smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1nncn1CC[NH+]1CCC([C@H](O)C(C)C)CC1	ZINC000820684182	925544686	/nfs/dbraw/zinc/54/46/86/925544686.db2.gz	LZMLTRAXSWNJCO-CQSZACIVSA-N	1	0	266.389	1.315	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@@H](CN(C)c2cc(=O)[nH]cn2)C1	ZINC000821246015	925575113	/nfs/dbraw/zinc/57/51/13/925575113.db2.gz	GWZGANPOVZPNQK-LBPRGKRZSA-N	1	0	264.373	1.596	50	0		CDAARO
CCCc1cnc(C)nc1NC1CC[NH+](CCO)CC1	ZINC000823012084	925661773	/nfs/dbraw/zinc/66/17/73/925661773.db2.gz	ZXEOHRXNNIYDHC-UHFFFAOYSA-N	1	0	278.400	1.606	50	0		CDAARO
COCC1CCN(C(=O)C[NH+]2CCCCCC2)CC1	ZINC000824371009	925819483	/nfs/dbraw/zinc/81/94/83/925819483.db2.gz	LFKMRWJWOHXBDE-UHFFFAOYSA-N	1	0	268.401	1.747	50	0		CDAARO
Cc1cc(C)nc(S[C@H]2C[NH2+][C@H](C(=O)N(C)C)C2)n1	ZINC000828128636	926047225	/nfs/dbraw/zinc/04/72/25/926047225.db2.gz	VARJLXZXPNJMPO-MNOVXSKESA-N	1	0	280.397	1.004	50	0		CDAARO
Cn1cnc(C[NH2+]C[C@@](C)(CO)c2ccccc2)c1	ZINC000585083658	930863413	/nfs/dbraw/zinc/86/34/13/930863413.db2.gz	XADSVFKWBRLAKP-HNNXBMFYSA-N	1	0	259.353	1.460	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1C1CN(CCc2nccn2C)C1	ZINC001506408338	975152846	/nfs/dbraw/zinc/15/28/46/975152846.db2.gz	RQDRUWANHBIPRO-CYBMUJFWSA-N	1	0	262.401	1.521	50	0		CDAARO
O=C(CN1CCC[N@@H+]2CCC[C@H]2C1)NCC1CCCCC1	ZINC001506424841	975159340	/nfs/dbraw/zinc/15/93/40/975159340.db2.gz	NTMRFMYUZBODJR-INIZCTEOSA-N	1	0	293.455	1.853	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@H](C(=O)NCCCc2cnn(C)c2)C1	ZINC000095524929	185004045	/nfs/dbraw/zinc/00/40/45/185004045.db2.gz	LADPOYKDNPPWRU-HNNXBMFYSA-N	1	0	292.427	1.589	50	0		CDAARO
Cc1noc(C)c1C(=O)NC1CC[NH+](CC2CC2)CC1	ZINC000095954021	185041135	/nfs/dbraw/zinc/04/11/35/185041135.db2.gz	SQDZXXUYRPLIBK-UHFFFAOYSA-N	1	0	277.368	1.896	50	0		CDAARO
C[NH+](C)C[C@H]1CCN(C(=O)Cc2[nH]nc3ccccc32)C1	ZINC000095959736	185043565	/nfs/dbraw/zinc/04/35/65/185043565.db2.gz	XWJWVILKOKDBPU-GFCCVEGCSA-N	1	0	286.379	1.516	50	0		CDAARO
c1ccc(C[NH2+]C[C@H]2COC3(CCOCC3)O2)nc1	ZINC000095991140	185058414	/nfs/dbraw/zinc/05/84/14/185058414.db2.gz	FHHJTHUCRZAPMT-ZDUSSCGKSA-N	1	0	264.325	1.093	50	0		CDAARO
O[C@@H](C[NH+]1CCC(n2ccnn2)CC1)c1ccc(F)cc1	ZINC000095994228	185059374	/nfs/dbraw/zinc/05/93/74/185059374.db2.gz	YWOQQAHOVZPLNE-HNNXBMFYSA-N	1	0	290.342	1.788	50	0		CDAARO
C[NH+](C)C(C)(C)CNC(=O)NCC[C@H]1CCCCO1	ZINC000096003449	185062305	/nfs/dbraw/zinc/06/23/05/185062305.db2.gz	PDZVPFVEKDVVIE-GFCCVEGCSA-N	1	0	271.405	1.585	50	0		CDAARO
O=C(C[C@@H]1CCCO1)N1CCC[C@@H]1C1CC[NH2+]CC1	ZINC000087212160	539086995	/nfs/dbraw/zinc/08/69/95/539086995.db2.gz	ILRKOBGDQHCLNE-UONOGXRCSA-N	1	0	266.385	1.546	50	0		CDAARO
O=C(C1CCCC1)N1CC[C@@H]([NH2+]C2CCOCC2)C1	ZINC000089818007	539087566	/nfs/dbraw/zinc/08/75/66/539087566.db2.gz	CENHTJXDBYCCSR-CQSZACIVSA-N	1	0	266.385	1.546	50	0		CDAARO
COc1ccc(-n2nc(C)nc2[C@@H]2CC[NH2+]C2)cc1	ZINC000096140055	185105843	/nfs/dbraw/zinc/10/58/43/185105843.db2.gz	NUYKVAXRKHWSOJ-LLVKDONJSA-N	1	0	258.325	1.661	50	0		CDAARO
C[NH+](C)CC(=O)NCC1(c2ccncc2)CCCCC1	ZINC000195569865	342628759	/nfs/dbraw/zinc/62/87/59/342628759.db2.gz	DXKPKTLNNMCHOT-UHFFFAOYSA-N	1	0	275.396	1.961	50	0		CDAARO
C[C@@H]1CCCN(C(=O)C[C@H]2CCCCO2)[C@H]1C[NH3+]	ZINC000252155393	361831857	/nfs/dbraw/zinc/83/18/57/361831857.db2.gz	NEMIIYIMYJGNHJ-UPJWGTAASA-N	1	0	254.374	1.531	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN(Cc2cc(C(C)(C)C)n[nH]2)C1	ZINC000072144597	282141590	/nfs/dbraw/zinc/14/15/90/282141590.db2.gz	BXGDHFFOESMHPS-CYBMUJFWSA-N	1	0	294.443	1.717	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@H](O)C[NH2+]Cc1ccccc1	ZINC000096675810	342173224	/nfs/dbraw/zinc/17/32/24/342173224.db2.gz	YCTJTEUCQCEJNN-CYBMUJFWSA-N	1	0	280.368	1.662	50	0		CDAARO
CCC1(CC)[C@H](NC(=O)[C@H]2C[C@H](OC)C[NH2+]2)[C@H](C)[C@@H]1OC	ZINC000189319592	361912800	/nfs/dbraw/zinc/91/28/00/361912800.db2.gz	FRHDUIZGECCWHC-QNSTZXKLSA-N	1	0	298.427	1.319	50	0		CDAARO
CC(C)N(C)C(=O)[C@H](C)[NH+]1CCC(n2ccnn2)CC1	ZINC000097233208	342205390	/nfs/dbraw/zinc/20/53/90/342205390.db2.gz	LSBZWFLESAVUPQ-LBPRGKRZSA-N	1	0	279.388	1.170	50	0		CDAARO
[NH3+]C1CCN(C(=O)C2(c3cccc(F)c3)CC2)CC1	ZINC000097019372	185152964	/nfs/dbraw/zinc/15/29/64/185152964.db2.gz	LVOXVFANGRGZBL-UHFFFAOYSA-N	1	0	262.328	1.807	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+]C[C@](C)(O)c2cnn(C)c2)C12CCC2	ZINC000097034571	185157311	/nfs/dbraw/zinc/15/73/11/185157311.db2.gz	JEGUHUCJEBTTOZ-KFWWJZLASA-N	1	0	293.411	1.565	50	0		CDAARO
O=C(c1ccc(C[NH+]2CCC(O)CC2)cc1)N1CCCC1	ZINC000032869443	539135502	/nfs/dbraw/zinc/13/55/02/539135502.db2.gz	PKFJQTHKENJCLF-UHFFFAOYSA-N	1	0	288.391	1.879	50	0		CDAARO
CC[C@H]([NH2+]C[C@@H]1CCOC1)c1cccc(S(N)(=O)=O)c1	ZINC000096501604	529615337	/nfs/dbraw/zinc/61/53/37/529615337.db2.gz	LWKUHQOBWQGQBP-FZMZJTMJSA-N	1	0	298.408	1.411	50	0		CDAARO
CS(=O)(=O)N[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CCCSC1	ZINC000253370915	342416320	/nfs/dbraw/zinc/41/63/20/342416320.db2.gz	XZJVYNWJQAHZSH-GRYCIOLGSA-N	1	0	292.470	1.190	50	0		CDAARO
CC[C@H](C)c1cc(C(=O)N2CC[C@@H](C[NH3+])C2)on1	ZINC000178532413	362245726	/nfs/dbraw/zinc/24/57/26/362245726.db2.gz	GOXNRPXVIBQZBE-UWVGGRQHSA-N	1	0	251.330	1.609	50	0		CDAARO
CC(C)Oc1cccnc1C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179095096	362253282	/nfs/dbraw/zinc/25/32/82/362253282.db2.gz	ICUGBTBNLLCMLG-LLVKDONJSA-N	1	0	263.341	1.303	50	0		CDAARO
Cn1ccc(NC(=O)C[N@H+](C)CCC[C@@H]2CCCO2)n1	ZINC000252494894	362388577	/nfs/dbraw/zinc/38/85/77/362388577.db2.gz	OHOIZBDHGWEJCS-GFCCVEGCSA-N	1	0	280.372	1.250	50	0		CDAARO
C[C@@H](CCO)[NH2+]C1CCN(c2nccs2)CC1	ZINC000097081042	185523107	/nfs/dbraw/zinc/52/31/07/185523107.db2.gz	NUJPRHQEERMGSR-JTQLQIEISA-N	1	0	255.387	1.472	50	0		CDAARO
C[C@H](c1cccnc1)N1CCO[C@H](CNc2cccnn2)C1	ZINC000089910028	347624371	/nfs/dbraw/zinc/62/43/71/347624371.db2.gz	YVSVLCYLHJZVPM-UKRRQHHQSA-N	1	0	299.378	1.746	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+][C@H]1CCCC[C@@H]1S(C)(=O)=O	ZINC000095940758	290863014	/nfs/dbraw/zinc/86/30/14/290863014.db2.gz	CMUFVEOSXRYYBA-QWRGUYRKSA-N	1	0	291.413	1.131	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNC(=O)c1c(C)cc(C)[nH]c1=O	ZINC000073555707	349169865	/nfs/dbraw/zinc/16/98/65/349169865.db2.gz	RVUFXLSTCCLTNI-ZDUSSCGKSA-N	1	0	291.395	1.596	50	0		CDAARO
Cc1cc(O)ccc1C(=O)NCC[N@@H+]1CCC[C@@H](CO)C1	ZINC000584884532	349342258	/nfs/dbraw/zinc/34/22/58/349342258.db2.gz	KCAHCGUXJJIEPS-CYBMUJFWSA-N	1	0	292.379	1.135	50	0		CDAARO
Cc1[nH]ccc1C(=O)N1CC[N@@H+](CC(C)C)[C@@H](CCO)C1	ZINC000584886662	349344594	/nfs/dbraw/zinc/34/45/94/349344594.db2.gz	KTPWCUGHDOEFRS-AWEZNQCLSA-N	1	0	293.411	1.488	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CN(C)C(=O)Cc2ccncc2)C1	ZINC000584886683	349344879	/nfs/dbraw/zinc/34/48/79/349344879.db2.gz	QCUIJVOUOQVVPC-HNNXBMFYSA-N	1	0	291.395	1.051	50	0		CDAARO
COCCn1cncc1C[NH2+]C1CSCCSC1	ZINC000584889636	349348723	/nfs/dbraw/zinc/34/87/23/349348723.db2.gz	DWJZUBSHINBWMW-UHFFFAOYSA-N	1	0	287.454	1.468	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](C(=O)N2CCC3(CCCC3)C2)C1	ZINC000584891324	349350241	/nfs/dbraw/zinc/35/02/41/349350241.db2.gz	MCALXDFCDFLZOS-CQSZACIVSA-N	1	0	280.412	1.747	50	0		CDAARO
CC[N@@H+]1CCCN(C(=O)[C@@H]2CC(C(C)C)=NO2)CC1	ZINC000584897651	349358863	/nfs/dbraw/zinc/35/88/63/349358863.db2.gz	LKFZFFICOFQCGL-ZDUSSCGKSA-N	1	0	267.373	1.342	50	0		CDAARO
CC(C)(C[NH+]1CCCC1)NC(=O)c1cnc(N)s1	ZINC000584894660	349355283	/nfs/dbraw/zinc/35/52/83/349355283.db2.gz	LEAXUWDITVMNOJ-UHFFFAOYSA-N	1	0	268.386	1.160	50	0		CDAARO
C[NH+](C)C[C@H]1CSCCCN1C(=O)C(C)(C)C	ZINC000090699752	180027883	/nfs/dbraw/zinc/02/78/83/180027883.db2.gz	USURIPCUOHKPLI-NSHDSACASA-N	1	0	258.431	1.928	50	0		CDAARO
O[C@@]1(C[NH2+][C@@H]2CCSc3ccccc32)CCOC1	ZINC000090848009	180044650	/nfs/dbraw/zinc/04/46/50/180044650.db2.gz	PWWOPMHLPUYEJZ-TZMCWYRMSA-N	1	0	265.378	1.965	50	0		CDAARO
COc1ccc2c(c1)CCC[C@H]2[NH2+]C[C@@]1(O)CCOC1	ZINC000090848584	180045762	/nfs/dbraw/zinc/04/57/62/180045762.db2.gz	RKGWXDASLRSJAW-CVEARBPZSA-N	1	0	277.364	1.814	50	0		CDAARO
C[C@H](CC(=O)Nc1ccc(F)cc1)[NH2+]C[C@]1(O)CCOC1	ZINC000090849542	180045953	/nfs/dbraw/zinc/04/59/53/180045953.db2.gz	WNKPCQCMIMSDMB-IAQYHMDHSA-N	1	0	296.342	1.284	50	0		CDAARO
COc1ccc(C)cc1[C@H](C)[NH2+]C[C@@]1(O)CCOC1	ZINC000090849775	180045960	/nfs/dbraw/zinc/04/59/60/180045960.db2.gz	AQLJOPHKDKBOMC-WFASDCNBSA-N	1	0	265.353	1.806	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN2C[C@H](CO)CC[C@H]2C1	ZINC000104850035	186028905	/nfs/dbraw/zinc/02/89/05/186028905.db2.gz	UKFJLHLYPJBMCY-NEPJUHHUSA-N	1	0	270.373	1.310	50	0		CDAARO
COC[C@]1(O)CCN(C(=O)CC[NH+]2CCCC2)CC1(C)C	ZINC000091620464	180208422	/nfs/dbraw/zinc/20/84/22/180208422.db2.gz	RWZREXWSOAHZBZ-MRXNPFEDSA-N	1	0	298.427	1.108	50	0		CDAARO
CC(C)[C@H]1CN(S(=O)(=O)c2ccccc2F)C[C@@H]1[NH3+]	ZINC000091691270	180227323	/nfs/dbraw/zinc/22/73/23/180227323.db2.gz	KQLSINKATIWARY-PWSUYJOCSA-N	1	0	286.372	1.430	50	0		CDAARO
Cc1nc(C)c(C)c(NCCC[N@@H+]2CCC[C@H](CO)C2)n1	ZINC000091782393	180253651	/nfs/dbraw/zinc/25/36/51/180253651.db2.gz	MGDBDEZDMWGGEJ-HNNXBMFYSA-N	1	0	292.427	1.908	50	0		CDAARO
Cc1ncnc(NCCC[N@@H+]2CCCC[C@@H]2CO)c1C	ZINC000091781034	180253966	/nfs/dbraw/zinc/25/39/66/180253966.db2.gz	YJBRXXQFSCNQRV-CQSZACIVSA-N	1	0	278.400	1.742	50	0		CDAARO
CC(C)Oc1ccccc1C[NH2+]C[C@@H]1CN(C)CCO1	ZINC000105472549	186058520	/nfs/dbraw/zinc/05/85/20/186058520.db2.gz	LLDDYCUCGRWZRW-OAHLLOKOSA-N	1	0	278.396	1.894	50	0		CDAARO
Cc1ccc2[nH]c(C[NH2+]CCCn3cncn3)cc(=O)c2c1	ZINC000091933615	180288399	/nfs/dbraw/zinc/28/83/99/180288399.db2.gz	VMXUXCVKYQDBKS-UHFFFAOYSA-N	1	0	297.362	1.608	50	0		CDAARO
Cn1cncc1C[NH2+][C@H]1CCN(c2ccccc2)C1	ZINC000106475781	186119654	/nfs/dbraw/zinc/11/96/54/186119654.db2.gz	WFHVFLRKJQGIIT-ZDUSSCGKSA-N	1	0	256.353	1.789	50	0		CDAARO
CCOC[C@H](O)C[NH2+][C@@]1(CO)C[C@@H](C)CC(C)(C)C1	ZINC000108125960	186204956	/nfs/dbraw/zinc/20/49/56/186204956.db2.gz	ANXDBOQKBDETAP-GUTXKFCHSA-N	1	0	273.417	1.551	50	0		CDAARO
CC(C)c1cc(CNC(=O)N2CC[C@H](C[NH+](C)C)C2)on1	ZINC000130007235	187465484	/nfs/dbraw/zinc/46/54/84/187465484.db2.gz	MMGABJGQOQOZLU-GFCCVEGCSA-N	1	0	294.399	1.891	50	0		CDAARO
O=C1c2ccccc2C(=O)N1CCN1CCSCC1	ZINC000034300411	363204902	/nfs/dbraw/zinc/20/49/02/363204902.db2.gz	NEBRDMZOIILQAF-UHFFFAOYSA-N	1	0	276.361	1.331	50	0		CDAARO
Ic1cnn([C@H]2CCC[NH2+]C2)c1	ZINC000070677733	283041630	/nfs/dbraw/zinc/04/16/30/283041630.db2.gz	SRLZBDQBJOWJID-QMMMGPOBSA-N	1	0	277.109	1.412	50	0		CDAARO
CCSCC[N@@H+]1CC[C@](C(N)=O)(c2ccccc2)C1	ZINC000411959285	363388334	/nfs/dbraw/zinc/38/83/34/363388334.db2.gz	CXSNFELNKOZYTF-OAHLLOKOSA-N	1	0	278.421	1.869	50	0		CDAARO
C[C@@H](c1ccsc1)N1CCN(C(=O)C[NH+](C)C)CC1	ZINC000097379047	356107238	/nfs/dbraw/zinc/10/72/38/356107238.db2.gz	MFCLFWNXXGYDMO-LBPRGKRZSA-N	1	0	281.425	1.515	50	0		CDAARO
[NH3+][C@H]1CCCN(S(=O)(=O)Cc2ccc(F)cc2)C1	ZINC000036297245	356109090	/nfs/dbraw/zinc/10/90/90/356109090.db2.gz	KDWMOXQTFQEWFI-LBPRGKRZSA-N	1	0	272.345	1.079	50	0		CDAARO
CCCNC(=O)c1ccccc1OC1CC[NH2+]CC1	ZINC000012359707	356294789	/nfs/dbraw/zinc/29/47/89/356294789.db2.gz	LPOLZUPPWJORHK-UHFFFAOYSA-N	1	0	262.353	1.957	50	0		CDAARO
NS(=O)(=O)c1ccc(CC[NH2+]Cc2cccnc2)cc1	ZINC000020051619	356524088	/nfs/dbraw/zinc/52/40/88/356524088.db2.gz	BNHRULXKZYEPBQ-UHFFFAOYSA-N	1	0	291.376	1.061	50	0		CDAARO
CC(=O)NCCNC(=O)C[N@@H+]1CCC[C@H]1c1cccs1	ZINC000026483242	356694290	/nfs/dbraw/zinc/69/42/90/356694290.db2.gz	VXETXLFIGGPGCL-LBPRGKRZSA-N	1	0	295.408	1.137	50	0		CDAARO
COCC(=O)NC[C@@H](C)[N@@H+]1CCc2ccccc2C1	ZINC000025939159	356685589	/nfs/dbraw/zinc/68/55/89/356685589.db2.gz	ABILSTNWWBGOOK-GFCCVEGCSA-N	1	0	262.353	1.196	50	0		CDAARO
C([NH2+][C@H]1CCCOC1)C1(N2CCOCC2)CCCCC1	ZINC000154181863	356818863	/nfs/dbraw/zinc/81/88/63/356818863.db2.gz	HXQJAFREYRDKKD-HNNXBMFYSA-N	1	0	282.428	1.790	50	0		CDAARO
CC(C)c1ncncc1C(=O)N1CCC[C@H]([C@H](C)[NH3+])C1	ZINC000269297200	356928097	/nfs/dbraw/zinc/92/80/97/356928097.db2.gz	WHURRLBBLNNPOI-RYUDHWBXSA-N	1	0	276.384	1.799	50	0		CDAARO
[NH3+][C@H]1CCC2(C[C@@H]1OCc1ccccc1)OCCO2	ZINC000037981084	356949626	/nfs/dbraw/zinc/94/96/26/356949626.db2.gz	BJBTZUJRKVTZDI-KBPBESRZSA-N	1	0	263.337	1.826	50	0		CDAARO
Cc1ccc(C)c([C@H]2CN(C(=O)CC[NH3+])[C@@H](C)CO2)c1	ZINC000119066267	357251736	/nfs/dbraw/zinc/25/17/36/357251736.db2.gz	LKEVFEUBNCOJDV-DZGCQCFKSA-N	1	0	276.380	1.941	50	0		CDAARO
OCCOCC[NH2+]Cc1ccccc1C(F)(F)F	ZINC000057358768	357355514	/nfs/dbraw/zinc/35/55/14/357355514.db2.gz	ZNELJBXUUNOZOC-UHFFFAOYSA-N	1	0	263.259	1.804	50	0		CDAARO
CCSCC[N@H+]1CC=C(c2cnn(CCO)c2)CC1	ZINC000065388099	357535140	/nfs/dbraw/zinc/53/51/40/357535140.db2.gz	XFEMKNDPNXXPNO-UHFFFAOYSA-N	1	0	281.425	1.718	50	0		CDAARO
CCN(C(=O)CC[NH2+][C@H](C(N)=O)C(C)C)c1ccccc1	ZINC000065432730	357541636	/nfs/dbraw/zinc/54/16/36/357541636.db2.gz	RMMGZIKQTRFLLG-HNNXBMFYSA-N	1	0	291.395	1.529	50	0		CDAARO
CCC[N@H+](CCS(C)(=O)=O)[C@@H]1C[C@@H](OCC)C1(C)C	ZINC000106931424	283267033	/nfs/dbraw/zinc/26/70/33/283267033.db2.gz	SIIXLNPVAHEELN-CHWSQXEVSA-N	1	0	291.457	1.947	50	0		CDAARO
CC(C)SCC(=O)NCC[C@H]1CCC[N@H+](C)C1	ZINC000067743106	357623350	/nfs/dbraw/zinc/62/33/50/357623350.db2.gz	GQORYJLATHQZQL-GFCCVEGCSA-N	1	0	258.431	1.976	50	0		CDAARO
CCN(CC)C(=O)[C@@H]1C[C@@H]([NH3+])CN1C(=O)C1=CCCCC1	ZINC000067691468	357619310	/nfs/dbraw/zinc/61/93/10/357619310.db2.gz	AJJVFNHADQJBBE-KGLIPLIRSA-N	1	0	293.411	1.283	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CNC(=O)c2ccsc2)C1	ZINC000068494986	357649256	/nfs/dbraw/zinc/64/92/56/357649256.db2.gz	GNTJUYUKRZZUCJ-LLVKDONJSA-N	1	0	268.382	1.446	50	0		CDAARO
O=S(=O)(C1CC1)N1CCC([NH2+]C[C@@H]2CC=CCC2)CC1	ZINC000095434100	357653470	/nfs/dbraw/zinc/65/34/70/357653470.db2.gz	ONYWWHQFQPCKAJ-CYBMUJFWSA-N	1	0	298.452	1.889	50	0		CDAARO
Cc1ncc(CO)c(CN2CC[C@@]3(C2)CCC[NH2+]C3)c1O	ZINC000067895942	357636465	/nfs/dbraw/zinc/63/64/65/357636465.db2.gz	LWAVPRWBOFHXPM-INIZCTEOSA-N	1	0	291.395	1.163	50	0		CDAARO
Cc1nn(C)c2nc(C)nc(N(C)CCC[NH+](C)C)c12	ZINC000072424766	357833439	/nfs/dbraw/zinc/83/34/39/357833439.db2.gz	LZLNCZUQNORQAR-UHFFFAOYSA-N	1	0	276.388	1.368	50	0		CDAARO
OC[C@@]1(O)CCC[N@H+](Cc2c[nH]nc2-c2ccccc2)C1	ZINC000072430623	357835126	/nfs/dbraw/zinc/83/51/26/357835126.db2.gz	WAQNQLRSSHSXSV-MRXNPFEDSA-N	1	0	287.363	1.396	50	0		CDAARO
Cc1nc(C)c(C(=O)N(CC[NH+](C)C)C[C@@H]2CCCO2)o1	ZINC000073427114	357879819	/nfs/dbraw/zinc/87/98/19/357879819.db2.gz	PKZIBRLRRNDMFW-ZDUSSCGKSA-N	1	0	295.383	1.474	50	0		CDAARO
Cn1ccnc1[C@@H]([NH2+]CCNc1ccccn1)C1CC1	ZINC000097033764	357919085	/nfs/dbraw/zinc/91/90/85/357919085.db2.gz	UPVZYEGPSNKIHK-AWEZNQCLSA-N	1	0	271.368	1.968	50	0		CDAARO
COC(=O)[C@@]12CCC[C@H]1C[N@H+](Cc1ccncc1)C2	ZINC000097082973	357945822	/nfs/dbraw/zinc/94/58/22/357945822.db2.gz	ZHMOWTRATIEDCY-DZGCQCFKSA-N	1	0	260.337	1.857	50	0		CDAARO
C[C@H]([NH2+][C@@H]1CCN(CC(F)(F)F)C1=O)[C@@H]1CCCO1	ZINC000097108811	357983676	/nfs/dbraw/zinc/98/36/76/357983676.db2.gz	WZUBIPCYLBHRCY-AEJSXWLSSA-N	1	0	280.290	1.307	50	0		CDAARO
Cc1cc2cccc(C(=O)N3CC[C@@H]([NH3+])[C@H](O)C3)c2o1	ZINC000082134772	358148924	/nfs/dbraw/zinc/14/89/24/358148924.db2.gz	GBJMIEZNDYCPDA-CHWSQXEVSA-N	1	0	274.320	1.275	50	0		CDAARO
Cc1cccc(N2C[C@H](C)N(C(=O)CN(C)C)CC2=O)c1	ZINC000082136744	358149047	/nfs/dbraw/zinc/14/90/47/358149047.db2.gz	BQVFFGJFYVIVEY-ZDUSSCGKSA-N	1	0	289.379	1.120	50	0		CDAARO
CNC(=O)[C@H]1CCC[N@H+](Cc2cn3cc(C)ccc3n2)C1	ZINC000084075724	358224118	/nfs/dbraw/zinc/22/41/18/358224118.db2.gz	HBAAEEGJZNUOAT-ZDUSSCGKSA-N	1	0	286.379	1.601	50	0		CDAARO
C[NH2+]C[C@@H](C)CNS(=O)(=O)c1cc(C)oc1C	ZINC000195555237	358557637	/nfs/dbraw/zinc/55/76/37/358557637.db2.gz	AQRIZWGJBAXBRK-MRVPVSSYSA-N	1	0	260.359	1.030	50	0		CDAARO
C[NH2+][C@@H](C)C(=O)Nc1cc(Cl)ccc1N(C)C	ZINC000054074072	358702135	/nfs/dbraw/zinc/70/21/35/358702135.db2.gz	WHKLQEHLLRVTPC-QMMMGPOBSA-N	1	0	255.749	1.952	50	0		CDAARO
Cc1nonc1OCCNC(=O)CC[C@@H]1CCCC[N@H+]1C	ZINC000095372922	358688447	/nfs/dbraw/zinc/68/84/47/358688447.db2.gz	NPGDANDYTQCBKH-LBPRGKRZSA-N	1	0	296.371	1.138	50	0		CDAARO
CC(C)(C)c1cc(Cn2cc([C@@H]3CCC[NH2+]C3)nn2)n[nH]1	ZINC000095374109	358688618	/nfs/dbraw/zinc/68/86/18/358688618.db2.gz	FLUGCTBXCCMZCZ-LLVKDONJSA-N	1	0	288.399	1.814	50	0		CDAARO
CCc1[nH+]c(N)nc(NCCCn2cnnc2)c1C	ZINC000095388012	358691375	/nfs/dbraw/zinc/69/13/75/358691375.db2.gz	RCBDSTUTLFSAJS-UHFFFAOYSA-N	1	0	261.333	1.023	50	0		CDAARO
CCC[C@@H]1CN(Cc2nc(C(C)C)no2)C[C@H]1NC(C)=O	ZINC000095500316	358695389	/nfs/dbraw/zinc/69/53/89/358695389.db2.gz	GRFBGYMOWJDUOQ-CHWSQXEVSA-N	1	0	294.399	1.930	50	0		CDAARO
CN(C)c1cc(N(C2CC2)C2CC[NH2+]CC2)ncn1	ZINC000618254095	358755685	/nfs/dbraw/zinc/75/56/85/358755685.db2.gz	DJZXITPBEASASF-UHFFFAOYSA-N	1	0	261.373	1.263	50	0		CDAARO
CCOc1ccc(CCNC(=O)C[C@H]2COCC[NH2+]2)cc1	ZINC000097259180	358762456	/nfs/dbraw/zinc/76/24/56/358762456.db2.gz	DNNBPCXHRBIAJG-AWEZNQCLSA-N	1	0	292.379	1.123	50	0		CDAARO
CC[C@@H]1CN(c2nccnc2OC)CC[N@@H+]1C(C)C	ZINC000096149745	358709601	/nfs/dbraw/zinc/70/96/01/358709601.db2.gz	VNXUIWLQGXMROP-GFCCVEGCSA-N	1	0	264.373	1.794	50	0		CDAARO
Cc1cc(C)cc(O[C@H](C)C(=O)NCC[NH+](C)C)c1	ZINC000098086246	358812891	/nfs/dbraw/zinc/81/28/91/358812891.db2.gz	DCDWQQQWBFZCJB-CYBMUJFWSA-N	1	0	264.369	1.749	50	0		CDAARO
C[C@H](Cc1ccccc1F)[NH2+]CC(=O)N1CCOCC1	ZINC000186743217	358820211	/nfs/dbraw/zinc/82/02/11/358820211.db2.gz	XHVUZTONHINGKV-GFCCVEGCSA-N	1	0	280.343	1.205	50	0		CDAARO
O=C(NCC[C@@H]1CCC[NH2+]1)c1c[nH]c(=O)c2ccccc12	ZINC000097499684	358780565	/nfs/dbraw/zinc/78/05/65/358780565.db2.gz	FPCGYAYVCVFUOH-NSHDSACASA-N	1	0	285.347	1.400	50	0		CDAARO
COc1cc(C[N@H+](C)C[C@H]2COCCO2)cc2c1OCO2	ZINC000097522344	358781633	/nfs/dbraw/zinc/78/16/33/358781633.db2.gz	PTODDMSBJRHPEX-LBPRGKRZSA-N	1	0	295.335	1.271	50	0		CDAARO
Cc1ccc(CN2C[C@H](O)[C@@H]([NH+]3CCCC3)C2)s1	ZINC000097553432	358785181	/nfs/dbraw/zinc/78/51/81/358785181.db2.gz	BUMFOLGABDBWJE-KBPBESRZSA-N	1	0	266.410	1.697	50	0		CDAARO
Cc1n[nH]c(CCC(=O)NCCc2c[nH]cn2)c1C	ZINC000097655514	358790154	/nfs/dbraw/zinc/79/01/54/358790154.db2.gz	WGVMEGJJLASZRL-UHFFFAOYSA-N	1	0	261.329	1.041	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1C(=O)N1CCC(c2ncc[nH]2)CC1	ZINC000097675481	358792662	/nfs/dbraw/zinc/79/26/62/358792662.db2.gz	CKUGCDUQQNCSNU-CYBMUJFWSA-N	1	0	276.384	1.600	50	0		CDAARO
CCOCCC[N@@H+]1CCC[C@@H](c2nnc3n2CCC3)C1	ZINC000120360496	358797083	/nfs/dbraw/zinc/79/70/83/358797083.db2.gz	PQPJAPNGWKOWFU-CYBMUJFWSA-N	1	0	278.400	1.830	50	0		CDAARO
O=C(C(=O)N1CC[C@H]([NH+]2CCCCC2)C1)c1ccccc1	ZINC000215329310	358884688	/nfs/dbraw/zinc/88/46/88/358884688.db2.gz	CSLDARHFLTXCQD-HNNXBMFYSA-N	1	0	286.375	1.956	50	0		CDAARO
CN(C(=O)[C@@H](C[NH3+])c1ccc(F)cc1)[C@@H]1CCOC1	ZINC000262048649	358998802	/nfs/dbraw/zinc/99/88/02/358998802.db2.gz	HBMDBNFNGXXBKE-OLZOCXBDSA-N	1	0	266.316	1.115	50	0		CDAARO
CCn1cc(Cl)c(C(=O)NCC[NH+](CC)CC)n1	ZINC000028222864	359173875	/nfs/dbraw/zinc/17/38/75/359173875.db2.gz	AOLFRNUMYNIYOE-UHFFFAOYSA-N	1	0	272.780	1.628	50	0		CDAARO
CN1C(=O)[C@H]2C[N@H+](Cc3ccc(F)c(Cl)c3)C[C@H]2C1=O	ZINC000257179872	359177776	/nfs/dbraw/zinc/17/77/76/359177776.db2.gz	JRNHJYNIGDHZDZ-AOOOYVTPSA-N	1	0	296.729	1.526	50	0		CDAARO
CC(=O)N[C@H]1CCCN(C(=O)C[C@@H]([NH3+])c2ccccc2)C1	ZINC000037815247	359452713	/nfs/dbraw/zinc/45/27/13/359452713.db2.gz	HKIZICYTMVPCSN-LSDHHAIUSA-N	1	0	289.379	1.204	50	0		CDAARO
CCOc1ccc(C(=O)N2C[C@@H](CO)[C@H]([NH+](C)C)C2)cc1	ZINC000257183552	359490253	/nfs/dbraw/zinc/49/02/53/359490253.db2.gz	HQEWTTOLSBFAAZ-DZGCQCFKSA-N	1	0	292.379	1.080	50	0		CDAARO
O=S(=O)(NC1CC[NH+](C2CC2)CC1)c1ccc(F)cc1	ZINC000014102416	366535913	/nfs/dbraw/zinc/53/59/13/366535913.db2.gz	ZJXFZJSFWITYBN-UHFFFAOYSA-N	1	0	298.383	1.731	50	0		CDAARO
CCCCOC[C@H](O)C[NH+]1CCN(c2ccccn2)CC1	ZINC000033603407	359972362	/nfs/dbraw/zinc/97/23/62/359972362.db2.gz	DAKZIHQIWZQYPD-OAHLLOKOSA-N	1	0	293.411	1.381	50	0		CDAARO
C[C@H](CC[NH+](C)C)NC(=O)[C@@H]1C[C@H]1c1cccnc1	ZINC000248221926	360463160	/nfs/dbraw/zinc/46/31/60/360463160.db2.gz	IBMRYCFZFPEFMZ-KWCYVHTRSA-N	1	0	261.369	1.642	50	0		CDAARO
Cc1nc(-c2cccc(C(=O)N[C@@H]3CC[NH2+]C3)c2)no1	ZINC000126561727	360536899	/nfs/dbraw/zinc/53/68/99/360536899.db2.gz	AOKKVFAGLASDAO-GFCCVEGCSA-N	1	0	272.308	1.137	50	0		CDAARO
c1csc(-c2ncc(CN3CC[C@H]4C[NH2+]C[C@H]43)cn2)c1	ZINC000426534090	360680716	/nfs/dbraw/zinc/68/07/16/360680716.db2.gz	RPKJTEAVQKVPAK-QWHCGFSZSA-N	1	0	286.404	1.999	50	0		CDAARO
CCOc1ccc(CN2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)cn1	ZINC000426697295	360697375	/nfs/dbraw/zinc/69/73/75/360697375.db2.gz	GKIRBNNECYAWDT-NMWPEEMBSA-N	1	0	273.380	1.663	50	0		CDAARO
Cc1nc(CNC(=O)C[C@H]2CCCC[N@@H+]2C)n(C)c1C	ZINC000426726746	360700120	/nfs/dbraw/zinc/70/01/20/360700120.db2.gz	JOCCITCORKYRDC-CYBMUJFWSA-N	1	0	278.400	1.528	50	0		CDAARO
C[C@@H](C(=O)NCCc1cccc(=O)[nH]1)[NH+]1CCCCC1	ZINC000426734545	360700677	/nfs/dbraw/zinc/70/06/77/360700677.db2.gz	SUCBCALXZLZFOA-LBPRGKRZSA-N	1	0	277.368	1.320	50	0		CDAARO
CC(C)Cc1cc(CSc2nnc(C[NH3+])n2C)no1	ZINC000426737352	360700783	/nfs/dbraw/zinc/70/07/83/360700783.db2.gz	GSCNZSRVSXXFTJ-UHFFFAOYSA-N	1	0	281.385	1.753	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)[C@H]1CCCO1)c1cccs1	ZINC000036079482	360842135	/nfs/dbraw/zinc/84/21/35/360842135.db2.gz	QWPOANHMPNVXFA-GHMZBOCLSA-N	1	0	268.382	1.646	50	0		CDAARO
CCc1ccc(C(=O)NCCC[N@@H+]2CCC[C@@H](O)C2)[nH]1	ZINC000426552093	361012902	/nfs/dbraw/zinc/01/29/02/361012902.db2.gz	YJOXHRITSKYNQO-CYBMUJFWSA-N	1	0	279.384	1.154	50	0		CDAARO
O=C(C[C@@H]1CC[NH2+]C1)N1CC(Oc2ccc(F)cc2)C1	ZINC000299776063	200867274	/nfs/dbraw/zinc/86/72/74/200867274.db2.gz	NBYGJFOYHUCSRI-NSHDSACASA-N	1	0	278.327	1.415	50	0		CDAARO
Nc1cc[nH+]cc1C(=O)N1CCO[C@H]2CCCC[C@@H]21	ZINC000127554875	283681765	/nfs/dbraw/zinc/68/17/65/283681765.db2.gz	SXXKBZWDRFXKDD-STQMWFEESA-N	1	0	261.325	1.447	50	0		CDAARO
c1ccc(-c2cc(NCCN3CCOCC3)ncn2)cc1	ZINC000019794070	361582495	/nfs/dbraw/zinc/58/24/95/361582495.db2.gz	JWIUZAADLWNKTB-UHFFFAOYSA-N	1	0	284.363	1.888	50	0		CDAARO
C[NH+](C)CCNc1c(=O)c(=O)c1NC1CCCCCC1	ZINC000101690626	364035632	/nfs/dbraw/zinc/03/56/32/364035632.db2.gz	XUIWUTWTKPTDHY-UHFFFAOYSA-N	1	0	279.384	1.391	50	0		CDAARO
OCC[NH+](CCO)Cc1ccc(Br)cc1	ZINC000000280229	364130721	/nfs/dbraw/zinc/13/07/21/364130721.db2.gz	YOYHVMIRZKMMPG-UHFFFAOYSA-N	1	0	274.158	1.236	50	0		CDAARO
COc1ccc(CN(C)CCN2CCNC2=O)c(OC)c1	ZINC000290199635	364587260	/nfs/dbraw/zinc/58/72/60/364587260.db2.gz	GNMQEORKEGIQGP-UHFFFAOYSA-N	1	0	293.367	1.161	50	0		CDAARO
C[C@H](O)[C@@H]1CC[N@@H+]([C@H]2CCN(c3ccccc3)C2=O)C1	ZINC000272578951	365302695	/nfs/dbraw/zinc/30/26/95/365302695.db2.gz	NYTFMPULJCINSJ-GUTXKFCHSA-N	1	0	274.364	1.495	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@@H]1[NH2+]Cc1cscn1	ZINC000089949175	366979294	/nfs/dbraw/zinc/97/92/94/366979294.db2.gz	FTKPJGUTMOHVCY-YPMHNXCESA-N	1	0	267.398	1.880	50	0		CDAARO
CC[C@H]1C[N@@H+]2CCC[C@H]2CN1CCCN1CCOCC1	ZINC000245442411	367273748	/nfs/dbraw/zinc/27/37/48/367273748.db2.gz	WGQBRMVSMXMOIC-HOTGVXAUSA-N	1	0	281.444	1.267	50	0		CDAARO
C[C@@H]1CCCN(S(=O)(=O)c2ccccc2)[C@H]1C[NH3+]	ZINC000252114539	367255066	/nfs/dbraw/zinc/25/50/66/367255066.db2.gz	IHMZNNHJCBLYEU-YPMHNXCESA-N	1	0	268.382	1.435	50	0		CDAARO
CC[C@@H]1C[N@@H+]([C@@H]2[C@@H]3CCO[C@H]3C2(C)C)CCN1C[C@@H](C)O	ZINC000252477648	367546460	/nfs/dbraw/zinc/54/64/60/367546460.db2.gz	SBPKRZCDZFOEHU-IBEHDNSVSA-N	1	0	296.455	1.577	50	0		CDAARO
CCCC(=O)NC[C@@H]1CCC[N@@H+]([C@H]2CCCC[C@H]2O)C1	ZINC000252513058	367715761	/nfs/dbraw/zinc/71/57/61/367715761.db2.gz	XBULBUGNXGBABS-SOUVJXGZSA-N	1	0	282.428	1.918	50	0		CDAARO
CC(C)COCC[N@@H+]1CCCC[C@@H]1[C@H]1CNC(=O)C1	ZINC000252537789	367812424	/nfs/dbraw/zinc/81/24/24/367812424.db2.gz	MJDLPRBDNUHYGN-ZIAGYGMSSA-N	1	0	268.401	1.650	50	0		CDAARO
C[C@@H]1C[N@H+](CCCCC2CCOCC2)CCN1CCO	ZINC000252569043	368160181	/nfs/dbraw/zinc/16/01/81/368160181.db2.gz	VVICVVZHGJASSF-OAHLLOKOSA-N	1	0	284.444	1.582	50	0		CDAARO
CC(C)[NH2+]CCN1CCC(OC2CCOCC2)CC1	ZINC000241435203	369121901	/nfs/dbraw/zinc/12/19/01/369121901.db2.gz	NLQFUVGVEVATFS-UHFFFAOYSA-N	1	0	270.417	1.644	50	0		CDAARO
CN1CC[NH+](C[C@@H]2CCCN(Cc3nccs3)C2)CC1	ZINC000367622492	369201892	/nfs/dbraw/zinc/20/18/92/369201892.db2.gz	IFYWRZKSGNZWCX-AWEZNQCLSA-N	1	0	294.468	1.603	50	0		CDAARO
c1ccc(N2CCN(CC[NH2+]CC3CC3)CC2)cc1	ZINC000037613576	369351637	/nfs/dbraw/zinc/35/16/37/369351637.db2.gz	RPXZGAPLFHYFAU-UHFFFAOYSA-N	1	0	259.397	1.808	50	0		CDAARO
CC[C@H](Cn1ccnc1)NC(=O)Nc1nc(C)ns1	ZINC000063848681	370120998	/nfs/dbraw/zinc/12/09/98/370120998.db2.gz	ULFZAKUZAGVMEJ-SECBINFHSA-N	1	0	280.357	1.643	50	0		CDAARO
Cc1ccc(C(=O)NCCF)c(OCCC[NH3+])c1	ZINC000299758907	372746921	/nfs/dbraw/zinc/74/69/21/372746921.db2.gz	FHGRAWVUOOAFGF-UHFFFAOYSA-N	1	0	254.305	1.422	50	0		CDAARO
Cc1c(Cl)cccc1NC(=O)N[C@@H]1C[NH2+]CC[C@H]1O	ZINC000299787100	372761348	/nfs/dbraw/zinc/76/13/48/372761348.db2.gz	OWXGTPDORHEDMH-VXGBXAGGSA-N	1	0	283.759	1.493	50	0		CDAARO
O=C(NC1CCN(c2ccc(F)cc2)CC1)[C@@H]1C=CC[NH2+]1	ZINC000299787470	372761750	/nfs/dbraw/zinc/76/17/50/372761750.db2.gz	OCKWVPSHSVICHD-HNNXBMFYSA-N	1	0	289.354	1.439	50	0		CDAARO
CCC[C@@H](NC(=O)c1[nH]nnc1C)c1nccn1C	ZINC000299801649	372771106	/nfs/dbraw/zinc/77/11/06/372771106.db2.gz	ZVDVEVMZGHGCHR-SECBINFHSA-N	1	0	262.317	1.118	50	0		CDAARO
Cc1nc[nH]c1C[N@H+](CCC(N)=O)CCc1ccccc1	ZINC000299800920	372771543	/nfs/dbraw/zinc/77/15/43/372771543.db2.gz	XCZQXZUFNXMXKK-UHFFFAOYSA-N	1	0	286.379	1.638	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@@]1(C(F)F)CC[NH2+]C1	ZINC000299805315	372772613	/nfs/dbraw/zinc/77/26/13/372772613.db2.gz	IVORNZPANYCEIQ-LLVKDONJSA-N	1	0	250.289	1.756	50	0		CDAARO
C[NH+](C)[C@H]1CCN(C(=O)c2cccc(-c3cnccn3)c2)C1	ZINC000299802371	372773569	/nfs/dbraw/zinc/77/35/69/372773569.db2.gz	YXSCDXDGOVUJFX-HNNXBMFYSA-N	1	0	296.374	1.920	50	0		CDAARO
COC[C@H]1CC[N@H+](CCCOc2ccc(C(N)=O)cc2)C1	ZINC000244734972	189910871	/nfs/dbraw/zinc/91/08/71/189910871.db2.gz	NQSFIGZCLJUQSU-ZDUSSCGKSA-N	1	0	292.379	1.523	50	0		CDAARO
Cc1noc([C@@H]2C[N@@H+](C3CCSCC3)C[C@H]2CO)n1	ZINC000253402133	373690301	/nfs/dbraw/zinc/69/03/01/373690301.db2.gz	GBFJHDMUROORDQ-CMPLNLGQSA-N	1	0	283.397	1.281	50	0		CDAARO
Cc1ccc(C)c(C(=O)N2C[C@@H](CO)[C@H]([NH+](C)C)C2)c1	ZINC000253403811	373692622	/nfs/dbraw/zinc/69/26/22/373692622.db2.gz	HLZXRUAETLFOQE-DZGCQCFKSA-N	1	0	276.380	1.298	50	0		CDAARO
Cn1ccc(C[NH+]2CCN(c3ccccn3)CC2)cc1=O	ZINC000051214172	373792369	/nfs/dbraw/zinc/79/23/69/373792369.db2.gz	VCTPZCTWSHUKHI-UHFFFAOYSA-N	1	0	284.363	1.103	50	0		CDAARO
Cc1ccc([C@H]2CCC[N@@H+]2CC(=O)N2CCNC2=O)cc1	ZINC000036392928	374559580	/nfs/dbraw/zinc/55/95/80/374559580.db2.gz	NZNVQZGOPMEYLS-CQSZACIVSA-N	1	0	287.363	1.684	50	0		CDAARO
Cc1nnc(CNC(=O)c2cccc([C@@H]3CCC[NH2+]C3)c2)[nH]1	ZINC000095385132	374897678	/nfs/dbraw/zinc/89/76/78/374897678.db2.gz	CFIQLWPMXFBUJK-CQSZACIVSA-N	1	0	299.378	1.510	50	0		CDAARO
O=C(c1n[nH]c2c1CCCC2)N1CC[C@H]([NH+]2CCCC2)C1	ZINC000095469686	374966504	/nfs/dbraw/zinc/96/65/04/374966504.db2.gz	CXPFOWFVYMQLDV-LBPRGKRZSA-N	1	0	288.395	1.599	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)Cc1ccc2c(c1)OCC2	ZINC000095474648	374968215	/nfs/dbraw/zinc/96/82/15/374968215.db2.gz	YTGHUZBFDPRUJC-OAHLLOKOSA-N	1	0	288.391	1.765	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@H]1C(=O)NCCc1nccn1C	ZINC000095401005	374906493	/nfs/dbraw/zinc/90/64/93/374906493.db2.gz	QQYAUVXPQMZOJD-ZDUSSCGKSA-N	1	0	278.400	1.342	50	0		CDAARO
O[C@H](C[NH2+]C1CCOCC1)c1c(F)cccc1F	ZINC000037893130	374990384	/nfs/dbraw/zinc/99/03/84/374990384.db2.gz	PZPVTISAWAXZAU-GFCCVEGCSA-N	1	0	257.280	1.767	50	0		CDAARO
Cn1ccc(CNC(=O)N2CCC[C@H]3C[N@H+](C)CC[C@H]32)c1	ZINC000096499811	375107313	/nfs/dbraw/zinc/10/73/13/375107313.db2.gz	KCNMLPRRRITDLH-LSDHHAIUSA-N	1	0	290.411	1.651	50	0		CDAARO
Cn1cc(C2CC[NH+](CCN3CCCC3=O)CC2)cn1	ZINC000097202980	375157228	/nfs/dbraw/zinc/15/72/28/375157228.db2.gz	ZDHRVSAUFSRMGU-UHFFFAOYSA-N	1	0	276.384	1.222	50	0		CDAARO
O=C(NCC[NH2+]Cc1ccco1)c1ccc(F)cc1	ZINC000002852659	375349508	/nfs/dbraw/zinc/34/95/08/375349508.db2.gz	PGGBCEOPSNCCMH-UHFFFAOYSA-N	1	0	262.284	1.938	50	0		CDAARO
CCOC(=O)C1=C(C[N@@H+]2CCC[C@@H](CC)C2)NC(=O)NC1	ZINC000030143111	375560756	/nfs/dbraw/zinc/56/07/56/375560756.db2.gz	XJNSOIFGKQSYDB-LLVKDONJSA-N	1	0	295.383	1.238	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(C(N)=O)cc1	ZINC000003583656	375755344	/nfs/dbraw/zinc/75/53/44/375755344.db2.gz	YSWABPUDJVXWHA-LLVKDONJSA-N	1	0	275.352	1.598	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(C(=O)NCc2cccc(CO)c2)C1	ZINC000187804929	375827565	/nfs/dbraw/zinc/82/75/65/375827565.db2.gz	GPZCMDGSYPLDFT-HNNXBMFYSA-N	1	0	291.395	1.272	50	0		CDAARO
c1cc([C@H]2[NH2+]CCc3nc[nH]c32)n(-c2cccnc2)c1	ZINC000067880412	377278783	/nfs/dbraw/zinc/27/87/83/377278783.db2.gz	ZWPSTEYHFQUESF-OAHLLOKOSA-N	1	0	265.320	1.831	50	0		CDAARO
COC[C@H]1CC[N@H+](Cc2nnc(-c3ccco3)o2)C1	ZINC000265796388	190207333	/nfs/dbraw/zinc/20/73/33/190207333.db2.gz	NFYVIHORSHYQLA-JTQLQIEISA-N	1	0	263.297	1.798	50	0		CDAARO
CC[NH+](CC)C[C@@H](C)NC(=O)c1c(Cl)c(C)nn1C	ZINC000002781824	378055037	/nfs/dbraw/zinc/05/50/37/378055037.db2.gz	DBDZSIXVYADLTM-SECBINFHSA-N	1	0	286.807	1.842	50	0		CDAARO
CO[C@H]1CN(c2cc(C(C)C)nc(C)n2)CC[C@H]1[NH3+]	ZINC000071763554	379634245	/nfs/dbraw/zinc/63/42/45/379634245.db2.gz	IPFGATDERCWMOH-YPMHNXCESA-N	1	0	264.373	1.461	50	0		CDAARO
C[C@H]([NH2+]C[C@H]1CCN(S(C)(=O)=O)C1)c1ccsc1	ZINC000090797588	184617172	/nfs/dbraw/zinc/61/71/72/184617172.db2.gz	DXKNFBOZLPELMJ-WDEREUQCSA-N	1	0	288.438	1.680	50	0		CDAARO
CCC(CC)(CO)[NH2+][C@H]1CCN(CC(F)(F)F)C1=O	ZINC000096424684	256758287	/nfs/dbraw/zinc/75/82/87/256758287.db2.gz	BUZAZXUBFJWBGD-VIFPVBQESA-N	1	0	282.306	1.290	50	0		CDAARO
Cc1cc(N2CC[NH2+]CC2)ncc1Br	ZINC000019721228	390229035	/nfs/dbraw/zinc/22/90/35/390229035.db2.gz	KMVMTDWWYHSLGI-UHFFFAOYSA-N	1	0	256.147	1.562	50	0		CDAARO
CCc1ccc(OC[C@H](O)CN2CC[NH+](C)CC2)cc1	ZINC000019338634	390226407	/nfs/dbraw/zinc/22/64/07/390226407.db2.gz	YYTLATYPGKVEQP-OAHLLOKOSA-N	1	0	278.396	1.236	50	0		CDAARO
CC(C)CC[NH+]1CCN(CCOC[C@@H]2CCCO2)CC1	ZINC000096421131	390514187	/nfs/dbraw/zinc/51/41/87/390514187.db2.gz	GMQXLXWACSTJSL-INIZCTEOSA-N	1	0	284.444	1.846	50	0		CDAARO
Cc1cc(N2CC[C@@H](C[NH+]3CCOCC3)C2)nc(C)n1	ZINC000096429722	390516366	/nfs/dbraw/zinc/51/63/66/390516366.db2.gz	ARNQRIJCOPLCFS-AWEZNQCLSA-N	1	0	276.384	1.252	50	0		CDAARO
C[C@@H]1C[NH2+]C[C@@H](C)N1Cc1ccc(-n2cncn2)cc1	ZINC000097095579	390676496	/nfs/dbraw/zinc/67/64/96/390676496.db2.gz	HJXAZNUEGUXJOV-CHWSQXEVSA-N	1	0	271.368	1.450	50	0		CDAARO
CN1CCN(C(=O)[C@H]2CC[C@H]([NH3+])C2)c2ccc(F)cc21	ZINC000262634457	390943850	/nfs/dbraw/zinc/94/38/50/390943850.db2.gz	GNLHQXDNZUOFGV-JQWIXIFHSA-N	1	0	277.343	1.736	50	0		CDAARO
CC[C@H]1CN(c2nccnc2OC)CC[N@@H+]1C(C)C	ZINC000096149746	390912994	/nfs/dbraw/zinc/91/29/94/390912994.db2.gz	VNXUIWLQGXMROP-LBPRGKRZSA-N	1	0	264.373	1.794	50	0		CDAARO
CC(C)(C)OC(=O)[C@](C)(O)C[NH2+][C@H]1CCC[C@H]2C[C@H]21	ZINC000549376099	391934243	/nfs/dbraw/zinc/93/42/43/391934243.db2.gz	FVDLTYUJOZHBPQ-OZTPJHRESA-N	1	0	269.385	1.857	50	0		CDAARO
CC(C)NC(=O)C[N@H+](C[C@@H]1CCCO1)[C@@H]1CCSC1	ZINC000089952643	392531235	/nfs/dbraw/zinc/53/12/35/392531235.db2.gz	WEXALBPGUMGZGR-OLZOCXBDSA-N	1	0	286.441	1.498	50	0		CDAARO
C[C@@H]1C[N@@H+](C[C@H]2CCCN2c2ncccn2)C[C@H](C)O1	ZINC000195570824	393301341	/nfs/dbraw/zinc/30/13/41/393301341.db2.gz	DOGPHANFVICORJ-HZSPNIEDSA-N	1	0	276.384	1.555	50	0		CDAARO
O=C(C[C@H]1CCCO1)NC[C@@H]1[NH2+]CCc2ccccc21	ZINC000261843349	140398358	/nfs/dbraw/zinc/39/83/58/140398358.db2.gz	WASIZIWUEGNBFT-HIFRSBDPSA-N	1	0	274.364	1.559	50	0		CDAARO
OC1(C[NH2+][C@H]2CCN(CC(F)(F)F)C2)CCSCC1	ZINC000088727481	296538834	/nfs/dbraw/zinc/53/88/34/296538834.db2.gz	ZXFVEUWJLHGXHW-JTQLQIEISA-N	1	0	298.374	1.471	50	0		CDAARO
C[C@H](C[NH3+])C(=O)N1CCc2c(cnn2-c2ccccc2)C1	ZINC000262348217	149050399	/nfs/dbraw/zinc/05/03/99/149050399.db2.gz	GEFVXFPKAKKPBX-GFCCVEGCSA-N	1	0	284.363	1.352	50	0		CDAARO
O=C([C@@H]1C[NH2+]CCO1)N1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000178404620	304369667	/nfs/dbraw/zinc/36/96/67/304369667.db2.gz	KHDDSKBTMNXGNQ-KGLIPLIRSA-N	1	0	294.782	1.992	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1cc2ccccc2oc1=O	ZINC000002314582	169785041	/nfs/dbraw/zinc/78/50/41/169785041.db2.gz	RJWISNIAXQMLDD-UHFFFAOYSA-N	1	0	288.347	1.865	50	0		CDAARO
Cc1cccc(OCC(=O)OCCC[NH+](C)C)c1	ZINC000004600411	169988759	/nfs/dbraw/zinc/98/87/59/169988759.db2.gz	GGBNPHISXQNYMZ-UHFFFAOYSA-N	1	0	251.326	1.869	50	0		CDAARO
CCOC(=O)c1[nH]c(C)c(C(=O)NCCC[NH+](C)C)c1C	ZINC000005054312	170061926	/nfs/dbraw/zinc/06/19/26/170061926.db2.gz	GXPPOMZDIOTCCN-UHFFFAOYSA-N	1	0	295.383	1.490	50	0		CDAARO
CCC[NH+]1CCC(NC(=O)C2CCN(C(C)=O)CC2)CC1	ZINC000006726560	170233186	/nfs/dbraw/zinc/23/31/86/170233186.db2.gz	GNXBXNOTOHFHPP-UHFFFAOYSA-N	1	0	295.427	1.236	50	0		CDAARO
CC[NH+]1CCN(CCNC(=O)Nc2ccccc2C)CC1	ZINC000020153991	171038145	/nfs/dbraw/zinc/03/81/45/171038145.db2.gz	FPBAASCUDISVGH-UHFFFAOYSA-N	1	0	290.411	1.754	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2ccc(=O)[nH]n2)CCCCCC1	ZINC000021200105	171299410	/nfs/dbraw/zinc/29/94/10/171299410.db2.gz	KJDSQLFUDNZULX-UHFFFAOYSA-N	1	0	292.383	1.567	50	0		CDAARO
Cc1cccc(OCC(=O)NCCC[NH+](C)C)c1	ZINC000022170775	171367638	/nfs/dbraw/zinc/36/76/38/171367638.db2.gz	HXPHLCJRQQYFOI-UHFFFAOYSA-N	1	0	250.342	1.442	50	0		CDAARO
COc1ccccc1C[C@H](C)[NH2+][C@H]1CCS(=O)(=O)C1	ZINC000037509967	173243374	/nfs/dbraw/zinc/24/33/74/173243374.db2.gz	KGYVVSVHOHKTCK-AAEUAGOBSA-N	1	0	283.393	1.403	50	0		CDAARO
C[NH2+]CC(=O)N[C@@H](C)c1nc2c(s1)CCCC2	ZINC000071738855	176258241	/nfs/dbraw/zinc/25/82/41/176258241.db2.gz	LMHVWBHSHYSIIN-QMMMGPOBSA-N	1	0	253.371	1.419	50	0		CDAARO
Cc1ccc(O[C@@H](C)C(=O)NCC[NH+](C)C)c(C)c1	ZINC000072117304	176318802	/nfs/dbraw/zinc/31/88/02/176318802.db2.gz	JWDMOMURXGNCQU-ZDUSSCGKSA-N	1	0	264.369	1.749	50	0		CDAARO
CCCc1nc(C(=O)N2CC[C@@](O)(C[NH+](C)C)C2)cs1	ZINC000072150288	176326320	/nfs/dbraw/zinc/32/63/20/176326320.db2.gz	OVZDPQFAUMJMRD-CQSZACIVSA-N	1	0	297.424	1.234	50	0		CDAARO
CCc1cc(C[N@@H+]2CCCC[C@H]2CN2CCOCC2)on1	ZINC000077505895	177275944	/nfs/dbraw/zinc/27/59/44/177275944.db2.gz	MNOXXMKHFMTFEC-HNNXBMFYSA-N	1	0	293.411	1.924	50	0		CDAARO
CC[NH+]1CCN(c2nn3cnnc3c3ccccc32)CC1	ZINC000027795217	273667762	/nfs/dbraw/zinc/66/77/62/273667762.db2.gz	AEHUVUDYAIRKNU-UHFFFAOYSA-N	1	0	282.351	1.419	50	0		CDAARO
CCC[C@H]([NH3+])C(=O)N1CCOC[C@@H]1c1ccccc1	ZINC000376789930	276042777	/nfs/dbraw/zinc/04/27/77/276042777.db2.gz	PIGFLTSUJGSXSV-UONOGXRCSA-N	1	0	262.353	1.714	50	0		CDAARO
CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CCN2C(=O)NC[C@H]2C1	ZINC000249043855	276179807	/nfs/dbraw/zinc/17/98/07/276179807.db2.gz	DVCHTSDRHWOKMQ-MELADBBJSA-N	1	0	263.385	1.688	50	0		CDAARO
C[C@H](Cn1c(=O)[nH]c2ccccc2c1=O)[NH+]1CCCC1	ZINC000036398040	279140683	/nfs/dbraw/zinc/14/06/83/279140683.db2.gz	YLWIPZFYMNNVCC-LLVKDONJSA-N	1	0	273.336	1.174	50	0		CDAARO
CC[C@H](O)CN1C[C@H](CC)[N@H+](CC(C)(C)O)C[C@@H]1CC	ZINC000252500412	288113407	/nfs/dbraw/zinc/11/34/07/288113407.db2.gz	SVBXLJRYOZVQCU-KKUMJFAQSA-N	1	0	286.460	1.703	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F)[C@@H]1CC[NH2+]C1	ZINC000179125887	281837609	/nfs/dbraw/zinc/83/76/09/281837609.db2.gz	YRDHOFBTDRPKKO-YUSALJHKSA-N	1	0	280.318	1.889	50	0		CDAARO
Nc1nc(C2CC([NH3+])C2)cc(N2CCC(F)CC2)n1	ZINC000223040828	295366754	/nfs/dbraw/zinc/36/67/54/295366754.db2.gz	DZJCXFSNFWQPOZ-UHFFFAOYSA-N	1	0	265.336	1.202	50	0		CDAARO
[NH3+]CC[C@@H]1CCCCN1S(=O)(=O)c1cccs1	ZINC000020182135	303386182	/nfs/dbraw/zinc/38/61/82/303386182.db2.gz	CTDKNRUFDGPBSC-JTQLQIEISA-N	1	0	274.411	1.640	50	0		CDAARO
C[NH+](C)C[C@@H](O)CNC(=O)c1sccc1Cl	ZINC000534577608	328310350	/nfs/dbraw/zinc/31/03/50/328310350.db2.gz	FELBRELUWOOATP-ZETCQYMHSA-N	1	0	262.762	1.054	50	0		CDAARO
Cc1ccccc1OCCC(=O)N1C[C@H]2CC[C@@H](C1)[C@H]2[NH3+]	ZINC000534587690	328315955	/nfs/dbraw/zinc/31/59/55/328315955.db2.gz	BNLRRNUYQNBVJK-HALDLXJZSA-N	1	0	288.391	1.960	50	0		CDAARO
O=C(NC1CCN(c2ccccc2F)CC1)[C@@H]1C=CC[NH2+]1	ZINC000534642760	328329120	/nfs/dbraw/zinc/32/91/20/328329120.db2.gz	HTDDCAAQRQAWPI-AWEZNQCLSA-N	1	0	289.354	1.439	50	0		CDAARO
CC[N@H+](C)C[C@@H](C)CNC(=O)N(C)Cc1ccon1	ZINC000534637081	328334266	/nfs/dbraw/zinc/33/42/66/328334266.db2.gz	IKGASXVJFPYTHO-NSHDSACASA-N	1	0	268.361	1.404	50	0		CDAARO
C[C@@H]1CCC[N@H+](CCC(=O)NCC2(CO)CCCC2)C1	ZINC000534637116	328334280	/nfs/dbraw/zinc/33/42/80/328334280.db2.gz	YFLXRKIWMXOJDQ-CQSZACIVSA-N	1	0	282.428	1.777	50	0		CDAARO
CC[N@H+](C)C1(CNC(=O)c2cncnc2)CCCC1	ZINC000534639492	328335394	/nfs/dbraw/zinc/33/53/94/328335394.db2.gz	ZNNYMCDVYHMQMV-UHFFFAOYSA-N	1	0	262.357	1.471	50	0		CDAARO
C[NH+]1CCC(OCCCNC(=O)[C@]2(C)CCCCO2)CC1	ZINC000534651801	328337642	/nfs/dbraw/zinc/33/76/42/328337642.db2.gz	WNNMOWJTWBAKPB-INIZCTEOSA-N	1	0	298.427	1.563	50	0		CDAARO
Cc1cc(O)ccc1C(=O)N1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+]	ZINC000534667880	328346368	/nfs/dbraw/zinc/34/63/68/328346368.db2.gz	ILNHEESEIXAMFM-GNXNZQSNSA-N	1	0	260.337	1.510	50	0		CDAARO
COc1cccc(S(=O)(=O)NC(C)(C)C[NH+](C)C)c1	ZINC000534661867	328349415	/nfs/dbraw/zinc/34/94/15/328349415.db2.gz	QBSPTRMZONZQOC-UHFFFAOYSA-N	1	0	286.397	1.314	50	0		CDAARO
CCc1ccc(C(=O)N[C@H]2COC[C@@H]2[NH+]2CCCC2)[nH]1	ZINC000534671629	328347736	/nfs/dbraw/zinc/34/77/36/328347736.db2.gz	AJYGWYSJTYQTQI-KBPBESRZSA-N	1	0	277.368	1.170	50	0		CDAARO
O=C(/C=C/c1ccccc1)N[C@H]1COC[C@@H]1[NH+]1CCCC1	ZINC000534675324	328355992	/nfs/dbraw/zinc/35/59/92/328355992.db2.gz	LFDDZXDWZWUMEH-FHQWLQQXSA-N	1	0	286.375	1.679	50	0		CDAARO
CN(C)S(=O)(=O)CCC[NH2+][C@H]1CCCCC1(C)C	ZINC000119917667	323208652	/nfs/dbraw/zinc/20/86/52/323208652.db2.gz	TVMIFNSQOPADBY-LBPRGKRZSA-N	1	0	276.446	1.826	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+]C[C@@]2(O)CCSC2)C1(C)C	ZINC000195550640	323571592	/nfs/dbraw/zinc/57/15/92/323571592.db2.gz	SBTKSQKGXAZLJR-WZRBSPASSA-N	1	0	259.415	1.648	50	0		CDAARO
[NH3+]CCc1ccc(C(=O)NCCC[C@@H]2CCOC2)cc1	ZINC000401986897	328450904	/nfs/dbraw/zinc/45/09/04/328450904.db2.gz	DQLUJDZUHWLOSS-CQSZACIVSA-N	1	0	276.380	1.734	50	0		CDAARO
Cc1nc(C(=O)N2CCCC[C@@H]2[C@@H](C)[NH3+])cs1	ZINC000087428990	330373057	/nfs/dbraw/zinc/37/30/57/330373057.db2.gz	ARQJCOWHKDSIHB-LDYMZIIASA-N	1	0	253.371	1.793	50	0		CDAARO
CCn1c(Cn2cncn2)nnc1C1CC[NH+](CC)CC1	ZINC000091943445	482592901	/nfs/dbraw/zinc/59/29/01/482592901.db2.gz	YRDIKZWADBKJKI-UHFFFAOYSA-N	1	0	289.387	1.137	50	0		CDAARO
COc1ccccc1N1CCN(c2ncccc2C[NH3+])CC1	ZINC000022263649	482665137	/nfs/dbraw/zinc/66/51/37/482665137.db2.gz	VCCABYVYLPNGBV-UHFFFAOYSA-N	1	0	298.390	1.876	50	0		CDAARO
C[C@H](CCCC(C)(C)O)CC[N@@H+]1CCCNC(=O)C1	ZINC000670435510	482971446	/nfs/dbraw/zinc/97/14/46/482971446.db2.gz	UEFIFWMVDMNRMX-CYBMUJFWSA-N	1	0	270.417	1.776	50	0		CDAARO
CCOC(=O)N1CC[C@H]([NH2+]CCc2noc(C(C)C)n2)C1	ZINC000670443394	482988056	/nfs/dbraw/zinc/98/80/56/482988056.db2.gz	NGGRMAZNYFCQTM-NSHDSACASA-N	1	0	296.371	1.556	50	0		CDAARO
CN(C(=O)C[N@H+](C)C[C@@H]1CC(=O)N(C)C1)C1CCCCC1	ZINC000670465121	483055500	/nfs/dbraw/zinc/05/55/00/483055500.db2.gz	VYKVEFBPNVTUOV-ZDUSSCGKSA-N	1	0	295.427	1.188	50	0		CDAARO
COc1ccccc1N1CC[C@H]([NH2+]C2CCOCC2)C1=O	ZINC000090392525	483233031	/nfs/dbraw/zinc/23/30/31/483233031.db2.gz	SQLXMBMHCWNOHC-ZDUSSCGKSA-N	1	0	290.363	1.569	50	0		CDAARO
O=c1cc([C@H]2C[C@@H]([NH2+]C3CCOCC3)C2)nc(C2CC2)[nH]1	ZINC000220519004	534319076	/nfs/dbraw/zinc/31/90/76/534319076.db2.gz	DMUMEDZZBKNFGA-AULYBMBSSA-N	1	0	289.379	1.662	50	0		CDAARO
C[C@@H]1CC[C@@H](c2ccc(NS(C)(=O)=O)cc2)C[NH2+]1	ZINC000757216178	577036323	/nfs/dbraw/zinc/03/63/23/577036323.db2.gz	YFZMMQOOIVEXHT-ZYHUDNBSSA-N	1	0	268.382	1.914	50	0		CDAARO
CC(C)[N@@H+]1CC[C@H](C[NH+](C)CCn2cccn2)C1	ZINC000299766555	678313356	/nfs/dbraw/zinc/31/33/56/678313356.db2.gz	PAGGXAJGAPIEGD-CQSZACIVSA-N	1	0	250.390	1.545	50	0		CDAARO
CCCC1(CO)CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1	ZINC000952962919	614895762	/nfs/dbraw/zinc/89/57/62/614895762.db2.gz	DIVJSFNRQNFNDX-ZDUSSCGKSA-N	1	0	268.401	1.482	50	0		CDAARO
CCOCC[N@H+]1CC=C(CN(CC)C(C)=O)CC1	ZINC000065417797	678809028	/nfs/dbraw/zinc/80/90/28/678809028.db2.gz	LFKFMARFRNLOFA-UHFFFAOYSA-N	1	0	254.374	1.523	50	0		CDAARO
C[NH+](C)CCn1nccc1C(=O)Nc1ccccc1F	ZINC000864056347	678162877	/nfs/dbraw/zinc/16/28/77/678162877.db2.gz	BIQYRRZNABWBCO-UHFFFAOYSA-N	1	0	276.315	1.836	50	0		CDAARO
COCCn1cc(NC(=O)C(C)(C)[NH+]2CCCCC2)cn1	ZINC000863948179	678323035	/nfs/dbraw/zinc/32/30/35/678323035.db2.gz	QHLUXQJADJSSJP-UHFFFAOYSA-N	1	0	294.399	1.733	50	0		CDAARO
O=C1C[C@H]2CC[C@@H](CN1)[N@@H+]2C1CSCCSC1	ZINC000065371716	678341680	/nfs/dbraw/zinc/34/16/80/678341680.db2.gz	YXDRQLOECPQIEB-ZJUUUORDSA-N	1	0	272.439	1.188	50	0		CDAARO
CN(CCC[C@@H]1CCCO1)Cc1cc2n(n1)CC[NH2+]C2	ZINC000072153831	678903860	/nfs/dbraw/zinc/90/38/60/678903860.db2.gz	PBYWPJPDINUZQU-OAHLLOKOSA-N	1	0	278.400	1.377	50	0		CDAARO
Cc1cc(C)cc(NC(=O)N2C[C@H]3C[NH2+]C[C@]3(CO)C2)c1	ZINC001772709352	1159444140	/nfs/dbraw/zinc/44/41/40/1159444140.db2.gz	IXBQSBIRTZGNKX-CZUORRHYSA-N	1	0	289.379	1.349	50	0		CDAARO
Cc1nc(N)nc(N[C@@H]2CCC[C@H]2[NH+](C)C)c1Cl	ZINC001506431650	909211331	/nfs/dbraw/zinc/21/13/31/909211331.db2.gz	TYQZNCRMIZELPM-RKDXNWHRSA-N	1	0	269.780	1.915	50	0		CDAARO
C[N@@H+]1C[C@H](C(=O)Nc2c[nH]ccc2=O)[C@@H](C(F)(F)F)C1	ZINC000952880132	910440998	/nfs/dbraw/zinc/44/09/98/910440998.db2.gz	BRSNONYTFKMKPW-YUMQZZPRSA-N	1	0	289.257	1.054	50	0		CDAARO
CSc1ncc(C[NH+]2CCC3(CCO3)CC2)cn1	ZINC001138706431	936559637	/nfs/dbraw/zinc/55/96/37/936559637.db2.gz	YIHXKYRGIIQHJD-UHFFFAOYSA-N	1	0	265.382	1.953	50	0		CDAARO
Cc1nn(C)c(C)c1C(=O)N1CCC[N@@H+](C2CCC2)CC1	ZINC000825290566	925860698	/nfs/dbraw/zinc/86/06/98/925860698.db2.gz	VXHVHSFUZZCTQH-UHFFFAOYSA-N	1	0	290.411	1.737	50	0		CDAARO
O=C(c1cccc2c1CCC2=O)N1CCC[NH2+]CC1	ZINC000828177515	926059795	/nfs/dbraw/zinc/05/97/95/926059795.db2.gz	LHIXBVJZWXZFLU-UHFFFAOYSA-N	1	0	258.321	1.251	50	0		CDAARO
O=C(NC[C@H]1CCCN(c2cc[nH+]cc2)C1)c1ccon1	ZINC000828228719	926088876	/nfs/dbraw/zinc/08/88/76/926088876.db2.gz	FOCOEADWGGVEKS-GFCCVEGCSA-N	1	0	286.335	1.716	50	0		CDAARO
CN(Cc1cnccc1Cl)C[C@H]1CCC[N@H+](CCO)C1	ZINC000828760434	926187822	/nfs/dbraw/zinc/18/78/22/926187822.db2.gz	OCIQDBAQRPXWBB-CYBMUJFWSA-N	1	0	297.830	1.871	50	0		CDAARO
O=C(NCc1nccs1)[C@H]1CC[C@@H]2CCCC[N@H+]12	ZINC000585122141	930988214	/nfs/dbraw/zinc/98/82/14/930988214.db2.gz	OMFJSSWRPHVFCR-WDEREUQCSA-N	1	0	265.382	1.776	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(NCC2(C)COC2)c1C	ZINC001529113722	968983651	/nfs/dbraw/zinc/98/36/51/968983651.db2.gz	IHRYXBQHVHZNTF-UHFFFAOYSA-N	1	0	250.346	1.608	50	0		CDAARO
CSc1nc(N)cc(N[C@@H]2CCC[C@H]2[NH+](C)C)n1	ZINC001506396488	975147794	/nfs/dbraw/zinc/14/77/94/975147794.db2.gz	BGJBBDSBXYYLCF-RKDXNWHRSA-N	1	0	267.402	1.675	50	0		CDAARO
COc1nccnc1N(C)C[C@@H]1CC[N@H+](C)C1(C)C	ZINC001506404048	975150184	/nfs/dbraw/zinc/15/01/84/975150184.db2.gz	FLIADSZIWYQIBB-NSHDSACASA-N	1	0	264.373	1.652	50	0		CDAARO
COc1cc(C(=O)N(C)C[C@H](C)C[NH+]2CCCC2)ccn1	ZINC001506404971	975151481	/nfs/dbraw/zinc/15/14/81/975151481.db2.gz	SVBLTKDWBPHALN-ZDUSSCGKSA-N	1	0	291.395	1.894	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN(c2ncccc2F)C1	ZINC001506412727	975154553	/nfs/dbraw/zinc/15/45/53/975154553.db2.gz	MSYLGCVTMXLLJZ-NSHDSACASA-N	1	0	253.321	1.235	50	0		CDAARO
Cc1nnc(N2CC[C@H]([NH+](C)C)[C@@H](O)C2)c2ccccc12	ZINC001506418975	975156964	/nfs/dbraw/zinc/15/69/64/975156964.db2.gz	LIWFSFDWSKYQGH-GJZGRUSLSA-N	1	0	286.379	1.439	50	0		CDAARO
C[C@@H](CCN(C)c1nccnc1N(C)C)[NH+]1CCCC1	ZINC001506419061	975157222	/nfs/dbraw/zinc/15/72/22/975157222.db2.gz	WOGPJDYUMPOJQF-ZDUSSCGKSA-N	1	0	277.416	1.853	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N(Cc1cnn(C)c1)C(C)C	ZINC001506421775	975158216	/nfs/dbraw/zinc/15/82/16/975158216.db2.gz	JSHQTXVDDJTGRA-LBPRGKRZSA-N	1	0	284.429	1.238	50	0		CDAARO
O[C@H]1COC[C@@H]1[NH2+]C1CCN(c2ccc(F)c(F)c2)CC1	ZINC001506423211	975159131	/nfs/dbraw/zinc/15/91/31/975159131.db2.gz	UIPWHVDHJRKVEQ-GJZGRUSLSA-N	1	0	298.333	1.283	50	0		CDAARO
CCN(CC[NH+]1CCCC1)C(=O)c1cc(C)c(C)[nH]c1=O	ZINC001506427668	975160603	/nfs/dbraw/zinc/16/06/03/975160603.db2.gz	MBHNKMVNJHLYNZ-UHFFFAOYSA-N	1	0	291.395	1.962	50	0		CDAARO
NC(=O)COc1ccc(C[NH+]2CCCC2)cc1Cl	ZINC000215061435	1163197822	/nfs/dbraw/zinc/19/78/22/1163197822.db2.gz	HGGJOWGNCDQJDQ-UHFFFAOYSA-N	1	0	268.744	1.800	50	0		CDAARO
CN(C[C@H]1CC[N@H+](C)C1(C)C)C(=O)c1cncc(O)c1	ZINC000584903127	341986614	/nfs/dbraw/zinc/98/66/14/341986614.db2.gz	FASGUCHWKFAAGV-GFCCVEGCSA-N	1	0	277.368	1.590	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@H](NC(=O)[C@H]2CC[C@@H](O)CC2)C1	ZINC000584902389	341986877	/nfs/dbraw/zinc/98/68/77/341986877.db2.gz	RILJPOZSAGSILK-RWMBFGLXSA-N	1	0	268.401	1.527	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](c2nc(-c3cccnn3)no2)C1	ZINC000095516938	185002882	/nfs/dbraw/zinc/00/28/82/185002882.db2.gz	JZWZXUMGQBDPHY-NSHDSACASA-N	1	0	289.339	1.352	50	0		CDAARO
Nc1nc(NCCCc2ccncc2)cc(C2CC([NH3+])C2)n1	ZINC000222840439	230398526	/nfs/dbraw/zinc/39/85/26/230398526.db2.gz	PTEYUIXMSYLLKJ-UHFFFAOYSA-N	1	0	298.394	1.703	50	0		CDAARO
Cn1c(SC[C@H]2CCCOC2)nnc1C1CC[NH2+]CC1	ZINC000426635236	230425193	/nfs/dbraw/zinc/42/51/93/230425193.db2.gz	DIEUOFSLDXOOBI-NSHDSACASA-N	1	0	296.440	1.801	50	0		CDAARO
C[C@H]([NH2+]CC(=O)NCc1ccccn1)c1ccncc1	ZINC000097370705	342002172	/nfs/dbraw/zinc/00/21/72/342002172.db2.gz	FDRKYYZVUDCPQJ-LBPRGKRZSA-N	1	0	270.336	1.444	50	0		CDAARO
COC(=O)CC[NH+]1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000095828982	185029142	/nfs/dbraw/zinc/02/91/42/185029142.db2.gz	JJXOONYNOVPAIU-UHFFFAOYSA-N	1	0	286.372	1.539	50	0		CDAARO
Cn1nnnc1SCC[N@H+](C)Cc1ccc(F)cc1	ZINC000097377168	342003084	/nfs/dbraw/zinc/00/30/84/342003084.db2.gz	IPUMYPRUEHUFRC-UHFFFAOYSA-N	1	0	281.360	1.573	50	0		CDAARO
CC1CC[NH+](CCCCNC(=O)Nc2ncnn2C)CC1	ZINC000095977112	185052277	/nfs/dbraw/zinc/05/22/77/185052277.db2.gz	MBXDHMCEUQMJGG-UHFFFAOYSA-N	1	0	294.403	1.449	50	0		CDAARO
O=C(N[C@@H]1CC[N@@H+](C2CC2)C1)c1cccn1C1CC1	ZINC000095994949	185060458	/nfs/dbraw/zinc/06/04/58/185060458.db2.gz	BZWBHEUZTFFWRP-LLVKDONJSA-N	1	0	259.353	1.790	50	0		CDAARO
C[C@@H](Cn1cccn1)[NH2+]Cc1cc(F)ncc1F	ZINC000239527562	361745358	/nfs/dbraw/zinc/74/53/58/361745358.db2.gz	ASZMSEDAPGOLCQ-VIFPVBQESA-N	1	0	252.268	1.735	50	0		CDAARO
CC(C)[C@@H](C[NH2+]Cc1cncnc1)c1ccnn1C	ZINC000241587958	361752987	/nfs/dbraw/zinc/75/29/87/361752987.db2.gz	OYKCQFWCOGUPGR-CYBMUJFWSA-N	1	0	259.357	1.740	50	0		CDAARO
Cc1ccc(C)c(OCCOCCNCC[NH3+])c1C	ZINC000022034177	342088949	/nfs/dbraw/zinc/08/89/49/342088949.db2.gz	ZDEKUHWGFOGUPH-UHFFFAOYSA-N	1	0	266.385	1.556	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)c1cccc(-c2ccoc2)c1	ZINC000195554007	342625764	/nfs/dbraw/zinc/62/57/64/342625764.db2.gz	NZFXMJRUQMOQPE-CABCVRRESA-N	1	0	286.331	1.663	50	0		CDAARO
O=S1(=O)CC[C@@H](C[NH2+][C@@H]2CCc3ccc(F)cc32)C1	ZINC000095419619	539087956	/nfs/dbraw/zinc/08/79/56/539087956.db2.gz	HDHVKYHTZIWKFY-IINYFYTJSA-N	1	0	283.368	1.837	50	0		CDAARO
C[C@@H]1C[N@H+](C[C@H]2CCCO2)CC[C@H]1NC(=O)NC(C)(C)C	ZINC000252477251	361840253	/nfs/dbraw/zinc/84/02/53/361840253.db2.gz	KVWQMJHJSBYUBJ-MGPQQGTHSA-N	1	0	297.443	1.974	50	0		CDAARO
[NH3+][C@H]1C[C@H](c2nnc(Cn3ccc(C4CC4)n3)n2C2CC2)C1	ZINC000244758099	361861957	/nfs/dbraw/zinc/86/19/57/361861957.db2.gz	OSJFPNMXECQDLI-HAQNSBGRSA-N	1	0	298.394	1.940	50	0		CDAARO
CN(C)C(=O)[C@H]1CC[C@@H](C[NH2+]C2Cc3ccccc3C2)O1	ZINC000097033467	185155718	/nfs/dbraw/zinc/15/57/18/185155718.db2.gz	UMSTUHBHFYQIIF-JKSUJKDBSA-N	1	0	288.391	1.379	50	0		CDAARO
C[C@@H]([NH2+][C@@H]1CCC(=O)N(C)C1)c1cccc(CO)c1	ZINC000097035123	185157453	/nfs/dbraw/zinc/15/74/53/185157453.db2.gz	YIFWYGUIGLDVPA-BXUZGUMPSA-N	1	0	262.353	1.450	50	0		CDAARO
C[C@@H]1C[C@@H](N2CC[C@H](CNc3ccccn3)C2)C(=O)O1	ZINC000097200653	342217135	/nfs/dbraw/zinc/21/71/35/342217135.db2.gz	QBQYGQJINRHXCR-JHJVBQTASA-N	1	0	275.352	1.519	50	0		CDAARO
CCc1ncc(C(=O)N[C@H]2CCc3nc(C)cn3C2)s1	ZINC000097198832	342217167	/nfs/dbraw/zinc/21/71/67/342217167.db2.gz	XQVHOKPBZVTNKI-JTQLQIEISA-N	1	0	290.392	1.955	50	0		CDAARO
C[C@H]([NH2+]CCCNc1ccccc1)c1cnnn1C	ZINC000585134583	342215554	/nfs/dbraw/zinc/21/55/54/342215554.db2.gz	AVEQMTWWRWWCLW-LBPRGKRZSA-N	1	0	259.357	1.968	50	0		CDAARO
CSc1ccc(NC(=O)NC[C@]2(O)CC[NH2+]C2)cc1	ZINC000299801215	539055510	/nfs/dbraw/zinc/05/55/10/539055510.db2.gz	WJRFIZLJRPEGQV-ZDUSSCGKSA-N	1	0	281.381	1.254	50	0		CDAARO
Cc1cccc(-n2cc(C(=O)N3CC[NH2+]C[C@@H]3C)nn2)c1	ZINC000125760438	187199190	/nfs/dbraw/zinc/19/91/90/187199190.db2.gz	WERAZFGCWJNJHR-LBPRGKRZSA-N	1	0	285.351	1.010	50	0		CDAARO
CC[C@@H]1[C@@H](C(=O)N2CC[C@@H](O)CC(C)(C)C2)CC[N@@H+]1C	ZINC000585131466	362056829	/nfs/dbraw/zinc/05/68/29/362056829.db2.gz	WXWAJKNRJJKRAQ-HZSPNIEDSA-N	1	0	282.428	1.726	50	0		CDAARO
COC(=O)[C@@H]1CC[N@H+](C[C@H](O)C(F)(F)F)C[C@H]1C	ZINC000249088690	362230544	/nfs/dbraw/zinc/23/05/44/362230544.db2.gz	NOFMBKAGFXNTPR-HLTSFMKQSA-N	1	0	269.263	1.041	50	0		CDAARO
Cc1nn(C)c(N(C)C)c1CN[C@H]1CC[N@@H+]2CCCC[C@@H]12	ZINC000229306791	282268582	/nfs/dbraw/zinc/26/85/82/282268582.db2.gz	JXDYRIPWIBUNIM-GJZGRUSLSA-N	1	0	291.443	1.511	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)COc2cc(C)ccc2C)C1	ZINC000179003243	362251007	/nfs/dbraw/zinc/25/10/07/362251007.db2.gz	DSHMTANFMSBRQX-CQSZACIVSA-N	1	0	276.380	1.750	50	0		CDAARO
Cc1c(Cl)cccc1OCC(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179115110	362252144	/nfs/dbraw/zinc/25/21/44/362252144.db2.gz	UHUNNTTXJXUVLJ-NSHDSACASA-N	1	0	282.771	1.848	50	0		CDAARO
CN(C[C@@H]1CC[N@H+](C)C1)C(=O)Cc1ccsc1	ZINC000223888740	529954405	/nfs/dbraw/zinc/95/44/05/529954405.db2.gz	CFXFKFCALAJIPC-GFCCVEGCSA-N	1	0	252.383	1.701	50	0		CDAARO
CCCC[N@H+](CC)CCn1c(=O)cc(C)[nH]c1=O	ZINC000253536280	362434827	/nfs/dbraw/zinc/43/48/27/362434827.db2.gz	MLXAECMEFSBOJT-UHFFFAOYSA-N	1	0	253.346	1.379	50	0		CDAARO
CC[NH+](CC)CCOC(=O)c1ccccc1C(=O)OC	ZINC000033645986	344960360	/nfs/dbraw/zinc/96/03/60/344960360.db2.gz	NUUNQOLVOABWEI-UHFFFAOYSA-N	1	0	279.336	1.972	50	0		CDAARO
COC(=O)[C@H](CCCC[NH+](C)C)NC(=O)OC(C)(C)C	ZINC000097756880	185661407	/nfs/dbraw/zinc/66/14/07/185661407.db2.gz	ZVBNCZSCAKJIMI-NSHDSACASA-N	1	0	288.388	1.785	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN1C(=O)CCC1CCCC1	ZINC000085469767	179075121	/nfs/dbraw/zinc/07/51/21/179075121.db2.gz	ACRSWSCERFFZJJ-CQSZACIVSA-N	1	0	268.401	1.746	50	0		CDAARO
Cc1nc(N(C)C)cc(NCCNC(=O)C2CCCC2)[nH+]1	ZINC000036708042	362834750	/nfs/dbraw/zinc/83/47/50/362834750.db2.gz	QHFHOPCLWCYOMR-UHFFFAOYSA-N	1	0	291.399	1.569	50	0		CDAARO
CCCCS(=O)(=O)NCC1([NH+](C)C)CCCC1	ZINC000064944952	348949596	/nfs/dbraw/zinc/94/95/96/348949596.db2.gz	BGNZZHCLGGOPEC-UHFFFAOYSA-N	1	0	262.419	1.580	50	0		CDAARO
CC[NH+]1CCN(CC(=O)NCCC2=CCCCC2)CC1	ZINC000069537229	349104411	/nfs/dbraw/zinc/10/44/11/349104411.db2.gz	DOULAZBETBIRES-UHFFFAOYSA-N	1	0	279.428	1.631	50	0		CDAARO
Cc1ccccc1N1CCC([NH2+][C@H]2CCCNC2=O)CC1	ZINC000584896275	349357230	/nfs/dbraw/zinc/35/72/30/349357230.db2.gz	GZTGZLRHGHOTJV-HNNXBMFYSA-N	1	0	287.407	1.832	50	0		CDAARO
CCC[C@@H](CNc1ncc(C)c(N(C)C)n1)[NH+](C)C	ZINC000584896867	349357977	/nfs/dbraw/zinc/35/79/77/349357977.db2.gz	YUDCEUNFJOBJBH-LBPRGKRZSA-N	1	0	265.405	1.993	50	0		CDAARO
CC(C)C[NH+]1CCN(C(=O)CCCN2CCCC2=O)CC1	ZINC000584897070	349358157	/nfs/dbraw/zinc/35/81/57/349358157.db2.gz	YJXYRNJCWDUFKP-UHFFFAOYSA-N	1	0	295.427	1.189	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@@H](CN(C)C(=O)c2cncnc2)C1	ZINC000584886378	349344997	/nfs/dbraw/zinc/34/49/97/349344997.db2.gz	FOYNJVIRWRLWFF-ZDUSSCGKSA-N	1	0	276.384	1.669	50	0		CDAARO
CC(C)(C[NH2+][C@H]1CCNC(=O)CC1)N1CCCC1	ZINC000584897077	349358302	/nfs/dbraw/zinc/35/83/02/349358302.db2.gz	DZEYVTNXSDSKHU-GFCCVEGCSA-N	1	0	253.390	1.119	50	0		CDAARO
CC(C)O[C@H]1C[N@@H+](C2CSCCSC2)C[C@@H]1O	ZINC000584896576	349358458	/nfs/dbraw/zinc/35/84/58/349358458.db2.gz	LOIGGSWTRYNIFJ-RYUDHWBXSA-N	1	0	277.455	1.305	50	0		CDAARO
CC(C)[NH+]1CCC(CNC(=O)C[C@@H]2CCOC2)CC1	ZINC000584890218	349349533	/nfs/dbraw/zinc/34/95/33/349349533.db2.gz	OYASTOAQHHUPCA-AWEZNQCLSA-N	1	0	268.401	1.650	50	0		CDAARO
CCC[N@@H+]1CC[C@@H](Cn2cnc3cccnc3c2=O)C1	ZINC000584891240	349350110	/nfs/dbraw/zinc/35/01/10/349350110.db2.gz	YIXILDHKUQNRAM-GFCCVEGCSA-N	1	0	272.352	1.523	50	0		CDAARO
CC[C@H](CNC(=O)NCc1cc[nH]n1)[NH+]1CCCC1	ZINC000089943411	179889043	/nfs/dbraw/zinc/88/90/43/179889043.db2.gz	MQPMAVFNBRACIS-GFCCVEGCSA-N	1	0	265.361	1.083	50	0		CDAARO
O=C(CN1CCC[N@H+](CC2CCC2)CC1)N1CCCC1	ZINC000089819051	179870810	/nfs/dbraw/zinc/87/08/10/179870810.db2.gz	IEUWZTZUGOTUCF-UHFFFAOYSA-N	1	0	279.428	1.417	50	0		CDAARO
C[NH+](C)C[C@@H]1CSCCCN1C(=O)C(C)(C)C	ZINC000090699753	180027844	/nfs/dbraw/zinc/02/78/44/180027844.db2.gz	USURIPCUOHKPLI-LLVKDONJSA-N	1	0	258.431	1.928	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc3c(c2)CCO3)C[C@H]1CCO	ZINC000104640997	186011352	/nfs/dbraw/zinc/01/13/52/186011352.db2.gz	FIIANGNLMSWUIL-OAHLLOKOSA-N	1	0	276.380	1.120	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)c2ccncc2Cl)C1	ZINC000091456811	180160313	/nfs/dbraw/zinc/16/03/13/180160313.db2.gz	FAZVBBAPJRHNBM-JTQLQIEISA-N	1	0	267.760	1.807	50	0		CDAARO
CCC[C@]1(CO)CCC[N@H+](CCC(=O)N2CCCC2)C1	ZINC000091604930	180204646	/nfs/dbraw/zinc/20/46/46/180204646.db2.gz	XGZAIUINPKDVAL-INIZCTEOSA-N	1	0	282.428	1.874	50	0		CDAARO
CN1CC[NH+](C2(CNc3ccncn3)CCCC2)CC1	ZINC000091713847	180231616	/nfs/dbraw/zinc/23/16/16/180231616.db2.gz	PLPSVGFAZOEPRR-UHFFFAOYSA-N	1	0	275.400	1.449	50	0		CDAARO
Cc1cc(C)n(CCC[N@@H+]2CC(C)(C)[C@@](C)(O)C2)n1	ZINC000091807112	180260365	/nfs/dbraw/zinc/26/03/65/180260365.db2.gz	UPZMYGLNXFHJKF-HNNXBMFYSA-N	1	0	265.401	1.983	50	0		CDAARO
CCO[C@H](CC)C(=O)N1C[C@H]2CCCC[N@@H+]2C[C@H]1C	ZINC000252512209	350386002	/nfs/dbraw/zinc/38/60/02/350386002.db2.gz	OBYQYPIBXJNZMM-MGPQQGTHSA-N	1	0	268.401	1.887	50	0		CDAARO
O=C(COC1CC[NH2+]CC1)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000111797110	186458332	/nfs/dbraw/zinc/45/83/32/186458332.db2.gz	ZJLRJVUUOZSKCQ-HUUCEWRRSA-N	1	0	274.364	1.427	50	0		CDAARO
OCCC[NH2+]Cc1cc(Cl)c2c(c1)OCCO2	ZINC000036804097	363156617	/nfs/dbraw/zinc/15/66/17/363156617.db2.gz	OTEWDELTDJRZEB-UHFFFAOYSA-N	1	0	257.717	1.583	50	0		CDAARO
O=C([C@@H]1C[C@H](O)C[NH2+]1)N1CCC(Cc2ccccc2)CC1	ZINC000036963185	363302047	/nfs/dbraw/zinc/30/20/47/363302047.db2.gz	LRCUBBGXTFLPIY-HOTGVXAUSA-N	1	0	288.391	1.191	50	0		CDAARO
CNC(=O)Oc1ccc(OCc2cccc[n+]2C)cc1	ZINC000000387352	355907936	/nfs/dbraw/zinc/90/79/36/355907936.db2.gz	UEAONONWDJNHSM-UHFFFAOYSA-O	1	0	273.312	1.808	50	0		CDAARO
O=c1c(Cl)c(N2CC[NH2+]CC2)cnn1-c1ccccc1	ZINC000000151447	355891745	/nfs/dbraw/zinc/89/17/45/355891745.db2.gz	YPCRZRLLNDTCOR-UHFFFAOYSA-N	1	0	290.754	1.296	50	0		CDAARO
O=C(COc1ccc(F)cc1)O[C@@H]1C[NH+]2CCC1CC2	ZINC000000203551	355896607	/nfs/dbraw/zinc/89/66/07/355896607.db2.gz	XHPLXOQGCDRAHV-CQSZACIVSA-N	1	0	279.311	1.842	50	0		CDAARO
CCOC(=O)C[C@H]([NH3+])c1cc(OC)cc(OC)c1	ZINC000002545039	355974217	/nfs/dbraw/zinc/97/42/17/355974217.db2.gz	PRMOXKMXQABQKA-LBPRGKRZSA-N	1	0	253.298	1.657	50	0		CDAARO
CC[NH+](CC)CCOC(=O)COc1ccc(OC)cc1	ZINC000002009578	355957177	/nfs/dbraw/zinc/95/71/77/355957177.db2.gz	CDOHBQBWALXALM-UHFFFAOYSA-N	1	0	281.352	1.959	50	0		CDAARO
COC(=O)[C@H](CC(C)C)NC(=O)[C@H]([NH3+])CC(C)C	ZINC000004556760	356035950	/nfs/dbraw/zinc/03/59/50/356035950.db2.gz	AJMOLNFDYWTVQW-MNOVXSKESA-N	1	0	258.362	1.064	50	0		CDAARO
COCc1cc(C(=O)N(C)[C@H]2CC[NH2+]C2)ccc1F	ZINC000299738519	356263883	/nfs/dbraw/zinc/26/38/83/356263883.db2.gz	BWMZOMSXVAOEKH-LBPRGKRZSA-N	1	0	266.316	1.406	50	0		CDAARO
CCO[C@@H]1C[C@@H](N(C)C(=O)C[NH2+]C[C@H]2CCCO2)C1(C)C	ZINC000299739934	356275300	/nfs/dbraw/zinc/27/53/00/356275300.db2.gz	TVIRZGJINSTGHT-MGPQQGTHSA-N	1	0	298.427	1.417	50	0		CDAARO
COc1cccc(OC[C@@H](O)C[NH2+]C2CCCC2)c1	ZINC000004320497	356242976	/nfs/dbraw/zinc/24/29/76/356242976.db2.gz	SHHURLJGQDGSSL-ZDUSSCGKSA-N	1	0	265.353	1.967	50	0		CDAARO
CC(C)CNC(=O)[C@@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000012473964	356301242	/nfs/dbraw/zinc/30/12/42/356301242.db2.gz	VXJPQVZMRDVLRS-CQSZACIVSA-N	1	0	281.444	1.565	50	0		CDAARO
C[C@@H]1CCC[N@H+](C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000013154393	356340306	/nfs/dbraw/zinc/34/03/06/356340306.db2.gz	HCCKNZYVNMCZOW-CHWSQXEVSA-N	1	0	293.363	1.887	50	0		CDAARO
Cc1ccc(OCC(=O)N2CCC[N@@H+](C)CC2)cc1	ZINC000013323128	356343049	/nfs/dbraw/zinc/34/30/49/356343049.db2.gz	JWQGQLXHZZWUGB-UHFFFAOYSA-N	1	0	262.353	1.538	50	0		CDAARO
COc1cc(C[NH2+]Cc2ccccn2)ccc1OCCO	ZINC000013730946	356354730	/nfs/dbraw/zinc/35/47/30/356354730.db2.gz	RGFALMZNAIXLLH-UHFFFAOYSA-N	1	0	288.347	1.751	50	0		CDAARO
C[C@@H](C(N)=O)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000032652210	356329982	/nfs/dbraw/zinc/32/99/82/356329982.db2.gz	SUSHMTQXTFULRW-GPAKFWEMSA-N	1	0	273.380	1.191	50	0		CDAARO
CCN(CC)C(=O)CN(C)Cc1ccc(C(N)=O)cc1	ZINC000014230325	356381057	/nfs/dbraw/zinc/38/10/57/356381057.db2.gz	WTJFLVWXQAXBNE-UHFFFAOYSA-N	1	0	277.368	1.086	50	0		CDAARO
O=C1NC(=O)C2(CC[NH+](Cc3ccccc3)CC2)N1	ZINC000019256058	356478064	/nfs/dbraw/zinc/47/80/64/356478064.db2.gz	ISFXLJGTXHSNDU-UHFFFAOYSA-N	1	0	259.309	1.701	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1cc(N)ccc1Cl	ZINC000019260427	356478622	/nfs/dbraw/zinc/47/86/22/356478622.db2.gz	MHDKMRSSHCIOKM-UHFFFAOYSA-N	1	0	269.776	1.994	50	0		CDAARO
O=C(C[NH+]1CCCC1)NCC1(c2ccccc2)CC1	ZINC000025418547	356675443	/nfs/dbraw/zinc/67/54/43/356675443.db2.gz	BNKGLFBIHXXNEB-UHFFFAOYSA-N	1	0	258.365	1.930	50	0		CDAARO
C[C@@H]1CN(C(=O)CN2CCc3ccccc3C2)C[C@H](C)O1	ZINC000032819261	356681461	/nfs/dbraw/zinc/68/14/61/356681461.db2.gz	YXFJXHIWHYHDEO-OKILXGFUSA-N	1	0	288.391	1.681	50	0		CDAARO
C[C@H]([N@H+](C)CC(=O)NC(=O)NC(C)(C)C)C(C)(C)C	ZINC000027133390	356703953	/nfs/dbraw/zinc/70/39/53/356703953.db2.gz	FQWXZEGDVRQMLU-JTQLQIEISA-N	1	0	271.405	1.977	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]Cc2nonc2C)CC1	ZINC000070261633	356742325	/nfs/dbraw/zinc/74/23/25/356742325.db2.gz	VVNUXRMEWPUCAZ-UHFFFAOYSA-N	1	0	268.317	1.089	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]C[C@H]2CCCO2)CC1	ZINC000000757662	356734409	/nfs/dbraw/zinc/73/44/09/356734409.db2.gz	UENAQCDMPDETAM-GFCCVEGCSA-N	1	0	256.346	1.376	50	0		CDAARO
CCc1ccccc1O[C@@H](C)C(=O)N1CC[NH2+]CC1	ZINC000032023178	356773456	/nfs/dbraw/zinc/77/34/56/356773456.db2.gz	AZWBLZNZLMMIIN-LBPRGKRZSA-N	1	0	262.353	1.448	50	0		CDAARO
CCN1CCC[C@@H]([N@@H+]2CCC[C@@H](CCCO)C2)C1	ZINC000032519451	356781974	/nfs/dbraw/zinc/78/19/74/356781974.db2.gz	IWFICYUSBZVCBY-LSDHHAIUSA-N	1	0	254.418	1.955	50	0		CDAARO
CCc1nc(CNc2nc(N(C)C)[nH+]c(C)c2C)no1	ZINC000032561031	356783067	/nfs/dbraw/zinc/78/30/67/356783067.db2.gz	BATXCZDHPGDYBH-UHFFFAOYSA-N	1	0	276.344	1.717	50	0		CDAARO
C[NH2+]CC(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000037822445	356936843	/nfs/dbraw/zinc/93/68/43/356936843.db2.gz	FWWMESRISCGHGG-LBPRGKRZSA-N	1	0	268.744	1.459	50	0		CDAARO
Cc1sc2[nH]c(CSCC[NH3+])nc(=O)c2c1C	ZINC000036929900	356890930	/nfs/dbraw/zinc/89/09/30/356890930.db2.gz	RWALRFCXIWMKMO-UHFFFAOYSA-N	1	0	269.395	1.793	50	0		CDAARO
Cc1ccc(CNC(=O)c2ccc(NN)[nH+]c2)cc1	ZINC000051112661	357246584	/nfs/dbraw/zinc/24/65/84/357246584.db2.gz	QBXYWSNRPRDADJ-UHFFFAOYSA-N	1	0	256.309	1.606	50	0		CDAARO
[NH3+]Cc1nnnn1-c1ccc(Oc2ccccc2)cc1	ZINC000054744679	357325268	/nfs/dbraw/zinc/32/52/68/357325268.db2.gz	GGGDDACTIFFSIL-UHFFFAOYSA-N	1	0	267.292	1.913	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CC[N@@H+]3CCC[C@@H]3C2)cc1	ZINC000055051861	357326893	/nfs/dbraw/zinc/32/68/93/357326893.db2.gz	KTVIWFIEOVGCHN-CYBMUJFWSA-N	1	0	280.393	1.464	50	0		CDAARO
COCCN1CCC[C@H]([NH2+]C2Cc3ccccc3C2)C1	ZINC000095422078	357342370	/nfs/dbraw/zinc/34/23/70/357342370.db2.gz	LGXAVSAEYBGXIJ-INIZCTEOSA-N	1	0	274.408	1.854	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N[C@](C)(C[NH3+])C2CC2)c1	ZINC000095431214	357449721	/nfs/dbraw/zinc/44/97/21/357449721.db2.gz	GLTVNBUZUSGMTF-CYBMUJFWSA-N	1	0	286.372	1.540	50	0		CDAARO
Cc1nc2c(c(N(C)Cc3cccc(O)c3)n1)CC[NH2+]CC2	ZINC000065394358	357536024	/nfs/dbraw/zinc/53/60/24/357536024.db2.gz	WVZULBBSWROJGH-UHFFFAOYSA-N	1	0	298.390	1.815	50	0		CDAARO
COc1ccc(C[N@H+](C)CC2(CO)CCC2)cc1O	ZINC000065403739	357537597	/nfs/dbraw/zinc/53/75/97/357537597.db2.gz	JUNZAYRIEWGFCJ-UHFFFAOYSA-N	1	0	265.353	1.995	50	0		CDAARO
Cc1c(CN(C)c2cc(OC(C)C)nc(N)n2)cnn1C	ZINC000065491902	357544825	/nfs/dbraw/zinc/54/48/25/357544825.db2.gz	PKDDIIJIODTDJO-UHFFFAOYSA-N	1	0	290.371	1.524	50	0		CDAARO
CCCCOCC(=O)N1CCC2(CC1)C[N@H+](C)CCN2C	ZINC000067803905	357629041	/nfs/dbraw/zinc/62/90/41/357629041.db2.gz	WSQRZHQMOGSCJV-UHFFFAOYSA-N	1	0	297.443	1.042	50	0		CDAARO
Cc1nc2cc(CC(=O)N[C@@H]3CC[C@@H]([NH3+])C3)ccc2[nH]1	ZINC000067975204	357642285	/nfs/dbraw/zinc/64/22/85/357642285.db2.gz	ZKCIRFKEPKDUPC-VXGBXAGGSA-N	1	0	272.352	1.410	50	0		CDAARO
Cc1nn(-c2ccccc2)cc1C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188445338	357686237	/nfs/dbraw/zinc/68/62/37/357686237.db2.gz	JCFMQRKWLAKUBL-GFCCVEGCSA-N	1	0	284.363	1.615	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1CCNc1ccc2cc[nH]c2n1	ZINC000072430780	357834728	/nfs/dbraw/zinc/83/47/28/357834728.db2.gz	YNEMGRGMQANMLI-ZDUSSCGKSA-N	1	0	274.368	1.822	50	0		CDAARO
Cc1nccn1CCN(C)c1cc(C)nc2ccnn21	ZINC000072477476	357838079	/nfs/dbraw/zinc/83/80/79/357838079.db2.gz	JEPVJYORMMPYGC-UHFFFAOYSA-N	1	0	270.340	1.679	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)[C@@H]2CSc3ccccc32)C1	ZINC000092239191	357940237	/nfs/dbraw/zinc/94/02/37/357940237.db2.gz	KLEBOJXWEVYRFZ-CMPLNLGQSA-N	1	0	262.378	1.826	50	0		CDAARO
COC(=O)[C@@H](O)C1CC[NH+](CCc2ccccc2F)CC1	ZINC000097095658	357953599	/nfs/dbraw/zinc/95/35/99/357953599.db2.gz	QRQCZMPYWWJUJV-HNNXBMFYSA-N	1	0	295.354	1.614	50	0		CDAARO
O=C(c1ccc(Br)o1)N1CC[N@@H+]2CCC[C@@H]2C1	ZINC000027932577	358060552	/nfs/dbraw/zinc/06/05/52/358060552.db2.gz	CLBOISIFYXXZDR-SECBINFHSA-N	1	0	299.168	1.962	50	0		CDAARO
C[N@H+](Cc1cccc(F)c1F)C1(CO)CCOCC1	ZINC000191002083	358106062	/nfs/dbraw/zinc/10/60/62/358106062.db2.gz	BEAUACFAUBXXDY-UHFFFAOYSA-N	1	0	271.307	1.938	50	0		CDAARO
CNC(=O)NC(=O)C[NH2+][C@H](C)C12CC3CC(CC(C3)C1)C2	ZINC000024831113	283358279	/nfs/dbraw/zinc/35/82/79/283358279.db2.gz	WOEDYYZAABATBF-GYPVXTSCSA-N	1	0	293.411	1.637	50	0		CDAARO
CC[C@@H]([NH2+][C@H]1CCc2nc(COC)nn2C1)C1CCC1	ZINC000567336063	358662155	/nfs/dbraw/zinc/66/21/55/358662155.db2.gz	MELDKJCZXWNORX-QWHCGFSZSA-N	1	0	278.400	1.908	50	0		CDAARO
CCc1cnc(N(C)C[C@H]2CCC[N@H+](CCO)C2)nc1	ZINC000095387895	358691154	/nfs/dbraw/zinc/69/11/54/358691154.db2.gz	HERHICNBDHHHNK-CQSZACIVSA-N	1	0	278.400	1.180	50	0		CDAARO
Cn1c2ccccc2cc(C(=O)NCC[C@@H]2CCC[NH2+]2)c1=O	ZINC000097402568	358773687	/nfs/dbraw/zinc/77/36/87/358773687.db2.gz	DFGMUQISLAKYGJ-ZDUSSCGKSA-N	1	0	299.374	1.410	50	0		CDAARO
OC1(C[NH+]2CCCC2)CCN(Cc2cccnc2)CC1	ZINC000216014804	358918477	/nfs/dbraw/zinc/91/84/77/358918477.db2.gz	ZRJRZXJPHHIYES-UHFFFAOYSA-N	1	0	275.396	1.504	50	0		CDAARO
CN(C[C@]1(C)CC[N@H+](C)C1)C(=O)CSc1ccncc1	ZINC000221445954	359248607	/nfs/dbraw/zinc/24/86/07/359248607.db2.gz	XCRRWGANKWDPLO-OAHLLOKOSA-N	1	0	293.436	1.974	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@H](O)C2)cc(OC)c1	ZINC000000209238	359302690	/nfs/dbraw/zinc/30/26/90/359302690.db2.gz	BCUULGGKAXRXTI-LBPRGKRZSA-N	1	0	251.326	1.661	50	0		CDAARO
O=c1cc([C@H]2C[C@H]([NH2+]C3CCOCC3)C2)nc(C2CC2)[nH]1	ZINC000222248319	359329562	/nfs/dbraw/zinc/32/95/62/359329562.db2.gz	DMUMEDZZBKNFGA-BJHJDKERSA-N	1	0	289.379	1.662	50	0		CDAARO
CCC[NH+]1CCC(NC(=O)c2[nH]nc(N)c2Cl)CC1	ZINC000223790317	359456215	/nfs/dbraw/zinc/45/62/15/359456215.db2.gz	APFAMJSSLIYXHT-UHFFFAOYSA-N	1	0	285.779	1.250	50	0		CDAARO
Cc1ccc(C(=O)N2CC[C@@H]3COCC[N@@H+](C)[C@@H]3C2)s1	ZINC000257185397	359513596	/nfs/dbraw/zinc/51/35/96/359513596.db2.gz	WSOMPLPKVUPHEQ-CHWSQXEVSA-N	1	0	294.420	1.849	50	0		CDAARO
CCC[N@@H+]1CCC[C@H]1C(=O)N1CCC[C@@H]([NH2+]C)C1	ZINC000261718806	359551808	/nfs/dbraw/zinc/55/18/08/359551808.db2.gz	LHJSKJRXKJKNPT-OLZOCXBDSA-N	1	0	253.390	1.071	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)[C@@H]1CCOC1	ZINC000248161205	360417545	/nfs/dbraw/zinc/41/75/45/360417545.db2.gz	XQGCZQWMZBCQCW-JHJVBQTASA-N	1	0	252.358	1.108	50	0		CDAARO
COC(=O)[C@@H](Sc1nnc(C[NH3+])n1C)c1ccccc1	ZINC000426477637	360564920	/nfs/dbraw/zinc/56/49/20/360564920.db2.gz	WFNNXARAVYWHPZ-NSHDSACASA-N	1	0	292.364	1.280	50	0		CDAARO
Cc1n[nH]c(C)c1[C@@H](C)NC(=O)N1CC[NH+](C(C)C)CC1	ZINC000426477175	360566490	/nfs/dbraw/zinc/56/64/90/360566490.db2.gz	HSFNXYLZYJKGSJ-LLVKDONJSA-N	1	0	293.415	1.823	50	0		CDAARO
CCn1cc(CN(C)c2ncnc3c2c(C)nn3C)c(C)n1	ZINC000426534157	360681520	/nfs/dbraw/zinc/68/15/20/360681520.db2.gz	YPQKSNMRIPLIBF-UHFFFAOYSA-N	1	0	299.382	1.833	50	0		CDAARO
Cc1cc(CNC(=O)N2CCC[C@@]3(CC[NH2+]C3)C2)[nH]n1	ZINC000426589741	360686588	/nfs/dbraw/zinc/68/65/88/360686588.db2.gz	ICOGOXTXSIPUBR-AWEZNQCLSA-N	1	0	277.372	1.003	50	0		CDAARO
CCc1noc2ncc(C(=O)N3CC[C@H](C[NH3+])C3)cc12	ZINC000178519324	189123187	/nfs/dbraw/zinc/12/31/87/189123187.db2.gz	KYWZUGLUWSIPNP-SECBINFHSA-N	1	0	274.324	1.206	50	0		CDAARO
CC[C@@H](Oc1ccccc1C)C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178592175	189128938	/nfs/dbraw/zinc/12/89/38/189128938.db2.gz	BSLCTCMLORBGTD-UONOGXRCSA-N	1	0	276.380	1.960	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)Cc2cn3ccccc3n2)C1	ZINC000178593907	189129677	/nfs/dbraw/zinc/12/96/77/189129677.db2.gz	SNXLLBFQUGGENC-LBPRGKRZSA-N	1	0	272.352	1.087	50	0		CDAARO
O=C(C1CCC1)N1CCc2[nH]cnc2C12CC[NH2+]CC2	ZINC000247874307	361206363	/nfs/dbraw/zinc/20/63/63/361206363.db2.gz	NCOBLZMXAOGJJD-UHFFFAOYSA-N	1	0	274.368	1.173	50	0		CDAARO
CC(C)NC(=O)C[NH2+]Cc1ccc(OC(F)F)cc1	ZINC000035133752	361294941	/nfs/dbraw/zinc/29/49/41/361294941.db2.gz	QMBDQTSIAOZKOU-UHFFFAOYSA-N	1	0	272.295	1.902	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000335591178	361602787	/nfs/dbraw/zinc/60/27/87/361602787.db2.gz	NZKWLKMHZRSLSC-LLVKDONJSA-N	1	0	287.285	1.948	50	0		CDAARO
CCOC(=O)C[C@@]1([NH3+])CCN(C(=O)OC(C)(C)C)C1	ZINC000238250601	361580075	/nfs/dbraw/zinc/58/00/75/361580075.db2.gz	BIENJLIIUBFKDP-ZDUSSCGKSA-N	1	0	272.345	1.278	50	0		CDAARO
C[C@H](Cn1cccn1)[NH2+]Cc1cccc2c1OCO2	ZINC000036325294	361654364	/nfs/dbraw/zinc/65/43/64/361654364.db2.gz	OBIKEKFCDFSTSQ-LLVKDONJSA-N	1	0	259.309	1.790	50	0		CDAARO
CC[C@](C)(O)C[NH+]1CCC(Cn2cncn2)CC1	ZINC000189243774	361685696	/nfs/dbraw/zinc/68/56/96/361685696.db2.gz	QWHAXSXSRSVUIY-ZDUSSCGKSA-N	1	0	252.362	1.151	50	0		CDAARO
C[NH+](C)CC(C)(C)CNC(=O)CCc1cn[nH]c1	ZINC000629943296	364209780	/nfs/dbraw/zinc/20/97/80/364209780.db2.gz	IMDMBCFYARPTCB-UHFFFAOYSA-N	1	0	252.362	1.046	50	0		CDAARO
CCO[C@@H]1C[C@@](CO)([NH2+]Cc2cncnc2)C1(C)C	ZINC000186578881	364612002	/nfs/dbraw/zinc/61/20/02/364612002.db2.gz	WZYBCZLURGCBQJ-OCCSQVGLSA-N	1	0	265.357	1.132	50	0		CDAARO
Cc1nc(/C=C\C(=O)N2CC[C@H]([NH3+])C[C@@H]2C)cs1	ZINC000606441986	366880467	/nfs/dbraw/zinc/88/04/67/366880467.db2.gz	JBKRZSAPZFZXKL-AKGUPNBXSA-N	1	0	265.382	1.803	50	0		CDAARO
CC(C)(C)[N@H+](CC(N)=O)Cc1cc2ccccc2[nH]c1=O	ZINC000089643060	366895856	/nfs/dbraw/zinc/89/58/56/366895856.db2.gz	ORNRIMOUUWYDEH-UHFFFAOYSA-N	1	0	287.363	1.614	50	0		CDAARO
O=C(C[N@H+]1CCCC[C@H]1CCO)NC(C1CC1)C1CC1	ZINC000089819032	366941489	/nfs/dbraw/zinc/94/14/89/366941489.db2.gz	MFZRZUKDZHTXOE-AWEZNQCLSA-N	1	0	280.412	1.528	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2ncc(F)cc2F)CCOCC1	ZINC000222444182	189731122	/nfs/dbraw/zinc/73/11/22/189731122.db2.gz	VCKKOAUWBCMKIU-UHFFFAOYSA-N	1	0	299.321	1.200	50	0		CDAARO
OC[C@@H](O)C[NH2+]Cc1ccc(SC(F)(F)F)cc1	ZINC000090282351	367028312	/nfs/dbraw/zinc/02/83/12/367028312.db2.gz	RNUJXDRNNNJSSB-VIFPVBQESA-N	1	0	281.299	1.741	50	0		CDAARO
CCOC(=O)[C@@]1(COC)CCC[N@H+](Cc2cncn2C)C1	ZINC000252486689	367574151	/nfs/dbraw/zinc/57/41/51/367574151.db2.gz	HOPWNVXDEPCBDN-HNNXBMFYSA-N	1	0	295.383	1.212	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CNC(=O)N2CCSC(C)(C)C2)C1	ZINC000089919593	370195973	/nfs/dbraw/zinc/19/59/73/370195973.db2.gz	BZUVBSKWFOCHOI-LBPRGKRZSA-N	1	0	285.457	1.865	50	0		CDAARO
Cc1nc(CCN2CC[N@@H+]3CCC[C@H]3C2)cs1	ZINC000300411948	370277429	/nfs/dbraw/zinc/27/74/29/370277429.db2.gz	FKVGWKXQVYMWGF-ZDUSSCGKSA-N	1	0	251.399	1.774	50	0		CDAARO
CO[C@H]1CC[N@@H+](C2CCN(C(=O)C(C)(C)C)CC2)C1	ZINC000575605354	370606416	/nfs/dbraw/zinc/60/64/16/370606416.db2.gz	JXBVTQPSVFJWOC-ZDUSSCGKSA-N	1	0	268.401	1.744	50	0		CDAARO
O=C1c2cccc3cccc(c32)C(=O)N1CC[NH2+]CCO	ZINC000003892630	371103130	/nfs/dbraw/zinc/10/31/30/371103130.db2.gz	URSGUHDKQBISNA-UHFFFAOYSA-N	1	0	284.315	1.018	50	0		CDAARO
O=C(NC[C@@H]1CCC[NH2+]1)c1cccnc1N1CCCC1	ZINC000178769064	372208545	/nfs/dbraw/zinc/20/85/45/372208545.db2.gz	ZYIHUKNJJKPDKJ-LBPRGKRZSA-N	1	0	274.368	1.164	50	0		CDAARO
C[C@H]([NH3+])CCNC(=O)Cc1csc(-c2ccoc2)n1	ZINC000178657241	372200343	/nfs/dbraw/zinc/20/03/43/372200343.db2.gz	WMHMHAFCVBXBFT-VIFPVBQESA-N	1	0	279.365	1.799	50	0		CDAARO
O=C(NC[C@@H]1CCC2(CC[NH2+]CC2)O1)c1cccnc1	ZINC000299791109	372764930	/nfs/dbraw/zinc/76/49/30/372764930.db2.gz	CPMVAICYPVITFJ-ZDUSSCGKSA-N	1	0	275.352	1.113	50	0		CDAARO
O=C1C[C@@H](C[NH+]2CC(n3cccn3)C2)CN1c1ccccc1	ZINC000299790778	372764236	/nfs/dbraw/zinc/76/42/36/372764236.db2.gz	BXJIYNAOYAEDDM-AWEZNQCLSA-N	1	0	296.374	1.793	50	0		CDAARO
Cc1cc(-c2ccccc2)nc(CN2CC[C@@H]([NH3+])C2)n1	ZINC000244718799	189909799	/nfs/dbraw/zinc/90/97/99/189909799.db2.gz	LQZFMJVTFURXJM-CQSZACIVSA-N	1	0	268.364	1.985	50	0		CDAARO
CCNC(=O)NC(=O)[C@@H](C)[N@H+](C)Cc1ccccc1C	ZINC000015419712	373626136	/nfs/dbraw/zinc/62/61/36/373626136.db2.gz	DWGLQZVSNBNOAE-GFCCVEGCSA-N	1	0	277.368	1.661	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)[C@@H](C)n1cccn1	ZINC000253375902	373679961	/nfs/dbraw/zinc/67/99/61/373679961.db2.gz	RIJSKECRKBTQOE-RBSFLKMASA-N	1	0	290.411	1.919	50	0		CDAARO
[NH3+]C[C@@H]1CCCCN1C(=O)Cc1ccc(F)c(F)c1	ZINC000095045399	373692287	/nfs/dbraw/zinc/69/22/87/373692287.db2.gz	UGQPTMOHYLPAQR-NSHDSACASA-N	1	0	268.307	1.847	50	0		CDAARO
CC[C@H]1CN(c2ncnc3[nH]ccc32)CC[N@@H+]1C[C@H](C)O	ZINC000107136557	373798439	/nfs/dbraw/zinc/79/84/39/373798439.db2.gz	KSTFUXVVZPKJAJ-RYUDHWBXSA-N	1	0	289.383	1.239	50	0		CDAARO
Cc1ccc([C@H](CNC(=O)c2cncn2C)[NH+](C)C)cc1	ZINC000277807599	193765217	/nfs/dbraw/zinc/76/52/17/193765217.db2.gz	WBVRTQIEGYONPJ-AWEZNQCLSA-N	1	0	286.379	1.761	50	0		CDAARO
C[C@@H]1C[C@@H](Nc2ccnn2C[C@H]2CCOC2)C[N@@H+]1C1CC1	ZINC000108462748	412828949	/nfs/dbraw/zinc/82/89/49/412828949.db2.gz	FPLPJJACKCPSGZ-MGPQQGTHSA-N	1	0	290.411	1.957	50	0		CDAARO
O[C@@H]1CCN(CCOc2ccccc2Br)C1	ZINC000093789696	374783870	/nfs/dbraw/zinc/78/38/70/374783870.db2.gz	APANPWOQVYOHBR-SNVBAGLBSA-N	1	0	286.169	1.895	50	0		CDAARO
CCCc1nnc(N2CCC[C@@]3(CC[N@H+](C)C3)C2)o1	ZINC000095358077	374889999	/nfs/dbraw/zinc/88/99/99/374889999.db2.gz	SPZRHEXAGYFMJL-AWEZNQCLSA-N	1	0	264.373	1.944	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+]C2CCN(C(N)=O)CC2)C12CCCC2	ZINC000095423472	374923693	/nfs/dbraw/zinc/92/36/93/374923693.db2.gz	MYZFJXVJBHFYIW-UONOGXRCSA-N	1	0	295.427	1.857	50	0		CDAARO
CCC[NH+]1CCN(C(=O)NCc2cccnc2)CC1	ZINC000095469758	374966022	/nfs/dbraw/zinc/96/60/22/374966022.db2.gz	BHUNIFUSCZGKIW-UHFFFAOYSA-N	1	0	262.357	1.319	50	0		CDAARO
COC(=O)CC[NH+]1CCN(c2ccc(F)cc2)CC1	ZINC000095950782	375039320	/nfs/dbraw/zinc/03/93/20/375039320.db2.gz	CLHNEVBGPZLWNR-UHFFFAOYSA-N	1	0	266.316	1.511	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCn2c(nnc2-c2ccccc2)C1	ZINC000095971707	375044937	/nfs/dbraw/zinc/04/49/37/375044937.db2.gz	PVHAVVVRADVGJU-GFCCVEGCSA-N	1	0	285.351	1.025	50	0		CDAARO
Cc1ccc(C[NH2+][C@H](CC(N)=O)C2CCOCC2)nc1	ZINC000097037629	375138710	/nfs/dbraw/zinc/13/87/10/375138710.db2.gz	GYFFHOLBOXGNHV-CQSZACIVSA-N	1	0	277.368	1.150	50	0		CDAARO
COC(=O)[C@]12CCC[C@H]1C[N@H+](Cc1cccn1C)C2	ZINC000097084948	375146728	/nfs/dbraw/zinc/14/67/28/375146728.db2.gz	LRHCXIUSZNDQPC-WFASDCNBSA-N	1	0	262.353	1.800	50	0		CDAARO
Cc1ccccc1OCC(=O)N1CCC[C@H]([C@@H](C)[NH3+])C1	ZINC000299739664	375199847	/nfs/dbraw/zinc/19/98/47/375199847.db2.gz	RDHMSAKSBQQJBQ-KGLIPLIRSA-N	1	0	276.380	1.960	50	0		CDAARO
CCCc1nnc(NC(=O)[C@@H]2CCCC[NH2+]2)s1	ZINC000253432814	189992696	/nfs/dbraw/zinc/99/26/96/189992696.db2.gz	OLXQGUZNBJVLST-QMMMGPOBSA-N	1	0	254.359	1.571	50	0		CDAARO
CCN(CC(=O)Nc1ccc(F)cc1)CC(=O)NC(C)C	ZINC000003334790	375652829	/nfs/dbraw/zinc/65/28/29/375652829.db2.gz	FMMJAKFBDHXDOD-UHFFFAOYSA-N	1	0	295.358	1.611	50	0		CDAARO
CCc1noc(C[C@@H]2CCOC3(CC[NH2+]CC3)C2)n1	ZINC000257181264	190007974	/nfs/dbraw/zinc/00/79/74/190007974.db2.gz	FKAFUFVIKBBJHT-NSHDSACASA-N	1	0	265.357	1.723	50	0		CDAARO
CCN(C(=O)C[NH+]1CCC(c2cc[nH]n2)CC1)C1CC1	ZINC000058209485	375689563	/nfs/dbraw/zinc/68/95/63/375689563.db2.gz	UGBZYLMBXKCIGC-UHFFFAOYSA-N	1	0	276.384	1.600	50	0		CDAARO
O=C(NC[C@@H]1CC[N@@H+](C2CC2)C1)NC1CCCC1	ZINC000031084014	375735201	/nfs/dbraw/zinc/73/52/01/375735201.db2.gz	XUUDBMOHMAROFC-NSHDSACASA-N	1	0	251.374	1.713	50	0		CDAARO
C[NH2+][C@H](C)CNC(=O)c1cc(C2CC2)nc2onc(C)c21	ZINC000261645068	190042240	/nfs/dbraw/zinc/04/22/40/190042240.db2.gz	DPIGJVUWIDLOPP-MRVPVSSYSA-N	1	0	288.351	1.746	50	0		CDAARO
C[C@H](CNC(=O)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C)[N@H+](C)C1CC1	ZINC000240333657	376016797	/nfs/dbraw/zinc/01/67/97/376016797.db2.gz	FEQSNETXIMENLX-YXCITZCRSA-N	1	0	295.427	1.582	50	0		CDAARO
C[C@@H]1Cc2ccccc2N1CCNC(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000263258883	190067288	/nfs/dbraw/zinc/06/72/88/190067288.db2.gz	LPYHWIFDPIVHDG-VHDGCEQUSA-N	1	0	287.407	1.681	50	0		CDAARO
CSCCN1CCN(C(=O)C2(C)CC[NH+](C)CC2)CC1	ZINC000670473383	483083273	/nfs/dbraw/zinc/08/32/73/483083273.db2.gz	GNOICXLROFXLKD-UHFFFAOYSA-N	1	0	299.484	1.226	50	0		CDAARO
Cc1nc(C[NH3+])cc(NCCN2CCc3ccccc32)n1	ZINC000067433092	377073719	/nfs/dbraw/zinc/07/37/19/377073719.db2.gz	FZPPETMQSXLULB-UHFFFAOYSA-N	1	0	283.379	1.718	50	0		CDAARO
O=C(CSC1=[NH+]CCN1)NC12CC3CC(CC(C3)C1)C2	ZINC000004166699	377101358	/nfs/dbraw/zinc/10/13/58/377101358.db2.gz	LKEMIEMDALYJRM-UHFFFAOYSA-N	1	0	293.436	1.764	50	0		CDAARO
CCS(=O)(=O)NCCC[NH2+][C@@H]1CCC[C@H](C)[C@H]1C	ZINC000245338663	378070522	/nfs/dbraw/zinc/07/05/22/378070522.db2.gz	NQBLXMYGWIIOIN-YNEHKIRRSA-N	1	0	276.446	1.730	50	0		CDAARO
CCCS(=O)(=O)NCC1CCN(c2cc[nH+]cc2)CC1	ZINC000070922018	379508796	/nfs/dbraw/zinc/50/87/96/379508796.db2.gz	RHFSOSMMWNQCFN-UHFFFAOYSA-N	1	0	297.424	1.627	50	0		CDAARO
CC(=O)Oc1c(C)[n+](C)cc2c1COC(C)(C)OC2	ZINC000000210919	169575968	/nfs/dbraw/zinc/57/59/68/169575968.db2.gz	IGXWUTRBFZLIEO-UHFFFAOYSA-N	1	0	266.317	1.528	50	0		CDAARO
COCCN1CCC[C@@]2(CC[N@@H+](C3CCOCC3)C2)C1	ZINC000012438744	285031113	/nfs/dbraw/zinc/03/11/13/285031113.db2.gz	JKTUIRWOLPOVGX-MRXNPFEDSA-N	1	0	282.428	1.600	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)/C=C\c2ccc3c(c2)OCCO3)C1	ZINC000493169877	253388592	/nfs/dbraw/zinc/38/85/92/253388592.db2.gz	HHUPUFMDLAAMSR-QQHVMHFCSA-N	1	0	274.320	1.031	50	0		CDAARO
C[C@@H]1C[C@H]([NH3+])CCN1C(=O)/C=C\c1cncc(F)c1	ZINC000493494433	253476642	/nfs/dbraw/zinc/47/66/42/253476642.db2.gz	MVEWXZOLXAEWRH-MIZUNLALSA-N	1	0	263.316	1.572	50	0		CDAARO
O=C1OCC[C@@H]1N1CCC[C@H](C[NH+]2CCCCCC2)C1	ZINC000106655285	296403913	/nfs/dbraw/zinc/40/39/13/296403913.db2.gz	VAIGOKZCXOYSFX-CABCVRRESA-N	1	0	280.412	1.890	50	0		CDAARO
OCCOCCC[NH2+][C@@H]1CCCNc2ccccc21	ZINC000193275521	285261721	/nfs/dbraw/zinc/26/17/21/285261721.db2.gz	NTHGGZHWQLAJNZ-OAHLLOKOSA-N	1	0	264.369	1.922	50	0		CDAARO
Cc1cccnc1[C@H]([NH2+]C[C@@H](O)Cn1cccn1)C(C)C	ZINC000096424383	256758685	/nfs/dbraw/zinc/75/86/85/256758685.db2.gz	PGUJKMLEIZPVBJ-HUUCEWRRSA-N	1	0	288.395	1.934	50	0		CDAARO
CC(C)[NH2+][C@H]1CCn2c(=O)[nH]c3cccc(c32)[C@H]1O	ZINC000043163830	390430715	/nfs/dbraw/zinc/43/07/15/390430715.db2.gz	ZSTCZWJCLIRCOJ-WCQYABFASA-N	1	0	261.325	1.133	50	0	in-man	CDAARO
Cc1cccc(OCCN2CC[NH+](CCO)CC2)c1C	ZINC000033359703	390389763	/nfs/dbraw/zinc/38/97/63/390389763.db2.gz	QLPUJFHGZQBIOO-UHFFFAOYSA-N	1	0	278.396	1.292	50	0		CDAARO
CCC[N@@H+](Cc1ccc(SC)cc1)C[C@@H](O)CO	ZINC000055384851	390489560	/nfs/dbraw/zinc/48/95/60/390489560.db2.gz	ICDXLKRNFFDNOP-CYBMUJFWSA-N	1	0	269.410	1.974	50	0		CDAARO
CC(C)CNC(=O)C[NH2+][C@](C)(CO)C1CCCCC1	ZINC000096420073	390514400	/nfs/dbraw/zinc/51/44/00/390514400.db2.gz	SYOOOIFQZCOPBW-OAHLLOKOSA-N	1	0	270.417	1.680	50	0		CDAARO
O=C([O-])[C@@H]1C[N@H+](C[C@H]2[C@@H]3C[NH2+]C[C@H]23)C[C@H]1c1ccccc1	ZINC000102222739	390462313	/nfs/dbraw/zinc/46/23/13/390462313.db2.gz	AJGGMWNBVNOYME-ZVDSWSACSA-N	1	0	286.375	1.252	50	0		CDAARO
CS(=O)(=O)[C@@H]1CCC[C@H]([NH2+]Cc2ccns2)C1	ZINC000404273476	390958774	/nfs/dbraw/zinc/95/87/74/390958774.db2.gz	MDWLWJHWGAYBSA-GXSJLCMTSA-N	1	0	274.411	1.589	50	0		CDAARO
C[C@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)N1CCCC[C@H]1C	ZINC000248057745	390912871	/nfs/dbraw/zinc/91/28/71/390912871.db2.gz	CFWSDSLZPMVERL-RDBSUJKOSA-N	1	0	268.401	1.623	50	0		CDAARO
COc1ccc2c3c1O[C@H]1C(=O)CC[C@H]4[C@@H](C2)[N@@H+](C)CC[C@]314	ZINC000001280665	390987545	/nfs/dbraw/zinc/98/75/45/390987545.db2.gz	LLPOLZWFYMWNKH-CMKMFDCUSA-N	1	0	299.370	1.933	50	0	fda	CDAARO
C[C@H](CC(=O)N1[C@H](C)COC[C@H]1C)[C@H]1CCC[NH2+]C1	ZINC000262641645	391335590	/nfs/dbraw/zinc/33/55/90/391335590.db2.gz	RXRQCYLJONXAON-SYQHCUMBSA-N	1	0	268.401	1.648	50	0		CDAARO
Cn1nc(C(=O)N2[C@@H]3CC[C@H]2C[N@H+](C)CC3)c2ccccc21	ZINC000252484397	391609112	/nfs/dbraw/zinc/60/91/12/391609112.db2.gz	FVHMTRWVZNKBGY-OLZOCXBDSA-N	1	0	298.390	1.882	50	0		CDAARO
O=C(NC1CC[NH+](C2CCCC2)CC1)c1cnc[nH]1	ZINC000299760620	391721436	/nfs/dbraw/zinc/72/14/36/391721436.db2.gz	VSZYCFUYEAXZDX-UHFFFAOYSA-N	1	0	262.357	1.547	50	0		CDAARO
CC(=O)NCC1CC[NH+](CC[C@@H]2CCOC2)CC1	ZINC000437688106	392478559	/nfs/dbraw/zinc/47/85/59/392478559.db2.gz	PVRHWUJPUQOUOY-CQSZACIVSA-N	1	0	254.374	1.261	50	0		CDAARO
CCOc1ccccc1/C=C\C(=O)N1CC[C@H]([NH3+])C1	ZINC000493809253	393442662	/nfs/dbraw/zinc/44/26/62/393442662.db2.gz	HCWCUOCZDXFDGJ-WSROAFLRSA-N	1	0	260.337	1.658	50	0		CDAARO
O=S(=O)(CC1CCCC1)N1CCC2(C1)CC[NH2+]CC2	ZINC000262340734	140426312	/nfs/dbraw/zinc/42/63/12/140426312.db2.gz	SSWVBFWIFXNKAS-UHFFFAOYSA-N	1	0	286.441	1.582	50	0		CDAARO
CC(C)N1CC[C@H]([NH2+][C@@H]2CCC[C@H]3OCC[C@H]32)C1=O	ZINC000245771057	397655312	/nfs/dbraw/zinc/65/53/12/397655312.db2.gz	MKHNSZDPYAELGA-RFQIPJPRSA-N	1	0	266.385	1.543	50	0		CDAARO
CC(C)NC(=O)C[N@H+](C[C@H]1CCCO1)[C@H]1CCSC1	ZINC000245986274	397702995	/nfs/dbraw/zinc/70/29/95/397702995.db2.gz	WEXALBPGUMGZGR-QWHCGFSZSA-N	1	0	286.441	1.498	50	0		CDAARO
CCOCC[N@H+](C)C[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000408516915	286075774	/nfs/dbraw/zinc/07/57/74/286075774.db2.gz	QSKCXJDJGCNHAC-AWEZNQCLSA-N	1	0	290.404	1.230	50	0		CDAARO
O=C([C@@H]1CCOC1)N1CCC[C@H]1C[NH+]1CCCC1	ZINC000066943827	304354013	/nfs/dbraw/zinc/35/40/13/304354013.db2.gz	GARQBOVUXTXDBF-OLZOCXBDSA-N	1	0	252.358	1.110	50	0		CDAARO
COCC[NH2+]CCOCCOc1ccc(F)cc1	ZINC000002981120	169846938	/nfs/dbraw/zinc/84/69/38/169846938.db2.gz	DCCCBOJOQZYELY-UHFFFAOYSA-N	1	0	257.305	1.457	50	0		CDAARO
CCOc1cc(C[NH2+]C2CC2)cc(Cl)c1OCC(N)=O	ZINC000005245577	170079014	/nfs/dbraw/zinc/07/90/14/170079014.db2.gz	SRQKKINSQJPZKC-UHFFFAOYSA-N	1	0	298.770	1.855	50	0		CDAARO
[NH3+]C[C@@H](c1cccnc1)S(=O)(=O)c1ccc(F)cc1	ZINC000008031088	170315271	/nfs/dbraw/zinc/31/52/71/170315271.db2.gz	BANHAGSXTBSCPV-ZDUSSCGKSA-N	1	0	280.324	1.694	50	0		CDAARO
O=C(c1ccccc1)N1CCC2(CC1)[NH2+]CCc1nc[nH]c12	ZINC000008743967	170353406	/nfs/dbraw/zinc/35/34/06/170353406.db2.gz	BETVQNNVHGBVPL-UHFFFAOYSA-N	1	0	296.374	1.687	50	0		CDAARO
C[NH+](C)CCCNS(=O)(=O)Cc1ccc(F)cc1	ZINC000010111492	170397640	/nfs/dbraw/zinc/39/76/40/170397640.db2.gz	JZSYNTDQZVHCDU-UHFFFAOYSA-N	1	0	274.361	1.197	50	0		CDAARO
COc1ccc(C(=O)N2CCC([NH3+])CC2)cc1OC	ZINC000015423809	170665990	/nfs/dbraw/zinc/66/59/90/170665990.db2.gz	KUUGWWSIUPROEV-UHFFFAOYSA-N	1	0	264.325	1.267	50	0		CDAARO
[NH3+]CCS[C@@H]1CC(=O)N(Cc2ccccc2)C1=O	ZINC000018249500	170749316	/nfs/dbraw/zinc/74/93/16/170749316.db2.gz	SSVUWARSVUMHGE-LLVKDONJSA-N	1	0	264.350	1.006	50	0		CDAARO
O=C(C[NH2+]C[C@H]1CCCO1)Nc1ccc(F)cc1	ZINC000020055610	170981168	/nfs/dbraw/zinc/98/11/68/170981168.db2.gz	OUQNNAPDHBVYRR-GFCCVEGCSA-N	1	0	252.289	1.533	50	0		CDAARO
CCn1nc(C)c(CN2CC[N@H+](C)[C@@H](CCO)C2)c1C	ZINC000020453358	171208364	/nfs/dbraw/zinc/20/83/64/171208364.db2.gz	JEQIMUDBQHGGEB-AWEZNQCLSA-N	1	0	280.416	1.018	50	0		CDAARO
[NH3+]CCNCCOCCOc1cccc2ccccc21	ZINC000022079107	171352597	/nfs/dbraw/zinc/35/25/97/171352597.db2.gz	RYWKZQBVNHJACF-UHFFFAOYSA-N	1	0	274.364	1.784	50	0		CDAARO
COc1ccc2[nH]c(CN3CC[NH2+][C@H](C)C3)nc2c1	ZINC000022122131	171353965	/nfs/dbraw/zinc/35/39/65/171353965.db2.gz	DXZOYAMZSPMJAW-SNVBAGLBSA-N	1	0	260.341	1.365	50	0		CDAARO
CC[C@H](CO)[NH2+]Cc1nn(CC)nc1-c1ccccc1	ZINC000035287322	172105083	/nfs/dbraw/zinc/10/50/83/172105083.db2.gz	UYMWWWYSACJNIM-CYBMUJFWSA-N	1	0	274.368	1.826	50	0		CDAARO
CCOc1cc2c(cc1C[NH2+][C@@H](C)CO)O[C@@H](C)C2	ZINC000035603843	172292283	/nfs/dbraw/zinc/29/22/83/172292283.db2.gz	YPNWKUOFHVPGPO-QWRGUYRKSA-N	1	0	265.353	1.879	50	0		CDAARO
C[C@H](NC(=O)C[C@H]([NH3+])c1ccccc1)[C@H]1CCCO1	ZINC000035734946	172387041	/nfs/dbraw/zinc/38/70/41/172387041.db2.gz	HNYUXPNMXOUXHN-FPMFFAJLSA-N	1	0	262.353	1.760	50	0		CDAARO
[NH3+][C@H](CO)Cc1ccc(I)cc1	ZINC000044466880	175177724	/nfs/dbraw/zinc/17/77/24/175177724.db2.gz	MPCOBLKNQSOAGC-VIFPVBQESA-N	1	0	277.105	1.153	50	0		CDAARO
C[NH2+][C@H]1CCN(c2cc(OC)cc(OC)c2)C1=O	ZINC000049647310	175497058	/nfs/dbraw/zinc/49/70/58/175497058.db2.gz	JGVSFHUTYMOAEV-LBPRGKRZSA-N	1	0	250.298	1.029	50	0		CDAARO
COc1ccc(-c2ccc(=O)n(CCC[NH3+])n2)cc1	ZINC000061957835	175659210	/nfs/dbraw/zinc/65/92/10/175659210.db2.gz	TZGWOUCNOXYHCM-UHFFFAOYSA-N	1	0	259.309	1.268	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@@H]([NH3+])CN1Cc1ccc(C)cc1OC	ZINC000067561141	175777966	/nfs/dbraw/zinc/77/79/66/175777966.db2.gz	LSMITLMZMJZYQF-KGLIPLIRSA-N	1	0	291.395	1.041	50	0		CDAARO
C[NH+]1CCC(CCNS(=O)(=O)Cc2ccccc2)CC1	ZINC000072119091	176319672	/nfs/dbraw/zinc/31/96/72/176319672.db2.gz	KICDIWDQFJYQRM-UHFFFAOYSA-N	1	0	296.436	1.838	50	0		CDAARO
c1cc2c(ncnc2NC[C@H]2C[NH2+]CCOC2)s1	ZINC000072152122	176327361	/nfs/dbraw/zinc/32/73/61/176327361.db2.gz	MGXRBMIVLLJDGW-SECBINFHSA-N	1	0	264.354	1.339	50	0		CDAARO
CCCn1ccnc1CN1CC[C@H]2[NH2+]CCC[C@]2(CO)C1	ZINC000072156493	176328450	/nfs/dbraw/zinc/32/84/50/176328450.db2.gz	HJKAPBPZLAFOEQ-GDBMZVCRSA-N	1	0	292.427	1.230	50	0		CDAARO
CCn1cc(NC(=O)CC2CC[NH2+]CC2)c(C)n1	ZINC000072344633	176373057	/nfs/dbraw/zinc/37/30/57/176373057.db2.gz	OXKMJZSMEXAHEV-UHFFFAOYSA-N	1	0	250.346	1.540	50	0		CDAARO
Nc1ncccc1CN1CC[C@@](O)(C[NH+]2CCCCC2)C1	ZINC000077379389	177260613	/nfs/dbraw/zinc/26/06/13/177260613.db2.gz	XVXIUACZBBREIS-MRXNPFEDSA-N	1	0	290.411	1.087	50	0		CDAARO
C[C@@H](CN1C(=O)NC2(CC[NH2+]CC2)C1=O)c1ccccc1	ZINC000077424309	177265850	/nfs/dbraw/zinc/26/58/50/177265850.db2.gz	JIDDORKRSMCXES-LBPRGKRZSA-N	1	0	287.363	1.464	50	0		CDAARO
O=c1[nH]c(-c2ccc(F)c(F)c2)nc2c1CC[NH2+]C2	ZINC000077470995	177272319	/nfs/dbraw/zinc/27/23/19/177272319.db2.gz	ATWIQXBHEWNSOF-UHFFFAOYSA-N	1	0	263.247	1.361	50	0		CDAARO
CCOCC[N@H+](C)C[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000408516916	423892916	/nfs/dbraw/zinc/89/29/16/423892916.db2.gz	QSKCXJDJGCNHAC-CQSZACIVSA-N	1	0	290.404	1.230	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)c1ccc2nccn2c1	ZINC000178285903	273967835	/nfs/dbraw/zinc/96/78/35/273967835.db2.gz	NWNVRGRXGASSIN-GFCCVEGCSA-N	1	0	258.325	1.158	50	0		CDAARO
Cc1cc(-c2cccc3c2O[C@@H](C[NH3+])C3)nc(N(C)C)n1	ZINC000067741942	274672019	/nfs/dbraw/zinc/67/20/19/274672019.db2.gz	CZCZUXJZRRLANL-GFCCVEGCSA-N	1	0	284.363	1.780	50	0		CDAARO
CCOCC[N@H+](C)[C@@H]1C[C@@H]2CCCC[C@H]2NC1=O	ZINC000408524521	276317475	/nfs/dbraw/zinc/31/74/75/276317475.db2.gz	VGHCFYOCGDRQJB-YNEHKIRRSA-N	1	0	254.374	1.402	50	0		CDAARO
CCO[C@H]1C[C@H](NC(=O)NCC[N@H+](C)C2CC2)C12CCC2	ZINC000096444033	276364924	/nfs/dbraw/zinc/36/49/24/276364924.db2.gz	KPYHKZOZTORFLX-KBPBESRZSA-N	1	0	295.427	1.728	50	0		CDAARO
CCc1ccc(S(=O)(=O)N[C@H]2CCC[C@@H]2C[NH3+])cc1	ZINC000089092063	276689757	/nfs/dbraw/zinc/68/97/57/276689757.db2.gz	MEFXCPYLYLUFTH-OCCSQVGLSA-N	1	0	282.409	1.655	50	0		CDAARO
C[NH+](C)[C@H](CNc1ccc2nnnn2n1)c1ccccc1	ZINC000008851443	276792931	/nfs/dbraw/zinc/79/29/31/276792931.db2.gz	XBPABUNQPVWYMR-GFCCVEGCSA-N	1	0	283.339	1.234	50	0		CDAARO
C[NH+]1CCC(NC(=O)[C@]2(C)CC2(Cl)Cl)CC1	ZINC000002872594	277030259	/nfs/dbraw/zinc/03/02/59/277030259.db2.gz	SRRVBVOXXYADTJ-JTQLQIEISA-N	1	0	265.184	1.781	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H](O)[C@@H]([NH+]2CCc3ccccc3CC2)C1	ZINC000079437103	277368381	/nfs/dbraw/zinc/36/83/81/277368381.db2.gz	ALBKJDCBTBGXHD-HRCADAONSA-N	1	0	289.375	1.400	50	0		CDAARO
COc1ccc2c(c1)C[C@@H]([NH2+][C@H]1CCC(=O)N(C)C1)CC2	ZINC000095973402	277963083	/nfs/dbraw/zinc/96/30/83/277963083.db2.gz	LNDSQGSRLYSFMA-GJZGRUSLSA-N	1	0	288.391	1.763	50	0		CDAARO
CCOC(=O)N(C)C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1	ZINC000095976557	279568907	/nfs/dbraw/zinc/56/89/07/279568907.db2.gz	UQUUYHUOTSPQLV-UONOGXRCSA-N	1	0	284.400	1.843	50	0		CDAARO
C[C@H]1[C@@H](NC(=O)c2cc(-c3ccco3)n[nH]2)CCC[N@@H+]1C	ZINC000096010245	280105395	/nfs/dbraw/zinc/10/53/95/280105395.db2.gz	CMQDWAOFWFXWCP-QWRGUYRKSA-N	1	0	288.351	1.882	50	0		CDAARO
C[C@@H]1CCCN(C(=O)CC[C@H]2CCOC2)[C@H]1C[NH3+]	ZINC000247295619	280326512	/nfs/dbraw/zinc/32/65/12/280326512.db2.gz	ODOCEXYEGKZSBT-AGIUHOORSA-N	1	0	254.374	1.389	50	0		CDAARO
C[C@H]1CN(C)c2ccccc2N(C(=O)[C@@]2(F)CC[NH2+]C2)C1	ZINC000252671450	300229729	/nfs/dbraw/zinc/22/97/29/300229729.db2.gz	VUQJPRZUQYDKFM-BLLLJJGKSA-N	1	0	291.370	1.807	50	0		CDAARO
CN(C(=O)c1ccn(-c2ccccc2F)n1)[C@@H]1CC[NH2+]C1	ZINC000179049835	315966693	/nfs/dbraw/zinc/96/66/93/315966693.db2.gz	YIBQWDIVVDUTCX-LLVKDONJSA-N	1	0	288.326	1.445	50	0		CDAARO
Cc1cc(C)nc(CNC(=O)c2cccc(C[NH3+])c2)n1	ZINC000534575266	328309882	/nfs/dbraw/zinc/30/98/82/328309882.db2.gz	APAPLAULQCNZQY-UHFFFAOYSA-N	1	0	270.336	1.482	50	0		CDAARO
CCC(=O)N1CCC([NH2+][C@@H](C)Cn2ccnc2CC)CC1	ZINC000534578273	328310935	/nfs/dbraw/zinc/31/09/35/328310935.db2.gz	ZZIUKRFUFHFKGK-ZDUSSCGKSA-N	1	0	292.427	1.825	50	0		CDAARO
Cc1ccnc(CC(=O)NCC2([NH+](C)C)CCCC2)c1	ZINC000534584747	328314741	/nfs/dbraw/zinc/31/47/41/328314741.db2.gz	BLAFSRHZFOJZIE-UHFFFAOYSA-N	1	0	275.396	1.923	50	0		CDAARO
C[C@H](C(=O)NCC1(CN2CCOCC2)CC1)n1cccc1	ZINC000534585447	328315072	/nfs/dbraw/zinc/31/50/72/328315072.db2.gz	KVSXCJZMNSLDSO-CQSZACIVSA-N	1	0	291.395	1.278	50	0		CDAARO
CN(Cc1cccc2cnccc21)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000534675008	328346214	/nfs/dbraw/zinc/34/62/14/328346214.db2.gz	JHSSIIDHFZVIJL-HNNXBMFYSA-N	1	0	267.332	1.721	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+]C[C@]2(O)CCSC2)C1(C)C	ZINC000097231012	323207689	/nfs/dbraw/zinc/20/76/89/323207689.db2.gz	SBTKSQKGXAZLJR-DMDPSCGWSA-N	1	0	259.415	1.648	50	0		CDAARO
CC1(C)[C@H]([NH2+]Cc2nnc3n2CCCC3)[C@H]2CCCO[C@@H]21	ZINC000183863208	323348922	/nfs/dbraw/zinc/34/89/22/323348922.db2.gz	KTESGAHJDCXLOJ-DFBGVHRSSA-N	1	0	290.411	1.908	50	0		CDAARO
Cc1ccc(C)c(S(=O)(=O)NCC[C@H]2CC[NH2+]C2)c1	ZINC000110797860	533706565	/nfs/dbraw/zinc/70/65/65/533706565.db2.gz	ZVPVBJSXOWFXDW-CYBMUJFWSA-N	1	0	282.409	1.581	50	0		CDAARO
Cc1nn(C)c2ncnc(NCCCCCC[NH3+])c12	ZINC000072438511	327110518	/nfs/dbraw/zinc/11/05/18/327110518.db2.gz	ZZCIQHDOWORNKP-UHFFFAOYSA-N	1	0	262.361	1.603	50	0		CDAARO
NC(=[NH2+])NCCCc1ccccc1Br	ZINC000071577344	330381502	/nfs/dbraw/zinc/38/15/02/330381502.db2.gz	BBGPEMAJHSIGJB-UHFFFAOYSA-N	1	0	256.147	1.865	50	0		CDAARO
Cc1ccsc1[C@@H](C)[NH2+]CC(=O)N1CCOCC1	ZINC000095988823	330436037	/nfs/dbraw/zinc/43/60/37/330436037.db2.gz	GOSJSPCDGPDZQW-LLVKDONJSA-N	1	0	268.382	1.566	50	0		CDAARO
O=C1C[C@@H](C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)CN1	ZINC000585094496	482829908	/nfs/dbraw/zinc/82/99/08/482829908.db2.gz	RNWVYRUULWSLRB-VHSXEESVSA-N	1	0	264.291	1.787	50	0		CDAARO
COCc1nnc(C2([NH+]3CCCC3)CCCC2)[n-]1	ZINC000670451379	483013136	/nfs/dbraw/zinc/01/31/36/483013136.db2.gz	XROMROLZPUXCAQ-UHFFFAOYSA-N	1	0	250.346	1.816	50	0		CDAARO
CCCN1CC[C@@H]([NH2+]C2CSCCSC2)C1	ZINC000670458259	483039634	/nfs/dbraw/zinc/03/96/34/483039634.db2.gz	ABVGTNZVGPJPOO-LLVKDONJSA-N	1	0	260.472	1.909	50	0		CDAARO
COC[C@@H](C)NC(=O)C1CC[NH+](Cc2cc(C)n[nH]2)CC1	ZINC000670460446	483043537	/nfs/dbraw/zinc/04/35/37/483043537.db2.gz	RLLKHADSRCAWNR-GFCCVEGCSA-N	1	0	294.399	1.081	50	0		CDAARO
Nc1nc(CNC(=O)C[C@H]([NH3+])c2ccccc2)cs1	ZINC000670463505	483053724	/nfs/dbraw/zinc/05/37/24/483053724.db2.gz	LWYVXHOKUHFQJX-NSHDSACASA-N	1	0	276.365	1.432	50	0		CDAARO
Cc1ccc(F)cc1C(=O)N1C[C@H](O)[C@@H]([NH+]2CCCC2)C1	ZINC000670466597	483056648	/nfs/dbraw/zinc/05/66/48/483056648.db2.gz	YDHVRSLTTNFPLZ-GJZGRUSLSA-N	1	0	292.354	1.415	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CCc2nc(C3CC3)no2)n1	ZINC000670472808	483081644	/nfs/dbraw/zinc/08/16/44/483081644.db2.gz	UWZLCKSXLKQIAM-NSHDSACASA-N	1	0	289.383	1.981	50	0		CDAARO
CCn1cc([C@H]2OCC[C@H]2C[NH2+]Cc2c[nH]nc2C)cn1	ZINC000083843476	483203921	/nfs/dbraw/zinc/20/39/21/483203921.db2.gz	OSTFOBNLGHQMBE-WFASDCNBSA-N	1	0	289.383	1.802	50	0		CDAARO
[NH3+]C1CCN(C(=O)CCOc2ccccc2F)CC1	ZINC000032114371	527143083	/nfs/dbraw/zinc/14/30/83/527143083.db2.gz	VOOXQLOPGLPPRL-UHFFFAOYSA-N	1	0	266.316	1.544	50	0		CDAARO
CC(C)COCCNC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@@H]21	ZINC000096499715	528096724	/nfs/dbraw/zinc/09/67/24/528096724.db2.gz	VQLPYPQRMKTEMR-GJZGRUSLSA-N	1	0	297.443	1.785	50	0		CDAARO
C[C@H](Cn1cccn1)[NH2+]C[C@@H]1CC(=O)Nc2ccccc21	ZINC000097162380	545522513	/nfs/dbraw/zinc/52/25/13/545522513.db2.gz	HPZXYKGDYQYPPC-OLZOCXBDSA-N	1	0	284.363	1.987	50	0		CDAARO
Cc1cc(N2CC[C@@H]([NH3+])C2=O)ccc1Br	ZINC000049648446	538350407	/nfs/dbraw/zinc/35/04/07/538350407.db2.gz	DSTFDWMELKKNBB-SNVBAGLBSA-N	1	0	269.142	1.822	50	0		CDAARO
CC(C)NS(=O)(=O)CC[NH2+][C@@H](C)Cc1ccccc1	ZINC000223815196	538804121	/nfs/dbraw/zinc/80/41/21/538804121.db2.gz	WIKDALKFFZUYLI-ZDUSSCGKSA-N	1	0	284.425	1.535	50	0		CDAARO
O=C(c1ccc[nH]c1=O)N1CCC[C@@H](c2ncc[nH]2)C1	ZINC000075552174	567904145	/nfs/dbraw/zinc/90/41/45/567904145.db2.gz	PCJQOWNNRGVFDL-SNVBAGLBSA-N	1	0	272.308	1.530	50	0		CDAARO
C[C@@H]1C[NH2+]C[C@H](c2ccc(NS(C)(=O)=O)cc2)C1	ZINC000757214586	574907619	/nfs/dbraw/zinc/90/76/19/574907619.db2.gz	UDJLLEPNTOVNCJ-CMPLNLGQSA-N	1	0	268.382	1.771	50	0		CDAARO
C[C@H](C[C@@H]1CCC(=O)N1)[NH2+]C[C@@H]1CCOC(C)(C)C1	ZINC000926557019	618066923	/nfs/dbraw/zinc/06/69/23/618066923.db2.gz	FKBHZDYYWXTCIJ-UPJWGTAASA-N	1	0	268.401	1.838	50	0		CDAARO
COCC[C@]1(CO)CCC[N@H+](CC2CCOCC2)C1	ZINC000091951912	679717645	/nfs/dbraw/zinc/71/76/45/679717645.db2.gz	KYAGLHBTYHAIKG-OAHLLOKOSA-N	1	0	271.401	1.524	50	0		CDAARO
CC(=O)N1CCN(c2cc[nH+]c3ccccc32)C[C@H](O)C1	ZINC000091793507	682322227	/nfs/dbraw/zinc/32/22/27/682322227.db2.gz	UIBPPTATQGTCRP-CYBMUJFWSA-N	1	0	285.347	1.264	50	0		CDAARO
CC[NH+](CC)CCCNC(=O)N1CCc2[nH]c(C)nc2C1	ZINC000426495892	682384075	/nfs/dbraw/zinc/38/40/75/682384075.db2.gz	XUJPBTALGUJOAR-UHFFFAOYSA-N	1	0	293.415	1.518	50	0		CDAARO
Cc1cccc(C[NH2+]CCN2CCC[C@H](CO)C2)n1	ZINC000952975057	682550597	/nfs/dbraw/zinc/55/05/97/682550597.db2.gz	NWRSFECDFSVAGA-AWEZNQCLSA-N	1	0	263.385	1.184	50	0		CDAARO
Cc1nc2ccccc2n1CC[NH2+][C@@H](C)c1cnnn1C	ZINC000863982401	683071086	/nfs/dbraw/zinc/07/10/86/683071086.db2.gz	IMVOHQDIKJDSFN-NSHDSACASA-N	1	0	284.367	1.824	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CCN(C)S(=O)(=O)N1CCCC1	ZINC000952962189	683584670	/nfs/dbraw/zinc/58/46/70/683584670.db2.gz	BSEFEVZYKCEHEI-CYBMUJFWSA-N	1	0	289.445	1.133	50	0		CDAARO
Cc1cnc(CNC(=O)C[NH+]2CCCCCC2)cn1	ZINC000065504681	683806333	/nfs/dbraw/zinc/80/63/33/683806333.db2.gz	KMXARYDDSQSIAS-UHFFFAOYSA-N	1	0	262.357	1.277	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@H]1CC2(CO1)CC[NH2+]CC2	ZINC000215644386	683869836	/nfs/dbraw/zinc/86/98/36/683869836.db2.gz	UDRFMMANEMUIEH-LLVKDONJSA-N	1	0	270.373	1.670	50	0		CDAARO
O=C1C[C@H]([NH2+]C2CCOCC2)CN1Cc1cccc(F)c1	ZINC000012073425	683882296	/nfs/dbraw/zinc/88/22/96/683882296.db2.gz	YOJMAYJKHIWDRP-HNNXBMFYSA-N	1	0	292.354	1.695	50	0		CDAARO
Cc1ncc(Cl)c(N2C[C@H](O)[C@@H]([NH+]3CCCCC3)C2)n1	ZINC001772705396	1159440023	/nfs/dbraw/zinc/44/00/23/1159440023.db2.gz	MPSODPNRGAKVFQ-STQMWFEESA-N	1	0	296.802	1.474	50	0		CDAARO
CC(C)[NH+]1CCN(CCC(=O)NCc2cccs2)CC1	ZINC000585135409	1164216628	/nfs/dbraw/zinc/21/66/28/1164216628.db2.gz	IGQLXMJWRZFEJC-UHFFFAOYSA-N	1	0	295.452	1.780	50	0		CDAARO
Cc1n[nH]c(C)c1CC[N@@H+](C)[C@@H](C)C(=O)NC1CCCC1	ZINC001704351497	1177698738	/nfs/dbraw/zinc/69/87/38/1177698738.db2.gz	YEGWRRZZNUHTOE-ZDUSSCGKSA-N	1	0	292.427	1.948	50	0		CDAARO
CC[N@H+](C)[C@@H]1CCN(C(=O)Nc2c(C)n[nH]c2C)C1	ZINC000585081779	902237607	/nfs/dbraw/zinc/23/76/07/902237607.db2.gz	AJTYQFPLEKLUCZ-LLVKDONJSA-N	1	0	265.361	1.584	50	0		CDAARO
CCCCCOCC(=O)N1C[C@]2(C)C[N@H+](C)C[C@]2(C)C1	ZINC000585128846	902295858	/nfs/dbraw/zinc/29/58/58/902295858.db2.gz	PCDJFVFWJZGOFK-IYBDPMFKSA-N	1	0	282.428	1.993	50	0		CDAARO
C[NH2+]C[C@H](O)[C@H](C)C(=O)NC1CC(C)(C)CC(C)(C)C1	ZINC000952882211	910446984	/nfs/dbraw/zinc/44/69/84/910446984.db2.gz	JGOXBLQGYMWEQQ-AAEUAGOBSA-N	1	0	284.444	1.924	50	0		CDAARO
C[NH2+]C[C@H](O)[C@@H](C)C(=O)NC1CC(C)(C)CC(C)(C)C1	ZINC000952882214	910448643	/nfs/dbraw/zinc/44/86/43/910448643.db2.gz	JGOXBLQGYMWEQQ-YPMHNXCESA-N	1	0	284.444	1.924	50	0		CDAARO
C/C=C/C[N@@H+]1CCC[C@H](CNC(=O)CCn2cnnc2)C1	ZINC000820394975	925521899	/nfs/dbraw/zinc/52/18/99/925521899.db2.gz	PGKNBIKMWYSBNN-BAABZTOOSA-N	1	0	291.399	1.073	50	0		CDAARO
CN(C)S(=O)(=O)NCCCC[NH+]1CCCCCC1	ZINC000823725434	925730317	/nfs/dbraw/zinc/73/03/17/925730317.db2.gz	VVWDTPCCSVGGIU-UHFFFAOYSA-N	1	0	277.434	1.039	50	0		CDAARO
CO[C@H]1CCN(C(=O)CC[NH+]2CCCCCCC2)C1	ZINC000824300519	925815007	/nfs/dbraw/zinc/81/50/07/925815007.db2.gz	XHOSXKMVMYFADQ-AWEZNQCLSA-N	1	0	268.401	1.890	50	0		CDAARO
Cc1nncn1CC[N@@H+]1CCC[C@@H](C(C)(C)O)C1	ZINC000825297049	925862666	/nfs/dbraw/zinc/86/26/66/925862666.db2.gz	NIBYSASWGVONFJ-GFCCVEGCSA-N	1	0	252.362	1.069	50	0		CDAARO
CC(=O)NCC(=O)Nc1ccccc1C[NH+]1CCCCC1	ZINC000828075171	926033085	/nfs/dbraw/zinc/03/30/85/926033085.db2.gz	QHKKJAOMBPKBFS-UHFFFAOYSA-N	1	0	289.379	1.747	50	0		CDAARO
Cc1nc(N)nc(NCC[N@@H+]2CCC[C@@H](CO)C2)c1Cl	ZINC000828711179	926169144	/nfs/dbraw/zinc/16/91/44/926169144.db2.gz	NGYZSOLDPQHTBH-SNVBAGLBSA-N	1	0	299.806	1.137	50	0		CDAARO
CCCCCOCC(=O)NC1(CCO)CC[NH+](C)CC1	ZINC000585125834	931000279	/nfs/dbraw/zinc/00/02/79/931000279.db2.gz	HCBXCYOUHTYFTJ-UHFFFAOYSA-N	1	0	286.416	1.156	50	0		CDAARO
COCCCC[NH+]1CCN(c2ccc(C)cn2)CC1	ZINC001209218335	940450757	/nfs/dbraw/zinc/45/07/57/940450757.db2.gz	CRTLBQNERCAGME-UHFFFAOYSA-N	1	0	263.385	1.939	50	0		CDAARO
C[C@H]1CCc2nn3ccnc(N4CC[NH2+]CC4)c3c2C1	ZINC000409421898	941341206	/nfs/dbraw/zinc/34/12/06/941341206.db2.gz	HYMDRACEWNLJCL-NSHDSACASA-N	1	0	271.368	1.264	50	0		CDAARO
Cc1cccc(CCN(CC[NH+](C)C)C[C@@H]2CCCO2)n1	ZINC001506399489	975149185	/nfs/dbraw/zinc/14/91/85/975149185.db2.gz	GUAZKYJHCAUHIY-KRWDZBQOSA-N	1	0	291.439	1.975	50	0		CDAARO
Cn1ccnc1CC[N@@H+]1CCC[C@@H](c2cc(=O)[nH]cn2)C1	ZINC001506402447	975150463	/nfs/dbraw/zinc/15/04/63/975150463.db2.gz	NOXRADWJASNUSB-GFCCVEGCSA-N	1	0	287.367	1.338	50	0		CDAARO
CN(C)C(=O)CN1CCC[N@H+](CCCC(F)(F)F)CC1	ZINC001506407157	975151530	/nfs/dbraw/zinc/15/15/30/975151530.db2.gz	OUYLCJYHFIUPDD-UHFFFAOYSA-N	1	0	295.349	1.425	50	0		CDAARO
CC[N@@H+](Cc1cncn1CCOC)C[C@H]1CCCO1	ZINC001506416683	975155412	/nfs/dbraw/zinc/15/54/12/975155412.db2.gz	FROJLLHMTILUKJ-CQSZACIVSA-N	1	0	267.373	1.530	50	0		CDAARO
CC(C)(C[NH2+]CCCc1csc(N)n1)N1CCOCC1	ZINC001506428782	975161797	/nfs/dbraw/zinc/16/17/97/975161797.db2.gz	SWRWTHKXBZPEPZ-UHFFFAOYSA-N	1	0	298.456	1.358	50	0		CDAARO
O=C(C[C@@H]1C[NH2+]CCO1)NCc1cccc(Cl)c1F	ZINC000215258135	1163268155	/nfs/dbraw/zinc/26/81/55/1163268155.db2.gz	FCJVZMVLVZKZOM-SNVBAGLBSA-N	1	0	286.734	1.474	50	0		CDAARO
C[C@H]1C[C@H]([NH3+])CCN1C(=O)Cc1cccc(F)c1	ZINC000124794542	230394589	/nfs/dbraw/zinc/39/45/89/230394589.db2.gz	KUPIMUMTGLKBIB-GXFFZTMASA-N	1	0	250.317	1.706	50	0		CDAARO
Cc1cc(-c2ccccc2)nnc1NCCN1CC[NH2+]CC1	ZINC000095630175	185017056	/nfs/dbraw/zinc/01/70/56/185017056.db2.gz	DSULVDIIXDFKIC-UHFFFAOYSA-N	1	0	297.406	1.769	50	0		CDAARO
C[C@H]1CCCC[C@H]1[NH2+]Cc1nc(CS(C)(=O)=O)no1	ZINC000095941194	185036115	/nfs/dbraw/zinc/03/61/15/185036115.db2.gz	PRVSBVVGGMHJEF-VHSXEESVSA-N	1	0	287.385	1.283	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2cn3cc(Cl)ccc3n2)C1	ZINC000050243253	365572491	/nfs/dbraw/zinc/57/24/91/365572491.db2.gz	GQECXAZGOCZJAF-SNVBAGLBSA-N	1	0	250.733	1.521	50	0		CDAARO
C[C@@H](C[NH2+]C(C1CC1)C1CC1)N1CCOC[C@@H]1C	ZINC000095967930	185046896	/nfs/dbraw/zinc/04/68/96/185046896.db2.gz	QABMJDGBHGTZNB-RYUDHWBXSA-N	1	0	252.402	1.874	50	0		CDAARO
C[C@H](C[C@H](O)c1cccs1)[NH2+]Cc1cnnn1C	ZINC000095978227	185052169	/nfs/dbraw/zinc/05/21/69/185052169.db2.gz	GJPLLFMZTWDSRY-KOLCDFICSA-N	1	0	266.370	1.478	50	0		CDAARO
CCOCC[NH2+][C@@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000309737745	342024072	/nfs/dbraw/zinc/02/40/72/342024072.db2.gz	RBLKKLHZIBIXSO-QWRGUYRKSA-N	1	0	260.378	1.914	50	0		CDAARO
Cc1ncc(/C=C/C(=O)N2CC[NH2+]C[C@H]2C)s1	ZINC000124857400	187157847	/nfs/dbraw/zinc/15/78/47/187157847.db2.gz	KMMVKFCGOHLEEC-CDAZIORVSA-N	1	0	251.355	1.285	50	0		CDAARO
CCOc1ccccc1CCC(=O)N1CC[NH2+]C[C@H]1C	ZINC000124945763	187162586	/nfs/dbraw/zinc/16/25/86/187162586.db2.gz	ATTCKOZQHBUHQE-CYBMUJFWSA-N	1	0	276.380	1.838	50	0		CDAARO
COCCC(=O)N1CCC(Nc2cc[nH+]c(C)c2)CC1	ZINC000274381949	365642833	/nfs/dbraw/zinc/64/28/33/365642833.db2.gz	SYBGKRIIJMRWOK-UHFFFAOYSA-N	1	0	277.368	1.829	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)c1cnn(C2CCCC2)c1C	ZINC000195554001	342625792	/nfs/dbraw/zinc/62/57/92/342625792.db2.gz	DXVUOYBONLJMLE-KBPBESRZSA-N	1	0	292.383	1.023	50	0		CDAARO
CCCC[C@H]([NH3+])C(=O)N1CC[C@H]2OCCC[C@@H]2C1	ZINC000195554460	342625955	/nfs/dbraw/zinc/62/59/55/342625955.db2.gz	MJKATVHZWBRJMN-FRRDWIJNSA-N	1	0	254.374	1.531	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](C(=O)N2CC(c3nccs3)C2)C1	ZINC000243902100	361831182	/nfs/dbraw/zinc/83/11/82/361831182.db2.gz	BFZZHWTYUZAZBN-LLVKDONJSA-N	1	0	295.408	1.037	50	0		CDAARO
Nc1nc(NCCCc2cccnc2)cc([C@H]2C[C@H]([NH3+])C2)n1	ZINC000244773871	361861499	/nfs/dbraw/zinc/86/14/99/361861499.db2.gz	PIEHJURSZLDBQR-JOCQHMNTSA-N	1	0	298.394	1.703	50	0		CDAARO
Cc1ccccc1OCCC[N@@H+](C)CCn1cc[nH]c1=O	ZINC000244899439	361869304	/nfs/dbraw/zinc/86/93/04/361869304.db2.gz	ZJZGQDQMHSYRER-UHFFFAOYSA-N	1	0	289.379	1.886	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1cc(F)c(F)c(F)c1	ZINC000097229409	342204903	/nfs/dbraw/zinc/20/49/03/342204903.db2.gz	PEBQVZZEMUQQLY-SSDOTTSWSA-N	1	0	296.314	1.510	50	0		CDAARO
O[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@@H+]2Cc1nc2cccnc2s1	ZINC000440943593	361952633	/nfs/dbraw/zinc/95/26/33/361952633.db2.gz	ZBGSUDQASNLVLX-UHEDFLHXSA-N	1	0	287.388	1.892	50	0		CDAARO
c1n[nH]cc1O[C@@H]1COC[C@@H]1[NH2+][C@@H]1CCc2ccccc21	ZINC000685940995	539045921	/nfs/dbraw/zinc/04/59/21/539045921.db2.gz	NELPNJYBKPVPIM-OWCLPIDISA-N	1	0	285.347	1.833	50	0		CDAARO
O=C(NC[C@H]1C[N@@H+]2CCC[C@@H]2CO1)c1cc(F)cc(F)c1	ZINC000058368282	539161047	/nfs/dbraw/zinc/16/10/47/539161047.db2.gz	DJGNYVXWWYTLQX-KGLIPLIRSA-N	1	0	296.317	1.558	50	0		CDAARO
CCc1cc(CSc2nnc(CC[NH3+])n2C)on1	ZINC000426498350	529528430	/nfs/dbraw/zinc/52/84/30/529528430.db2.gz	APDQHVUZFFPCSE-UHFFFAOYSA-N	1	0	267.358	1.159	50	0		CDAARO
O=C(NCc1nccs1)[C@@H]1CCN1C1CCCC1	ZINC000585121402	362041983	/nfs/dbraw/zinc/04/19/83/362041983.db2.gz	OKLNXAMTJRUPLD-NSHDSACASA-N	1	0	265.382	1.776	50	0		CDAARO
COC(C)(C)C[C@H](C)[NH2+][C@@H]1CCCC[C@H]1C(N)=O	ZINC000253370947	342416345	/nfs/dbraw/zinc/41/63/45/342416345.db2.gz	YQECQZLYZUSYRN-QJPTWQEYSA-N	1	0	256.390	1.824	50	0		CDAARO
NC(=O)c1cccc(C[N@@H+]2CCCSCC2)c1	ZINC000089980174	362324938	/nfs/dbraw/zinc/32/49/38/362324938.db2.gz	PKXVKUOBIGTCAP-UHFFFAOYSA-N	1	0	250.367	1.724	50	0		CDAARO
CC(C)(C)OC(=O)NCCC(=O)CCC(=O)CC[NH3+]	ZINC000002599097	362438491	/nfs/dbraw/zinc/43/84/91/362438491.db2.gz	LPMYXQHEUHKXOV-UHFFFAOYSA-N	1	0	272.345	1.168	50	0		CDAARO
[NH3+]CC(=O)N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000120545291	362461287	/nfs/dbraw/zinc/46/12/87/362461287.db2.gz	YXJVKSCXAMXBOQ-SECBINFHSA-N	1	0	289.162	1.932	50	0		CDAARO
COc1ccc([C@H]2CN(C)C(=O)[C@@]23CCC[NH2+]C3)cc1	ZINC000044137127	345421598	/nfs/dbraw/zinc/42/15/98/345421598.db2.gz	DXBJNJAMXPGLDM-GDBMZVCRSA-N	1	0	274.364	1.621	50	0		CDAARO
C[C@H](CCn1cccn1)[NH2+][C@H]1CCCC[C@@H]1C(N)=O	ZINC000124110924	345720395	/nfs/dbraw/zinc/72/03/95/345720395.db2.gz	FODIDOQZNWPCBU-AGIUHOORSA-N	1	0	264.373	1.295	50	0		CDAARO
COC[C@@H](C)[NH2+][C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000095968487	136517863	/nfs/dbraw/zinc/51/78/63/136517863.db2.gz	XQHITRLHDYTTOL-JKSUJKDBSA-N	1	0	291.439	1.822	50	0		CDAARO
C[C@H](NC(=O)c1csnn1)C(C)(C)C[NH+](C)C	ZINC000085290741	179006792	/nfs/dbraw/zinc/00/67/92/179006792.db2.gz	LOXMAMFLZARAAO-QMMMGPOBSA-N	1	0	256.375	1.244	50	0		CDAARO
COc1ccc(OCCN(C)C(=O)[C@H]2CCC[C@@H]2[NH3+])cc1	ZINC000085366940	179036915	/nfs/dbraw/zinc/03/69/15/179036915.db2.gz	GKEYHTJOSLAXDM-GJZGRUSLSA-N	1	0	292.379	1.660	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)c2ccccc2)CC1	ZINC000085467901	179073415	/nfs/dbraw/zinc/07/34/15/179073415.db2.gz	UEZMTLHAKZSNIJ-UHFFFAOYSA-N	1	0	262.353	1.527	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[N@@H+]1CC[C@@H]2CCCC[C@H]2C1	ZINC000036446857	348747242	/nfs/dbraw/zinc/74/72/42/348747242.db2.gz	YOVRCEQNLOHWNK-SRVKXCTJSA-N	1	0	267.373	1.343	50	0		CDAARO
CC1CC[NH+](CCCNC(=O)N(C)Cc2ncc[nH]2)CC1	ZINC000584888490	349347203	/nfs/dbraw/zinc/34/72/03/349347203.db2.gz	UARHBBATXOTWRG-UHFFFAOYSA-N	1	0	293.415	1.673	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)NC[C@H]1CC[C@H](CO)CC1	ZINC000584891076	349350264	/nfs/dbraw/zinc/35/02/64/349350264.db2.gz	XFAHUKRNTOPGFE-HDJSIYSDSA-N	1	0	268.401	1.291	50	0		CDAARO
CN(CC[NH+]1CCCC1)C(=O)C[C@@H]1CCCOC1	ZINC000584899811	349361231	/nfs/dbraw/zinc/36/12/31/349361231.db2.gz	XWODGFPCNQKXDV-ZDUSSCGKSA-N	1	0	254.374	1.357	50	0		CDAARO
COc1ccc2c(c1)C[C@H]([NH2+]C[C@@H](C)[S@](C)=O)CC2	ZINC000090843037	180044577	/nfs/dbraw/zinc/04/45/77/180044577.db2.gz	AILYWZGCDXMZSV-FRGNPEFRSA-N	1	0	281.421	1.909	50	0		CDAARO
CCNC(=O)N[C@@H]1CC[N@H+](CCCOCC)C[C@H]1C	ZINC000110597194	350182644	/nfs/dbraw/zinc/18/26/44/350182644.db2.gz	MIXBMOITUKGJIA-CHWSQXEVSA-N	1	0	271.405	1.443	50	0		CDAARO
CN(CCOc1ccccc1F)C(=O)[C@@H]1CC[C@@H]([NH3+])C1	ZINC000091544110	180185007	/nfs/dbraw/zinc/18/50/07/180185007.db2.gz	MNRKJWFPKXXKOL-VXGBXAGGSA-N	1	0	280.343	1.790	50	0		CDAARO
Cc1cc(NCc2nc3ccccc3n2C)nc(N)[nH+]1	ZINC000091665189	180221285	/nfs/dbraw/zinc/22/12/85/180221285.db2.gz	QCJQFGLTKOZGON-UHFFFAOYSA-N	1	0	268.324	1.866	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@H]1c1cnn(C)c1)C1CC[NH+](C)CC1	ZINC000364112581	362953427	/nfs/dbraw/zinc/95/34/27/362953427.db2.gz	AMRMFHFYBRPCDY-UONOGXRCSA-N	1	0	276.384	1.076	50	0		CDAARO
Cc1cc(F)cc(CN2C[C@H](CO)[C@H](C[NH+](C)C)C2)c1	ZINC000091914963	180286191	/nfs/dbraw/zinc/28/61/91/180286191.db2.gz	DGRPCLUZKQLHNZ-HUUCEWRRSA-N	1	0	280.387	1.736	50	0		CDAARO
CC1(C)CN(C(=O)CCC[NH+]2CCCCC2)C[C@]1(C)O	ZINC000092004030	180304787	/nfs/dbraw/zinc/30/47/87/180304787.db2.gz	WNVHIXXDOPGENH-INIZCTEOSA-N	1	0	282.428	1.872	50	0		CDAARO
CC[N@H+](C)C[C@@H]1CN(C(=O)c2csc(C)c2)C[C@@H]1CO	ZINC000092020217	180307923	/nfs/dbraw/zinc/30/79/23/180307923.db2.gz	MGUCIIXTFQVHQA-ZIAGYGMSSA-N	1	0	296.436	1.689	50	0		CDAARO
C[C@H]([NH2+][C@@H]1CCN(S(C)(=O)=O)C[C@H]1C)c1ccncc1	ZINC000252669034	350437483	/nfs/dbraw/zinc/43/74/83/350437483.db2.gz	GFQDUNIMFZSDMA-MBNYWOFBSA-N	1	0	297.424	1.402	50	0		CDAARO
C[C@H]1C[N@@H+]2CCC[C@H]2CN1S(=O)(=O)c1cncc(F)c1	ZINC000106911720	186149710	/nfs/dbraw/zinc/14/97/10/186149710.db2.gz	WIQUMFIORPANAY-JQWIXIFHSA-N	1	0	299.371	1.078	50	0		CDAARO
C[C@@H]1C[N@H+](CC(C)(C)O)CCN1c1nccs1	ZINC000095373352	351395543	/nfs/dbraw/zinc/39/55/43/351395543.db2.gz	OOYUVVOUFPWSRR-SNVBAGLBSA-N	1	0	255.387	1.425	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1C(=O)NCCC[C@@H]1CCCC[C@@H]1O	ZINC000122528556	187037152	/nfs/dbraw/zinc/03/71/52/187037152.db2.gz	HSRYAQWTUWNIRM-MJBXVCDLSA-N	1	0	268.401	1.528	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CN(C(=O)c2ccc(F)cc2Cl)CCO1	ZINC000122886173	187057844	/nfs/dbraw/zinc/05/78/44/187057844.db2.gz	CCYDMVGBYIUFGG-PELKAZGASA-N	1	0	286.734	1.667	50	0		CDAARO
CC[NH+]1CCC(CC(=O)NC[C@H](O)c2cccnc2)CC1	ZINC000065466698	363282766	/nfs/dbraw/zinc/28/27/66/363282766.db2.gz	QIPYCMLBDDHQAN-HNNXBMFYSA-N	1	0	291.395	1.353	50	0		CDAARO
CCN(Cc1ccncc1)C(=O)CN1CCC[N@H+](C)CC1	ZINC000065463888	363285312	/nfs/dbraw/zinc/28/53/12/363285312.db2.gz	LASJTZCJOQFLSF-UHFFFAOYSA-N	1	0	290.411	1.068	50	0		CDAARO
COC(=O)CC[N@@H+]1CCNC(=O)C[C@H]1c1ccccc1	ZINC000089400827	291028439	/nfs/dbraw/zinc/02/84/39/291028439.db2.gz	NZLDYWYAGNAYSY-ZDUSSCGKSA-N	1	0	276.336	1.113	50	0		CDAARO
O=C1C[C@H]([NH+]2CCCCC2)C(=O)N1Cc1ccccc1	ZINC000000084440	355885518	/nfs/dbraw/zinc/88/55/18/355885518.db2.gz	LFFMNEGDAQZGMW-AWEZNQCLSA-N	1	0	272.348	1.800	50	0		CDAARO
O=C(C[NH+]1CCCC1)N1CCN(C(=O)c2ccccc2)C1	ZINC000000196482	355895418	/nfs/dbraw/zinc/89/54/18/355895418.db2.gz	UEZYXVDULHYKHV-UHFFFAOYSA-N	1	0	287.363	1.024	50	0		CDAARO
COc1cccc(OCCOCC[N@H+](C)CCO)c1	ZINC000002981076	355989562	/nfs/dbraw/zinc/98/95/62/355989562.db2.gz	UEQMKSDUDWCCLN-UHFFFAOYSA-N	1	0	269.341	1.015	50	0		CDAARO
CCOC(=O)C1=C(O)NC(N2CCCCC2)=[NH+][C@@H]1C(C)C	ZINC000002441150	355969829	/nfs/dbraw/zinc/96/98/29/355969829.db2.gz	QCAZAEYHWCNBBL-NWDGAFQWSA-N	1	0	295.383	1.162	50	0		CDAARO
Cn1nc(C(F)(F)F)cc1C(=O)NC1CC[NH+](C)CC1	ZINC000002778232	356107432	/nfs/dbraw/zinc/10/74/32/356107432.db2.gz	XWAUDTFETQWLNI-UHFFFAOYSA-N	1	0	290.289	1.263	50	0		CDAARO
CCOc1c(C[NH2+]CCO)cc(Cl)cc1OC	ZINC000010436631	356258248	/nfs/dbraw/zinc/25/82/48/356258248.db2.gz	ILRDZDQKIHXKSQ-UHFFFAOYSA-N	1	0	259.733	1.829	50	0		CDAARO
CCO[C@@H]1C[C@H](N(C)C(=O)C[NH2+]C[C@H]2CCCO2)C1(C)C	ZINC000299739933	356275571	/nfs/dbraw/zinc/27/55/71/356275571.db2.gz	TVIRZGJINSTGHT-HZSPNIEDSA-N	1	0	298.427	1.417	50	0		CDAARO
[NH3+]CCS(=O)(=O)N1CCC(Cc2ccccc2)CC1	ZINC000011755730	356279261	/nfs/dbraw/zinc/27/92/61/356279261.db2.gz	KQHUVZDPRYYHIY-UHFFFAOYSA-N	1	0	282.409	1.230	50	0		CDAARO
CC[C@@H](CNC(=O)Cc1c(C)noc1C)[NH+]1CCCC1	ZINC000032654042	356330911	/nfs/dbraw/zinc/33/09/11/356330911.db2.gz	ZSZOYLPKEXXUCM-ZDUSSCGKSA-N	1	0	279.384	1.825	50	0		CDAARO
COCC(=O)N[C@H]1CCC[N@H+](Cc2cccc(OC)c2)C1	ZINC000019789174	356504219	/nfs/dbraw/zinc/50/42/19/356504219.db2.gz	KCYQISWMFHAONJ-AWEZNQCLSA-N	1	0	292.379	1.422	50	0		CDAARO
CC[NH+]1CCN(CCCOc2ccccc2C=O)CC1	ZINC000019798141	356505642	/nfs/dbraw/zinc/50/56/42/356505642.db2.gz	NNESAQAALNQTQH-UHFFFAOYSA-N	1	0	276.380	1.906	50	0		CDAARO
Brc1ccc(CN2CC[NH2+]CC2)s1	ZINC000019803781	356506096	/nfs/dbraw/zinc/50/60/96/356506096.db2.gz	STQKVDLGECMYRM-UHFFFAOYSA-N	1	0	261.188	1.916	50	0		CDAARO
CC(C)[C@H]([NH3+])C(=O)Nc1cnn(Cc2ccccc2)c1	ZINC000037770068	356531341	/nfs/dbraw/zinc/53/13/41/356531341.db2.gz	NHCOBJWPUOFLSS-AWEZNQCLSA-N	1	0	272.352	1.853	50	0		CDAARO
CC(C)(C)[C@H](O)C[NH2+][C@H]1CCN(CC(F)(F)F)C1	ZINC000088720947	366293601	/nfs/dbraw/zinc/29/36/01/366293601.db2.gz	LENAEGRRZFUAMQ-VHSXEESVSA-N	1	0	268.323	1.620	50	0		CDAARO
Cc1ccc(COC[C@H](O)C[NH+]2CCN(C)CC2)cc1	ZINC000023114597	356627891	/nfs/dbraw/zinc/62/78/91/356627891.db2.gz	LFHHZWGBVDKOFO-MRXNPFEDSA-N	1	0	278.396	1.120	50	0		CDAARO
CC(=O)c1cccc(OC[C@@H](O)C[N@@H+]2CCC[C@@H](O)C2)c1	ZINC000023387161	356641489	/nfs/dbraw/zinc/64/14/89/356641489.db2.gz	FPNOPAJNRCQVRK-CABCVRRESA-N	1	0	293.363	1.086	50	0		CDAARO
C[C@@H]([NH2+]Cc1cncn1C)c1ccc2c(c1)OCO2	ZINC000112340318	356723182	/nfs/dbraw/zinc/72/31/82/356723182.db2.gz	ACOKKEJZFDCLLN-SNVBAGLBSA-N	1	0	259.309	2.000	50	0		CDAARO
NC(=O)[C@@H]1CCC[N@H+](Cc2cc(F)ccc2F)C1	ZINC000000757250	356813918	/nfs/dbraw/zinc/81/39/18/356813918.db2.gz	WUYXDWVKDYOUBK-SECBINFHSA-N	1	0	254.280	1.662	50	0		CDAARO
COCCC(=O)NCc1ccc(C[NH+]2CCCC2)cc1	ZINC000171355914	356819901	/nfs/dbraw/zinc/81/99/01/356819901.db2.gz	XWTQTRKAWSHOSF-UHFFFAOYSA-N	1	0	276.380	1.935	50	0		CDAARO
COc1ccccc1C[NH2+]C1CCN(C(C)=O)CC1	ZINC000034995468	356825835	/nfs/dbraw/zinc/82/58/35/356825835.db2.gz	NWNIYSZFMGYCNE-UHFFFAOYSA-N	1	0	262.353	1.796	50	0		CDAARO
O=C(Nc1cc(Cl)ccc1O)C1CC[NH2+]CC1	ZINC000032625197	356783610	/nfs/dbraw/zinc/78/36/10/356783610.db2.gz	GIWLSSKLZAAODK-UHFFFAOYSA-N	1	0	254.717	1.984	50	0	in-vitro	CDAARO
C[N@H+]1[C@@H]2CC[C@H]1CCN(S(=O)(=O)c1ccccc1)C2	ZINC000071779943	356919504	/nfs/dbraw/zinc/91/95/04/356919504.db2.gz	DEFSDSKFGXCVMR-QWHCGFSZSA-N	1	0	280.393	1.544	50	0		CDAARO
[NH3+]CC(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000037822421	356936081	/nfs/dbraw/zinc/93/60/81/356936081.db2.gz	VOIYSFDFEDLQOL-NSHDSACASA-N	1	0	254.717	1.199	50	0		CDAARO
c1csc(C2=NN=C(N3CC[NH2+]CC3)SC2)c1	ZINC000038478398	356961962	/nfs/dbraw/zinc/96/19/62/356961962.db2.gz	SYLNCRLENBECIV-UHFFFAOYSA-N	1	0	266.395	1.460	50	0		CDAARO
COC(=O)[C@H](CC[NH2+]Cc1ccc(OC)cc1)[C@H](C)O	ZINC000043214669	363572216	/nfs/dbraw/zinc/57/22/16/363572216.db2.gz	CEENHDWLURPRQT-SMDDNHRTSA-N	1	0	281.352	1.345	50	0		CDAARO
[NH3+]Cc1n[nH]c(=O)n1-c1ccccc1Oc1ccccc1	ZINC000065371343	357531664	/nfs/dbraw/zinc/53/16/64/357531664.db2.gz	IFQVRJHRDGQXPP-UHFFFAOYSA-N	1	0	282.303	1.812	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N(C)C[C@@H]2CCCO2)c1C	ZINC000065394758	357535471	/nfs/dbraw/zinc/53/54/71/357535471.db2.gz	QKZGAERPTXFBBC-LBPRGKRZSA-N	1	0	264.373	1.775	50	0		CDAARO
CN(CCC[NH+](C)C)c1cc(NC2CC2)nc(N)n1	ZINC000065394115	357535994	/nfs/dbraw/zinc/53/59/94/357535994.db2.gz	AWUGTFRHNIEDFH-UHFFFAOYSA-N	1	0	264.377	1.021	50	0		CDAARO
CC(C)NC(=O)C[NH2+][C@@H](C)COc1ccccc1	ZINC000065395200	357537133	/nfs/dbraw/zinc/53/71/33/357537133.db2.gz	FSGSBTHYYKMCHC-LBPRGKRZSA-N	1	0	250.342	1.568	50	0		CDAARO
Cc1cccc([C@@H](C(=O)N2CCC([NH3+])CC2)N(C)C)c1	ZINC000065404434	357537681	/nfs/dbraw/zinc/53/76/81/357537681.db2.gz	JRTRFGFAOQWPJA-HNNXBMFYSA-N	1	0	275.396	1.547	50	0		CDAARO
Cn1c(CC2CC[NH2+]CC2)nnc1SC[C@H]1CCCO1	ZINC000065526328	357547066	/nfs/dbraw/zinc/54/70/66/357547066.db2.gz	LFNKEOSQQHJHKC-GFCCVEGCSA-N	1	0	296.440	1.628	50	0		CDAARO
CC[N@@H+]1CCN(Cc2cnc(OC)nc2)CC1(C)C	ZINC000067757301	357625076	/nfs/dbraw/zinc/62/50/76/357625076.db2.gz	FOKRRKSGJWJMCQ-UHFFFAOYSA-N	1	0	264.373	1.401	50	0		CDAARO
Cc1cc(F)ccc1NC(=O)C[NH2+][C@@H](C)Cn1ccnc1	ZINC000067818666	357628899	/nfs/dbraw/zinc/62/88/99/357628899.db2.gz	PTNXDMAQRXCVMG-LBPRGKRZSA-N	1	0	290.342	1.947	50	0		CDAARO
CCOC(=O)[C@@H]1CCCCN1c1cc(CC[NH3+])nc(C)n1	ZINC000067490186	357610864	/nfs/dbraw/zinc/61/08/64/357610864.db2.gz	FGCKHPNHVHESBP-ZDUSSCGKSA-N	1	0	292.383	1.208	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)Nc2cc(CC[NH3+])nc(C)n2)n1	ZINC000067947832	357638654	/nfs/dbraw/zinc/63/86/54/357638654.db2.gz	VSOBMHYCNHMNTQ-LLVKDONJSA-N	1	0	288.399	1.600	50	0		CDAARO
CCC[NH+]1CCN(c2ccc(-c3nc(C)no3)cn2)CC1	ZINC000072454237	357837400	/nfs/dbraw/zinc/83/74/00/357837400.db2.gz	QTYITVSXUGVLDQ-UHFFFAOYSA-N	1	0	287.367	1.972	50	0		CDAARO
CC[C@](C)(CNC(=O)/C=C/c1ccco1)N1CCOCC1	ZINC000036397035	357843439	/nfs/dbraw/zinc/84/34/39/357843439.db2.gz	MVYBXEBRJPDLCO-FYCOFBDGSA-N	1	0	292.379	1.910	50	0		CDAARO
Cc1nc(C)c(C(=O)N(CC[NH+](C)C)C[C@H]2CCCO2)o1	ZINC000073427120	357879733	/nfs/dbraw/zinc/87/97/33/357879733.db2.gz	PKZIBRLRRNDMFW-CYBMUJFWSA-N	1	0	295.383	1.474	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H](O)CN1[C@@H](C)Cc1ccsc1	ZINC000097084382	357943939	/nfs/dbraw/zinc/94/39/39/357943939.db2.gz	IHKFHZJLXATPCR-WCQGTBRESA-N	1	0	269.366	1.287	50	0		CDAARO
CC(C)Oc1ccc(S(=O)(=O)N[C@H]2CCC[NH2+]C2)cc1	ZINC000097234931	358050453	/nfs/dbraw/zinc/05/04/53/358050453.db2.gz	BDEPWAPYNWCKGV-LBPRGKRZSA-N	1	0	298.408	1.504	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]CCN1CCC[C@@H](C)C1	ZINC000097159196	358186821	/nfs/dbraw/zinc/18/68/21/358186821.db2.gz	CCMHQKKIFCGGNX-LLVKDONJSA-N	1	0	250.390	1.848	50	0		CDAARO
O=c1[nH]c2ccccc2cc1C[NH2+]C1CCC(O)CC1	ZINC000020089669	358323740	/nfs/dbraw/zinc/32/37/40/358323740.db2.gz	WUBGFSRQEAKRAD-UHFFFAOYSA-N	1	0	272.348	1.921	50	0		CDAARO
CC(C)[C@H](O)CC[NH2+][C@@H]1CCN(CC(F)(F)F)C1	ZINC000088734831	366429213	/nfs/dbraw/zinc/42/92/13/366429213.db2.gz	NIZGLMBHXWHSKZ-GHMZBOCLSA-N	1	0	268.323	1.620	50	0		CDAARO
C[C@@H]1COCC[C@H]1Nc1cc(C(N)=O)ccc1C[NH+](C)C	ZINC000195104723	358410706	/nfs/dbraw/zinc/41/07/06/358410706.db2.gz	BGRXQOKUDNGFGR-BXUZGUMPSA-N	1	0	291.395	1.684	50	0		CDAARO
Cc1ncnc(NCC2([NH+](C)C)CCOCC2)c1C	ZINC000095358549	358684773	/nfs/dbraw/zinc/68/47/73/358684773.db2.gz	PREQXJXNAZPNBQ-UHFFFAOYSA-N	1	0	264.373	1.616	50	0		CDAARO
Cc1nc(Cc2nc(CC[NH+](C)C)no2)cs1	ZINC000095372493	358688687	/nfs/dbraw/zinc/68/86/87/358688687.db2.gz	KRYWZGZZZFOBRA-UHFFFAOYSA-N	1	0	252.343	1.529	50	0		CDAARO
CCC[C@H](Nc1cc(C(C)C)[nH+]c(N)n1)C(=O)NC	ZINC000095381392	358690634	/nfs/dbraw/zinc/69/06/34/358690634.db2.gz	MPZXPYNIOAQANM-VIFPVBQESA-N	1	0	265.361	1.509	50	0		CDAARO
COCc1cc(CNC(=O)C2CC[NH+](C(C)C)CC2)[nH]n1	ZINC000095391772	358692161	/nfs/dbraw/zinc/69/21/61/358692161.db2.gz	WKVHPQKJLZBWTF-UHFFFAOYSA-N	1	0	294.399	1.293	50	0		CDAARO
Cc1c(NC(=O)N2CCCC[C@@H]2C[NH3+])cccc1C(N)=O	ZINC000097301255	358765928	/nfs/dbraw/zinc/76/59/28/358765928.db2.gz	UVOKWIPPWDCXBW-LLVKDONJSA-N	1	0	290.367	1.439	50	0		CDAARO
CCCc1cc(C(=O)N2C[C@H]3CC[C@@H]2C[N@H+](C)C3)no1	ZINC000096153278	358710158	/nfs/dbraw/zinc/71/01/58/358710158.db2.gz	APNBBJFCTOKDNI-NWDGAFQWSA-N	1	0	277.368	1.793	50	0		CDAARO
CN(CC1(CO)CCC1)C(=O)Nc1cccc(C[NH3+])c1	ZINC000097394407	358772992	/nfs/dbraw/zinc/77/29/92/358772992.db2.gz	FPJGVJNKJWEYOI-UHFFFAOYSA-N	1	0	277.368	1.772	50	0		CDAARO
CN(C)c1ncccc1C(=O)NCC[C@@H]1CCC[NH2+]1	ZINC000097546512	358784485	/nfs/dbraw/zinc/78/44/85/358784485.db2.gz	MHDTVYFVVFOQKW-NSHDSACASA-N	1	0	262.357	1.020	50	0		CDAARO
Cc1nnc([C@H](C)NC(=O)C2([NH+]3CCCC3)CCCC2)[nH]1	ZINC000215940299	358911400	/nfs/dbraw/zinc/91/14/00/358911400.db2.gz	LTKWIIKBMDXKSB-NSHDSACASA-N	1	0	291.399	1.699	50	0		CDAARO
Cc1cccc2nc(C(=O)NCCc3c[nH]cn3)c(F)n21	ZINC000215330920	358884847	/nfs/dbraw/zinc/88/48/47/358884847.db2.gz	JTMOIAMFHGQCOG-UHFFFAOYSA-N	1	0	287.298	1.477	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)c1ccc(O)c(C)c1	ZINC000218974518	359072706	/nfs/dbraw/zinc/07/27/06/359072706.db2.gz	QUJHZVNQAJHSGD-JSGCOSHPSA-N	1	0	278.352	1.150	50	0		CDAARO
COc1ccc(C2([C@H](O)C[NH3+])CCCC2)cc1OC	ZINC000003157365	359054916	/nfs/dbraw/zinc/05/49/16/359054916.db2.gz	GRCUYEZEYQMJGM-CQSZACIVSA-N	1	0	265.353	1.835	50	0		CDAARO
CC[N@H+](C1CN(C(=O)c2ccncc2)C1)C1CCOCC1	ZINC000257179814	359176613	/nfs/dbraw/zinc/17/66/13/359176613.db2.gz	JNMMQVKDSJGJHM-UHFFFAOYSA-N	1	0	289.379	1.407	50	0		CDAARO
OC[C@@H](O)c1cc2n(n1)CCC[N@@H+](C1CCCC1)C2	ZINC000221360090	359241014	/nfs/dbraw/zinc/24/10/14/359241014.db2.gz	KFXXMBMZJOWOIB-CQSZACIVSA-N	1	0	265.357	1.057	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@@H](Cn2cnc3ncccc3c2=O)C1	ZINC000032516103	359221164	/nfs/dbraw/zinc/22/11/64/359221164.db2.gz	HWHLHFYNBPYACZ-CYBMUJFWSA-N	1	0	286.379	1.912	50	0		CDAARO
CC[N@@H+]1CC2(C[C@H]1c1nnc(C)o1)CCN(C(C)=O)CC2	ZINC000257188623	359531884	/nfs/dbraw/zinc/53/18/84/359531884.db2.gz	FWMJTUCAAVVARH-ZDUSSCGKSA-N	1	0	292.383	1.773	50	0		CDAARO
COC1(c2nc(C3CCOCC3)no2)CC[NH2+]CC1	ZINC000225498182	359594052	/nfs/dbraw/zinc/59/40/52/359594052.db2.gz	MNNOFMVONJYTEY-UHFFFAOYSA-N	1	0	267.329	1.189	50	0		CDAARO
O=C(C[NH+]1CCCC1)NC[C@H]1COc2ccccc2O1	ZINC000000366617	359618303	/nfs/dbraw/zinc/61/83/03/359618303.db2.gz	XUKAEANAMAKHNU-LBPRGKRZSA-N	1	0	276.336	1.038	50	0		CDAARO
O[C@H]1CCC[N@H+](Cc2ccc(-n3cccn3)cc2)C1	ZINC000032758421	359693013	/nfs/dbraw/zinc/69/30/13/359693013.db2.gz	MFXITEJIQLIENW-HNNXBMFYSA-N	1	0	257.337	1.829	50	0		CDAARO
CCc1ccc2occ(C(=O)N[C@@H](CO)C[NH+](C)C)c2c1	ZINC000408517885	359902679	/nfs/dbraw/zinc/90/26/79/359902679.db2.gz	ZOPSMALUDXHASG-GFCCVEGCSA-N	1	0	290.363	1.648	50	0		CDAARO
C[C@@H]1CC[N@H+](CC(=O)N[C@H]2CCOC(C)(C)C2)C1	ZINC000408517997	359903843	/nfs/dbraw/zinc/90/38/43/359903843.db2.gz	RJLUFBWQISIMIP-NEPJUHHUSA-N	1	0	254.374	1.402	50	0		CDAARO
CCn1cnc2c1ncnc2N1CC[C@@H]([NH+](C)C)[C@@H]1C	ZINC000408518612	359909388	/nfs/dbraw/zinc/90/93/88/359909388.db2.gz	PWMDKAWYBNWBHF-WDEREUQCSA-N	1	0	274.372	1.375	50	0		CDAARO
CCOCC[N@H+](C)C[C@@H]1CN(c2ccccc2)CCO1	ZINC000408522622	359928875	/nfs/dbraw/zinc/92/88/75/359928875.db2.gz	KQJHKGIUTDPICC-MRXNPFEDSA-N	1	0	278.396	1.860	50	0		CDAARO
C[C@H]1Cc2ccccc2N1C(=O)C[C@@H]1COCC[NH2+]1	ZINC000128829327	360053480	/nfs/dbraw/zinc/05/34/80/360053480.db2.gz	GDVFNIIRGXBQLY-WCQYABFASA-N	1	0	260.337	1.343	50	0		CDAARO
O=C(N[C@@H]1CCCC[C@H]1CO)[C@@H]1CC12CC[NH2+]CC2	ZINC000231316201	360054865	/nfs/dbraw/zinc/05/48/65/360054865.db2.gz	KZFLCDFUBJTKOW-RWMBFGLXSA-N	1	0	266.385	1.043	50	0		CDAARO
Cc1c[nH+]c(C)n1C[C@@H]1CCN(S(=O)(=O)C(C)C)C1	ZINC000409420917	360224326	/nfs/dbraw/zinc/22/43/26/360224326.db2.gz	DFVUBZIOOAYPQB-CYBMUJFWSA-N	1	0	285.413	1.560	50	0		CDAARO
CCN1C(=O)[C@H]2CC3(CN2C1=O)CC[NH+](CC(C)C)CC3	ZINC000409419982	360229215	/nfs/dbraw/zinc/22/92/15/360229215.db2.gz	GLNCUHKABVFZGY-CYBMUJFWSA-N	1	0	293.411	1.781	50	0		CDAARO
Cc1c[nH+]c(C)n1C[C@@H]1CCN(C(=O)c2ccnn2C)C1	ZINC000409421002	360230112	/nfs/dbraw/zinc/23/01/12/360230112.db2.gz	VKJSMVKZPZBNKP-CYBMUJFWSA-N	1	0	287.367	1.396	50	0		CDAARO
C[C@H](c1ccc(-c2n[nH]c(C(=O)N(C)C)n2)cc1)[NH+](C)C	ZINC000426440458	360528810	/nfs/dbraw/zinc/52/88/10/360528810.db2.gz	YWAAUPVAUPIKQD-SNVBAGLBSA-N	1	0	287.367	1.796	50	0		CDAARO
CC(=O)Nc1ccc(C(=O)O[C@@H](C)C[NH+](C)C)cc1	ZINC000143841429	360536948	/nfs/dbraw/zinc/53/69/48/360536948.db2.gz	QLYIOURIXWBCJF-JTQLQIEISA-N	1	0	264.325	1.752	50	0		CDAARO
O=C(Cn1nccc1[C@H]1CCC[NH2+]C1)NCC(F)(F)F	ZINC000426498748	360677569	/nfs/dbraw/zinc/67/75/69/360677569.db2.gz	RIWHREULNRZVPR-VIFPVBQESA-N	1	0	290.289	1.029	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2cc(C(C)C)on2)n1C	ZINC000426533770	360680567	/nfs/dbraw/zinc/68/05/67/360680567.db2.gz	JERYNRKXYHNFOT-UHFFFAOYSA-N	1	0	281.385	1.938	50	0		CDAARO
C[NH2+]Cc1nnc(SCCC(F)(F)C(F)F)n1C	ZINC000426651451	360692459	/nfs/dbraw/zinc/69/24/59/360692459.db2.gz	XRYXAKSVHVFUOA-UHFFFAOYSA-N	1	0	286.298	1.917	50	0		CDAARO
Cc1ccc(N2CCC(N[C@@H]3CC[NH2+]C3)CC2)cc1	ZINC000426380769	360661229	/nfs/dbraw/zinc/66/12/29/360661229.db2.gz	ZCRIGHZEBBRXNP-OAHLLOKOSA-N	1	0	259.397	1.915	50	0		CDAARO
Cn1c(SCCc2ncc[nH]2)nnc1[C@H]1CCC[NH2+]C1	ZINC000426712758	360698934	/nfs/dbraw/zinc/69/89/34/360698934.db2.gz	OJJUMMUBSOGVRW-JTQLQIEISA-N	1	0	292.412	1.340	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)/C=C/c2ccc3c(c2)CCO3)C1	ZINC000178997320	189160348	/nfs/dbraw/zinc/16/03/48/189160348.db2.gz	HLDPLAFFVBHGKT-LYKUJDHUSA-N	1	0	286.375	1.703	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)Cc2cc(Cl)ccc2OC)C1	ZINC000178962256	189157808	/nfs/dbraw/zinc/15/78/08/189157808.db2.gz	FQBMYRLNCYAIRJ-LLVKDONJSA-N	1	0	296.798	1.959	50	0		CDAARO
CC(C)n1ccc(C(=O)N[C@H]2COC[C@@H]2[NH+]2CCCC2)n1	ZINC000426552303	361012723	/nfs/dbraw/zinc/01/27/23/361012723.db2.gz	ILRSUKFBNQWFLC-KBPBESRZSA-N	1	0	292.383	1.057	50	0		CDAARO
CCC[N@@H+]1CCCC[C@@H]1C(=O)N[C@H]1CCc2nccn2C1	ZINC000248160861	361289170	/nfs/dbraw/zinc/28/91/70/361289170.db2.gz	LGKZVCBBCHTRHM-UONOGXRCSA-N	1	0	290.411	1.579	50	0		CDAARO
Cc1cc2oc(=O)cc(CN3CC[NH+](C)CC3)c2cc1O	ZINC000019371213	361427257	/nfs/dbraw/zinc/42/72/57/361427257.db2.gz	IEGHGSHWFWPUAB-UHFFFAOYSA-N	1	0	288.347	1.554	50	0		CDAARO
O=C(COc1cc(Cl)ccc1Cl)N1CC[NH2+]CC1	ZINC000019795594	364083062	/nfs/dbraw/zinc/08/30/62/364083062.db2.gz	BMFOFIGUGMRHCE-UHFFFAOYSA-N	1	0	289.162	1.804	50	0		CDAARO
Cc1ccc(OCC[NH2+]CCO)c(Br)c1	ZINC000003461574	364755365	/nfs/dbraw/zinc/75/53/65/364755365.db2.gz	YPBSXCYQZYVGPY-UHFFFAOYSA-N	1	0	274.158	1.718	50	0		CDAARO
CS[C@@H]1CN(C(=O)Nc2cc(C)no2)C[C@H]1[NH+](C)C	ZINC000089608787	366883831	/nfs/dbraw/zinc/88/38/31/366883831.db2.gz	OLGOISRCAPGDOP-NXEZZACHSA-N	1	0	284.385	1.492	50	0		CDAARO
c1cc2c(c(C[NH2+]CCc3nnc4n3CCC4)c1)OCO2	ZINC000089774325	366931713	/nfs/dbraw/zinc/93/17/13/366931713.db2.gz	DSMUUUSGLHFRAM-UHFFFAOYSA-N	1	0	286.335	1.285	50	0		CDAARO
OCCC1([NH2+]Cc2cccc(O)c2)CCOCC1	ZINC000089780642	366933448	/nfs/dbraw/zinc/93/34/48/366933448.db2.gz	DLSSPBOTVLPGAL-UHFFFAOYSA-N	1	0	251.326	1.413	50	0		CDAARO
CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1CC(=O)N(CC)CC	ZINC000089949303	366979022	/nfs/dbraw/zinc/97/90/22/366979022.db2.gz	CKENJVGWRLIJJW-UONOGXRCSA-N	1	0	267.417	1.413	50	0		CDAARO
COCc1cc(C(=O)NC[C@H]([NH3+])c2ccccc2)no1	ZINC000090254256	367026554	/nfs/dbraw/zinc/02/65/54/367026554.db2.gz	XYBYKSRFKOGQHI-LBPRGKRZSA-N	1	0	275.308	1.251	50	0		CDAARO
O=C(N[C@H]1CC12CC[NH2+]CC2)N1CCO[C@@H]2CCC[C@@H]21	ZINC000627119261	367489610	/nfs/dbraw/zinc/48/96/10/367489610.db2.gz	LPDYZNQJWBREGS-XQQFMLRXSA-N	1	0	279.384	1.091	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]C[C@@H]1CC(=O)N(C)[C@H]1c1ccccc1	ZINC000252486738	367573873	/nfs/dbraw/zinc/57/38/73/367573873.db2.gz	MPSXSWRTXIHNIJ-QEWYBTABSA-N	1	0	288.391	1.973	50	0		CDAARO
CN(C)c1ccccc1C[NH2+][C@@H](CS(C)(=O)=O)C1CC1	ZINC000252503501	367651172	/nfs/dbraw/zinc/65/11/72/367651172.db2.gz	VEAKITGJBUVXOE-AWEZNQCLSA-N	1	0	296.436	1.665	50	0		CDAARO
CSC[C@H](C)CNC(=O)N(C)[C@@H]1CC[N@H+](C)C[C@H]1C	ZINC000252511742	367679663	/nfs/dbraw/zinc/67/96/63/367679663.db2.gz	KHKSNNYKWADIFF-JHJVBQTASA-N	1	0	287.473	1.967	50	0		CDAARO
CO[C@]1(C)C[C@@H](NC(=O)[C@@H]2CCC[NH2+]C2)C1(C)C	ZINC000121685146	368052431	/nfs/dbraw/zinc/05/24/31/368052431.db2.gz	KOLFHEAYEQJMLV-JTNHKYCSSA-N	1	0	254.374	1.306	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H](O)C[N@@H+]1C[C@H]1CCc2ccccc2C1	ZINC000252584728	368161366	/nfs/dbraw/zinc/16/13/66/368161366.db2.gz	CJYXIPGPCYXWNO-MAZHCROVSA-N	1	0	289.375	1.400	50	0		CDAARO
CC[NH+]1CCN(CC(=O)N[C@@H]2CCc3ccccc32)CC1	ZINC000360184767	368166331	/nfs/dbraw/zinc/16/63/31/368166331.db2.gz	UWHQONJUSOHWJA-MRXNPFEDSA-N	1	0	287.407	1.428	50	0		CDAARO
CN(C[C@H]1CCC[N@@H+]1C)S(=O)(=O)N1CCCCCC1	ZINC000420767203	244369932	/nfs/dbraw/zinc/36/99/32/244369932.db2.gz	NBFDRAQTDJXVJY-CYBMUJFWSA-N	1	0	289.445	1.133	50	0		CDAARO
Cc1cc(C(=O)NCC[N@@H+]2CCC[C@@H](CO)C2)cc(C)n1	ZINC000299781827	372756756	/nfs/dbraw/zinc/75/67/56/372756756.db2.gz	WSYOMOALYUAFMD-CQSZACIVSA-N	1	0	291.395	1.133	50	0		CDAARO
CSCCN1CCN(C(=O)c2n[nH]cc2Cl)CC1	ZINC000299781124	372757535	/nfs/dbraw/zinc/75/75/35/372757535.db2.gz	QVIILRHMWRDLPG-UHFFFAOYSA-N	1	0	288.804	1.184	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)Nc2snnc2-c2ccccc2)C1	ZINC000299801086	372771317	/nfs/dbraw/zinc/77/13/17/372771317.db2.gz	VRQRXQJXPDEWDL-SNVBAGLBSA-N	1	0	289.364	1.770	50	0		CDAARO
Cc1nc([C@@H]2CCCN(Cc3nnc(C)s3)C2)no1	ZINC000299801076	372771427	/nfs/dbraw/zinc/77/14/27/372771427.db2.gz	VLHCHFFLMUFUAP-SNVBAGLBSA-N	1	0	279.369	1.918	50	0		CDAARO
O=C(N[C@@H]1C[N@@H+](CC2CC2)C[C@H]1CO)c1ccccc1	ZINC000253412399	373720233	/nfs/dbraw/zinc/72/02/33/373720233.db2.gz	QXJSSWJPWSUFAV-LSDHHAIUSA-N	1	0	274.364	1.119	50	0		CDAARO
CCOC(=O)[C@@H]1CCC[C@H]1[N@@H+]1CCC[C@H](NC(=O)CC)C1	ZINC000108157295	412813327	/nfs/dbraw/zinc/81/33/27/412813327.db2.gz	OHNDJQAWTSRJAO-BFHYXJOUSA-N	1	0	296.411	1.709	50	0		CDAARO
CCOC(=O)CC1([NH3+])CCN(C(=O)OC(C)(C)C)CC1	ZINC000091301618	373899172	/nfs/dbraw/zinc/89/91/72/373899172.db2.gz	SZMBLZJHDPDRPH-UHFFFAOYSA-N	1	0	286.372	1.668	50	0		CDAARO
C[C@@H](NC(=O)N1CC[C@@H](C[NH+](C)C)C1)c1cnn(C)c1	ZINC000130124880	374356444	/nfs/dbraw/zinc/35/64/44/374356444.db2.gz	USLCLKVVQRYRES-NEPJUHHUSA-N	1	0	279.388	1.074	50	0		CDAARO
Cc1cc(CN(C)C[C@@H]2CC[N@H+](C)C2(C)C)[nH]n1	ZINC000670455415	483028486	/nfs/dbraw/zinc/02/84/86/483028486.db2.gz	IWIVPJHXZVGUGY-LBPRGKRZSA-N	1	0	250.390	1.880	50	0		CDAARO
Cc1nc2ccccc2n1CC(=O)OCC(=O)NC1CC1	ZINC000012655125	374559613	/nfs/dbraw/zinc/55/96/13/374559613.db2.gz	IIEJSCFPRAOKCE-UHFFFAOYSA-N	1	0	287.319	1.167	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1cccc(OC)c1O	ZINC000019839315	374806182	/nfs/dbraw/zinc/80/61/82/374806182.db2.gz	YEKDXUWSFHIGSA-UHFFFAOYSA-N	1	0	266.341	1.472	50	0		CDAARO
c1cc(CN2CCC([NH+]3CCSCC3)CC2)n[nH]1	ZINC000019740343	374782687	/nfs/dbraw/zinc/78/26/87/374782687.db2.gz	YYBYXSYDAGKTKN-UHFFFAOYSA-N	1	0	266.414	1.423	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]C[C@H](Cc1ccc(F)cc1)C(N)=O	ZINC000108470563	412829466	/nfs/dbraw/zinc/82/94/66/412829466.db2.gz	ZNBZYMSYQCWOQK-JKOKRWQUSA-N	1	0	280.343	1.237	50	0		CDAARO
Cc1cc(CN(C)C(=O)[C@@H]2CCCCC[N@@H+]2C)no1	ZINC000095354997	374888138	/nfs/dbraw/zinc/88/81/38/374888138.db2.gz	OOGWYFMSDFVJGU-ZDUSSCGKSA-N	1	0	265.357	1.816	50	0		CDAARO
C[C@@H](CCSc1ccccc1)[N@@H+]1CCO[C@H](C(N)=O)C1	ZINC000095428287	374926445	/nfs/dbraw/zinc/92/64/45/374926445.db2.gz	NVDOKMLTOGMXNN-JSGCOSHPSA-N	1	0	294.420	1.743	50	0		CDAARO
CCc1nn(C)c(CC)c1C[NH2+][C@H]1CCN(C(C)=O)C1	ZINC000095440134	374941653	/nfs/dbraw/zinc/94/16/53/374941653.db2.gz	SLTVGKRJOJGLPS-LBPRGKRZSA-N	1	0	278.400	1.255	50	0		CDAARO
CC[NH+](CC)CC(=O)N1CCCN1C(=O)OC(C)(C)C	ZINC000095448331	374948511	/nfs/dbraw/zinc/94/85/11/374948511.db2.gz	QYOUGKLDQOPKQW-UHFFFAOYSA-N	1	0	285.388	1.713	50	0		CDAARO
C[C@H](OC(=O)c1ccn2c[nH+]cc2c1)C(=O)NC1CC1	ZINC000095454586	374953442	/nfs/dbraw/zinc/95/34/42/374953442.db2.gz	BXLRJPLCUCXJRN-VIFPVBQESA-N	1	0	273.292	1.158	50	0		CDAARO
C[NH2+]CCCNS(=O)(=O)c1cc(C)c(C)s1	ZINC000095467151	374962081	/nfs/dbraw/zinc/96/20/81/374962081.db2.gz	IHALZRIHSDBXNZ-UHFFFAOYSA-N	1	0	262.400	1.253	50	0		CDAARO
c1ccc(C[C@H](CN2CCOCC2)[NH2+][C@@H]2CCOC2)cc1	ZINC000095967900	375042764	/nfs/dbraw/zinc/04/27/64/375042764.db2.gz	YLGIGSOWUQYDQL-IAGOWNOFSA-N	1	0	290.407	1.308	50	0		CDAARO
C[N@H+](C1CCCC1)C(C)(C)C(=O)NCc1csc(=O)[nH]1	ZINC000095988413	375048725	/nfs/dbraw/zinc/04/87/25/375048725.db2.gz	XAQWWJFIJOPFBB-UHFFFAOYSA-N	1	0	297.424	1.706	50	0		CDAARO
CN(Cc1ccccc1F)C(=O)[C@@]1(F)CC[NH2+]C1	ZINC000299739923	375200391	/nfs/dbraw/zinc/20/03/91/375200391.db2.gz	SYRSZLNYSGEDSM-CYBMUJFWSA-N	1	0	254.280	1.486	50	0		CDAARO
COC(=O)c1ccc(NC(=O)[C@@H]2CCC[NH2+]C2)c(F)c1	ZINC000253430969	189992414	/nfs/dbraw/zinc/99/24/14/189992414.db2.gz	GGOBECMPEMVUNQ-SNVBAGLBSA-N	1	0	280.299	1.550	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1C(=O)/C=C\C1CCOCC1	ZINC000493336700	375444492	/nfs/dbraw/zinc/44/44/92/375444492.db2.gz	NETVNBKOGDQAMW-DSYXLKISSA-N	1	0	252.358	1.309	50	0		CDAARO
O=C(C1CCC1)N1CC[NH+](CC[C@@H]2CCOC2)CC1	ZINC000670440518	542011262	/nfs/dbraw/zinc/01/12/62/542011262.db2.gz	TVRBVLQLAKPUAI-CYBMUJFWSA-N	1	0	266.385	1.357	50	0		CDAARO
CC[C@H](CO)[NH2+]CC(=O)Nc1ccc(C)cc1F	ZINC000003338951	375654309	/nfs/dbraw/zinc/65/43/09/375654309.db2.gz	VAJFRNOAXMGLQV-SNVBAGLBSA-N	1	0	254.305	1.433	50	0		CDAARO
COc1c(CN[C@H]2CC[N@@H+]3CCCC[C@H]23)c(C)nn1C	ZINC000058297555	375722435	/nfs/dbraw/zinc/72/24/35/375722435.db2.gz	AICHSUINHAWPNB-UONOGXRCSA-N	1	0	278.400	1.454	50	0		CDAARO
Cc1noc(-c2cccnc2N2CC[C@@H]([NH+]3CC=CC3)C2)n1	ZINC000101341831	376024068	/nfs/dbraw/zinc/02/40/68/376024068.db2.gz	FUQNIPXXFOJJEA-CYBMUJFWSA-N	1	0	297.362	1.891	50	0		CDAARO
CO[C@@H]1CC[C@@H]2OCC[N@H+](CCc3ccncc3)[C@H]2C1	ZINC000246081123	376375119	/nfs/dbraw/zinc/37/51/19/376375119.db2.gz	BZQURKMTFLHUEX-PMPSAXMXSA-N	1	0	276.380	1.892	50	0		CDAARO
O=C(NCCc1ccc(O)cc1)NCC[C@H]1CCC[NH2+]1	ZINC000417395141	376553487	/nfs/dbraw/zinc/55/34/87/376553487.db2.gz	UFGMKCAFADVIGG-CYBMUJFWSA-N	1	0	277.368	1.376	50	0		CDAARO
Nc1cnc(-c2cc3c(c(F)c2)O[C@H](C[NH3+])C3)cn1	ZINC000067642324	377194077	/nfs/dbraw/zinc/19/40/77/377194077.db2.gz	LIYKSTFSXXYGOZ-VIFPVBQESA-N	1	0	260.272	1.127	50	0		CDAARO
O=C1C[C@H]2CC[C@@H](CN1)[N@@H+]2Cc1ccc(-c2cc[nH]n2)o1	ZINC000067642829	377194136	/nfs/dbraw/zinc/19/41/36/377194136.db2.gz	MEZSHDPMJDXLIE-MNOVXSKESA-N	1	0	286.335	1.523	50	0		CDAARO
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(CC[NH3+])cc1	ZINC000000053768	296320377	/nfs/dbraw/zinc/32/03/77/296320377.db2.gz	AKNMFKYHSBWRLH-GFCCVEGCSA-N	1	0	282.409	1.751	50	0		CDAARO
COc1ccc(S(=O)(=O)C[C@@H]2CCC[NH2+]C2)cc1	ZINC000011967553	184533539	/nfs/dbraw/zinc/53/35/39/184533539.db2.gz	OYPCDATUUUWGKD-LLVKDONJSA-N	1	0	269.366	1.469	50	0		CDAARO
COc1ccc(OC[C@H](O)C[NH+]2CCCCC2)cc1	ZINC000000189905	390134788	/nfs/dbraw/zinc/13/47/88/390134788.db2.gz	RDFFRMBMQFHLKQ-CYBMUJFWSA-N	1	0	265.353	1.921	50	0	aggregator	CDAARO
CCCC[N@H+](C)[C@H](C)C(=O)Nc1ccc(C(N)=O)cc1	ZINC000032799797	390210658	/nfs/dbraw/zinc/21/06/58/390210658.db2.gz	NSPKLYHOCFKYQK-LLVKDONJSA-N	1	0	277.368	1.844	50	0		CDAARO
C[C@@H]1C[N@H+](C)CC[C@@H]1N(C)C(=O)CCOCC(F)(F)F	ZINC000096422445	390519192	/nfs/dbraw/zinc/51/91/92/390519192.db2.gz	KZVWNVRTBQICIR-MNOVXSKESA-N	1	0	296.333	1.754	50	0		CDAARO
CC[N@@H+]1CC[C@@H]2[C@H](C1)OCCN2C(=O)[C@H](C)CSC	ZINC000241316715	285381566	/nfs/dbraw/zinc/38/15/66/285381566.db2.gz	LUHUULSRFSAWEP-UPJWGTAASA-N	1	0	286.441	1.307	50	0		CDAARO
CC(C)n1cc(C(=O)NCC2([NH+](C)C)CCOCC2)cn1	ZINC000077426978	390810175	/nfs/dbraw/zinc/81/01/75/390810175.db2.gz	OJVAOSJUJVAPCF-UHFFFAOYSA-N	1	0	294.399	1.305	50	0		CDAARO
O=C(NCc1ccc2sccc2c1)[C@H]1C[NH2+]CCO1	ZINC000215574234	390995354	/nfs/dbraw/zinc/99/53/54/390995354.db2.gz	PAPWLARQPZEUJL-GFCCVEGCSA-N	1	0	276.361	1.506	50	0		CDAARO
C[C@H](CC(=O)N1[C@H](C)COC[C@@H]1C)[C@H]1CCC[NH2+]C1	ZINC000262641644	391335073	/nfs/dbraw/zinc/33/50/73/391335073.db2.gz	RXRQCYLJONXAON-MQYQWHSLSA-N	1	0	268.401	1.648	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@H]([N@@H+]2CC[C@@H](CCO)C2)C1	ZINC000259868111	391510753	/nfs/dbraw/zinc/51/07/53/391510753.db2.gz	MYACVXPGFGZZNB-QWHCGFSZSA-N	1	0	284.400	1.700	50	0		CDAARO
Cc1cnc(C[N@@H+]2CCCC[C@@H]2CN2CCOCC2)cn1	ZINC000336835887	392116846	/nfs/dbraw/zinc/11/68/46/392116846.db2.gz	KCKMOBHFSLRSEH-MRXNPFEDSA-N	1	0	290.411	1.472	50	0		CDAARO
CC(C)CN1CCC([NH2+]CC(C)(C)S(C)(=O)=O)CC1	ZINC000095423588	393148483	/nfs/dbraw/zinc/14/84/83/393148483.db2.gz	KNAOSYALZVLYKG-UHFFFAOYSA-N	1	0	290.473	1.520	50	0		CDAARO
COCC[N@H+](C)C[C@H]1CCCN1c1nccc(OC)n1	ZINC000095944992	393154479	/nfs/dbraw/zinc/15/44/79/393154479.db2.gz	DLYMNYSETDKNPA-GFCCVEGCSA-N	1	0	280.372	1.032	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]C1)N1CCN(c2ccccc2)CC1	ZINC000019413008	134700950	/nfs/dbraw/zinc/70/09/50/134700950.db2.gz	HXXQVBBUZYEVCH-CQSZACIVSA-N	1	0	273.380	1.335	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)NCCCOC1CCCC1	ZINC000238136727	140262267	/nfs/dbraw/zinc/26/22/67/140262267.db2.gz	RBXJKWUTXIVRKW-UHFFFAOYSA-N	1	0	268.401	1.842	50	0		CDAARO
CCN(CC)c1ncnc(N(CC)C[C@@H]2CCCO2)c1N	ZINC000103409860	397900072	/nfs/dbraw/zinc/90/00/72/397900072.db2.gz	KXWBARGRJMRUSY-LBPRGKRZSA-N	1	0	293.415	1.910	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N(C)[C@@H]1CCC[C@H]1SC	ZINC000095971185	286672375	/nfs/dbraw/zinc/67/23/75/286672375.db2.gz	UWBOVYWDRFBPHV-HBNTYKKESA-N	1	0	276.471	1.809	50	0		CDAARO
CCC[NH+]1CCC(N(C)C(=O)C[C@H]2CCCC(=O)N2)CC1	ZINC000367298156	159466853	/nfs/dbraw/zinc/46/68/53/159466853.db2.gz	BEXQPIQQDMZBLA-CYBMUJFWSA-N	1	0	295.427	1.378	50	0		CDAARO
Cc1ccc(OC[C@@H](O)C[NH2+]C(C)(C)CO)c(C)c1	ZINC000002476186	169793916	/nfs/dbraw/zinc/79/39/16/169793916.db2.gz	RLQYFLNOYKHAPH-ZDUSSCGKSA-N	1	0	267.369	1.404	50	0		CDAARO
COCC[NH2+]CCOCCOc1c(C)cccc1C	ZINC000002975029	169846266	/nfs/dbraw/zinc/84/62/66/169846266.db2.gz	HUUFTHGVURWHJO-UHFFFAOYSA-N	1	0	267.369	1.935	50	0		CDAARO
CC[NH2+]Cc1nc(-c2ccc(OC)c(OC)c2)no1	ZINC000004487205	169971340	/nfs/dbraw/zinc/97/13/40/169971340.db2.gz	FATKAMJFHZZZEX-UHFFFAOYSA-N	1	0	263.297	1.863	50	0		CDAARO
C=Cn1nccc1[C@@](O)(CCC[NH+](C)C)c1ccncc1	ZINC000005140117	170070585	/nfs/dbraw/zinc/07/05/85/170070585.db2.gz	WECVTOHVPCTMAT-MRXNPFEDSA-N	1	0	286.379	1.956	50	0		CDAARO
C[N@H+](CC(=O)Nc1ccccc1C(N)=O)C1CCCCC1	ZINC000006001442	170167227	/nfs/dbraw/zinc/16/72/27/170167227.db2.gz	GPNFLPKIIXMDJQ-UHFFFAOYSA-N	1	0	289.379	1.989	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)cc1C	ZINC000006667530	170224004	/nfs/dbraw/zinc/22/40/04/170224004.db2.gz	KMVYGYZLCYJKNI-CYBMUJFWSA-N	1	0	262.353	1.701	50	0		CDAARO
Cc1cc(=O)[nH]c2c1c(=O)[nH]n2[C@@H]1C[C@@H](C)[N@@H+](C)C[C@@H]1C	ZINC000008617277	170343012	/nfs/dbraw/zinc/34/30/12/170343012.db2.gz	MVFIEUFRENOXDE-HBNTYKKESA-N	1	0	290.367	1.228	50	0		CDAARO
COc1ccccc1OC[C@H](O)C[NH2+]C1CCCC1	ZINC000008844712	170357267	/nfs/dbraw/zinc/35/72/67/170357267.db2.gz	QBFYTUOJUHHBLM-CYBMUJFWSA-N	1	0	265.353	1.967	50	0		CDAARO
COc1ccc(OCC(=O)NCCC[NH+]2CCCC2)cc1	ZINC000010449995	170407199	/nfs/dbraw/zinc/40/71/99/170407199.db2.gz	HSSWIUPJPJKLLX-UHFFFAOYSA-N	1	0	292.379	1.676	50	0		CDAARO
CC(=O)Nc1cccc(NC(=O)C2CC[NH2+]CC2)c1	ZINC000019440066	170802103	/nfs/dbraw/zinc/80/21/03/170802103.db2.gz	ZDECJHYGKHUEFE-UHFFFAOYSA-N	1	0	261.325	1.583	50	0		CDAARO
NC(=O)CN1CC[NH+](Cc2cccc3ccccc32)CC1	ZINC000020533977	171240772	/nfs/dbraw/zinc/24/07/72/171240772.db2.gz	VTMYLMZYVZMPHA-UHFFFAOYSA-N	1	0	283.375	1.443	50	0		CDAARO
C[NH2+]CCc1c[nH]c2ccc(Cn3cncn3)cc12	ZINC000022064247	171351510	/nfs/dbraw/zinc/35/15/10/171351510.db2.gz	HTVLSIBBGWEXCH-UHFFFAOYSA-N	1	0	255.325	1.570	50	0	in-vitro	CDAARO
COc1cccc(C(=O)N(C)[C@@H]2CCC[NH2+]CC2)c1	ZINC000035605683	172292843	/nfs/dbraw/zinc/29/28/43/172292843.db2.gz	LRLFCVCWYSXXRP-CYBMUJFWSA-N	1	0	262.353	1.909	50	0		CDAARO
COc1ccc(CN(C)C(=O)[C@@H]2CCCC[NH2+]2)cc1F	ZINC000037758207	173682971	/nfs/dbraw/zinc/68/29/71/173682971.db2.gz	LDACBPJPAVPBLV-ZDUSSCGKSA-N	1	0	280.343	1.935	50	0		CDAARO
[NH3+]CCOc1ccc2nnc(-c3ccc(Cl)cc3)n2n1	ZINC000038478039	174141853	/nfs/dbraw/zinc/14/18/53/174141853.db2.gz	YXRBTAPXBFGHCG-UHFFFAOYSA-N	1	0	289.726	1.782	50	0		CDAARO
CCS(=O)(=O)c1ccccc1C(=O)NCCC[NH+](C)C	ZINC000044790695	175254388	/nfs/dbraw/zinc/25/43/88/175254388.db2.gz	FGJGKSZNWKPEFP-UHFFFAOYSA-N	1	0	298.408	1.162	50	0		CDAARO
CC(C)[NH+](CCNC(=O)c1ccnn1C)C(C)C	ZINC000063535231	175687228	/nfs/dbraw/zinc/68/72/28/175687228.db2.gz	VBHRFFGXWQOOPV-UHFFFAOYSA-N	1	0	252.362	1.269	50	0		CDAARO
CCc1cc(N(C)Cc2cc[nH]n2)nc(N(C)C)[nH+]1	ZINC000065375562	175724499	/nfs/dbraw/zinc/72/44/99/175724499.db2.gz	RDGGIONQSUSSQP-UHFFFAOYSA-N	1	0	260.345	1.465	50	0		CDAARO
C[NH2+]CC(=O)NCCc1nc(-c2ccccc2)cs1	ZINC000071735819	176257689	/nfs/dbraw/zinc/25/76/89/176257689.db2.gz	FYPJVNPVRXVUJQ-UHFFFAOYSA-N	1	0	275.377	1.688	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)c2cnn(Cc3ccccc3)c2)CC1	ZINC000072129419	176321263	/nfs/dbraw/zinc/32/12/63/176321263.db2.gz	YLNPGSDUXFBZIK-INIZCTEOSA-N	1	0	298.390	1.885	50	0		CDAARO
COc1ccc(F)c(CN2CCC[C@]3(CC[NH2+]C3)C2=O)c1	ZINC000072147455	176325564	/nfs/dbraw/zinc/32/55/64/176325564.db2.gz	IDIIVWOQGDMOIK-MRXNPFEDSA-N	1	0	292.354	1.936	50	0		CDAARO
O=C1CCCN1CC[N@@H+]1CCC[C@H](c2cc[nH]n2)C1	ZINC000072270689	176354672	/nfs/dbraw/zinc/35/46/72/176354672.db2.gz	PAFYSRJWFBKACT-LBPRGKRZSA-N	1	0	262.357	1.212	50	0		CDAARO
O=c1[nH]c(COc2ccccc2Cl)nc2c1CC[NH2+]C2	ZINC000077524034	177277749	/nfs/dbraw/zinc/27/77/49/177277749.db2.gz	LNQBZQZSMBTFPZ-UHFFFAOYSA-N	1	0	291.738	1.648	50	0		CDAARO
CC(C)(C)NC(=O)NCC[N@H+](CC1CC1)C1CC1	ZINC000095411247	278365781	/nfs/dbraw/zinc/36/57/81/278365781.db2.gz	SBAIJUPXUVIEKV-UHFFFAOYSA-N	1	0	253.390	1.959	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2SCCc3sccc32)CC[NH2+]1	ZINC000188382948	274330293	/nfs/dbraw/zinc/33/02/93/274330293.db2.gz	CZVQNSCAZAMBRW-SKDRFNHKSA-N	1	0	282.434	1.899	50	0		CDAARO
OCC(CO)[NH2+][C@H]1CCc2c1cc(Cl)cc2Cl	ZINC000089703977	275045406	/nfs/dbraw/zinc/04/54/06/275045406.db2.gz	CDOFAXQJYWQBSX-LBPRGKRZSA-N	1	0	276.163	1.924	50	0		CDAARO
CC1(C)CC[N@H+](CC(=O)N[C@@H]2CCOC(C)(C)C2)C1	ZINC000408517173	276113210	/nfs/dbraw/zinc/11/32/10/276113210.db2.gz	AUNYXUBXXVHATR-GFCCVEGCSA-N	1	0	268.401	1.792	50	0		CDAARO
CN1CC[C@H]([N@@H+]2CCN(C)c3ccccc3C2)C1=O	ZINC000265397908	277163863	/nfs/dbraw/zinc/16/38/63/277163863.db2.gz	WXTZYJZNJFCSQW-AWEZNQCLSA-N	1	0	259.353	1.169	50	0		CDAARO
COc1cnc(N2CCCN(c3cc[nH+]cc3C)CC2)nc1	ZINC000077355783	278072093	/nfs/dbraw/zinc/07/20/93/278072093.db2.gz	IWTBZWPMHVAJTF-UHFFFAOYSA-N	1	0	299.378	1.905	50	0		CDAARO
Cc1n[nH]c(C)c1C[N@@H+]1CCCC[C@H]1CN1CCOCC1	ZINC000130987412	279054482	/nfs/dbraw/zinc/05/44/82/279054482.db2.gz	HUEXYBZDXMJZEI-HNNXBMFYSA-N	1	0	292.427	1.713	50	0		CDAARO
Cc1cc(C)c(C[N@@H+]2CCN3C(=O)NC[C@@H]3C2)cc1C	ZINC000091863782	279288709	/nfs/dbraw/zinc/28/87/09/279288709.db2.gz	IIFMHYQGXIUQGD-OAHLLOKOSA-N	1	0	273.380	1.821	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H](O)[C@@H]2[C@@]2(CCCCC2=O)C1	ZINC000245255182	290281356	/nfs/dbraw/zinc/28/13/56/290281356.db2.gz	FYBWQOYLTXRONY-VIRABCJISA-N	1	0	251.370	1.839	50	0		CDAARO
[NH3+]Cc1ccccc1CN1C(=O)NC2(CCCCC2)C1=O	ZINC000019388625	295279217	/nfs/dbraw/zinc/27/92/17/295279217.db2.gz	IZYWBJVSGJJGGZ-UHFFFAOYSA-N	1	0	287.363	1.900	50	0		CDAARO
CCC(=O)N1CCC([NH2+]C2CSCCSC2)CC1	ZINC000534588976	328317012	/nfs/dbraw/zinc/31/70/12/328317012.db2.gz	DFGDXMOIRXTOSP-UHFFFAOYSA-N	1	0	288.482	1.826	50	0		CDAARO
O=C(NCc1ccc2c(c1)CCCC2)[C@@H]1C=CC[NH2+]1	ZINC000534591648	328318261	/nfs/dbraw/zinc/31/82/61/328318261.db2.gz	ZOGMVGDPXZLLQN-HNNXBMFYSA-N	1	0	256.349	1.710	50	0		CDAARO
CC(C)c1cc(CN2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)no1	ZINC000534629713	328328528	/nfs/dbraw/zinc/32/85/28/328328528.db2.gz	DVTLFYRJKDWPJY-KPWCQOOUSA-N	1	0	261.369	1.980	50	0		CDAARO
NC(=O)c1cccnc1NC[C@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534643538	328329518	/nfs/dbraw/zinc/32/95/18/328329518.db2.gz	WDTLKMNYOLRUNM-GFCCVEGCSA-N	1	0	288.395	1.857	50	0		CDAARO
C[NH+]1CCC(OCCCNc2cnccn2)CC1	ZINC000534632467	328332000	/nfs/dbraw/zinc/33/20/00/328332000.db2.gz	VDNMMXPRPHNITQ-UHFFFAOYSA-N	1	0	250.346	1.389	50	0		CDAARO
Cc1ccoc1C(=O)N[C@H]1COC[C@@H]1[NH+]1CCCC1	ZINC000534637689	328334238	/nfs/dbraw/zinc/33/42/38/328334238.db2.gz	UCBFNRRUOOXSBB-RYUDHWBXSA-N	1	0	264.325	1.181	50	0		CDAARO
O=C(Cc1cccs1)N[C@H]1COC[C@@H]1[NH+]1CCCCC1	ZINC000534662592	328350328	/nfs/dbraw/zinc/35/03/28/328350328.db2.gz	JJXFOLAJVBGVLZ-KBPBESRZSA-N	1	0	294.420	1.660	50	0		CDAARO
C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]CCCN1C(=O)CNC1=O	ZINC000097099878	323207415	/nfs/dbraw/zinc/20/74/15/323207415.db2.gz	RXEPNIIWWBYGJN-VXGBXAGGSA-N	1	0	281.400	1.733	50	0		CDAARO
c1cn(C2CCCC2)c(-c2cc3n(n2)CC[NH2+]C3)n1	ZINC000072438392	327110511	/nfs/dbraw/zinc/11/05/11/327110511.db2.gz	BXBJQIMJUANDNF-UHFFFAOYSA-N	1	0	257.341	1.965	50	0		CDAARO
CCN(CC[NH+]1CCC(C)CC1)c1nnc(CNC)o1	ZINC001772701698	1159437749	/nfs/dbraw/zinc/43/77/49/1159437749.db2.gz	BAFREXBKZVNLJA-UHFFFAOYSA-N	1	0	281.404	1.347	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCN(C(=O)c2ccnc(C3CC3)n2)C1	ZINC000299739376	482447837	/nfs/dbraw/zinc/44/78/37/482447837.db2.gz	NTUPSDCATRFZFZ-CMPLNLGQSA-N	1	0	274.368	1.553	50	0		CDAARO
CO[C@H](C)C(=O)N[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C	ZINC000097142618	482458611	/nfs/dbraw/zinc/45/86/11/482458611.db2.gz	KQORFPAOOVBLEK-GUTXKFCHSA-N	1	0	276.380	1.658	50	0		CDAARO
COC(=O)N1CC[C@H]([NH2+]Cc2ccc([S@](C)=O)cc2)C1	ZINC000085329584	482576156	/nfs/dbraw/zinc/57/61/56/482576156.db2.gz	PWXZVSREIKPBLO-FKIZINRSSA-N	1	0	296.392	1.354	50	0		CDAARO
Cc1ccc(-c2noc([C@@H](C)[NH+]3CCCC3)n2)nn1	ZINC000092028093	482598387	/nfs/dbraw/zinc/59/83/87/482598387.db2.gz	CZHUXECJRPFBKX-SNVBAGLBSA-N	1	0	259.313	1.992	50	0		CDAARO
CCn1nccc1C[NH2+]C1CCN([C@@H]2CCOC2)CC1	ZINC000585093602	482828887	/nfs/dbraw/zinc/82/88/87/482828887.db2.gz	KEQQHIKEKHCBOC-OAHLLOKOSA-N	1	0	278.400	1.246	50	0		CDAARO
COc1ncccc1C[N@@H+]1CC[C@@H](C(C)(C)O)C1	ZINC000670440198	482985503	/nfs/dbraw/zinc/98/55/03/482985503.db2.gz	DNNSDBFFPDQDPA-GFCCVEGCSA-N	1	0	250.342	1.683	50	0		CDAARO
Cc1c[nH]c(C[N@@H+]2CCC[C@@H](c3nnc[nH]3)C2)c(C)c1=O	ZINC000670446623	482997778	/nfs/dbraw/zinc/99/77/78/482997778.db2.gz	PNLJABHISXOMKK-GFCCVEGCSA-N	1	0	287.367	1.489	50	0		CDAARO
CCCCn1nc(C)nc1CN1CC[NH+](CC)CC1	ZINC000670451586	483012697	/nfs/dbraw/zinc/01/26/97/483012697.db2.gz	ZNGSVOJEXYKMQQ-UHFFFAOYSA-N	1	0	265.405	1.524	50	0		CDAARO
Cc1nc[nH]c1C(=O)NC[C@H]1CCC[N@H+]1C(C)C	ZINC000670460465	483043413	/nfs/dbraw/zinc/04/34/13/483043413.db2.gz	XJAZPMGBYKHIBR-LLVKDONJSA-N	1	0	250.346	1.321	50	0		CDAARO
Cc1cc(C[N@H+](C)CC[C@@H]2CCS(=O)(=O)C2)ccn1	ZINC000670462933	483051555	/nfs/dbraw/zinc/05/15/55/483051555.db2.gz	WWGKQNYAELDCLC-CYBMUJFWSA-N	1	0	282.409	1.647	50	0		CDAARO
Cc1cc(C[NH+]2CCC3(CCC(=O)N3C)CC2)[nH]n1	ZINC000670472555	483081267	/nfs/dbraw/zinc/08/12/67/483081267.db2.gz	ZASYFTORVSBCLE-UHFFFAOYSA-N	1	0	262.357	1.305	50	0		CDAARO
COc1cccc(CNC(=O)[C@@H](C)[NH+]2CCCCCC2)n1	ZINC000084001200	483233923	/nfs/dbraw/zinc/23/39/23/483233923.db2.gz	YMUNUQFOFCRGAE-CYBMUJFWSA-N	1	0	291.395	1.971	50	0		CDAARO
C[C@H](NC(=O)C[C@H]1CCOC1)C(C)(C)C[NH+](C)C	ZINC000096449604	534204221	/nfs/dbraw/zinc/20/42/21/534204221.db2.gz	GZIIVSSPQRDQCC-NWDGAFQWSA-N	1	0	256.390	1.506	50	0		CDAARO
CCc1nnc(C)cc1C(=O)NC(C)(C)CC[NH3+]	ZINC000142786686	522723569	/nfs/dbraw/zinc/72/35/69/522723569.db2.gz	YQZQDYSPPHKRCM-UHFFFAOYSA-N	1	0	250.346	1.205	50	0		CDAARO
CCc1oc(C(=O)N2CC[C@@H](C[NH2+]C)C2)cc1C	ZINC000178985833	522980181	/nfs/dbraw/zinc/98/01/81/522980181.db2.gz	GLXOMBIUTAZHST-NSHDSACASA-N	1	0	250.342	1.832	50	0		CDAARO
COc1cccc([C@@H]2C[C@@H]2C(=O)N2CC[C@H](C[NH3+])C2)c1	ZINC000178580851	524124385	/nfs/dbraw/zinc/12/43/85/524124385.db2.gz	DPRVYRVTQLZBDW-UGFHNGPFSA-N	1	0	274.364	1.606	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)c2cnc(-c3ccccc3)nc2)C1	ZINC000178589238	527237875	/nfs/dbraw/zinc/23/78/75/527237875.db2.gz	ANMRQONBMGSGLJ-GFCCVEGCSA-N	1	0	282.347	1.564	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)O[C@H](C)C(=O)N(C)C	ZINC000408525610	528503017	/nfs/dbraw/zinc/50/30/17/528503017.db2.gz	ILYOJPGRQNOBPR-MNOVXSKESA-N	1	0	258.362	1.017	50	0		CDAARO
O=C(C[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1)N1CCNC1=O	ZINC000015516918	538216708	/nfs/dbraw/zinc/21/67/08/538216708.db2.gz	BYPICHFBSHCXNV-NWDGAFQWSA-N	1	0	265.357	1.050	50	0		CDAARO
CC[C@@H]([NH3+])C1(O)CCN(C(=O)OC(C)(C)C)CC1	ZINC000958528716	615522778	/nfs/dbraw/zinc/52/27/78/615522778.db2.gz	SKKSUOBNUIGWRA-SNVBAGLBSA-N	1	0	258.362	1.486	50	0		CDAARO
C[C@@H]1[C@H](C)[NH2+]CCN1C(=O)C[C@H](O)c1ccccc1	ZINC000888096875	617760117	/nfs/dbraw/zinc/76/01/17/617760117.db2.gz	UXQMATVNQFZIBY-SCRDCRAPSA-N	1	0	262.353	1.319	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N(C)CCn2cccn2)c1C	ZINC000065387257	685322731	/nfs/dbraw/zinc/32/27/31/685322731.db2.gz	ZEIVGGLUUAAWBP-UHFFFAOYSA-N	1	0	274.372	1.492	50	0		CDAARO
Nc1cc(-c2cc3c(c(F)c2)O[C@@H](C[NH3+])C3)ccn1	ZINC000067789493	684904511	/nfs/dbraw/zinc/90/45/11/684904511.db2.gz	OCKAPYWOAZXUPL-LLVKDONJSA-N	1	0	259.284	1.732	50	0		CDAARO
C[C@H](Cc1ccno1)[NH2+]C[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000952995709	685757047	/nfs/dbraw/zinc/75/70/47/685757047.db2.gz	WDPDXUXBWCUKNO-QMTHXVAHSA-N	1	0	284.356	1.288	50	0		CDAARO
C[C@@H]1C[N@H+]([C@@H]2CCC(=O)N(CC3CC3)CC2)C[C@H](C)O1	ZINC000952987706	685868359	/nfs/dbraw/zinc/86/83/59/685868359.db2.gz	MQRXXCYVJOZVJF-VNHYZAJKSA-N	1	0	280.412	1.887	50	0		CDAARO
Cc1n[nH]cc1CN(C)C(=O)CC[C@H](C)[NH+]1CCOCC1	ZINC000952982757	685891463	/nfs/dbraw/zinc/89/14/63/685891463.db2.gz	MNODBRGROFIAPB-LBPRGKRZSA-N	1	0	294.399	1.177	50	0		CDAARO
O=C(Cn1cccn1)NC[C@H]1CCCN(c2cc[nH+]cc2)C1	ZINC000952972371	686270704	/nfs/dbraw/zinc/27/07/04/686270704.db2.gz	GNXKMXDHCKJIHF-CQSZACIVSA-N	1	0	299.378	1.311	50	0		CDAARO
CCc1nnc(CN(C)C[C@@H]2CC[N@H+](C)C2(C)C)[nH]1	ZINC000252500044	686304365	/nfs/dbraw/zinc/30/43/65/686304365.db2.gz	SMJIOGAVWGMBFO-NSHDSACASA-N	1	0	265.405	1.529	50	0		CDAARO
C[C@H]1CN(C(=O)c2csc(Cl)n2)C[C@H](C)[NH2+]1	ZINC000864096082	686913801	/nfs/dbraw/zinc/91/38/01/686913801.db2.gz	ZRSVOPLSFDJULF-BQBZGAKWSA-N	1	0	259.762	1.619	50	0		CDAARO
C[N@@H+](Cc1ccc[nH]c1=O)C[C@@H](O)c1ccccc1	ZINC000020137539	687009254	/nfs/dbraw/zinc/00/92/54/687009254.db2.gz	MSWBPLWRQHJRJY-CQSZACIVSA-N	1	0	258.321	1.540	50	0		CDAARO
Cc1n[nH]c(C)c1CCCNC(=O)[C@@H](C)n1ccnc1C	ZINC000426488252	687215687	/nfs/dbraw/zinc/21/56/87/687215687.db2.gz	MWMDEIRHHUDJBV-GFCCVEGCSA-N	1	0	289.383	1.841	50	0		CDAARO
O=C(N[C@@H]1CC[N@H+](Cc2ccsc2)C1)C1CC1	ZINC000827696055	687481895	/nfs/dbraw/zinc/48/18/95/687481895.db2.gz	SIRAPBNYHPNSLC-GFCCVEGCSA-N	1	0	250.367	1.849	50	0		CDAARO
C[C@@H](O)C[NH+]1CCC(CNC(=O)c2ccc(F)cc2)CC1	ZINC001001136842	687805310	/nfs/dbraw/zinc/80/53/10/687805310.db2.gz	BDIAKYIEFHXZIN-GFCCVEGCSA-N	1	0	294.370	1.648	50	0		CDAARO
COc1cc(C)ccc1OCC[N@H+]1C[C@@H]2[C@@H](O)C[C@@H]2C1	ZINC001772701253	1159436919	/nfs/dbraw/zinc/43/69/19/1159436919.db2.gz	JOZRKVHZQGKINF-RDBSUJKOSA-N	1	0	277.364	1.695	50	0		CDAARO
Cc1ncc(Cl)c(NCC[N@@H+]2CCCC[C@@H]2CO)n1	ZINC001772707054	1159441423	/nfs/dbraw/zinc/44/14/23/1159441423.db2.gz	PCNCMQMMQINUPP-LLVKDONJSA-N	1	0	284.791	1.697	50	0		CDAARO
C(C[C@H]1CC[NH2+]C1)c1noc(C2CCOCC2)n1	ZINC000675023955	899879975	/nfs/dbraw/zinc/87/99/75/899879975.db2.gz	IYMJFTCARQWMDO-JTQLQIEISA-N	1	0	251.330	1.506	50	0		CDAARO
CC(C)[NH2+]C1CCN(CCCc2ncc[nH]2)CC1	ZINC000952881658	910449297	/nfs/dbraw/zinc/44/92/97/910449297.db2.gz	QRKFHGNNLHOGGQ-UHFFFAOYSA-N	1	0	250.390	1.805	50	0		CDAARO
C[C@H](C1CCN(C(=O)C2(C)COC2)CC1)[NH+]1CCCC1	ZINC000821746063	925595622	/nfs/dbraw/zinc/59/56/22/925595622.db2.gz	QMPKSUYNTCWQLI-CYBMUJFWSA-N	1	0	280.412	1.746	50	0		CDAARO
C[C@H](C[NH+]1CCCC1)NC(=O)N1CC(c2ccncc2)C1	ZINC000821793844	925598594	/nfs/dbraw/zinc/59/85/94/925598594.db2.gz	HLUQKDBUZMTGJB-CYBMUJFWSA-N	1	0	288.395	1.675	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CN(C)c2ncc(F)c(OC)n2)C1	ZINC000824412501	925821373	/nfs/dbraw/zinc/82/13/73/925821373.db2.gz	YUKRYCVOPOYLFJ-NSHDSACASA-N	1	0	298.362	1.029	50	0		CDAARO
CC(C)(C)n1nc(CC(N)=O)nc1[C@@H]1CCC[C@H]([NH3+])C1	ZINC000827541569	925943812	/nfs/dbraw/zinc/94/38/12/925943812.db2.gz	XJORBUSEIRUVAD-ZJUUUORDSA-N	1	0	279.388	1.046	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)N1CCCC[C@H]1CO	ZINC000828710937	926168993	/nfs/dbraw/zinc/16/89/93/926168993.db2.gz	QEJZVIKSMZQAGY-ZDUSSCGKSA-N	1	0	254.374	1.236	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+](CC[S@@](C)=O)C1	ZINC000585079725	930851319	/nfs/dbraw/zinc/85/13/19/930851319.db2.gz	GJCCCJQGRZZWAK-WTOJCKNJSA-N	1	0	288.457	1.382	50	0		CDAARO
C[C@@H](C[NH+](C)C)[C@H]1CCCCN1C(=O)c1ccn(C)n1	ZINC000585128028	931012699	/nfs/dbraw/zinc/01/26/99/931012699.db2.gz	PZQKUTBBNDUKPR-GXTWGEPZSA-N	1	0	278.400	1.613	50	0		CDAARO
Cc1nnc(CN(C)CC[C@H](C)[NH+]2CCCC2)[nH]1	ZINC000243885786	937583350	/nfs/dbraw/zinc/58/33/50/937583350.db2.gz	ACGHXWIHJXJGEE-NSHDSACASA-N	1	0	251.378	1.419	50	0		CDAARO
COCC[NH+]1CCC(Cn2nc3c(cc2=O)CCC3)CC1	ZINC000585501926	932836839	/nfs/dbraw/zinc/83/68/39/932836839.db2.gz	NKENKNFSSRDVPF-UHFFFAOYSA-N	1	0	291.395	1.090	50	0		CDAARO
Cc1nncn1CCN1CCC[C@]2(CC[N@@H+](C)C2)C1	ZINC001506397506	975148098	/nfs/dbraw/zinc/14/80/98/975148098.db2.gz	SHGOLWXLDFAVCQ-CQSZACIVSA-N	1	0	263.389	1.004	50	0		CDAARO
CCCOc1ccc(OCC[N@@H+]2C[C@H](O)[C@@H](OC)C2)cc1	ZINC001506404385	975151918	/nfs/dbraw/zinc/15/19/18/975151918.db2.gz	XLZLJGUQCMADIX-HOTGVXAUSA-N	1	0	295.379	1.546	50	0		CDAARO
Cc1nc(N)nc(NC[C@@H]2CCCC[N@H+]2C)c1Cl	ZINC001506409042	975153231	/nfs/dbraw/zinc/15/32/31/975153231.db2.gz	ODUFVUATBBXRCP-VIFPVBQESA-N	1	0	269.780	1.917	50	0		CDAARO
CC(C)C[C@H](O)C(=O)N(C)CC[N@H+](C)C1CCCC1	ZINC001506411068	975154201	/nfs/dbraw/zinc/15/42/01/975154201.db2.gz	ZFICZDLBOUFZDT-AWEZNQCLSA-N	1	0	270.417	1.726	50	0		CDAARO
c1c[nH]c(CC[NH2+][C@@H]2CCN(c3ccccc3)C2)n1	ZINC001506418394	975156980	/nfs/dbraw/zinc/15/69/80/975156980.db2.gz	XNDDXDYHSKOLPQ-CYBMUJFWSA-N	1	0	256.353	1.821	50	0		CDAARO
Cc1nncn1CC[NH+]1CCC([C@@H](O)CC(C)C)CC1	ZINC001506421418	975158446	/nfs/dbraw/zinc/15/84/46/975158446.db2.gz	JHQSDPCJZOZGBC-HNNXBMFYSA-N	1	0	280.416	1.706	50	0		CDAARO
C[C@@H]1CCCN(C(=O)COc2cccc(F)c2)[C@H]1C[NH3+]	ZINC000408519273	230404174	/nfs/dbraw/zinc/40/41/74/230404174.db2.gz	YUGBOCYKIZGLCF-RISCZKNCSA-N	1	0	280.343	1.790	50	0		CDAARO
Cc1c(C(=O)N2CC[NH2+]C[C@H]2C)cnn1C(C)(C)C	ZINC000124512481	187140953	/nfs/dbraw/zinc/14/09/53/187140953.db2.gz	UQSGYHGSBDSFIM-SNVBAGLBSA-N	1	0	264.373	1.380	50	0		CDAARO
NC(=[NH2+])NCCCO[C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000095918048	185030772	/nfs/dbraw/zinc/03/07/72/185030772.db2.gz	OETBCKZVZFNTCU-RKDXNWHRSA-N	1	0	267.295	1.997	50	0		CDAARO
COC(=O)[C@]12CCC[C@@H]1C[N@H+](Cc1nc(C)ccc1O)C2	ZINC000096009045	185063783	/nfs/dbraw/zinc/06/37/83/185063783.db2.gz	UKOURTZGXNRNRN-WBMJQRKESA-N	1	0	290.363	1.871	50	0		CDAARO
C[N@@H+]1CC[C@@H]2CCN(C(=O)c3cc(C4CC4)on3)[C@@H]2C1	ZINC000240333284	361747934	/nfs/dbraw/zinc/74/79/34/361747934.db2.gz	FCSOOITZNUIIQC-ZWNOBZJWSA-N	1	0	275.352	1.718	50	0		CDAARO
COC(=O)N1CCC([NH2+]C2CCSCC2)CC1	ZINC000089401042	539087469	/nfs/dbraw/zinc/08/74/69/539087469.db2.gz	ZQNBSXPVLCTSEW-UHFFFAOYSA-N	1	0	258.387	1.702	50	0		CDAARO
COc1ccc(C[C@@H](C)[NH+]2CCN(C)CC2)cc1OC	ZINC000022586756	342089146	/nfs/dbraw/zinc/08/91/46/342089146.db2.gz	JZEYQYISFZVSPS-CYBMUJFWSA-N	1	0	278.396	1.882	50	0		CDAARO
[NH3+][C@@H](CC(=O)N1CC[C@]2(CCOC2)C1)c1ccccc1	ZINC000195544247	342626713	/nfs/dbraw/zinc/62/67/13/342626713.db2.gz	RVJQCDJBVJEHSH-HOCLYGCPSA-N	1	0	274.364	1.716	50	0		CDAARO
Cc1ncccc1C[NH2+][C@@H]1CCCCC[C@H]1C(N)=O	ZINC000195562101	342628590	/nfs/dbraw/zinc/62/85/90/342628590.db2.gz	OHKSSBGAJCFZEK-ZIAGYGMSSA-N	1	0	261.369	1.914	50	0		CDAARO
C[N@@H+]1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3c3ccco3)[C@@H]2C1	ZINC000095466167	539088020	/nfs/dbraw/zinc/08/80/20/539088020.db2.gz	HXZSYWQLVLBTLQ-XJFOESAGSA-N	1	0	274.364	1.936	50	0		CDAARO
COC(=O)c1nccnc1N1CC[C@@H](C[NH+]2CCCC2)C1	ZINC000591915310	342656893	/nfs/dbraw/zinc/65/68/93/342656893.db2.gz	LUHLIWFZMRGYQL-LBPRGKRZSA-N	1	0	290.367	1.185	50	0		CDAARO
Cc1nc2c(c(C)n1)C[C@@H](C[N@H+](C)CCc1ccccn1)O2	ZINC000244584416	361853491	/nfs/dbraw/zinc/85/34/91/361853491.db2.gz	CYYFLQFQFWQPPG-HNNXBMFYSA-N	1	0	298.390	1.966	50	0		CDAARO
CC[N@@H+]1CCC[C@H](NC(=O)c2cc(C)n(C)c2C)C1	ZINC000244701188	361857310	/nfs/dbraw/zinc/85/73/10/361857310.db2.gz	KBSNCQIWFKRLME-ZDUSSCGKSA-N	1	0	263.385	1.856	50	0		CDAARO
O=C(c1cn[nH]c1)N1CCC[N@@H+](C2CCCCC2)CC1	ZINC000244735134	361860341	/nfs/dbraw/zinc/86/03/41/361860341.db2.gz	NTIWPHFSWYUWSQ-UHFFFAOYSA-N	1	0	276.384	1.890	50	0		CDAARO
OC[C@H]1CCC[N@@H+]1Cc1cncn1Cc1ccccc1	ZINC000244735084	361860643	/nfs/dbraw/zinc/86/06/43/361860643.db2.gz	NSUGLBYSKBFCRF-OAHLLOKOSA-N	1	0	271.364	1.888	50	0		CDAARO
CNC(=O)[C@@H]1CCCC[N@@H+]1CCC(=O)Nc1cccnc1	ZINC000244796084	361864896	/nfs/dbraw/zinc/86/48/96/361864896.db2.gz	RSLFWINVJFEKKO-ZDUSSCGKSA-N	1	0	290.367	1.011	50	0		CDAARO
Cc1nc([C@H]2C[C@H]([NH3+])C2)cc(N2CC(c3cccnc3)C2)n1	ZINC000244840312	361866483	/nfs/dbraw/zinc/86/64/83/361866483.db2.gz	UKVCYMCCRZVZRU-CTYIDZIISA-N	1	0	295.390	1.989	50	0		CDAARO
CC[C@H]1CN(C(=O)c2ccc(C[NH3+])o2)CCS1	ZINC000097019840	185153035	/nfs/dbraw/zinc/15/30/35/185153035.db2.gz	MMRMVWRXQSQNKE-JTQLQIEISA-N	1	0	254.355	1.706	50	0		CDAARO
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1[NH2+]CC(N)=O	ZINC000253417333	361935387	/nfs/dbraw/zinc/93/53/87/361935387.db2.gz	KJPNHIQEZNROHE-CKYFFXLPSA-N	1	0	285.388	1.095	50	0		CDAARO
CSCC[C@H](C)[N@H+](C)C[C@H]1CCCS(=O)(=O)C1	ZINC000253416408	361936208	/nfs/dbraw/zinc/93/62/08/361936208.db2.gz	VAOQNVHZUJWKBJ-NWDGAFQWSA-N	1	0	279.471	1.885	50	0		CDAARO
C[C@@H](c1ccccn1)[NH+]1CCC(c2ncc(C(N)=O)[nH]2)CC1	ZINC000685941229	539045872	/nfs/dbraw/zinc/04/58/72/539045872.db2.gz	VJIHONJXNUVEQC-NSHDSACASA-N	1	0	299.378	1.844	50	0		CDAARO
O=C(NC1CC1)N1CCN(Cc2ccccc2F)CC1	ZINC000032843689	539135415	/nfs/dbraw/zinc/13/54/15/539135415.db2.gz	IIZCTPUKWPETEK-UHFFFAOYSA-N	1	0	277.343	1.815	50	0		CDAARO
C[N@H+](CCc1ccccc1)CC(=O)NCCc1ccccn1	ZINC000585121262	362040589	/nfs/dbraw/zinc/04/05/89/362040589.db2.gz	KKHPBEIRRUNDNJ-UHFFFAOYSA-N	1	0	297.402	1.915	50	0		CDAARO
c1cc(CC[NH+]2CCC(N3CCOCC3)CC2)ccn1	ZINC000585116279	362043497	/nfs/dbraw/zinc/04/34/97/362043497.db2.gz	OSYCTDNSJHKJRO-UHFFFAOYSA-N	1	0	275.396	1.421	50	0		CDAARO
C[C@@H](NCc1ncnn1C)[C@@H](c1ccccc1)[NH+](C)C	ZINC000585117755	362046253	/nfs/dbraw/zinc/04/62/53/362046253.db2.gz	VVLIFFBBSFKVTK-DOMZBBRYSA-N	1	0	273.384	1.596	50	0		CDAARO
Cc1cnccc1CC[NH2+][C@@H](C)C[C@H]1CCCC(=O)N1	ZINC000585117549	362046360	/nfs/dbraw/zinc/04/63/60/362046360.db2.gz	LFRLBLBTBNEXCR-DZGCQCFKSA-N	1	0	275.396	1.969	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2C[C@H]([NH+](C)C)C2(C)C)ns1	ZINC000585130416	362056064	/nfs/dbraw/zinc/05/60/64/362056064.db2.gz	PKTBUHZHECDVIO-QWRGUYRKSA-N	1	0	267.398	1.910	50	0		CDAARO
COC[C@@H](O)CN(C)c1cc[nH+]c2cc(F)ccc21	ZINC000083858984	362254918	/nfs/dbraw/zinc/25/49/18/362254918.db2.gz	FOKOFDRXLKBRBT-NSHDSACASA-N	1	0	264.300	1.817	50	0		CDAARO
O[C@H](C[N@@H+]1CCSC2(CCOCC2)C1)CC(F)(F)F	ZINC000189989020	362344436	/nfs/dbraw/zinc/34/44/36/362344436.db2.gz	XUPVMLVRJWPQID-JTQLQIEISA-N	1	0	299.358	1.898	50	0		CDAARO
Cc1c(C(=O)N[C@H]2CC[N@@H+](C(C)(C)C)C2)ccn1C	ZINC000617343421	345175331	/nfs/dbraw/zinc/17/53/31/345175331.db2.gz	SKEDHSWNRWTLQR-LBPRGKRZSA-N	1	0	263.385	1.936	50	0		CDAARO
COc1ccc(OCCN(C)C(=O)[C@H]2CCC[C@H]2[NH3+])cc1	ZINC000085366945	179037134	/nfs/dbraw/zinc/03/71/34/179037134.db2.gz	GKEYHTJOSLAXDM-LSDHHAIUSA-N	1	0	292.379	1.660	50	0		CDAARO
C[C@@H]1CN(C)CC[N@@H+]1CC1CCN(C(=O)C2CCC2)CC1	ZINC000085468060	179073554	/nfs/dbraw/zinc/07/35/54/179073554.db2.gz	GTGXEZQNDVCEPI-CQSZACIVSA-N	1	0	293.455	1.661	50	0		CDAARO
Clc1ccccc1-n1nncc1CN1CC[NH2+]CC1	ZINC000098211132	185699620	/nfs/dbraw/zinc/69/96/20/185699620.db2.gz	SYZHYHXHFFDMCR-UHFFFAOYSA-N	1	0	277.759	1.326	50	0		CDAARO
C[NH+](C)[C@@H]1CCC[C@H]1NC(=O)CCC(F)(F)F	ZINC000613659933	347852941	/nfs/dbraw/zinc/85/29/41/347852941.db2.gz	GCIIAWPQJHKQBJ-RKDXNWHRSA-N	1	0	252.280	1.928	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]CCn1ccnc1C	ZINC000584896030	349357215	/nfs/dbraw/zinc/35/72/15/349357215.db2.gz	LGFMOHMSYUYQEX-GFCCVEGCSA-N	1	0	261.373	1.629	50	0		CDAARO
COc1cccc2ncn(CC[C@H](C)[NH+](C)C)c(=O)c21	ZINC000584895980	349357382	/nfs/dbraw/zinc/35/73/82/349357382.db2.gz	KJNIPVBDVCSKFK-NSHDSACASA-N	1	0	275.352	1.745	50	0		CDAARO
COC(C)(C)CCNC(=O)CC[C@@H](C)[NH+]1CCN(C)CC1	ZINC000584886851	349345495	/nfs/dbraw/zinc/34/54/95/349345495.db2.gz	ZIQRDIRWLMRXFJ-CQSZACIVSA-N	1	0	299.459	1.334	50	0		CDAARO
c1cc(-c2nnc(C[NH2+][C@H]3CCSC3)[nH]2)ccn1	ZINC000584886927	349345946	/nfs/dbraw/zinc/34/59/46/349345946.db2.gz	OMKUUUWZPNWQLJ-JTQLQIEISA-N	1	0	261.354	1.462	50	0		CDAARO
O=C(C[N@H+]1CCC[C@@H](O)C1)N1CCC2(CCCC2)C1	ZINC000584892198	349351293	/nfs/dbraw/zinc/35/12/93/349351293.db2.gz	DTXXMQBVLSIETK-CYBMUJFWSA-N	1	0	266.385	1.236	50	0		CDAARO
Cc1cc(C(=O)N2CCC3(CC[N@@H+](C)C3)CC2)c(O)cn1	ZINC000584894164	349354309	/nfs/dbraw/zinc/35/43/09/349354309.db2.gz	KNNRYRBPRQGDER-UHFFFAOYSA-N	1	0	289.379	1.654	50	0		CDAARO
CC(C)c1ocnc1C(=O)N1C[C@H](O)[C@@H]([NH+]2CCCC2)C1	ZINC000584894065	349354369	/nfs/dbraw/zinc/35/43/69/349354369.db2.gz	VSGOAGGCPRTHGV-RYUDHWBXSA-N	1	0	293.367	1.079	50	0		CDAARO
C[C@H](CNS(=O)(=O)C1CC1)[NH2+]C1(c2ccccc2)CC1	ZINC000584898821	349360659	/nfs/dbraw/zinc/36/06/59/349360659.db2.gz	CLVRSJNGVIOZSN-GFCCVEGCSA-N	1	0	294.420	1.736	50	0		CDAARO
Cc1c[nH]c(CN(C)C(=O)[C@H]2CCCCC[N@@H+]2C)n1	ZINC000091535072	180182078	/nfs/dbraw/zinc/18/20/78/180182078.db2.gz	JGXYGGPWGDEONK-GFCCVEGCSA-N	1	0	264.373	1.551	50	0		CDAARO
Cc1ccccc1OCCN(C)C(=O)[C@@H]1CC[C@@H]([NH3+])C1	ZINC000091544114	180185164	/nfs/dbraw/zinc/18/51/64/180185164.db2.gz	GAWVMXAIRMSFQS-ZIAGYGMSSA-N	1	0	276.380	1.960	50	0		CDAARO
COC[C@]1(O)CC[N@H+](Cc2cccc(C)n2)CC1(C)C	ZINC000091645038	180214752	/nfs/dbraw/zinc/21/47/52/180214752.db2.gz	WCHDDPROVLCUAI-MRXNPFEDSA-N	1	0	278.396	1.999	50	0		CDAARO
CC[C@H](C(=O)NCCNc1cc(C)cc[nH+]1)n1cccn1	ZINC000091621032	180209059	/nfs/dbraw/zinc/20/90/59/180209059.db2.gz	SCDVNLPZXIDZPK-CYBMUJFWSA-N	1	0	287.367	1.766	50	0		CDAARO
Cc1c([C@H](C)NC(=O)C[NH3+])cnn1-c1ccc(F)cc1F	ZINC000091943914	180290097	/nfs/dbraw/zinc/29/00/97/180290097.db2.gz	PBBCBNQIOHPETF-QMMMGPOBSA-N	1	0	294.305	1.595	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2cccc3nccnc32)C[C@@H]1C1CC1	ZINC000092045732	180311095	/nfs/dbraw/zinc/31/10/95/180311095.db2.gz	HLWUPXIHZNUPDU-OLZOCXBDSA-N	1	0	282.347	1.439	50	0		CDAARO
CC(C)(C)NC(=O)NC(=O)C[NH+]1CCCCCCC1	ZINC000003351168	363156094	/nfs/dbraw/zinc/15/60/94/363156094.db2.gz	PSQZXJKDBHQFFT-UHFFFAOYSA-N	1	0	269.389	1.877	50	0		CDAARO
[NH2+]=C1Nc2nc3ccccc3n2[C@H](c2ccccn2)N1	ZINC000001408218	355934953	/nfs/dbraw/zinc/93/49/53/355934953.db2.gz	XDRRPGXVSUVWGM-GFCCVEGCSA-N	1	0	264.292	1.528	50	0		CDAARO
COc1ccc(OCC(=O)O[C@H]2C[NH+]3CCC2CC3)cc1	ZINC000000249804	355899274	/nfs/dbraw/zinc/89/92/74/355899274.db2.gz	UXKZILLANFPQSF-HNNXBMFYSA-N	1	0	291.347	1.711	50	0		CDAARO
FC(F)c1cc(C2CC2)nc(N2CC[NH2+]CC2)n1	ZINC000002554305	355974625	/nfs/dbraw/zinc/97/46/25/355974625.db2.gz	WIMRKJVFCDABHN-UHFFFAOYSA-N	1	0	254.284	1.701	50	0		CDAARO
CCOc1ccc(/C=C\C(=O)N2CC[NH2+][C@H](C)C2)cc1	ZINC000493272681	356241375	/nfs/dbraw/zinc/24/13/75/356241375.db2.gz	VOUOWMNEBQRSOA-OYVUYXNMSA-N	1	0	274.364	1.919	50	0		CDAARO
CC(C)(CNc1ccc2nnnn2n1)[NH+]1CCCCC1	ZINC000014136100	356376374	/nfs/dbraw/zinc/37/63/74/356376374.db2.gz	HPHLVDFGEDSTLO-UHFFFAOYSA-N	1	0	275.360	1.196	50	0		CDAARO
C[C@@H]1C[NH+](CCCNC(=O)c2ccoc2)C[C@@H](C)O1	ZINC000032826840	356383297	/nfs/dbraw/zinc/38/32/97/356383297.db2.gz	MIGLSIKEJZRGGO-VXGBXAGGSA-N	1	0	266.341	1.509	50	0		CDAARO
CC(C)CN1C(=O)N(C)C2(CC[NH+](C(C)C)CC2)C1=O	ZINC000014747966	356396673	/nfs/dbraw/zinc/39/66/73/356396673.db2.gz	GIOGYUWMYBYRCP-UHFFFAOYSA-N	1	0	281.400	1.779	50	0		CDAARO
CNC(=O)c1ccc(NC(=O)C[NH2+]C(C)(C)C)cc1	ZINC000015377245	356414474	/nfs/dbraw/zinc/41/44/74/356414474.db2.gz	KIXBNAYTOYQFGW-UHFFFAOYSA-N	1	0	263.341	1.373	50	0		CDAARO
CCOc1cc(CN2CCC([NH3+])CC2)ccc1O	ZINC000015423800	356415536	/nfs/dbraw/zinc/41/55/36/356415536.db2.gz	FUBMOVYOFWIFLM-UHFFFAOYSA-N	1	0	250.342	1.714	50	0		CDAARO
CCS(=O)(=O)c1ccc(N2CC[NH2+][C@@H](C)C2)c(F)c1	ZINC000015443629	356416452	/nfs/dbraw/zinc/41/64/52/356416452.db2.gz	QLOVVGFUELASSZ-JTQLQIEISA-N	1	0	286.372	1.417	50	0		CDAARO
CC(C)[NH+]1CCC([N@@H+]2CCC[C@@H](C(=O)NC3CC3)C2)CC1	ZINC000015064845	356405244	/nfs/dbraw/zinc/40/52/44/356405244.db2.gz	JDOOZUBUINAGTK-CQSZACIVSA-N	1	0	293.455	1.850	50	0		CDAARO
CCOC(=O)c1ccc(NC(=O)NCCC[NH+](C)C)cc1	ZINC000017023245	356451571	/nfs/dbraw/zinc/45/15/71/356451571.db2.gz	SDQSQWOJSANMRF-UHFFFAOYSA-N	1	0	293.367	1.937	50	0		CDAARO
CC(C)c1ccc(OC[C@H](O)CN2CC[NH+](C)CC2)cc1	ZINC000019367710	356482696	/nfs/dbraw/zinc/48/26/96/356482696.db2.gz	NSFVNTKHHAXOOF-MRXNPFEDSA-N	1	0	292.423	1.797	50	0		CDAARO
COC(=O)/C=C1\SC(=O)N(CN2CCCCC2)C1=O	ZINC000019866133	356511072	/nfs/dbraw/zinc/51/10/72/356511072.db2.gz	KOYJLKRASLVBFT-CLFYSBASSA-N	1	0	284.337	1.182	50	0		CDAARO
Cc1cc(NC(=O)CCCCC[NH+]2CCOCC2)no1	ZINC000019924772	356516567	/nfs/dbraw/zinc/51/65/67/356516567.db2.gz	RUAMFFJEZMGVPS-UHFFFAOYSA-N	1	0	281.356	1.814	50	0		CDAARO
CC(C)(C[NH2+]C[C@H](O)c1ccccc1)N1CCOCC1	ZINC000022030114	356598171	/nfs/dbraw/zinc/59/81/71/356598171.db2.gz	WSVKPFGFYGKJMK-HNNXBMFYSA-N	1	0	278.396	1.420	50	0		CDAARO
Cc1cc(C[N@@H+]2CCC[C@@H]2[C@H]2COCC[C@@]2(C)O)on1	ZINC000328954271	202128669	/nfs/dbraw/zinc/12/86/69/202128669.db2.gz	IKTWEQWPPUGCLC-RBSFLKMASA-N	1	0	280.368	1.735	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)C1	ZINC000247129423	356668964	/nfs/dbraw/zinc/66/89/64/356668964.db2.gz	NMCQEBHVPJQZPZ-UFGOTCBOSA-N	1	0	280.318	1.876	50	0		CDAARO
[NH3+]CC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000030714352	356751816	/nfs/dbraw/zinc/75/18/16/356751816.db2.gz	HDQPZMPHTRRNKZ-UHFFFAOYSA-N	1	0	251.717	1.439	50	0		CDAARO
O=C(CC[NH+]1CCCC1)NC[C@H]1OCCc2ccccc21	ZINC000000118781	356812405	/nfs/dbraw/zinc/81/24/05/356812405.db2.gz	DHEYIFFLMGXFGD-MRXNPFEDSA-N	1	0	288.391	1.903	50	0		CDAARO
C[N@H+](C[C@H]1CCCCO1)CC(C)(C)CN1CCOCC1	ZINC000032523836	356781520	/nfs/dbraw/zinc/78/15/20/356781520.db2.gz	VJXOLSIKUWYICK-OAHLLOKOSA-N	1	0	284.444	1.846	50	0		CDAARO
C[N@@H+]1CCC[C@H]1CCNC(=O)CCC(=O)NC1CCCC1	ZINC000055383795	357333466	/nfs/dbraw/zinc/33/34/66/357333466.db2.gz	PJPWPHFKYBOTNJ-AWEZNQCLSA-N	1	0	295.427	1.426	50	0		CDAARO
C[N@H+](CCNC(=O)NC[C@@]1(C)CCCS1)C1CC1	ZINC000096467154	357479398	/nfs/dbraw/zinc/47/93/98/357479398.db2.gz	JBBPDPPMNCRDJE-CYBMUJFWSA-N	1	0	271.430	1.666	50	0		CDAARO
C[C@@H]1CC(C)(C)C[C@@](CO)([NH2+]CCN2C(=O)CCC2=O)C1	ZINC000095432077	357514492	/nfs/dbraw/zinc/51/44/92/357514492.db2.gz	JVZHJPZAYTUROP-WBMJQRKESA-N	1	0	296.411	1.302	50	0		CDAARO
CCc1cc(NCC[C@H]2CCOC2)nc(N(C)C)[nH+]1	ZINC000065372813	357533142	/nfs/dbraw/zinc/53/31/42/357533142.db2.gz	NBOCWNSBGLECSF-NSHDSACASA-N	1	0	264.373	1.944	50	0		CDAARO
O=C(NC1CC1)c1cccc(OC[C@H]2CCC[NH2+]C2)c1	ZINC000066323517	357562223	/nfs/dbraw/zinc/56/22/23/357562223.db2.gz	MXQSAZKBVFLFOY-LBPRGKRZSA-N	1	0	274.364	1.957	50	0		CDAARO
CCCn1nccc1C(=O)NCC[C@@H]1CCC[N@H+](C)C1	ZINC000067805589	357628626	/nfs/dbraw/zinc/62/86/26/357628626.db2.gz	HYKWLDBNVLZXBE-ZDUSSCGKSA-N	1	0	278.400	1.755	50	0		CDAARO
COc1ccccc1OC[C@@H](O)C[NH2+]C(C)(C)C	ZINC000003650388	357657545	/nfs/dbraw/zinc/65/75/45/357657545.db2.gz	MFUFKDHTQHYPJS-NSHDSACASA-N	1	0	253.342	1.823	50	0		CDAARO
Cc1nc[nH]c1C(=O)NCC[C@H]1C[N@H+](CC(C)C)CCO1	ZINC000067869177	357634289	/nfs/dbraw/zinc/63/42/89/357634289.db2.gz	QLBYHAJKSAFJSQ-ZDUSSCGKSA-N	1	0	294.399	1.195	50	0		CDAARO
CO[C@@H]1C[C@@H](CO)[N@H+](CC2(O)CCC(C)CC2)C1	ZINC000408038994	357770570	/nfs/dbraw/zinc/77/05/70/357770570.db2.gz	QULHJOBNDRLGEO-YIFLHPOLSA-N	1	0	257.374	1.009	50	0		CDAARO
CCCc1nc(C)cc(N2Cc3cnn(CCO)c3C2)n1	ZINC000071762604	357779696	/nfs/dbraw/zinc/77/96/96/357779696.db2.gz	LUSHYSPCHUTILV-UHFFFAOYSA-N	1	0	287.367	1.447	50	0		CDAARO
Cc1cc2nc(C)cc(NCC[NH+]3CCCC3)n2n1	ZINC000072420168	357834002	/nfs/dbraw/zinc/83/40/02/357834002.db2.gz	IQMSPEUMLVOPCQ-UHFFFAOYSA-N	1	0	259.357	1.854	50	0		CDAARO
Nc1ncccc1CN1CCC([N@@H+]2CCC[C@H](O)C2)CC1	ZINC000072463069	357836868	/nfs/dbraw/zinc/83/68/68/357836868.db2.gz	YUIZSJMNEZBSPC-HNNXBMFYSA-N	1	0	290.411	1.085	50	0		CDAARO
NC(=O)N1CCC[N@@H+]([C@@H]2CCc3ccc(F)cc32)CC1	ZINC000095407503	283299223	/nfs/dbraw/zinc/29/92/23/283299223.db2.gz	KBRZTVUQSQNBCP-CQSZACIVSA-N	1	0	277.343	1.899	50	0		CDAARO
CCCc1cc(C(=O)N2CCC[C@](O)(C[NH+](C)C)C2)no1	ZINC000082166659	358150699	/nfs/dbraw/zinc/15/06/99/358150699.db2.gz	RSYNKFVPDIVHHP-HNNXBMFYSA-N	1	0	295.383	1.156	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N[C@H]1CCC[NH2+]C1	ZINC000193233036	358275973	/nfs/dbraw/zinc/27/59/73/358275973.db2.gz	NGKSRQPPRJXENT-LBPRGKRZSA-N	1	0	268.382	1.279	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CCn1ncn2cccc2c1=O	ZINC000095355945	358683679	/nfs/dbraw/zinc/68/36/79/358683679.db2.gz	WZAPDBIBAFYJKG-GFCCVEGCSA-N	1	0	260.341	1.370	50	0		CDAARO
CCc1nnc(CNC(=O)CC[C@@H]2CCC[N@H+](C)C2)s1	ZINC000095356923	358683896	/nfs/dbraw/zinc/68/38/96/358683896.db2.gz	GPEXQXKAGXNNRR-NSHDSACASA-N	1	0	296.440	1.839	50	0		CDAARO
CC(C)c1cc(N(C)CCCc2nccn2C)nc(N)[nH+]1	ZINC000095375247	358688369	/nfs/dbraw/zinc/68/83/69/358688369.db2.gz	FXPYKVWLUXWMRP-UHFFFAOYSA-N	1	0	288.399	1.985	50	0		CDAARO
CCc1noc([C@H]2CCC[N@@H+](C3CCOCC3)C2)n1	ZINC000095373641	358688408	/nfs/dbraw/zinc/68/84/08/358688408.db2.gz	SWPWMGQFEBMHOG-NSHDSACASA-N	1	0	265.357	1.990	50	0		CDAARO
CCc1[nH+]c(N)nc(NCCC(=O)N2CCCC2)c1C	ZINC000095379307	358689569	/nfs/dbraw/zinc/68/95/69/358689569.db2.gz	JPQLTFQMSPPZAB-UHFFFAOYSA-N	1	0	277.372	1.354	50	0		CDAARO
CCc1cnc(NCCC[N@@H+]2CCC[C@@H](CO)C2)nc1	ZINC000095383244	358690268	/nfs/dbraw/zinc/69/02/68/358690268.db2.gz	QOZALRNMNPGFCN-CQSZACIVSA-N	1	0	278.400	1.545	50	0		CDAARO
Cc1cc(C)nc(CNC(=O)CC[C@H]2CCC[N@@H+](C)C2)n1	ZINC000095387656	358691290	/nfs/dbraw/zinc/69/12/90/358691290.db2.gz	AJNWRFMJQAQYAH-CQSZACIVSA-N	1	0	290.411	1.832	50	0		CDAARO
CC[NH+]1CCC(CC(=O)NCCn2cc(Cl)cn2)CC1	ZINC000095390650	358692170	/nfs/dbraw/zinc/69/21/70/358692170.db2.gz	WBFOUUYWJJFEPK-UHFFFAOYSA-N	1	0	298.818	1.775	50	0		CDAARO
Cc1ccccc1OC1CCN(c2cc(N)nc(N)n2)CC1	ZINC000095523514	358696191	/nfs/dbraw/zinc/69/61/91/358696191.db2.gz	KTCSNRYSSYFYRM-UHFFFAOYSA-N	1	0	299.378	1.997	50	0		CDAARO
O[C@H]1C[NH2+][C@H](c2ncnn2-c2cccc3c2CCC3)C1	ZINC000097117656	358751909	/nfs/dbraw/zinc/75/19/09/358751909.db2.gz	CFHAAADTHMILBW-YPMHNXCESA-N	1	0	270.336	1.151	50	0		CDAARO
Cn1cnc2cc(C(=O)NCC[C@@H]3CCC[NH2+]3)ccc21	ZINC000097425543	358775083	/nfs/dbraw/zinc/77/50/83/358775083.db2.gz	KJWZGIJSNKVETG-LBPRGKRZSA-N	1	0	272.352	1.445	50	0		CDAARO
Cc1cc(C(=O)NCC(C)(C)C[NH+](C)C)c(=O)n(C)c1C	ZINC000215481192	358891487	/nfs/dbraw/zinc/89/14/87/358891487.db2.gz	ZHRVMVUVXWNEEH-UHFFFAOYSA-N	1	0	293.411	1.320	50	0		CDAARO
C[NH+](C)CCCn1cnc2c3ccccc3[nH]c2c1=O	ZINC000000526020	366522057	/nfs/dbraw/zinc/52/20/57/366522057.db2.gz	MTRWXJSRWLUEIZ-UHFFFAOYSA-N	1	0	270.336	1.830	50	0	biogenic	CDAARO
CO[C@H]1CC[N@H+](Cc2cnc(-c3ccccn3)nc2)C1	ZINC000216274922	358934508	/nfs/dbraw/zinc/93/45/08/358934508.db2.gz	QOZCLHBMTWIPRL-ZDUSSCGKSA-N	1	0	270.336	1.759	50	0		CDAARO
COc1cccc(C(=O)N2CC([NH+]3CCCCC3)C2)c1O	ZINC000220331298	359164604	/nfs/dbraw/zinc/16/46/04/359164604.db2.gz	NINMRGLYUMZICA-UHFFFAOYSA-N	1	0	290.363	1.711	50	0		CDAARO
C[C@]1(O)CCCN(C(=O)CCCn2ccnc2)CC1	ZINC000221398752	359244703	/nfs/dbraw/zinc/24/47/03/359244703.db2.gz	KPFQMEFPWYIRIG-AWEZNQCLSA-N	1	0	265.357	1.427	50	0		CDAARO
C[C@H]1CN(C(=O)c2ccc(C[NH3+])o2)CC(C)(C)O1	ZINC000094571083	359287894	/nfs/dbraw/zinc/28/78/94/359287894.db2.gz	CNYCSARHMCBPOH-VIFPVBQESA-N	1	0	252.314	1.378	50	0		CDAARO
Nc1cc(N)[nH+]c(SCC(=O)c2ccccc2)n1	ZINC000000351585	359570912	/nfs/dbraw/zinc/57/09/12/359570912.db2.gz	RKUVLNONDAQMDT-UHFFFAOYSA-N	1	0	260.322	1.616	50	0		CDAARO
CC1(C)CC[C@H]1[NH2+]CCOc1ccc(S(N)(=O)=O)cc1	ZINC000408523291	359931018	/nfs/dbraw/zinc/93/10/18/359931018.db2.gz	IODCYJPXXZBFST-CYBMUJFWSA-N	1	0	298.408	1.491	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)O[C@@H](C)C(=O)N(C)C	ZINC000408525611	359935787	/nfs/dbraw/zinc/93/57/87/359935787.db2.gz	ILYOJPGRQNOBPR-QWRGUYRKSA-N	1	0	258.362	1.017	50	0		CDAARO
CN1Cc2cccn2C[C@@H]1CNC(=O)c1cccc(F)c1	ZINC000409420308	360223321	/nfs/dbraw/zinc/22/33/21/360223321.db2.gz	FSAHNSALRMULLB-HNNXBMFYSA-N	1	0	287.338	1.871	50	0		CDAARO
[NH3+]C[C@@H]1CN(C(=O)c2ccc(Cl)cc2)CCO1	ZINC000011887361	360401032	/nfs/dbraw/zinc/40/10/32/360401032.db2.gz	SIEVAVUIDHVZNI-LLVKDONJSA-N	1	0	254.717	1.140	50	0		CDAARO
Cc1cccc(N2CCC(N3C[C@@H]([NH3+])[C@H](O)C3)CC2)c1C	ZINC000426677765	360695719	/nfs/dbraw/zinc/69/57/19/360695719.db2.gz	ROQNBEAVBBIQLN-NVXWUHKLSA-N	1	0	289.423	1.276	50	0		CDAARO
Cc1nnc(CNC(=O)c2cccc(C[NH+](C)C)c2)s1	ZINC000426384000	360662701	/nfs/dbraw/zinc/66/27/01/360662701.db2.gz	VUKMXEBCLNQHPM-UHFFFAOYSA-N	1	0	290.392	1.838	50	0		CDAARO
Cc1nonc1CSc1nnc(C2CC[NH2+]CC2)n1C	ZINC000426428361	360669147	/nfs/dbraw/zinc/66/91/47/360669147.db2.gz	YCYBMOGDIWWGGQ-UHFFFAOYSA-N	1	0	294.384	1.266	50	0		CDAARO
CCCCc1ccc(NC(=O)N[C@H]2C[NH2+]CC[C@H]2O)cc1	ZINC000426669145	360694531	/nfs/dbraw/zinc/69/45/31/360694531.db2.gz	QLGZAXWNZHQWRZ-LSDHHAIUSA-N	1	0	291.395	1.874	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)c2ccc(N3CCCC3=O)cc2)C1	ZINC000178536000	189124962	/nfs/dbraw/zinc/12/49/62/189124962.db2.gz	VBHJSRVSXRCKKJ-GFCCVEGCSA-N	1	0	287.363	1.234	50	0		CDAARO
C[NH2+]CC1CCN(C(=O)c2cnc(C)nc2C(C)C)CC1	ZINC000179032117	189163699	/nfs/dbraw/zinc/16/36/99/189163699.db2.gz	NJTNEZGVHFWIPJ-UHFFFAOYSA-N	1	0	290.411	1.980	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)COc1cccc(F)c1	ZINC000299739931	283594275	/nfs/dbraw/zinc/59/42/75/283594275.db2.gz	TVGKOUKDBKYPDF-GFCCVEGCSA-N	1	0	266.316	1.415	50	0		CDAARO
CO[C@]1(C)C[C@H](N(C)C(=O)[C@H]2CCC[NH2+]C2)C1(C)C	ZINC000246725636	360925260	/nfs/dbraw/zinc/92/52/60/360925260.db2.gz	OJRXYJZVMZASFW-SLEUVZQESA-N	1	0	268.401	1.648	50	0		CDAARO
COc1ccc(OC)c(NC(=O)N2C[C@@H]3CC[NH2+][C@@H]3C2)c1	ZINC000426535633	361003670	/nfs/dbraw/zinc/00/36/70/361003670.db2.gz	PQSVGTPRUWSOEF-GXFFZTMASA-N	1	0	291.351	1.529	50	0		CDAARO
CN(Cc1csc2ccccc12)C(=O)[C@@H]1C[C@@H](O)C[NH2+]1	ZINC000299748507	200856156	/nfs/dbraw/zinc/85/61/56/200856156.db2.gz	HGSJVZJSUOUEAJ-YPMHNXCESA-N	1	0	290.388	1.583	50	0		CDAARO
CC(C)Cc1ccc(S(=O)(=O)N2CCC([NH3+])CC2)cc1	ZINC000036178393	361201798	/nfs/dbraw/zinc/20/17/98/361201798.db2.gz	RMHNNZUCPLJTDM-UHFFFAOYSA-N	1	0	296.436	1.997	50	0		CDAARO
Cc1ccccc1[C@@H](CN1CCOCC1)[NH2+]C[C@@H](C)O	ZINC000183277744	189353463	/nfs/dbraw/zinc/35/34/63/189353463.db2.gz	ZUAQQTDNDIILLT-GDBMZVCRSA-N	1	0	278.396	1.339	50	0		CDAARO
C[C@H]([NH2+][C@@H](C(N)=O)c1ccc(F)cc1)[C@H]1CCCO1	ZINC000248580730	361609549	/nfs/dbraw/zinc/60/95/49/361609549.db2.gz	IJUHIDWPZOLMOQ-ZWKOPEQDSA-N	1	0	266.316	1.509	50	0		CDAARO
COC[C@@H](C)[NH2+]Cc1cc(OC)c(OC)cc1OC	ZINC000004685527	364815274	/nfs/dbraw/zinc/81/52/74/364815274.db2.gz	HOSKYBXXSQYAGF-SNVBAGLBSA-N	1	0	269.341	1.837	50	0		CDAARO
C(C[NH2+][C@H]1[C@H]2CCO[C@H]2C12CCC2)CO[C@H]1CCOC1	ZINC000194077385	189654394	/nfs/dbraw/zinc/65/43/94/189654394.db2.gz	RFMRMUZNNZFYAS-LJISPDSOSA-N	1	0	281.396	1.729	50	0		CDAARO
Cc1cc(S(=O)(=O)N(C)[C@H](C)C[NH3+])sc1C	ZINC000195555257	189679542	/nfs/dbraw/zinc/67/95/42/189679542.db2.gz	KLBPVXVVWMSQBU-MRVPVSSYSA-N	1	0	262.400	1.333	50	0		CDAARO
COc1ccc(CC(C)(C)NC(=O)C[NH+](C)C)cc1	ZINC000188897346	365458526	/nfs/dbraw/zinc/45/85/26/365458526.db2.gz	WPRQKUDLARMAKI-UHFFFAOYSA-N	1	0	264.369	1.694	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCN(C(=O)CCC(F)(F)F)C1	ZINC000088834108	367327554	/nfs/dbraw/zinc/32/75/54/367327554.db2.gz	IBRFSTQMDUUHIB-IUCAKERBSA-N	1	0	252.280	1.915	50	0		CDAARO
CCOCCC[N@@H+]1CC[C@H](NC(=O)[C@H]2CCCO2)[C@@H](C)C1	ZINC000252477287	367544756	/nfs/dbraw/zinc/54/47/56/367544756.db2.gz	LGJWVIAKXMVFNP-SOUVJXGZSA-N	1	0	298.427	1.419	50	0		CDAARO
C[C@@H](C(=O)[O-])[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1	ZINC000252539135	367811250	/nfs/dbraw/zinc/81/12/50/367811250.db2.gz	NTYPKJXETYHLKQ-DZGCQCFKSA-N	1	0	276.380	1.913	50	0		CDAARO
CC[N@@H+]1CC[C@H](Nc2nc(C)nc3oc(C)nc32)C1	ZINC000063869540	370912372	/nfs/dbraw/zinc/91/23/72/370912372.db2.gz	JGHNMVDCYWDQCW-JTQLQIEISA-N	1	0	261.329	1.741	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N[C@H]2CCC[C@H]2C[NH3+])c1	ZINC000089091972	368833240	/nfs/dbraw/zinc/83/32/40/368833240.db2.gz	JSCNBGUWLKZFAG-JQWIXIFHSA-N	1	0	286.372	1.540	50	0		CDAARO
CCCNC(=O)NCCn1c(C)c[nH+]c1C1CC1	ZINC000575556219	369133650	/nfs/dbraw/zinc/13/36/50/369133650.db2.gz	OODIAEBUJPFURJ-UHFFFAOYSA-N	1	0	250.346	1.778	50	0		CDAARO
COc1nnc(NC(=O)N2C[C@@H]3CCC[N@@H+]3C[C@H]2C)s1	ZINC000276557526	193379972	/nfs/dbraw/zinc/37/99/72/193379972.db2.gz	PBRNOIJIFIGOPT-BDAKNGLRSA-N	1	0	297.384	1.247	50	0		CDAARO
Cc1nc(C)c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)o1	ZINC000084061286	370089586	/nfs/dbraw/zinc/08/95/86/370089586.db2.gz	MOEGLGQNANEGPH-NEPJUHHUSA-N	1	0	263.341	1.600	50	0		CDAARO
O=C(c1cscn1)N1CCC([C@@H]2CC[NH2+]C2)CC1	ZINC000377752756	371680776	/nfs/dbraw/zinc/68/07/76/371680776.db2.gz	XPUDENGKLBZTHI-LLVKDONJSA-N	1	0	265.382	1.605	50	0		CDAARO
Cc1cc(F)ccc1NC(=O)NC[C@@]1(O)CCC[NH2+]C1	ZINC000299781282	372756828	/nfs/dbraw/zinc/75/68/28/372756828.db2.gz	VQYGFYGWUKPUJV-CQSZACIVSA-N	1	0	281.331	1.370	50	0		CDAARO
CCc1nccn1CCC(=O)N(C)C[C@@H]1CCCCO1	ZINC000299781030	372756980	/nfs/dbraw/zinc/75/69/80/372756980.db2.gz	KMVBAJNDAXUODI-ZDUSSCGKSA-N	1	0	279.384	1.863	50	0		CDAARO
c1nnn2c1CO[C@H]1C[N@H+](CCc3ccccc3)CC[C@@H]12	ZINC000299799016	372771516	/nfs/dbraw/zinc/77/15/16/372771516.db2.gz	UGFCZFJEAJXDOZ-HOTGVXAUSA-N	1	0	284.363	1.666	50	0		CDAARO
COCC(C)(C)[NH2+][C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000192569010	373620885	/nfs/dbraw/zinc/62/08/85/373620885.db2.gz	LSVNQFWUDINUSB-GFCCVEGCSA-N	1	0	292.379	1.815	50	0		CDAARO
Cc1noc([C@@H]2C[N@H+](Cc3ccco3)C[C@H]2CO)n1	ZINC000253404341	373694567	/nfs/dbraw/zinc/69/45/67/373694567.db2.gz	HUKNCXCDIBLJKE-CMPLNLGQSA-N	1	0	263.297	1.179	50	0		CDAARO
C[NH2+][C@@H]1CCN(Cc2cnn(-c3cc(C)cc(C)c3)n2)C1	ZINC000097162619	541892373	/nfs/dbraw/zinc/89/23/73/541892373.db2.gz	GSRISENVLGBWKW-CQSZACIVSA-N	1	0	285.395	1.678	50	0		CDAARO
O=C(c1ccc(CN[C@H]2CCC[NH2+]C2)cc1)N1CCCC1	ZINC000071278754	296207882	/nfs/dbraw/zinc/20/78/82/296207882.db2.gz	WRWFNNINSCENTH-INIZCTEOSA-N	1	0	287.407	1.764	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)NCC[C@H]2CC[NH2+]C2)c1	ZINC000104347456	374274941	/nfs/dbraw/zinc/27/49/41/374274941.db2.gz	MAQAUKXRWZFQTH-LLVKDONJSA-N	1	0	286.372	1.412	50	0		CDAARO
C[NH+]1CCN(Cc2c[nH]c(-c3ccccc3)n2)CC1	ZINC000019635324	374766907	/nfs/dbraw/zinc/76/69/07/374766907.db2.gz	DWICZMANEBXJKT-UHFFFAOYSA-N	1	0	256.353	1.824	50	0		CDAARO
OCC(CO)[NH2+][C@@H]1CCCSc2ccccc21	ZINC000095423361	374923298	/nfs/dbraw/zinc/92/32/98/374923298.db2.gz	BEDBQOJUHIBEME-GFCCVEGCSA-N	1	0	253.367	1.556	50	0		CDAARO
CN(C)c1nccc(C[NH2+]C2CCN(CC(F)F)CC2)n1	ZINC000097083886	375144578	/nfs/dbraw/zinc/14/45/78/375144578.db2.gz	SHCDSESAROTLEQ-UHFFFAOYSA-N	1	0	299.369	1.362	50	0		CDAARO
C[C@H]1OCC[C@H]1[NH2+]Cc1ccc(N2CCOC2=O)cc1	ZINC000097084775	375147157	/nfs/dbraw/zinc/14/71/57/375147157.db2.gz	MCZFZJMFPJPXLL-BXUZGUMPSA-N	1	0	276.336	1.910	50	0		CDAARO
CSCc1ccc(C(=O)N2CC[C@H](C[NH3+])C2)cc1	ZINC000299738894	375199708	/nfs/dbraw/zinc/19/97/08/375199708.db2.gz	IDANNENLZHXLMB-GFCCVEGCSA-N	1	0	264.394	1.970	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000299750482	375206761	/nfs/dbraw/zinc/20/67/61/375206761.db2.gz	NNPHBEYLGVZKEG-SOUVJXGZSA-N	1	0	276.380	1.838	50	0		CDAARO
Cc1[nH]ccc1C(=O)NC1CC[NH+](C2CCOCC2)CC1	ZINC000670471697	542012660	/nfs/dbraw/zinc/01/26/60/542012660.db2.gz	ZEXBWDCNBFCBAR-UHFFFAOYSA-N	1	0	291.395	1.696	50	0		CDAARO
CC(C)c1ccc(S(=O)(=O)NCC[NH+](C)C)cc1	ZINC000003454026	375704661	/nfs/dbraw/zinc/70/46/61/375704661.db2.gz	LUSOUEAECNPUAT-UHFFFAOYSA-N	1	0	270.398	1.650	50	0		CDAARO
CCc1c(C)nc(NC[C@@H]2CCC[NH2+]C2)[nH]c1=O	ZINC000057329940	375817204	/nfs/dbraw/zinc/81/72/04/375817204.db2.gz	ZGFVDNKDOBPABT-SNVBAGLBSA-N	1	0	250.346	1.052	50	0		CDAARO
CCOCC[N@@H+]1CCN(Cc2cscn2)C[C@H]1C	ZINC000241587986	376019013	/nfs/dbraw/zinc/01/90/13/376019013.db2.gz	OYTHVJJKJFANRU-GFCCVEGCSA-N	1	0	269.414	1.686	50	0		CDAARO
CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1Cc1cn2cccnc2n1	ZINC000246018084	376357317	/nfs/dbraw/zinc/35/73/17/376357317.db2.gz	LDIOZIFBJUHSOX-CABCVRRESA-N	1	0	285.395	1.788	50	0		CDAARO
C[C@@H]1Cc2ccccc2N1CCNC(=O)[C@@H]1CC[C@H]([NH3+])C1	ZINC000263258885	190067404	/nfs/dbraw/zinc/06/74/04/190067404.db2.gz	LPYHWIFDPIVHDG-YUELXQCFSA-N	1	0	287.407	1.681	50	0		CDAARO
CCCC(=O)N1CCC(C[N@@H+]2CCN(C)C[C@H]2C)CC1	ZINC000244983820	377819809	/nfs/dbraw/zinc/81/98/09/377819809.db2.gz	ISKUVCPRIBJFFV-CQSZACIVSA-N	1	0	281.444	1.661	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCNC(=O)c2cccc(=O)[nH]2)C[C@H](C)O1	ZINC000278632853	194077250	/nfs/dbraw/zinc/07/72/50/194077250.db2.gz	NHDAFKSFAMYBNQ-TXEJJXNPSA-N	1	0	293.367	1.016	50	0		CDAARO
CC[C@@H](C)[NH2+]C[C@@H](O)COCCOc1ccc(F)cc1	ZINC000041690318	184553360	/nfs/dbraw/zinc/55/33/60/184553360.db2.gz	DMADYEFBULAUGA-TZMCWYRMSA-N	1	0	285.359	1.970	50	0		CDAARO
COc1ccccc1/C=C\C(=O)N1CCC[C@H]1C[NH3+]	ZINC000493086393	253365748	/nfs/dbraw/zinc/36/57/48/253365748.db2.gz	OHPILIUEELZXPA-YXVBKTCISA-N	1	0	260.337	1.658	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)/C=C\c2cncc(F)c2)C1	ZINC000493349952	253436821	/nfs/dbraw/zinc/43/68/21/253436821.db2.gz	INFWCISPKLFKMX-ZFDPJTLLSA-N	1	0	277.343	1.692	50	0		CDAARO
CC(C)C[C@@H](C[NH3+])NS(=O)(=O)c1ccc(F)cc1	ZINC000095394024	184965448	/nfs/dbraw/zinc/96/54/48/184965448.db2.gz	FDRNHRYULKUPBS-NSHDSACASA-N	1	0	274.361	1.477	50	0		CDAARO
CCn1nc(C(=O)NC)c2c1CC[C@@H]([NH2+]CC(C)C)C2	ZINC000014538979	390212549	/nfs/dbraw/zinc/21/25/49/390212549.db2.gz	VODKPHKQNVTKPF-LLVKDONJSA-N	1	0	278.400	1.366	50	0		CDAARO
Fc1ccccc1OCCCCN1CC[NH2+]CC1	ZINC000020272188	390231725	/nfs/dbraw/zinc/23/17/25/390231725.db2.gz	NKXLVVWJBGREPH-UHFFFAOYSA-N	1	0	252.333	1.890	50	0		CDAARO
CN(C(=O)[C@H]1Cc2ccccc2C[NH2+]1)C1CCOCC1	ZINC000036321004	390410414	/nfs/dbraw/zinc/41/04/14/390410414.db2.gz	CFPMOSPBCKACOO-OAHLLOKOSA-N	1	0	274.364	1.338	50	0		CDAARO
Cc1cccc(NC2CC[NH+](CCOCCO)CC2)c1	ZINC000096421209	390514311	/nfs/dbraw/zinc/51/43/11/390514311.db2.gz	SXWRFXLLIWNPKX-UHFFFAOYSA-N	1	0	278.396	1.880	50	0		CDAARO
CCC(CC)(CO)[NH2+]CC(=O)N1CCCCCCC1	ZINC000096424679	390516001	/nfs/dbraw/zinc/51/60/01/390516001.db2.gz	CLHPFWNUQWDKBO-UHFFFAOYSA-N	1	0	270.417	1.920	50	0		CDAARO
C[C@@H]1C[NH2+]C[C@H](C)N1Cc1ccc(-n2cncn2)cc1	ZINC000097095577	390676607	/nfs/dbraw/zinc/67/66/07/390676607.db2.gz	HJXAZNUEGUXJOV-BETUJISGSA-N	1	0	271.368	1.450	50	0		CDAARO
Cc1cc(NC[C@H](O)CO)c2cc(F)ccc2[nH+]1	ZINC000097103085	390791372	/nfs/dbraw/zinc/79/13/72/390791372.db2.gz	RKNLYZXLCAYPLF-JTQLQIEISA-N	1	0	250.273	1.447	50	0		CDAARO
C[N@@H+]1CC[C@H]2CN(Cc3cnc(N4CCCC4)s3)C[C@H]21	ZINC000215039678	390986574	/nfs/dbraw/zinc/98/65/74/390986574.db2.gz	PSDXACSOMHNJAT-GXTWGEPZSA-N	1	0	292.452	1.879	50	0		CDAARO
C[N@H+](Cc1ccccc1Cn1cccn1)[C@H]1COC[C@@H]1O	ZINC000216272975	391007191	/nfs/dbraw/zinc/00/71/91/391007191.db2.gz	WVDMATFUDVDXDU-HOTGVXAUSA-N	1	0	287.363	1.123	50	0		CDAARO
C[C@@H]([NH3+])C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000121582512	391480636	/nfs/dbraw/zinc/48/06/36/391480636.db2.gz	WQYINDSPEMMTEK-BNOWGMLFSA-N	1	0	262.353	1.448	50	0		CDAARO
C[C@H](O)C[NH+]1CCN(C/C=C\c2ccccc2)CC1	ZINC000096295233	393174883	/nfs/dbraw/zinc/17/48/83/393174883.db2.gz	UGZQUESJJNOEBQ-KKTNHOPESA-N	1	0	260.381	1.698	50	0		CDAARO
CCOC(=O)CCNC(=O)[C@H]1CCCC[N@@H+]1C(C)C	ZINC000096421689	393184816	/nfs/dbraw/zinc/18/48/16/393184816.db2.gz	BVYIPSIEESWEFK-GFCCVEGCSA-N	1	0	270.373	1.319	50	0		CDAARO
CCN1CC[NH+](C[C@H](C)CNc2ccccn2)CC1	ZINC000195575042	393305011	/nfs/dbraw/zinc/30/50/11/393305011.db2.gz	VIGKHYLIZMBJGH-CQSZACIVSA-N	1	0	262.401	1.767	50	0		CDAARO
[NH3+]CCN(CCc1ccccc1)C(=O)[C@H]1CCOC1	ZINC000261625035	140365429	/nfs/dbraw/zinc/36/54/29/140365429.db2.gz	ADORGRZGZRVJPF-AWEZNQCLSA-N	1	0	262.353	1.053	50	0		CDAARO
Cc1ccc(CC(=O)N2CCCC[C@@H]2[C@@H](C)[NH3+])cn1	ZINC000262749603	292091078	/nfs/dbraw/zinc/09/10/78/292091078.db2.gz	MCZSCKWEJQOHIS-TZMCWYRMSA-N	1	0	261.369	1.661	50	0		CDAARO
CCO[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCC[C@@H]2[NH3+])C1(C)C	ZINC000299738577	286328917	/nfs/dbraw/zinc/32/89/17/286328917.db2.gz	CIIPPJDFQMVVIA-ZDEQEGDKSA-N	1	0	268.401	1.776	50	0		CDAARO
Cc1ccc2cccc(C(=O)N3CC[NH2+]C[C@H]3C)c2n1	ZINC000124311959	292385447	/nfs/dbraw/zinc/38/54/47/292385447.db2.gz	AUDMZRDGJXLBJI-GFCCVEGCSA-N	1	0	269.348	1.977	50	0		CDAARO
N=c1n(CCO)c2ccccc2n1CC[NH+]1CCCCC1	ZINC000004794063	170018295	/nfs/dbraw/zinc/01/82/95/170018295.db2.gz	MJKQHDSLMAFJOR-UHFFFAOYSA-N	1	0	288.395	1.400	50	0		CDAARO
C[NH+](C)CCC(=O)NC[C@H]1OCCc2ccccc21	ZINC000004862871	170032274	/nfs/dbraw/zinc/03/22/74/170032274.db2.gz	MXWHFMIKSYRLDW-CQSZACIVSA-N	1	0	262.353	1.368	50	0		CDAARO
CC[NH+](CC)CCCN1C(=O)N[C@@H](C(C)C)C1=O	ZINC000005349131	170088699	/nfs/dbraw/zinc/08/86/99/170088699.db2.gz	NEVMEDXZZOWLCL-NSHDSACASA-N	1	0	255.362	1.295	50	0		CDAARO
Cn1nnnc1SCCC[NH2+]C/C=C/c1ccccc1	ZINC000007540464	170290162	/nfs/dbraw/zinc/29/01/62/170290162.db2.gz	ZPNBSWCRUOSNGT-WEVVVXLNSA-N	1	0	289.408	1.995	50	0		CDAARO
Cc1ccsc1C[NH2+]CCCSc1nnnn1C	ZINC000007541489	170290354	/nfs/dbraw/zinc/29/03/54/170290354.db2.gz	DRDKZWWFDNHWGR-UHFFFAOYSA-N	1	0	283.426	1.852	50	0		CDAARO
NS(=O)(=O)c1ccc(CC[NH2+]Cc2ccsc2)cc1	ZINC000019990586	170962238	/nfs/dbraw/zinc/96/22/38/170962238.db2.gz	BIVFOVRESLZBTM-UHFFFAOYSA-N	1	0	296.417	1.728	50	0		CDAARO
CC(C)[NH2+]Cc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000020188674	171053378	/nfs/dbraw/zinc/05/33/78/171053378.db2.gz	QBPGBCOCCJHPFG-UHFFFAOYSA-N	1	0	298.408	1.206	50	0		CDAARO
COc1cccc2[nH]c3c(ncn(CC[NH+](C)C)c3=O)c21	ZINC000020393651	171180791	/nfs/dbraw/zinc/18/07/91/171180791.db2.gz	QVYOIGWYZBRKKV-UHFFFAOYSA-N	1	0	286.335	1.448	50	0		CDAARO
O=C(NCC[N@H+]1CCC[C@H](O)C1)c1ccc2occc2c1	ZINC000020601136	171266812	/nfs/dbraw/zinc/26/68/12/171266812.db2.gz	XOEXGSTZZHHOLG-AWEZNQCLSA-N	1	0	288.347	1.619	50	0		CDAARO
O[C@H]1C[N@H+](C/C=C/c2ccccc2)C[C@@H]1N1CCOCC1	ZINC000020912420	171279230	/nfs/dbraw/zinc/27/92/30/171279230.db2.gz	BIXAVHORGRPACT-SFXFJHKKSA-N	1	0	288.391	1.077	50	0		CDAARO
O=C(C(=O)N1CCC[N@@H+]2CCC[C@H]2C1)c1ccco1	ZINC000020997919	171284048	/nfs/dbraw/zinc/28/40/48/171284048.db2.gz	ILXMOKGXHJJKTH-NSHDSACASA-N	1	0	262.309	1.159	50	0		CDAARO
CC[NH+]1CCN(Cc2cc(=O)n3c(C)csc3n2)CC1	ZINC000022786846	171398653	/nfs/dbraw/zinc/39/86/53/171398653.db2.gz	PPMORZSIXMHEFH-UHFFFAOYSA-N	1	0	292.408	1.202	50	0		CDAARO
O=S(=O)(NC[C@@H]1CCC[NH2+]C1)c1cc(F)ccc1F	ZINC000037377312	173166665	/nfs/dbraw/zinc/16/66/65/173166665.db2.gz	NOLINZNXEXIYQF-SECBINFHSA-N	1	0	290.335	1.243	50	0		CDAARO
CC(C)C[C@@H]([NH3+])C(=O)N(Cc1nccn1C)C1CC1	ZINC000037813980	173761922	/nfs/dbraw/zinc/76/19/22/173761922.db2.gz	SMSNMKWUHPHENS-GFCCVEGCSA-N	1	0	264.373	1.285	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CCc2nnc(N)s2)n1	ZINC000067819124	175795084	/nfs/dbraw/zinc/79/50/84/175795084.db2.gz	LVAOGPHVDIOSKA-VIFPVBQESA-N	1	0	280.401	1.154	50	0		CDAARO
c1cncc(NCC[NH2+]C2CSCCSC2)c1	ZINC000067883595	175799487	/nfs/dbraw/zinc/79/94/87/175799487.db2.gz	XHPAQKITQRWADS-UHFFFAOYSA-N	1	0	269.439	1.932	50	0		CDAARO
CCn1c(CC2CC[NH+](CC=C(C)C)CC2)n[nH]c1=O	ZINC000071708099	176248480	/nfs/dbraw/zinc/24/84/80/176248480.db2.gz	ABOYDWKLALKAMP-UHFFFAOYSA-N	1	0	278.400	1.812	50	0		CDAARO
Cc1cc(F)ccc1NC(=O)CNC(=O)[C@H]([NH3+])CC(C)C	ZINC000071747311	176258747	/nfs/dbraw/zinc/25/87/47/176258747.db2.gz	WFYIFYGFZBVHBE-GFCCVEGCSA-N	1	0	295.358	1.562	50	0		CDAARO
CC(=O)C(=O)N1C[C@H](c2ccccc2)[C@@H]2[C@H]1C1CC[NH+]2CC1	ZINC000071765510	176262088	/nfs/dbraw/zinc/26/20/88/176262088.db2.gz	UDBGYTCGDFPGFF-BRWVUGGUSA-N	1	0	298.386	1.664	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1CCCn1ccnc1-c1ncc[nH]1	ZINC000072134637	176322366	/nfs/dbraw/zinc/32/23/66/176322366.db2.gz	QEEGGSDWIVQSGO-CYBMUJFWSA-N	1	0	289.383	1.510	50	0		CDAARO
CC(C)c1cncnc1NC[C@@H]1COCC[N@H+](C)C1	ZINC000072144677	176324003	/nfs/dbraw/zinc/32/40/03/176324003.db2.gz	NRVWZSRZNCNULC-LBPRGKRZSA-N	1	0	264.373	1.590	50	0		CDAARO
CSCCN(C)c1nc(N(C)C)nc2c1CC[NH2+]CC2	ZINC000072409085	176398422	/nfs/dbraw/zinc/39/84/22/176398422.db2.gz	MMASMMRAYYQHRK-UHFFFAOYSA-N	1	0	295.456	1.030	50	0		CDAARO
C[N@@H+]1CC[C@H]2CN(C(=O)c3cccc(-c4ncc[nH]4)c3)C[C@H]21	ZINC000077503847	177276143	/nfs/dbraw/zinc/27/61/43/177276143.db2.gz	VFHWNFYMFUYPJU-LSDHHAIUSA-N	1	0	296.374	1.853	50	0		CDAARO
Cc1nc[nH]c1CN1CCC[C@](O)(C[NH+]2CCCC2)C1	ZINC000077505878	177276238	/nfs/dbraw/zinc/27/62/38/177276238.db2.gz	VYZKZZACHREVBV-HNNXBMFYSA-N	1	0	278.400	1.141	50	0		CDAARO
C[NH+]1CCN(c2ncnc3sc4c(c32)CCC4)CC1	ZINC000006490436	273901574	/nfs/dbraw/zinc/90/15/74/273901574.db2.gz	RKMRYTBPIZGPQR-UHFFFAOYSA-N	1	0	274.393	1.932	50	0		CDAARO
O=C(c1n[nH]c2c1C[NH2+]CC2)N1CCc2ccccc21	ZINC000042783812	275010234	/nfs/dbraw/zinc/01/02/34/275010234.db2.gz	VWUCJVOOGVRJFZ-UHFFFAOYSA-N	1	0	268.320	1.258	50	0		CDAARO
CC1=C[C@H](C)[C@H]2C(=O)N(c3ccc[n+](C)c3)C(=O)[C@H]2C1	ZINC000085859288	276186262	/nfs/dbraw/zinc/18/62/62/276186262.db2.gz	UYHYCNHHAGZKQZ-FPMFFAJLSA-N	1	0	271.340	1.603	50	0		CDAARO
CN1C(=O)/C(=C\C=C2/CCC[N@@H+]2C)N(C)C1=S	ZINC000004747169	277005622	/nfs/dbraw/zinc/00/56/22/277005622.db2.gz	SXRPCRZFBUCPSR-KZZDLZNXSA-N	1	0	251.355	1.169	50	0		CDAARO
CN1CC[NH+](C[C@H]2CCCN(C(=O)c3cc[nH]c3)C2)CC1	ZINC000221299157	277108336	/nfs/dbraw/zinc/10/83/36/277108336.db2.gz	WPYWKHZBPADYHS-CQSZACIVSA-N	1	0	290.411	1.114	50	0		CDAARO
CNc1cc(C)[nH+]c(N2[C@@H]3CC[C@H]2CN(C)C(=O)C3)n1	ZINC000067692628	277301965	/nfs/dbraw/zinc/30/19/65/277301965.db2.gz	PGTLTUSDWKAGCJ-MNOVXSKESA-N	1	0	275.356	1.026	50	0		CDAARO
CC(C)N1CC[C@H](N2CC[NH+]([C@@H]3CCSC3)CC2)C1=O	ZINC000095413184	277627496	/nfs/dbraw/zinc/62/74/96/277627496.db2.gz	UEFYFJSKNHXYFR-KGLIPLIRSA-N	1	0	297.468	1.119	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccc(F)c(F)c2F)C[C@H](C)[NH2+]1	ZINC000094185058	288031213	/nfs/dbraw/zinc/03/12/13/288031213.db2.gz	CUSQYVZFUGHEKB-OCAPTIKFSA-N	1	0	272.270	1.926	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCCN1C(=O)c1ccc2nccn2c1	ZINC000262758824	278312730	/nfs/dbraw/zinc/31/27/30/278312730.db2.gz	PVXXYQHDFPBGBJ-YPMHNXCESA-N	1	0	272.352	1.676	50	0		CDAARO
CC(C)(C)c1ncc(S(C)(=O)=O)c([C@@H]2CCC[NH2+]C2)n1	ZINC000071752119	278572702	/nfs/dbraw/zinc/57/27/02/278572702.db2.gz	AYCCPJDWCUXMLE-SNVBAGLBSA-N	1	0	297.424	1.645	50	0		CDAARO
CCS(=O)(=O)N1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1	ZINC000004746105	280015322	/nfs/dbraw/zinc/01/53/22/280015322.db2.gz	OBHKVFLZCBWBCG-CHWSQXEVSA-N	1	0	274.430	1.532	50	0		CDAARO
C[NH+](C)Cc1cccc(CNC(=O)c2cn[nH]c2)c1	ZINC000194180994	280027079	/nfs/dbraw/zinc/02/70/79/280027079.db2.gz	ZGHXPRLGSLQFSH-UHFFFAOYSA-N	1	0	258.325	1.401	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)/C=C\c1ccc2c(c1)CCO2	ZINC000255115288	289356731	/nfs/dbraw/zinc/35/67/31/289356731.db2.gz	ORMDJUHGLYAKOR-KTLBGCOUSA-N	1	0	272.348	1.455	50	0		CDAARO
Cc1ncc(C(=O)N(C)[C@H]2CC[NH2+]C2)c(C(C)C)n1	ZINC000179114782	293566545	/nfs/dbraw/zinc/56/65/45/293566545.db2.gz	DZEDVMBEONTSML-NSHDSACASA-N	1	0	262.357	1.342	50	0		CDAARO
C[C@H]1CN(C(=O)CO[C@H]2CCCC[C@H]2C)C[C@@H]1[NH+](C)C	ZINC000257366305	300130049	/nfs/dbraw/zinc/13/00/49/300130049.db2.gz	RBMNHFVUIRYNRT-QPSCCSFWSA-N	1	0	282.428	1.990	50	0		CDAARO
Cc1ccccc1[C@H](CN1CCOCC1)[NH2+][C@H](C)CO	ZINC000183397010	302185405	/nfs/dbraw/zinc/18/54/05/302185405.db2.gz	XIRSHNFBPJCKQA-ZBFHGGJFSA-N	1	0	278.396	1.339	50	0		CDAARO
C1CC1c1nc(N2CCCC3(CC[NH2+]CC3)C2)no1	ZINC000534582471	328312340	/nfs/dbraw/zinc/31/23/40/328312340.db2.gz	XLOPLXQKLZYUTR-UHFFFAOYSA-N	1	0	262.357	1.917	50	0		CDAARO
CO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)Cn1ccc2ccccc21	ZINC000534587397	328316077	/nfs/dbraw/zinc/31/60/77/328316077.db2.gz	UKQZOPXVSSUEPT-ZFWWWQNUSA-N	1	0	287.363	1.087	50	0		CDAARO
CC[N@H+](C)C1(CNC(=O)C[C@@H]2CCOC2)CCCC1	ZINC000534631011	328331431	/nfs/dbraw/zinc/33/14/31/328331431.db2.gz	ALNJVDQFRRVYRA-ZDUSSCGKSA-N	1	0	268.401	1.794	50	0		CDAARO
Cc1cc(C(N)=O)c(N2CCC[C@]3(CC[NH2+]C3)C2)nc1C	ZINC000534632450	328332018	/nfs/dbraw/zinc/33/20/18/328332018.db2.gz	AUOFLRKQJDHMCF-MRXNPFEDSA-N	1	0	288.395	1.377	50	0		CDAARO
CC(=O)NC(C)(C)C[C@H](C)[NH2+]Cc1cccc(CO)c1	ZINC000534635476	328333557	/nfs/dbraw/zinc/33/35/57/328333557.db2.gz	CBNRUGABMBXJSS-LBPRGKRZSA-N	1	0	278.396	1.962	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]CC1(COC)CC1	ZINC000534648391	328343379	/nfs/dbraw/zinc/34/33/79/328343379.db2.gz	LLRVMUAEWNTBNK-GFCCVEGCSA-N	1	0	251.374	1.850	50	0		CDAARO
COc1cc2c(cc1OC)CN(C(=O)[C@@H]1C=CC[NH2+]1)CC2	ZINC000534655922	328339685	/nfs/dbraw/zinc/33/96/85/328339685.db2.gz	SSEBTVFZOPWRIM-ZDUSSCGKSA-N	1	0	288.347	1.117	50	0		CDAARO
CCS(=O)(=O)NC[C@H](C)[NH2+]C1(Cc2ccccc2)CC1	ZINC000534663389	328351087	/nfs/dbraw/zinc/35/10/87/328351087.db2.gz	WZMLXZGRLZWSAK-ZDUSSCGKSA-N	1	0	296.436	1.679	50	0		CDAARO
CCn1ccnc1C[NH2+]C[C@@H]1CCCn2ccnc21	ZINC000083843633	323207296	/nfs/dbraw/zinc/20/72/96/323207296.db2.gz	LGOCWKVHEQELPQ-LBPRGKRZSA-N	1	0	259.357	1.767	50	0		CDAARO
C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]CCCN1C(=O)CNC1=O	ZINC000097099876	323207407	/nfs/dbraw/zinc/20/74/07/323207407.db2.gz	RXEPNIIWWBYGJN-RYUDHWBXSA-N	1	0	281.400	1.733	50	0		CDAARO
CCCCCCN1CC2(CCN(C(=O)C[NH3+])CC2)OC1=O	ZINC000077422104	327132296	/nfs/dbraw/zinc/13/22/96/327132296.db2.gz	UJDQLKMONQUOFA-UHFFFAOYSA-N	1	0	297.399	1.339	50	0		CDAARO
CC(C)C[N@@H+]1CCCC[C@H]1CCNc1nnc(CN)o1	ZINC001772710007	1159444216	/nfs/dbraw/zinc/44/42/16/1159444216.db2.gz	UCTYVCNECHWMMF-LBPRGKRZSA-N	1	0	281.404	1.841	50	0		CDAARO
C[NH+](C)[C@H]1CCCCN(c2ncnc3nc[nH]c32)C1	ZINC000082134971	482763596	/nfs/dbraw/zinc/76/35/96/482763596.db2.gz	VPGUSFDYTOJTEP-JTQLQIEISA-N	1	0	260.345	1.273	50	0		CDAARO
O=C1CC[C@H]([N@@H+]2CCOc3ccccc3C2)CCN1	ZINC000670444372	482991149	/nfs/dbraw/zinc/99/11/49/482991149.db2.gz	CIVQMMLKMNSZEA-ZDUSSCGKSA-N	1	0	260.337	1.550	50	0		CDAARO
CC(C)(C(=O)NCCC[N@@H+]1CCC[C@@H](O)C1)n1cccc1	ZINC000670467087	483057654	/nfs/dbraw/zinc/05/76/54/483057654.db2.gz	NIGOFMMDXGJMJU-CQSZACIVSA-N	1	0	293.411	1.186	50	0		CDAARO
CC[NH+]1CCC(CC(=O)NCCC2(O)CCCC2)CC1	ZINC000670467969	483060235	/nfs/dbraw/zinc/06/02/35/483060235.db2.gz	IBSSGIIBLKYNAY-UHFFFAOYSA-N	1	0	282.428	1.920	50	0		CDAARO
C[N@H+](CCN1CCCC1=O)CC1(CO)CCCC1	ZINC000670472302	483080559	/nfs/dbraw/zinc/08/05/59/483080559.db2.gz	KNKVYRNMULIEHH-UHFFFAOYSA-N	1	0	254.374	1.093	50	0		CDAARO
COCCCC[NH+]1CCN(c2cc(C3CC3)ncn2)CC1	ZINC000670473108	483082434	/nfs/dbraw/zinc/08/24/34/483082434.db2.gz	DCTCYVCPRRCPJW-UHFFFAOYSA-N	1	0	290.411	1.903	50	0		CDAARO
Cc1cc([C@@H]2CCCN(C(=O)[C@@H]3CCCC[N@H+]3C)C2)[nH]n1	ZINC000084110270	483246935	/nfs/dbraw/zinc/24/69/35/483246935.db2.gz	GWOYZULSCDQUQW-HIFRSBDPSA-N	1	0	290.411	1.908	50	0		CDAARO
CC[C@@H]1C[N@H+](CC2(O)CCCCC2)CCN1C[C@@H](C)O	ZINC000084736466	483321436	/nfs/dbraw/zinc/32/14/36/483321436.db2.gz	VAUXIGXURRWGEN-HUUCEWRRSA-N	1	0	284.444	1.459	50	0		CDAARO
c1[nH]c2nccnc2c1C[NH2+][C@H]1CCO[C@@H]1c1cccnc1	ZINC000291642243	534463262	/nfs/dbraw/zinc/46/32/62/534463262.db2.gz	TWNIIOOGPUYCML-DZGCQCFKSA-N	1	0	295.346	1.973	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]CC(=O)NCc1ccco1	ZINC000097159279	567904813	/nfs/dbraw/zinc/90/48/13/567904813.db2.gz	HFDDEXHTPKKOOF-UHFFFAOYSA-N	1	0	262.313	1.026	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]Cc1ccc(-n2ccnc2)nc1	ZINC000097159291	567904982	/nfs/dbraw/zinc/90/49/82/567904982.db2.gz	LGZGUOTUVUSZNN-UHFFFAOYSA-N	1	0	268.324	1.589	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@H]([NH3+])c2ccsc2)C1	ZINC000958527928	613973330	/nfs/dbraw/zinc/97/33/30/613973330.db2.gz	ISVWFFOJCILFDC-SNVBAGLBSA-N	1	0	284.381	1.730	50	0		CDAARO
CC(C)(C)OC(=O)NCC[NH2+][C@@H]1C[C@@H]2COC[C@H]12	ZINC000952993328	613989082	/nfs/dbraw/zinc/98/90/82/613989082.db2.gz	GHCUJBYPENZDMX-OUAUKWLOSA-N	1	0	256.346	1.136	50	0		CDAARO
CC(C)[C@H]([NH3+])[C@]1(O)CCCN(C(=O)OC(C)(C)C)C1	ZINC000958528199	614228623	/nfs/dbraw/zinc/22/86/23/614228623.db2.gz	NWVYDGZVAUNTTK-FZMZJTMJSA-N	1	0	272.389	1.732	50	0		CDAARO
C[C@@H]1[C@H]2CCC[N@@H+]2CCN1CC(C)(C)CN1CCOCC1	ZINC000032565181	688359431	/nfs/dbraw/zinc/35/94/31/688359431.db2.gz	QATOXTAWNQLKAG-HZPDHXFCSA-N	1	0	295.471	1.513	50	0		CDAARO
Cc1nc[nH]c1CSCCNC(=O)[C@@H](C)[NH+](C)C	ZINC000426551744	688490154	/nfs/dbraw/zinc/49/01/54/688490154.db2.gz	CZWULQVBKLTIQG-SNVBAGLBSA-N	1	0	270.402	1.018	50	0		CDAARO
OCCNc1ccc(-c2cccc3c2CC[NH2+]C3)nn1	ZINC000071419201	688789868	/nfs/dbraw/zinc/78/98/68/688789868.db2.gz	AASPJJFGXPSMLH-UHFFFAOYSA-N	1	0	270.336	1.194	50	0		CDAARO
c1cc(C[NH2+][C@@H]2CCCN(c3ncccn3)C2)co1	ZINC000012705350	692583588	/nfs/dbraw/zinc/58/35/88/692583588.db2.gz	JIRGDOKGEWRMID-CYBMUJFWSA-N	1	0	258.325	1.828	50	0		CDAARO
[NH3+][C@@H](c1ccsc1)C1(O)C[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000958528227	694641999	/nfs/dbraw/zinc/64/19/99/694641999.db2.gz	OWVUDIFGWLPAJX-PSIUFMSWSA-N	1	0	287.406	1.219	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2c(OC)cccc2OC)C[C@@H]1[NH3+]	ZINC000091908027	694636968	/nfs/dbraw/zinc/63/69/68/694636968.db2.gz	YAHYEQPNJCDOQM-RYUDHWBXSA-N	1	0	292.379	1.903	50	0		CDAARO
O=C1COC[C@@H]2C[NH2+]CC[C@H]2N1Cc1ccccc1	ZINC000306591084	694712289	/nfs/dbraw/zinc/71/22/89/694712289.db2.gz	VIDQLCPBPXTUGA-UONOGXRCSA-N	1	0	260.337	1.024	50	0		CDAARO
CCCCN(Cc1cccnc1)C(=O)[C@H]1C=CC[NH2+]1	ZINC000952977985	694717475	/nfs/dbraw/zinc/71/74/75/694717475.db2.gz	ALOMIPPWPLVUCP-CQSZACIVSA-N	1	0	259.353	1.738	50	0		CDAARO
C[C@@H]1C[N@H+](Cc2ccc(-n3ccnc3)nc2)C[C@H]1CO	ZINC000191731354	695101046	/nfs/dbraw/zinc/10/10/46/695101046.db2.gz	HLGXJATWKZFPPS-OCCSQVGLSA-N	1	0	272.352	1.328	50	0		CDAARO
CS(=O)(=O)N[C@H]1CC[N@H+](Cc2coc3ccccc23)C1	ZINC000093530908	695170440	/nfs/dbraw/zinc/17/04/40/695170440.db2.gz	WJBHSVHRTOQZEJ-LBPRGKRZSA-N	1	0	294.376	1.556	50	0		CDAARO
CNC(=O)c1cccnc1N[C@@H]1CCC[C@H]1[NH+](C)C	ZINC001704302904	1177679841	/nfs/dbraw/zinc/67/98/41/1177679841.db2.gz	DCBWWVNZUZKFIP-VXGBXAGGSA-N	1	0	262.357	1.336	50	0		CDAARO
C[N@@H+]1CCCN(CCc2nc(-c3ccsc3)no2)CC1	ZINC000032576263	723419667	/nfs/dbraw/zinc/41/96/67/723419667.db2.gz	RBUOKCFQSLSGPB-UHFFFAOYSA-N	1	0	292.408	1.978	50	0		CDAARO
CC(C)(C(=O)N[C@@H]1CCc2c[nH]nc2C1)[NH+]1CCCC1	ZINC000426517542	723481344	/nfs/dbraw/zinc/48/13/44/723481344.db2.gz	GOWYNXRBKWRACS-GFCCVEGCSA-N	1	0	276.384	1.258	50	0		CDAARO
C[C@H]1C[N@H+](C)[C@@H](C)CN1c1cc(Cl)nc(N)n1	ZINC000108368352	719145132	/nfs/dbraw/zinc/14/51/32/719145132.db2.gz	AUBAJSJDJICIOF-YUMQZZPRSA-N	1	0	255.753	1.241	50	0		CDAARO
Cc1nccn1CCC[NH+]1CCC2(CC1)OCCC[C@H]2O	ZINC000299777967	900264749	/nfs/dbraw/zinc/26/47/49/900264749.db2.gz	CVUQGOPCPWLDQU-OAHLLOKOSA-N	1	0	293.411	1.588	50	0		CDAARO
Cc1cc(F)cc(C[N@@H+]2CC[C@@H](O)[C@@H](CO)C2)c1	ZINC001143580447	905119901	/nfs/dbraw/zinc/11/99/01/905119901.db2.gz	KIKRCVPCLDXAGK-TZMCWYRMSA-N	1	0	253.317	1.309	50	0		CDAARO
Cc1cnc(C[NH2+]C2CSCCSC2)cn1	ZINC000952963090	910475185	/nfs/dbraw/zinc/47/51/85/910475185.db2.gz	FPCPVEJKWZCLRK-UHFFFAOYSA-N	1	0	255.412	1.723	50	0		CDAARO
CC(C)Nc1cc(N2CC[C@@]3(C2)CCC[NH2+]C3)ncn1	ZINC000067885141	936620389	/nfs/dbraw/zinc/62/03/89/936620389.db2.gz	WPDRMEDVEGLHMG-HNNXBMFYSA-N	1	0	275.400	1.877	50	0		CDAARO
C[NH+](C)CC1(O)CCN(c2ncnc3ccsc32)CC1	ZINC000710642651	923257517	/nfs/dbraw/zinc/25/75/17/923257517.db2.gz	PXMLOSYPMFVJSS-UHFFFAOYSA-N	1	0	292.408	1.584	50	0		CDAARO
CCn1nc(-c2ccco2)nc1C[C@@H](C)N1CCOCC1	ZINC000823600813	925708198	/nfs/dbraw/zinc/70/81/98/925708198.db2.gz	XQYAMMBVTPBBOY-GFCCVEGCSA-N	1	0	290.367	1.821	50	0		CDAARO
Cc1nonc1CN1CCCN(c2cc[nH+]cc2)CC1	ZINC000585089989	930920024	/nfs/dbraw/zinc/92/00/24/930920024.db2.gz	WVTGMKGFSZBLQB-UHFFFAOYSA-N	1	0	273.340	1.485	50	0		CDAARO
COC(=O)[C@H](CC(C)C)NC(=O)C[NH2+]C1CCCCC1	ZINC000585116546	930967746	/nfs/dbraw/zinc/96/77/46/930967746.db2.gz	AIEIITCOJVRIID-ZDUSSCGKSA-N	1	0	284.400	1.613	50	0		CDAARO
O=C(NCc1nccs1)[C@@H]1CC[C@H]2CCCC[N@@H+]21	ZINC000585122139	930988564	/nfs/dbraw/zinc/98/85/64/930988564.db2.gz	OMFJSSWRPHVFCR-MNOVXSKESA-N	1	0	265.382	1.776	50	0		CDAARO
O=C(NC1(CO)CCSCC1)[C@H]1CC[C@@H]2CCCC[N@H+]12	ZINC000585122213	930989013	/nfs/dbraw/zinc/98/90/13/930989013.db2.gz	QWNZUBFGTWXJAR-QWHCGFSZSA-N	1	0	298.452	1.378	50	0		CDAARO
CCCCCOCC(=O)N1CC[C@@H]([NH+]2CCC2)C1	ZINC000585127927	931010617	/nfs/dbraw/zinc/01/06/17/931010617.db2.gz	MXPCXUXXMSHFGZ-CYBMUJFWSA-N	1	0	254.374	1.500	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@H]1C(=O)N[C@H]1CC[C@@H](CO)CC1	ZINC000585132260	931025917	/nfs/dbraw/zinc/02/59/17/931025917.db2.gz	RMVQFHAEKQRYIB-XQQFMLRXSA-N	1	0	268.401	1.527	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1C(=O)/C=C/c1nccs1	ZINC000089937797	934812709	/nfs/dbraw/zinc/81/27/09/934812709.db2.gz	YKZFLZQIXRUOKJ-FSIBCCDJSA-N	1	0	251.355	1.319	50	0		CDAARO
COc1ccc(C(=O)N(C)C[C@@H]2CCCC[N@@H+]2C)o1	ZINC000019840677	935722204	/nfs/dbraw/zinc/72/22/04/935722204.db2.gz	MMYXTTWXVFCTAG-NSHDSACASA-N	1	0	266.341	1.845	50	0		CDAARO
Cc1nn(C)cc1NC(=O)C[N@H+](C)C1CCCC1	ZINC001506398105	975147978	/nfs/dbraw/zinc/14/79/78/975147978.db2.gz	LNNGJOLRJSZJRU-UHFFFAOYSA-N	1	0	250.346	1.541	50	0		CDAARO
CCc1nn(C)c(NC(=O)[C@H]2CCC[N@H+](C)C2)c1CC	ZINC001506400271	975149088	/nfs/dbraw/zinc/14/90/88/975149088.db2.gz	CKMQJYALXPPLBX-NSHDSACASA-N	1	0	278.400	1.825	50	0		CDAARO
Cc1nc(N)nc(N2CC[C@H](C[NH+](C)C)C2)c1Cl	ZINC001506406776	975151669	/nfs/dbraw/zinc/15/16/69/975151669.db2.gz	RQQLXLHNWUAELH-SECBINFHSA-N	1	0	269.780	1.409	50	0		CDAARO
Cc1cccc(NC(=O)CC(=O)N[C@@H]2CC[C@@H]([NH3+])C2)c1	ZINC001506416565	975155851	/nfs/dbraw/zinc/15/58/51/975155851.db2.gz	CKNNSKFKWVEOSE-DGCLKSJQSA-N	1	0	275.352	1.320	50	0		CDAARO
Cc1ccn2c(nnc2NC(=O)C[NH+]2CCCCCC2)n1	ZINC001506423861	975159310	/nfs/dbraw/zinc/15/93/10/975159310.db2.gz	YCJYVTQTRCKFNR-UHFFFAOYSA-N	1	0	288.355	1.247	50	0		CDAARO
Cc1nnc(CCNC(=O)C2CC[NH+](C(C)C)CC2)s1	ZINC000095504242	185000809	/nfs/dbraw/zinc/00/08/09/185000809.db2.gz	YFQRMVSLGPZXFY-UHFFFAOYSA-N	1	0	296.440	1.626	50	0		CDAARO
C[C@@H](CCN=c1[nH]ccs1)[NH+]1CCN(C)CC1	ZINC000584902515	341987031	/nfs/dbraw/zinc/98/70/31/341987031.db2.gz	BQYKJDRLFDYXPC-NSHDSACASA-N	1	0	254.403	1.003	50	0		CDAARO
COc1cccn(C[C@H]2CC[N@@H+](C(C)C)C2)c1=O	ZINC000095529115	185004690	/nfs/dbraw/zinc/00/46/90/185004690.db2.gz	PLYYYMFIMWNHDP-LBPRGKRZSA-N	1	0	250.342	1.587	50	0		CDAARO
CCC[N@@H+]1CCCC[C@H]1C(=O)N[C@@H]1C=C[C@H](CO)C1	ZINC000095976850	185050751	/nfs/dbraw/zinc/05/07/51/185050751.db2.gz	LNWQJKFLYSDRLQ-MJBXVCDLSA-N	1	0	266.385	1.304	50	0		CDAARO
C[C@H]([NH2+]CC(=O)N1CCC[C@H](C)C1)C1CCOCC1	ZINC000095985397	185055679	/nfs/dbraw/zinc/05/56/79/185055679.db2.gz	YYRTWGYDLFDMRU-STQMWFEESA-N	1	0	268.401	1.650	50	0		CDAARO
CCc1ccc(S(=O)(=O)N[C@@H]2CC[NH2+]C2)cc1CC	ZINC000095996586	185061310	/nfs/dbraw/zinc/06/13/10/185061310.db2.gz	SFAYMHDYICNREW-CYBMUJFWSA-N	1	0	282.409	1.452	50	0		CDAARO
Cc1cnc(C[NH2+][C@@H]2CCC[C@H](S(C)(=O)=O)C2)s1	ZINC000241121711	361750848	/nfs/dbraw/zinc/75/08/48/361750848.db2.gz	JDJDJMXLVRVYAV-MNOVXSKESA-N	1	0	288.438	1.897	50	0		CDAARO
CC1CCC(O)(CN2CC[S@@](=O)C(C)(C)C2)CC1	ZINC000088615956	539087389	/nfs/dbraw/zinc/08/73/89/539087389.db2.gz	LPMIOXVQAQUDIG-WFZFXDGQSA-N	1	0	273.442	1.771	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)N[C@H](CO)C1CCCCC1	ZINC000386213232	342090062	/nfs/dbraw/zinc/09/00/62/342090062.db2.gz	HHXORVLWBKYDGP-CQSZACIVSA-N	1	0	268.401	1.434	50	0		CDAARO
[NH3+][C@H](C(=O)N1CC[C@H](Oc2cccnc2)C1)c1ccccc1	ZINC000195554354	342625974	/nfs/dbraw/zinc/62/59/74/342625974.db2.gz	KGKJWSXOONSLGA-HOTGVXAUSA-N	1	0	297.358	1.761	50	0		CDAARO
O=C(C1CC[NH2+]CC1)N1CC(Oc2ccccc2Cl)C1	ZINC000195554766	342626137	/nfs/dbraw/zinc/62/61/37/342626137.db2.gz	CNMSVBRXISRGQQ-UHFFFAOYSA-N	1	0	294.782	1.929	50	0		CDAARO
CCc1nnc(C[N@H+](CC)CC2CCOCC2)[nH]1	ZINC000244601997	361853158	/nfs/dbraw/zinc/85/31/58/361853158.db2.gz	DVWBDFKCFXUFGX-UHFFFAOYSA-N	1	0	252.362	1.616	50	0		CDAARO
CCc1nc2c(s1)[C@@H]([NH2+][C@@H]1CCCNC1=O)CCC2	ZINC000095967543	539088153	/nfs/dbraw/zinc/08/81/53/539088153.db2.gz	QSNUHXOQZRKHBP-GXSJLCMTSA-N	1	0	279.409	1.951	50	0		CDAARO
C[N@H+](CC(N)=O)Cc1ccc2c3c1cccc3C(=O)OC2	ZINC000244794888	361863435	/nfs/dbraw/zinc/86/34/35/361863435.db2.gz	QVRBZZQLHWPAGZ-UHFFFAOYSA-N	1	0	284.315	1.427	50	0		CDAARO
Cn1ccnc1CCNC(=O)[C@@H]1CCC[N@@H+]2CCCC[C@H]12	ZINC000244873070	361866485	/nfs/dbraw/zinc/86/64/85/361866485.db2.gz	WJNZECWVYANNOZ-ZIAGYGMSSA-N	1	0	290.411	1.343	50	0		CDAARO
CS[C@H](C)CNC(=O)C[C@H](C)C1CC[NH2+]CC1	ZINC000125432008	187184921	/nfs/dbraw/zinc/18/49/21/187184921.db2.gz	ZPGCZKZWHYQHIT-WDEREUQCSA-N	1	0	258.431	1.880	50	0		CDAARO
C[C@H]1C[N@H+](C)C[C@H]1NS(=O)(=O)Cc1ccc(F)cc1	ZINC000257366125	539096200	/nfs/dbraw/zinc/09/62/00/539096200.db2.gz	KOLRNSALKIOEPA-GXFFZTMASA-N	1	0	286.372	1.195	50	0		CDAARO
C[C@H]1CN(C(=O)C2CC2)CC[C@H]1[NH2+]Cc1ccccn1	ZINC000084714963	342267929	/nfs/dbraw/zinc/26/79/29/342267929.db2.gz	NMODUOCAYMNJCQ-SWLSCSKDSA-N	1	0	273.380	1.818	50	0		CDAARO
O=C(Nc1ccccc1-n1cccn1)[C@@H]1CCC[NH2+]1	ZINC000037026650	539141809	/nfs/dbraw/zinc/14/18/09/539141809.db2.gz	NNESVKFDNJYKNI-LBPRGKRZSA-N	1	0	256.309	1.563	50	0		CDAARO
Cc1cccc(C(=O)NCCCN2CC[NH2+]CC2)c1F	ZINC000125831286	187201892	/nfs/dbraw/zinc/20/18/92/187201892.db2.gz	VGFYRQPYLUYQKP-UHFFFAOYSA-N	1	0	279.359	1.159	50	0		CDAARO
Cc1cnn(-c2ccc(C(=O)N3CC[C@@H](C[NH3+])C3)cc2)c1	ZINC000178540775	362245654	/nfs/dbraw/zinc/24/56/54/362245654.db2.gz	LBRLPZRDEHYEMZ-ZDUSSCGKSA-N	1	0	284.363	1.602	50	0		CDAARO
COC[C@H]1CCCC[N@H+](CCN2CCO[C@H](C)C2)C1	ZINC000253397227	293195066	/nfs/dbraw/zinc/19/50/66/293195066.db2.gz	LRMVODRVXHRKCK-CABCVRRESA-N	1	0	270.417	1.456	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cccc3c2OCO3)C1	ZINC000179007401	362250734	/nfs/dbraw/zinc/25/07/34/362250734.db2.gz	XODJQHZDVJQRCC-JTQLQIEISA-N	1	0	262.309	1.097	50	0		CDAARO
C[C@H]([NH2+][C@H]1CCCC1(C)C)C(=O)NC[C@H]1CCCO1	ZINC000249107322	362262086	/nfs/dbraw/zinc/26/20/86/362262086.db2.gz	XGDGAEZWESZAQU-XQQFMLRXSA-N	1	0	268.401	1.838	50	0		CDAARO
O=C(Nc1ccncn1)N1CC[C@H](C[NH+]2CCCC2)C1	ZINC000190709020	362379266	/nfs/dbraw/zinc/37/92/66/362379266.db2.gz	FAHOGIHBLNMJOG-GFCCVEGCSA-N	1	0	275.356	1.426	50	0		CDAARO
C[C@H]1CC[N@H+](CC2CCSCC2)CC[S@]1=O	ZINC000602637834	344510631	/nfs/dbraw/zinc/51/06/31/344510631.db2.gz	ODMHPKDLGUOQKD-MEDUHNTESA-N	1	0	261.456	1.973	50	0		CDAARO
Cc1ccc(OCC(=O)N2CCC[C@@H]([NH3+])C2)cc1C	ZINC000191351338	362423950	/nfs/dbraw/zinc/42/39/50/362423950.db2.gz	IYRUUVSMRVQTBI-CYBMUJFWSA-N	1	0	262.353	1.632	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@@H](C)c1ccc(F)c(F)c1	ZINC000096490744	530014775	/nfs/dbraw/zinc/01/47/75/530014775.db2.gz	ICIDZRASBVVXSR-VIFPVBQESA-N	1	0	292.351	1.555	50	0		CDAARO
CN(C(=O)C[N@H+](C)CC1(C)COC1)C1CCCCC1	ZINC000608492600	345775140	/nfs/dbraw/zinc/77/51/40/345775140.db2.gz	LPHZDJXALYSOBP-UHFFFAOYSA-N	1	0	268.401	1.746	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CCCCC[C@H]1C[C@H](O)c1ccco1	ZINC000127504236	187311453	/nfs/dbraw/zinc/31/14/53/187311453.db2.gz	SULMRBFTBGXNGF-ZNMIVQPWSA-N	1	0	297.395	1.955	50	0		CDAARO
CC(C)N1CCC[C@H]([NH2+][C@@H]2CCC[C@H]3OCC[C@@H]32)C1=O	ZINC000098019382	185674774	/nfs/dbraw/zinc/67/47/74/185674774.db2.gz	YEFUXWQIHPWZMQ-APIJFGDWSA-N	1	0	280.412	1.933	50	0		CDAARO
C[C@@H](NC(=O)N1CCC[C@@H](O)C1)C(C)(C)C[NH+](C)C	ZINC000085423142	179059186	/nfs/dbraw/zinc/05/91/86/179059186.db2.gz	PKVLMGRRLYCPJV-VXGBXAGGSA-N	1	0	271.405	1.129	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]Cc1ccnc(OCC(F)F)c1	ZINC000091411395	482564372	/nfs/dbraw/zinc/56/43/72/482564372.db2.gz	UABMYZZZDSPKFA-ONGXEEELSA-N	1	0	272.295	1.993	50	0		CDAARO
C[NH2+]C[C@H](C)C(=O)N1CCN(c2ccccc2F)CC1	ZINC000092133877	136713710	/nfs/dbraw/zinc/71/37/10/136713710.db2.gz	UPDFYTAHWFMPDV-LBPRGKRZSA-N	1	0	279.359	1.330	50	0		CDAARO
COCCC[N@@H+]1CC[C@@H](N(Cc2ncc(C)o2)C(C)=O)C1	ZINC000089702321	347608019	/nfs/dbraw/zinc/60/80/19/347608019.db2.gz	XOTBSKKVECPJQO-CQSZACIVSA-N	1	0	295.383	1.442	50	0		CDAARO
OCCOCCC[NH2+][C@H]1CCCNc2ccccc21	ZINC000193275534	362885197	/nfs/dbraw/zinc/88/51/97/362885197.db2.gz	NTHGGZHWQLAJNZ-HNNXBMFYSA-N	1	0	264.369	1.922	50	0		CDAARO
Cc1cc(C(=O)N2CC[NH+](CC3CCC3)CC2)cc(=O)[nH]1	ZINC000584896248	349357574	/nfs/dbraw/zinc/35/75/74/349357574.db2.gz	DCFUJCKGKHOOAM-UHFFFAOYSA-N	1	0	289.379	1.654	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1n1cnc2cc(F)ccc2c1=O	ZINC000584886664	349344769	/nfs/dbraw/zinc/34/47/69/349344769.db2.gz	PGJWWVDVPKZEKW-KBPBESRZSA-N	1	0	291.326	1.427	50	0		CDAARO
CCC[C@H](CNc1ncc(C)c(N(C)C)n1)[NH+](C)C	ZINC000584896866	349358430	/nfs/dbraw/zinc/35/84/30/349358430.db2.gz	YUDCEUNFJOBJBH-GFCCVEGCSA-N	1	0	265.405	1.993	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1NC(=O)c1ncccc1C	ZINC000584894160	349354238	/nfs/dbraw/zinc/35/42/38/349354238.db2.gz	FQXVLYMINSOMNS-STQMWFEESA-N	1	0	277.368	1.227	50	0		CDAARO
CC(C)=CC[N@@H+]1CCN(Cc2cccnc2)C[C@H]1CCO	ZINC000104432336	186000041	/nfs/dbraw/zinc/00/00/41/186000041.db2.gz	GJAVRJRMWUNXKF-QGZVFWFLSA-N	1	0	289.423	1.916	50	0		CDAARO
COc1ccc2c(c1)CCC[C@H]2[NH2+]C[C@]1(O)CCOC1	ZINC000090848582	180045324	/nfs/dbraw/zinc/04/53/24/180045324.db2.gz	RKGWXDASLRSJAW-HZPDHXFCSA-N	1	0	277.364	1.814	50	0		CDAARO
COCCC[C@@]1(CO)CCC[N@H+](CCN2CCCC2=O)C1	ZINC000091365275	180142334	/nfs/dbraw/zinc/14/23/34/180142334.db2.gz	QSDSCOCWHQKPLS-INIZCTEOSA-N	1	0	298.427	1.110	50	0		CDAARO
Cc1cc(C)c2[nH]c(CN3CC[C@H]([NH3+])C3)cc(=O)c2c1	ZINC000091289301	180122141	/nfs/dbraw/zinc/12/21/41/180122141.db2.gz	QYFXHAVXXGBTON-LBPRGKRZSA-N	1	0	271.364	1.678	50	0		CDAARO
CCOCCC(=O)N1CCCN(c2cc[nH+]c(C)c2)CC1	ZINC000091468314	180164949	/nfs/dbraw/zinc/16/49/49/180164949.db2.gz	YPCUTEVECHDEOW-UHFFFAOYSA-N	1	0	291.395	1.855	50	0		CDAARO
O=C1CCC2(CC[NH2+]CC2)CN1CCCc1ncc[nH]1	ZINC000091644516	180214874	/nfs/dbraw/zinc/21/48/74/180214874.db2.gz	OBFDVOIKJQDJIP-UHFFFAOYSA-N	1	0	276.384	1.335	50	0		CDAARO
COC(C)(C)C(=O)N[C@H]1C[N@H+](C)C[C@@H]1c1ccccc1	ZINC000091808078	180260771	/nfs/dbraw/zinc/26/07/71/180260771.db2.gz	CVCYBOSMNMFMNG-KGLIPLIRSA-N	1	0	276.380	1.625	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2cc(C(F)(F)F)n[nH]2)C[C@@H]1[NH3+]	ZINC000091846975	180270295	/nfs/dbraw/zinc/27/02/95/180270295.db2.gz	ZCTNLRGFZCHLRU-YUMQZZPRSA-N	1	0	290.289	1.628	50	0		CDAARO
CCn1ccnc1C1CC[NH+](CC(=O)N(C)C)CC1	ZINC000091931063	180288174	/nfs/dbraw/zinc/28/81/74/180288174.db2.gz	HVEGRAWWWGPISN-UHFFFAOYSA-N	1	0	264.373	1.171	50	0		CDAARO
CC(C)[N@H+]1CCCC[C@H]1CNC(=O)N1CC[C@@H]([C@H](C)O)C1	ZINC000110714448	350290723	/nfs/dbraw/zinc/29/07/23/350290723.db2.gz	JVMIJQFUEURCEO-ZNMIVQPWSA-N	1	0	297.443	1.662	50	0		CDAARO
C[C@H](CNC(=O)c1cccnc1)[N@@H+]1CCC[C@@H](C)C1	ZINC000106078871	186101206	/nfs/dbraw/zinc/10/12/06/186101206.db2.gz	UBGKPLWHFGPLEA-CHWSQXEVSA-N	1	0	261.369	1.932	50	0		CDAARO
CC[C@@H]1CN([C@H](C)c2cccnc2)CC[N@@H+]1C[C@H](C)O	ZINC000106906875	186150327	/nfs/dbraw/zinc/15/03/27/186150327.db2.gz	CUZOHBLINTUKTA-SQWLQELKSA-N	1	0	277.412	1.920	50	0		CDAARO
O[C@H]([C@H]1CCC[N@@H+]1CCn1cccn1)C(F)(F)F	ZINC000106850560	186141177	/nfs/dbraw/zinc/14/11/77/186141177.db2.gz	ZFEQEOJGYRVZFT-NXEZZACHSA-N	1	0	263.263	1.271	50	0		CDAARO
C[C@@H]1C[N@H+](C[C@H](O)COCc2ccccc2)[C@@H](C)CO1	ZINC000107331053	186170807	/nfs/dbraw/zinc/17/08/07/186170807.db2.gz	WOHMRMXPSQKRFD-LZWOXQAQSA-N	1	0	279.380	1.673	50	0		CDAARO
Cc1nn(C)c2ncc(C[NH2+][C@@H]3CCCC[C@@H]3O)cc12	ZINC000107912613	186197080	/nfs/dbraw/zinc/19/70/80/186197080.db2.gz	IWDSUVXBPOJQLW-KGLIPLIRSA-N	1	0	274.368	1.670	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@@H]([NH3+])Cc2ccccc2)CCO1	ZINC000036770028	362966797	/nfs/dbraw/zinc/96/67/97/362966797.db2.gz	OCPOSFUIUZNKOX-KGLIPLIRSA-N	1	0	262.353	1.194	50	0		CDAARO
O=C(N[C@@H]1CCC[N@@H+](C2CCCCC2)C1)c1cn[nH]c1	ZINC000109303262	186246585	/nfs/dbraw/zinc/24/65/85/186246585.db2.gz	QWUONYSJQBEGFW-CYBMUJFWSA-N	1	0	276.384	1.937	50	0		CDAARO
C[NH+](C)[C@@H]1CCN([C@@H]2CCCN(CC(C)(C)C)C2=O)C1	ZINC000583650934	366007737	/nfs/dbraw/zinc/00/77/37/366007737.db2.gz	CYZVTJOBSLETAL-ZIAGYGMSSA-N	1	0	281.444	1.659	50	0		CDAARO
O=C1COCC2(CC[NH+](Cc3ccccc3)CC2)N1	ZINC000117687152	351190764	/nfs/dbraw/zinc/19/07/64/351190764.db2.gz	QIJBFLAOMNGEHG-UHFFFAOYSA-N	1	0	260.337	1.168	50	0		CDAARO
C[C@H]1C[N@H+](CC(C)(C)O)CCN1c1nccs1	ZINC000095373353	351395502	/nfs/dbraw/zinc/39/55/02/351395502.db2.gz	OOYUVVOUFPWSRR-JTQLQIEISA-N	1	0	255.387	1.425	50	0		CDAARO
C[N@H+](C1CCCC1)C(C)(C)C(=O)NC[C@@H]1CCC[C@H]1O	ZINC000096488968	351567762	/nfs/dbraw/zinc/56/77/62/351567762.db2.gz	YBZLJOQCGSUENH-GXTWGEPZSA-N	1	0	282.428	1.917	50	0		CDAARO
CC[N@H+](CCO)C[C@H](O)c1ccc(OC)c(OC)c1	ZINC000062353101	363187740	/nfs/dbraw/zinc/18/77/40/363187740.db2.gz	ASRYUTVBLACHBU-LBPRGKRZSA-N	1	0	269.341	1.051	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@@H]1NC(=O)c1ccc(F)c(F)c1F	ZINC000094184056	363241136	/nfs/dbraw/zinc/24/11/36/363241136.db2.gz	HSIKYTHLJKUCGT-XCBNKYQSSA-N	1	0	272.270	1.974	50	0		CDAARO
Cc1cc([C@H](C)NC(=O)[C@H]2C[C@H](O)C[NH2+]2)c(C)s1	ZINC000037002203	363312205	/nfs/dbraw/zinc/31/22/05/363312205.db2.gz	VGBCQAUXLJSYGB-PTOFAABTSA-N	1	0	268.382	1.265	50	0		CDAARO
COc1ccc(OCC(=O)NCC[NH+]2CCCC2)cc1	ZINC000000383105	355907946	/nfs/dbraw/zinc/90/79/46/355907946.db2.gz	DMBZXIJNZTZQRM-UHFFFAOYSA-N	1	0	278.352	1.286	50	0		CDAARO
COc1cccc(C[NH2+]C[C@H]2CCCO2)c1OC	ZINC000000268569	355899856	/nfs/dbraw/zinc/89/98/56/355899856.db2.gz	KRKRFPVLDYQKIR-GFCCVEGCSA-N	1	0	251.326	1.972	50	0		CDAARO
CCOc1ccccc1OCCCC[NH2+]CCO	ZINC000002931303	355988399	/nfs/dbraw/zinc/98/83/99/355988399.db2.gz	HXBUEVHJOYGZPJ-UHFFFAOYSA-N	1	0	253.342	1.826	50	0		CDAARO
COc1cccc(OCCSc2nc(N)cc(N)[nH+]2)c1	ZINC000002996655	355990829	/nfs/dbraw/zinc/99/08/29/355990829.db2.gz	KVXDMAVJTSWXQE-UHFFFAOYSA-N	1	0	292.364	1.821	50	0		CDAARO
c1nn(Cc2ccccc2)cc1CN[C@H]1CCC[NH2+]C1	ZINC000067740770	356007239	/nfs/dbraw/zinc/00/72/39/356007239.db2.gz	WSIUJQUKNRFNAR-INIZCTEOSA-N	1	0	270.380	1.773	50	0		CDAARO
COc1ccc(C[NH2+]CCSc2nnnn2C)cc1	ZINC000002178157	355962118	/nfs/dbraw/zinc/96/21/18/355962118.db2.gz	LCIYGVCSGGUUQR-UHFFFAOYSA-N	1	0	279.369	1.101	50	0		CDAARO
C[NH+](C)CCNC(=O)COc1ccc(Cl)cc1	ZINC000002496120	355972157	/nfs/dbraw/zinc/97/21/57/355972157.db2.gz	VFEUKRULGBAHHV-UHFFFAOYSA-N	1	0	256.733	1.397	50	0		CDAARO
COc1cc(OC)c(OC)cc1C[NH2+]C[C@@H]1CCCO1	ZINC000004498043	356032461	/nfs/dbraw/zinc/03/24/61/356032461.db2.gz	OXCKCCGTEIJZMV-LBPRGKRZSA-N	1	0	281.352	1.981	50	0		CDAARO
CCOC(=O)C[C@H]1[NH2+]CCC[C@H]1NC(=O)OC(C)(C)C	ZINC000004203236	356022006	/nfs/dbraw/zinc/02/20/06/356022006.db2.gz	JWIFFLUEVLMGJF-GHMZBOCLSA-N	1	0	286.372	1.585	50	0		CDAARO
Cn1cc(-c2cc(C(F)(F)F)n(CCC[NH3+])n2)cn1	ZINC000012394711	356296901	/nfs/dbraw/zinc/29/69/01/356296901.db2.gz	KUIDMQBUDJMMNT-UHFFFAOYSA-N	1	0	273.262	1.651	50	0		CDAARO
CCOc1cc(C)ccc1S(=O)(=O)N1CCN(C)CC1	ZINC000012420629	356299727	/nfs/dbraw/zinc/29/97/27/356299727.db2.gz	AMCOCGVOMAFVOJ-UHFFFAOYSA-N	1	0	298.408	1.330	50	0		CDAARO
CCN1C(=O)N(C)C(=O)C12CC[NH+]([C@H]1CCSC1)CC2	ZINC000014742896	356396879	/nfs/dbraw/zinc/39/68/79/356396879.db2.gz	YXHBEIPQFADFCA-NSHDSACASA-N	1	0	297.424	1.240	50	0		CDAARO
C[C@@H]1C[C@H](C)C[N@H+]([C@@H](C(=O)NC(N)=O)c2ccccc2)C1	ZINC000015377586	356414947	/nfs/dbraw/zinc/41/49/47/356414947.db2.gz	IKYGGGSLPZBIAC-MBNYWOFBSA-N	1	0	289.379	1.901	50	0		CDAARO
Cn1ccnc1[C@H](c1ccccc1)N1CC[NH2+]CC1	ZINC000019735767	356498087	/nfs/dbraw/zinc/49/80/87/356498087.db2.gz	BISLYFJHPWWIIU-AWEZNQCLSA-N	1	0	256.353	1.415	50	0		CDAARO
C[NH+]1CCN(CCOCCOc2ccc(Cl)cc2)CC1	ZINC000019792485	356503895	/nfs/dbraw/zinc/50/38/95/356503895.db2.gz	DEYQLXLMRIWFAE-UHFFFAOYSA-N	1	0	298.814	1.983	50	0		CDAARO
CC(C)[NH+]1CCN(Cc2ccc3c(c2)OCO3)CC1	ZINC000019850955	356510017	/nfs/dbraw/zinc/51/00/17/356510017.db2.gz	JJVQKDIULZXCGD-UHFFFAOYSA-N	1	0	262.353	1.941	50	0		CDAARO
CN1CCN(C(=O)Cc2ccc(Br)cc2)CC1	ZINC000019866038	356511019	/nfs/dbraw/zinc/51/10/19/356511019.db2.gz	TUNHKTBVUHEJBA-UHFFFAOYSA-N	1	0	297.196	1.766	50	0		CDAARO
CC(C)S(=O)(=O)N1CCC(C[NH3+])(C(F)(F)F)CC1	ZINC000725264749	538455731	/nfs/dbraw/zinc/45/57/31/538455731.db2.gz	UKQQWYIHWZRHOP-UHFFFAOYSA-N	1	0	288.335	1.328	50	0		CDAARO
O=C(CN1CC[N@@H+]2CCC[C@@H]2C1)Nc1ccc(Cl)cn1	ZINC000023477124	356643587	/nfs/dbraw/zinc/64/35/87/356643587.db2.gz	KUKLMGBYMHFFPB-GFCCVEGCSA-N	1	0	294.786	1.454	50	0		CDAARO
Fc1ccc(C[NH2+]CCN2CCOCC2)cc1F	ZINC000019953909	363548334	/nfs/dbraw/zinc/54/83/34/363548334.db2.gz	XZWPEAGAGFVODQ-UHFFFAOYSA-N	1	0	256.296	1.387	50	0		CDAARO
O=S(=O)(NCC[NH+]1CCCCCC1)c1ccccc1	ZINC000024682616	356658867	/nfs/dbraw/zinc/65/88/67/356658867.db2.gz	RKBHOAHHKCJAQH-UHFFFAOYSA-N	1	0	282.409	1.841	50	0		CDAARO
COc1ccc(C[C@H](C)[NH2+][C@H]2CCCCNC2=O)cc1	ZINC000004022531	356735841	/nfs/dbraw/zinc/73/58/41/356735841.db2.gz	WWPLVGJTGXDBAY-WFASDCNBSA-N	1	0	276.380	1.885	50	0		CDAARO
OCC1(O)CC[NH+](Cc2cccc3cccnc32)CC1	ZINC000067983315	356761037	/nfs/dbraw/zinc/76/10/37/356761037.db2.gz	CUDVNTVAIDDUEG-UHFFFAOYSA-N	1	0	272.348	1.554	50	0		CDAARO
COc1cc2oc(=O)c3c(c2cc1OC)CC[NH2+]C3	ZINC000034508668	356816706	/nfs/dbraw/zinc/81/67/06/356816706.db2.gz	JGUIPANVMMLLSQ-UHFFFAOYSA-N	1	0	261.277	1.456	50	0		CDAARO
c1n[nH]cc1CCC[NH+]1CCC(N2CCSCC2)CC1	ZINC000032553506	356782692	/nfs/dbraw/zinc/78/26/92/356782692.db2.gz	JUDBQYSXZHEMQZ-UHFFFAOYSA-N	1	0	294.468	1.856	50	0		CDAARO
CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C	ZINC000035993536	356854228	/nfs/dbraw/zinc/85/42/28/356854228.db2.gz	FBACONQWDFOSGR-UHFFFAOYSA-N	1	0	298.408	1.330	50	0		CDAARO
C[N@@H+](CC(=O)NCc1cccnc1)C[C@@H]1CCCOC1	ZINC000095395068	357113653	/nfs/dbraw/zinc/11/36/53/357113653.db2.gz	DHJBCPZTXVXVDM-AWEZNQCLSA-N	1	0	277.368	1.056	50	0		CDAARO
Cc1cn2c(n1)[C@H](C[NH2+]Cc1ccc(C(N)=O)cc1)CCC2	ZINC000084257766	357120772	/nfs/dbraw/zinc/12/07/72/357120772.db2.gz	LGXQDCOBIBFFOI-HNNXBMFYSA-N	1	0	298.390	1.958	50	0		CDAARO
CSCCC[N@@H+]1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1	ZINC000095402721	357195230	/nfs/dbraw/zinc/19/52/30/357195230.db2.gz	VZQOPGOZSDYXGO-JTQLQIEISA-N	1	0	282.413	1.441	50	0		CDAARO
CCOC(=O)C1=C(C[n+]2ccccc2)C(C)(C)OC1=O	ZINC000004610646	357240644	/nfs/dbraw/zinc/24/06/44/357240644.db2.gz	SWIRUCTVYTUWMO-UHFFFAOYSA-N	1	0	276.312	1.169	50	0		CDAARO
CCOc1ncccc1C(=O)NC[C@H]1CCC[N@@H+]1CC	ZINC000058160888	357380604	/nfs/dbraw/zinc/38/06/04/357380604.db2.gz	XDJOYFIBJSNQOP-GFCCVEGCSA-N	1	0	277.368	1.694	50	0		CDAARO
CCCc1nc(C)cc(N2C[C@H](O)[C@@H]([NH+]3CCCC3)C2)n1	ZINC000065410268	357539257	/nfs/dbraw/zinc/53/92/57/357539257.db2.gz	CEFZUFWDTOIMAW-KBPBESRZSA-N	1	0	290.411	1.383	50	0		CDAARO
CC(=O)NCC1=CCCN(CCn2cc(Cl)cn2)C1	ZINC000065490475	357544209	/nfs/dbraw/zinc/54/42/09/357544209.db2.gz	SSXWMRQCFJGVSD-UHFFFAOYSA-N	1	0	282.775	1.305	50	0		CDAARO
CC(=O)NCCc1cn(-c2cccc([C@@H](C)O)c2)cn1	ZINC000065491337	357544675	/nfs/dbraw/zinc/54/46/75/357544675.db2.gz	GPWGCOWJHFIGGL-LLVKDONJSA-N	1	0	273.336	1.604	50	0		CDAARO
CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)c2ccc[nH]c2=O)C1	ZINC000067649645	357616674	/nfs/dbraw/zinc/61/66/74/357616674.db2.gz	SPBWUIRTXSOPAI-ZDUSSCGKSA-N	1	0	291.395	1.473	50	0		CDAARO
CC(C)c1nc(CCNc2ncnc3c2CC[NH2+]C3)no1	ZINC000067867626	357633718	/nfs/dbraw/zinc/63/37/18/357633718.db2.gz	YGMSTTZCBGMGQZ-UHFFFAOYSA-N	1	0	288.355	1.283	50	0		CDAARO
C[C@H](Cc1ccccc1F)C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188470997	357694309	/nfs/dbraw/zinc/69/43/09/357694309.db2.gz	SQUMBMYVZNCVAC-VXGBXAGGSA-N	1	0	264.344	1.825	50	0		CDAARO
O=C([C@H]1Cc2ccccc2C[NH2+]1)N1C[C@@H]2[C@H]3CC[C@H](O3)[C@@H]2C1	ZINC000071754704	357779730	/nfs/dbraw/zinc/77/97/30/357779730.db2.gz	XMGSQQULGRHUPU-BPKGMFCQSA-N	1	0	298.386	1.337	50	0		CDAARO
O[C@@]1(CNCc2coc(-c3ccccc3)n2)CC[NH2+]C1	ZINC000072426234	357834666	/nfs/dbraw/zinc/83/46/66/357834666.db2.gz	KUGYOZXVEXPTSF-HNNXBMFYSA-N	1	0	273.336	1.156	50	0		CDAARO
Cn1c(CN2CCCC2)nnc1[C@H]1CCC[N@H+](C)C1	ZINC000072474882	357837874	/nfs/dbraw/zinc/83/78/74/357837874.db2.gz	RXIQZSQYKYEZLW-LBPRGKRZSA-N	1	0	263.389	1.220	50	0		CDAARO
Cc1nnc(CN[C@H](CC(N)=O)C2CCCCC2)o1	ZINC000097111056	357986467	/nfs/dbraw/zinc/98/64/67/357986467.db2.gz	ZRCARERSWNQIRZ-LLVKDONJSA-N	1	0	266.345	1.292	50	0		CDAARO
CC[C@H](CO)N1CCN(c2nccnc2OC(C)C)CC1	ZINC000097140737	357995600	/nfs/dbraw/zinc/99/56/00/357995600.db2.gz	SDBLXXKJAZPZKM-CYBMUJFWSA-N	1	0	294.399	1.157	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2Cc3ccccc3[C@@H]2[NH3+])c(=O)[nH]c1C	ZINC000091594104	358518907	/nfs/dbraw/zinc/51/89/07/358518907.db2.gz	PHWCGIALPVFEFS-GJZGRUSLSA-N	1	0	297.358	1.346	50	0		CDAARO
CN(C)c1cccc(C[N@H+](C)[C@H]2CCN(C3CC3)C2=O)c1	ZINC000095442087	358441122	/nfs/dbraw/zinc/44/11/22/358441122.db2.gz	CNLIUFTWNUMRKF-INIZCTEOSA-N	1	0	287.407	1.948	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H](O)C[N@@H+]1C[C@@H]1C(C)=CCC[C@@H]1C	ZINC000195578150	358567739	/nfs/dbraw/zinc/56/77/39/358567739.db2.gz	GVMYSEUEEJARIT-DGAVXFQQSA-N	1	0	267.369	1.587	50	0		CDAARO
CCc1[nH+]c(N)nc(N[C@@H](C)c2nnc(N)s2)c1C	ZINC000095370713	358687382	/nfs/dbraw/zinc/68/73/82/358687382.db2.gz	MOMWYDHVFDCGLT-LURJTMIESA-N	1	0	279.373	1.536	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1Nc1nccc(C(F)(F)F)n1	ZINC000095391078	358692103	/nfs/dbraw/zinc/69/21/03/358692103.db2.gz	MQLUGYZMDAVKFY-IUCAKERBSA-N	1	0	290.289	1.626	50	0		CDAARO
Cc1ccc(F)cc1NC(=O)N1CCO[C@H](C[NH+](C)C)C1	ZINC000095398679	358692884	/nfs/dbraw/zinc/69/28/84/358692884.db2.gz	BMWJMHIDYRCSNK-CYBMUJFWSA-N	1	0	295.358	1.928	50	0		CDAARO
c1csc(CN2CC[NH+](C3CCOCC3)CC2)n1	ZINC000097076155	358750625	/nfs/dbraw/zinc/75/06/25/358750625.db2.gz	GHFCMKQDYJIXBT-UHFFFAOYSA-N	1	0	267.398	1.440	50	0		CDAARO
Cn1cncc1-c1ccc(OCCC[NH+](C)C)nc1	ZINC000096153706	358710256	/nfs/dbraw/zinc/71/02/56/358710256.db2.gz	ATGJPWGWSCAMQT-UHFFFAOYSA-N	1	0	260.341	1.813	50	0		CDAARO
CN(C)c1ccc(CCNC(=O)[C@H]2CC[C@@H]([NH3+])C2)cc1	ZINC000097447114	358777757	/nfs/dbraw/zinc/77/77/57/358777757.db2.gz	WHGMXUBKYDMBJJ-UONOGXRCSA-N	1	0	275.396	1.539	50	0		CDAARO
CC(C)N(Cc1nccn1C)C(=O)[C@@H]1CCCC[N@@H+]1C	ZINC000097619547	358788250	/nfs/dbraw/zinc/78/82/50/358788250.db2.gz	ZFYQNPVVVRSVDY-ZDUSSCGKSA-N	1	0	278.400	1.641	50	0		CDAARO
C[C@@H](OC(=O)c1ccn2c[nH+]cc2c1)C(=O)NC1CC1	ZINC000095454587	358862678	/nfs/dbraw/zinc/86/26/78/358862678.db2.gz	BXLRJPLCUCXJRN-SECBINFHSA-N	1	0	273.292	1.158	50	0		CDAARO
CNC(=O)C[C@H](C)[N@H+](C)Cc1cc(C(C)(C)C)n[nH]1	ZINC000215463462	358889753	/nfs/dbraw/zinc/88/97/53/358889753.db2.gz	IKHRIKBICYKFCR-JTQLQIEISA-N	1	0	266.389	1.664	50	0		CDAARO
CC(C)c1nc(CN2CC[NH+](CCCO)CC2)co1	ZINC000215554145	358894086	/nfs/dbraw/zinc/89/40/86/358894086.db2.gz	ZBHFEYYEHDTUSM-UHFFFAOYSA-N	1	0	267.373	1.298	50	0		CDAARO
CC(C)(C)[C@H]1CCN(Cc2nnnn2C2CC2)C[C@@H]1O	ZINC000095466691	358926256	/nfs/dbraw/zinc/92/62/56/358926256.db2.gz	ZHHKZSXGXJNZNI-RYUDHWBXSA-N	1	0	279.388	1.237	50	0		CDAARO
Cc1n[nH]c(C)c1CCNC(=O)c1ccc(C[NH3+])cc1	ZINC000221256867	359222948	/nfs/dbraw/zinc/22/29/48/359222948.db2.gz	XBZOYQYJKABGJA-UHFFFAOYSA-N	1	0	272.352	1.458	50	0		CDAARO
O=C(NCCC[NH+]1CCCC1)NCc1ccccc1	ZINC000025080365	359334740	/nfs/dbraw/zinc/33/47/40/359334740.db2.gz	VFFBWXLMBSJLFK-UHFFFAOYSA-N	1	0	261.369	1.972	50	0		CDAARO
NC(=[NH2+])SCc1nc2cc(Cl)ccc2c(=O)[nH]1	ZINC000024033835	359555658	/nfs/dbraw/zinc/55/56/58/359555658.db2.gz	QKPBCSFMRUJAPP-UHFFFAOYSA-N	1	0	268.729	1.703	50	0		CDAARO
Cc1ccc2[nH]c([C@@H]3CCCN3C(=O)[C@@H](C)[NH3+])nc2c1	ZINC000261863062	359576952	/nfs/dbraw/zinc/57/69/52/359576952.db2.gz	PVXRZIRYCDJWFH-MFKMUULPSA-N	1	0	272.352	1.882	50	0		CDAARO
CC(=O)NC1CCC([NH2+][C@@H]2Cc3ccccc3[C@@H]2O)CC1	ZINC000187214615	359838155	/nfs/dbraw/zinc/83/81/55/359838155.db2.gz	DWBNMOFOBQCEQQ-MMADZMRASA-N	1	0	288.391	1.682	50	0		CDAARO
Cn1cc([C@@H]2CCCC[N@@H+]2CCC2OCCO2)cn1	ZINC000408516277	359899081	/nfs/dbraw/zinc/89/90/81/359899081.db2.gz	HDJRLDQXULROGS-ZDUSSCGKSA-N	1	0	265.357	1.710	50	0		CDAARO
CC[C@@H]1C[N@H+](CC)CCN1c1ncnc2c1ncn2CC	ZINC000521394698	359966520	/nfs/dbraw/zinc/96/65/20/359966520.db2.gz	FJZSMTXZZOSDMH-GFCCVEGCSA-N	1	0	288.399	1.767	50	0		CDAARO
C[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)COCC(F)(F)F	ZINC000248150755	360408074	/nfs/dbraw/zinc/40/80/74/360408074.db2.gz	UBFZDVWMGFEZKJ-WDEREUQCSA-N	1	0	294.317	1.651	50	0		CDAARO
Cn1c(SCCc2ncc[nH]2)nnc1[C@@H]1CCC[NH2+]C1	ZINC000426712759	360698730	/nfs/dbraw/zinc/69/87/30/360698730.db2.gz	OJJUMMUBSOGVRW-SNVBAGLBSA-N	1	0	292.412	1.340	50	0		CDAARO
[NH3+]CC(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1	ZINC000178719193	189139856	/nfs/dbraw/zinc/13/98/56/189139856.db2.gz	BQAYKDRXDYNPEB-UHFFFAOYSA-N	1	0	270.336	1.784	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C/C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179111026	189170587	/nfs/dbraw/zinc/17/05/87/189170587.db2.gz	BOKLMCMFAPPSGU-ORAHPGNNSA-N	1	0	282.775	1.215	50	0		CDAARO
c1cc2c(cc1CN1CC[C@H]3CC[C@@H](C1)[NH2+]3)OCCO2	ZINC000097243842	360937576	/nfs/dbraw/zinc/93/75/76/360937576.db2.gz	HUKHLPDNHGWSHI-KGLIPLIRSA-N	1	0	274.364	1.784	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccnc(C3CC3)n2)C[C@@H](C)[NH2+]1	ZINC000299738888	200849534	/nfs/dbraw/zinc/84/95/34/200849534.db2.gz	HXVBONAICSKUNA-NXEZZACHSA-N	1	0	260.341	1.176	50	0		CDAARO
Cc1c([C@H](C)NC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3[NH2+]2)cnn1C	ZINC000249332399	364538010	/nfs/dbraw/zinc/53/80/10/364538010.db2.gz	XAPHCLGEBSWALL-FDEJFUCISA-N	1	0	290.411	1.826	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)Cn1cccn1	ZINC000249689296	365161313	/nfs/dbraw/zinc/16/13/13/365161313.db2.gz	JLXXMVFNFGBNBX-UONOGXRCSA-N	1	0	276.384	1.358	50	0		CDAARO
COC(=O)CC[C@@H](C)[NH2+]Cc1cccc(CO)c1	ZINC000089895315	366958769	/nfs/dbraw/zinc/95/87/69/366958769.db2.gz	RPEPMWQGMXLGQX-LLVKDONJSA-N	1	0	251.326	1.610	50	0		CDAARO
O=C1C[C@H]([NH2+]CCCNc2ccccc2)CCCN1	ZINC000630059703	366966854	/nfs/dbraw/zinc/96/68/54/366966854.db2.gz	DZQMCALJCIOGSC-CQSZACIVSA-N	1	0	261.369	1.747	50	0		CDAARO
CCC(=O)N1CC[C@H]([NH2+]Cc2nccn2C)[C@@H](CC)C1	ZINC000089949196	366978283	/nfs/dbraw/zinc/97/82/83/366978283.db2.gz	VIDJXJXJSZPSAM-STQMWFEESA-N	1	0	278.400	1.547	50	0		CDAARO
O=C(NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(CO)c(F)c1	ZINC000252481770	367566138	/nfs/dbraw/zinc/56/61/38/367566138.db2.gz	CROOXCWKLANVES-NSHDSACASA-N	1	0	292.354	1.532	50	0		CDAARO
Cc1c[nH+]c(C)n1CCNC(=O)COCc1ccccc1	ZINC000575555519	369132635	/nfs/dbraw/zinc/13/26/35/369132635.db2.gz	ODKXFHUSUYKMAG-UHFFFAOYSA-N	1	0	287.363	1.833	50	0		CDAARO
CC[C@H]1COCCN1C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C	ZINC000074791652	369308384	/nfs/dbraw/zinc/30/83/84/369308384.db2.gz	XKEQQEXSQCTSBT-WIGRTHMWSA-N	1	0	295.427	1.822	50	0		CDAARO
C[C@H]([NH3+])CC(=O)N1CCC(Oc2ccccc2)CC1	ZINC000037650905	369676050	/nfs/dbraw/zinc/67/60/50/369676050.db2.gz	OTYJGGDMBFVLIU-LBPRGKRZSA-N	1	0	262.353	1.794	50	0		CDAARO
O=C1NCCCC[C@@H]1[N@@H+]1CCC[C@@H](OCC2CC2)C1	ZINC000375321344	376204515	/nfs/dbraw/zinc/20/45/15/376204515.db2.gz	VCQHIASGRBGOKQ-KGLIPLIRSA-N	1	0	266.385	1.546	50	0		CDAARO
C[C@@H]([NH3+])CCNC(=O)Cc1csc(-c2ccoc2)n1	ZINC000178657251	372201063	/nfs/dbraw/zinc/20/10/63/372201063.db2.gz	WMHMHAFCVBXBFT-SECBINFHSA-N	1	0	279.365	1.799	50	0		CDAARO
Cc1nn(-c2ccccc2)cc1C(=O)NC[C@@H]1CCC[NH2+]1	ZINC000178759712	372206651	/nfs/dbraw/zinc/20/66/51/372206651.db2.gz	BBWMLKMWAPNSSC-ZDUSSCGKSA-N	1	0	284.363	1.663	50	0		CDAARO
[NH3+][C@H]1C[C@H](c2nnc(CN3CCSCC3)n2C2CC2)C1	ZINC000244887836	189913926	/nfs/dbraw/zinc/91/39/26/189913926.db2.gz	YPKPLFZBLTWNOZ-XYPYZODXSA-N	1	0	293.440	1.367	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)C2(c3ccccc3)CC2)C[C@H]1CO	ZINC000253408304	373710748	/nfs/dbraw/zinc/71/07/48/373710748.db2.gz	KPOZZASLGMPGDG-DZGCQCFKSA-N	1	0	288.391	1.099	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1C(=O)Cc1ccc(F)c(F)c1	ZINC000095045398	373692410	/nfs/dbraw/zinc/69/24/10/373692410.db2.gz	UGQPTMOHYLPAQR-LLVKDONJSA-N	1	0	268.307	1.847	50	0		CDAARO
O=C(NC1CC1)[C@H](c1ccccc1)[N@@H+]1CCC[C@@H](O)C1	ZINC000106506867	373763642	/nfs/dbraw/zinc/76/36/42/373763642.db2.gz	LMBJYSVHWGCCDF-CABCVRRESA-N	1	0	274.364	1.463	50	0		CDAARO
CC[C@H](O)C[N@@H+]1CCC[C@H](C(C)(C)C(=O)OC)C1	ZINC000093298717	374738505	/nfs/dbraw/zinc/73/85/05/374738505.db2.gz	YIVYIIJBQIDVHB-RYUDHWBXSA-N	1	0	257.374	1.669	50	0		CDAARO
O=C(CN1CCC[C@@H]([NH+]2CCCC2)C1)NC1CCCC1	ZINC000095356559	374888181	/nfs/dbraw/zinc/88/81/81/374888181.db2.gz	PODRWIXPMAYIAF-OAHLLOKOSA-N	1	0	279.428	1.605	50	0		CDAARO
COC(=O)[C@@H](O)C1CC[NH+](Cc2ccc(C)cc2)CC1	ZINC000095432443	374933807	/nfs/dbraw/zinc/93/38/07/374933807.db2.gz	SXJORPQYLLRWCE-HNNXBMFYSA-N	1	0	277.364	1.741	50	0		CDAARO
O=C(NCC[NH2+][C@@H]1CCCSC1)c1cccs1	ZINC000097084491	375146490	/nfs/dbraw/zinc/14/64/90/375146490.db2.gz	DYJIFFFXDZGLDA-SNVBAGLBSA-N	1	0	270.423	1.963	50	0		CDAARO
COc1ccccc1COC[C@H](O)C[NH2+]C(C)(C)C	ZINC000002660994	375292204	/nfs/dbraw/zinc/29/22/04/375292204.db2.gz	JZKDASLHLVIEAD-CYBMUJFWSA-N	1	0	267.369	1.961	50	0		CDAARO
O=C(C1CCC1)N1CC[NH+](CC[C@H]2CCOC2)CC1	ZINC000670440519	542011359	/nfs/dbraw/zinc/01/13/59/542011359.db2.gz	TVRBVLQLAKPUAI-ZDUSSCGKSA-N	1	0	266.385	1.357	50	0		CDAARO
COc1ccccc1OCC[NH+]1CCC(O)CC1	ZINC000032106446	375801278	/nfs/dbraw/zinc/80/12/78/375801278.db2.gz	BOFDCWARGJQKMD-UHFFFAOYSA-N	1	0	251.326	1.531	50	0		CDAARO
O=S(=O)(C1CCCCC1)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000257365453	190038041	/nfs/dbraw/zinc/03/80/41/190038041.db2.gz	WYILOZJTNOHEKQ-LBPRGKRZSA-N	1	0	272.414	1.429	50	0		CDAARO
CCN(C(=O)C[C@@H]1COCC[NH2+]1)c1ccc(OC)cc1	ZINC000262031589	190047410	/nfs/dbraw/zinc/04/74/10/190047410.db2.gz	FCJMIFJMCJILHP-GFCCVEGCSA-N	1	0	278.352	1.427	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)NCC[C@@H]1CCC[N@@H+](C)C1	ZINC000067489679	377107955	/nfs/dbraw/zinc/10/79/55/377107955.db2.gz	HGYSWTOLSAPJRV-ZDUSSCGKSA-N	1	0	278.400	1.417	50	0		CDAARO
O=C(NC[C@H]1CC[N@@H+](C2CCCCC2)C1)c1nnc[nH]1	ZINC000244882429	377798423	/nfs/dbraw/zinc/79/84/23/377798423.db2.gz	XRMUIWBUANYJRY-LLVKDONJSA-N	1	0	277.372	1.189	50	0		CDAARO
COC[C@H]([NH2+][C@@H]1CCN(c2ccccn2)C1)C(C)C	ZINC000090802804	184617610	/nfs/dbraw/zinc/61/76/10/184617610.db2.gz	GSRSYQGRUUSQGE-KGLIPLIRSA-N	1	0	263.385	1.921	50	0		CDAARO
O=C1[C@H]([NH2+][C@@H]2CCC[C@@H]3OCC[C@@H]32)CCN1C1CC1	ZINC000252517640	296433226	/nfs/dbraw/zinc/43/32/26/296433226.db2.gz	NSQUBYSQBRZJRW-SYQHCUMBSA-N	1	0	264.369	1.297	50	0		CDAARO
Cn1c(SC[C@H]2CCC(=O)O2)nnc1C1CC[NH2+]CC1	ZINC000426529441	256861043	/nfs/dbraw/zinc/86/10/43/256861043.db2.gz	RLNFHEMMZMBZGV-SNVBAGLBSA-N	1	0	296.396	1.080	50	0		CDAARO
c1c([C@@H]2CCC[NH2+]C2)nnn1Cc1cn2c(n1)SCC2	ZINC000095355027	184950940	/nfs/dbraw/zinc/95/09/40/184950940.db2.gz	XHHKSAGFZUYZGC-SNVBAGLBSA-N	1	0	290.396	1.096	50	0		CDAARO
Cc1ccc(OCCOCCN2CC[NH+](C)CC2)cc1	ZINC000019792435	390228899	/nfs/dbraw/zinc/22/88/99/390228899.db2.gz	KDIZNVZQEKYPCS-UHFFFAOYSA-N	1	0	278.396	1.638	50	0		CDAARO
CCS[C@@H]1CC[C@@H]([N@H+](C)CCN2C(=O)CCC2=O)C1	ZINC000096441696	390521167	/nfs/dbraw/zinc/52/11/67/390521167.db2.gz	RMRVKXYHKGDTLJ-VXGBXAGGSA-N	1	0	284.425	1.741	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C(=O)N[C@@H]2COc3ccccc32)C1	ZINC000127258523	390815250	/nfs/dbraw/zinc/81/52/50/390815250.db2.gz	DKYQLPWUCFUVGM-KGYLQXTDSA-N	1	0	260.337	1.624	50	0		CDAARO
C[C@@H]([NH3+])C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000121582677	391480263	/nfs/dbraw/zinc/48/02/63/391480263.db2.gz	WQYINDSPEMMTEK-XBFCOCLRSA-N	1	0	262.353	1.448	50	0		CDAARO
OCC[C@H]1CCC[N@H+](CCOC[C@@H]2CCCO2)C1	ZINC000096421779	393185298	/nfs/dbraw/zinc/18/52/98/393185298.db2.gz	WPTLQIJXXNFCME-KGLIPLIRSA-N	1	0	257.374	1.276	50	0		CDAARO
CC(C)=CC[NH+]1CCC(N2CCC[C@@H]2C(N)=O)CC1	ZINC000096489099	393187146	/nfs/dbraw/zinc/18/71/46/393187146.db2.gz	FOHYRMPEJKLCIR-CQSZACIVSA-N	1	0	265.401	1.367	50	0		CDAARO
CC(C)[NH2+]CCN1CCC[C@@H](CNC(=O)C(C)(C)C)C1	ZINC000193443495	393341629	/nfs/dbraw/zinc/34/16/29/393341629.db2.gz	STKSFKJAMMUNRG-AWEZNQCLSA-N	1	0	283.460	1.859	50	0		CDAARO
CC[n+]1cc(-c2ccccc2)nc(N2CCOCC2)n1	ZINC000000061025	134517799	/nfs/dbraw/zinc/51/77/99/134517799.db2.gz	WTHXQRAFPNTBTP-UHFFFAOYSA-N	1	0	271.344	1.288	50	0	aggregator	CDAARO
CCc1[nH+]c(N)nc(N2CCN(c3cnccn3)CC2)c1C	ZINC000091952062	135074716	/nfs/dbraw/zinc/07/47/16/135074716.db2.gz	YGHNMMVALOJELW-UHFFFAOYSA-N	1	0	299.382	1.046	50	0		CDAARO
COC(C)(C)C[C@@H](C)[NH2+]C1CCS(=O)(=O)CC1	ZINC000036330915	292066115	/nfs/dbraw/zinc/06/61/15/292066115.db2.gz	IANXFWLFJNYMTL-SNVBAGLBSA-N	1	0	263.403	1.357	50	0		CDAARO
C[NH+](C)CCCNC(=O)C(=O)Nc1ccccc1Cl	ZINC000002850849	169837001	/nfs/dbraw/zinc/83/70/01/169837001.db2.gz	FPBDMRMJJYAWQF-UHFFFAOYSA-N	1	0	283.759	1.346	50	0		CDAARO
Cc1ccc(C)c(OCC(=O)NCCC[NH+](C)C)c1	ZINC000002960381	169845965	/nfs/dbraw/zinc/84/59/65/169845965.db2.gz	XZDBHIZBBYKFNY-UHFFFAOYSA-N	1	0	264.369	1.750	50	0		CDAARO
COc1cc(C[NH2+]C2CC2)cc(Cl)c1OCC(N)=O	ZINC000005269562	170081560	/nfs/dbraw/zinc/08/15/60/170081560.db2.gz	HNXQLOHCYMGDTC-UHFFFAOYSA-N	1	0	284.743	1.465	50	0		CDAARO
O=C1CCCN1C[C@H](O)C[NH2+]Cc1ccccc1Cl	ZINC000005764228	170138578	/nfs/dbraw/zinc/13/85/78/170138578.db2.gz	UHFGQXLGAWTHMF-GFCCVEGCSA-N	1	0	282.771	1.413	50	0		CDAARO
OCCOCC[NH2+]Cc1cccc(Br)c1	ZINC000006888781	170253368	/nfs/dbraw/zinc/25/33/68/170253368.db2.gz	XSUTYJFDWAAUOJ-UHFFFAOYSA-N	1	0	274.158	1.548	50	0		CDAARO
COC(=O)[C@H]1C[NH2+]C[C@H]1c1ccc(Br)cc1	ZINC000008699277	170346385	/nfs/dbraw/zinc/34/63/85/170346385.db2.gz	OHYNFAGOLZTLOM-QWRGUYRKSA-N	1	0	284.153	1.925	50	0		CDAARO
C[NH+](C)CCCNS(=O)(=O)Cc1cccc(Cl)c1	ZINC000010111488	170397840	/nfs/dbraw/zinc/39/78/40/170397840.db2.gz	GDGWOXZAPOVUSB-UHFFFAOYSA-N	1	0	290.816	1.711	50	0		CDAARO
CCCCC[C@H](C)NC(=O)C[NH+]1CCC(C(N)=O)CC1	ZINC000020940993	171281781	/nfs/dbraw/zinc/28/17/81/171281781.db2.gz	DDOKBSBNEKUPMJ-LBPRGKRZSA-N	1	0	283.416	1.269	50	0		CDAARO
O=C(NCCc1ccccc1F)C1CC[NH2+]CC1	ZINC000021951828	171339957	/nfs/dbraw/zinc/33/99/57/171339957.db2.gz	LEVNDHPMORXHQQ-UHFFFAOYSA-N	1	0	250.317	1.484	50	0		CDAARO
Cc1cc(C(=O)NCCC[NH+]2CCC(C)CC2)on1	ZINC000028068857	171546644	/nfs/dbraw/zinc/54/66/44/171546644.db2.gz	GEHAYOCMEGYQHM-UHFFFAOYSA-N	1	0	265.357	1.835	50	0		CDAARO
Cc1ccc(S(=O)(=O)N(C)[C@H]2CC[NH2+]C2)cc1C	ZINC000037539422	173259806	/nfs/dbraw/zinc/25/98/06/173259806.db2.gz	ITFFFPWOZGTRDY-LBPRGKRZSA-N	1	0	268.382	1.286	50	0		CDAARO
[NH3+]C1CCN(Cc2nc(-c3ccncc3)no2)CC1	ZINC000040351639	174244842	/nfs/dbraw/zinc/24/48/42/174244842.db2.gz	GLJMETSALDOSQX-UHFFFAOYSA-N	1	0	259.313	1.055	50	0		CDAARO
CNC(=O)c1cc(Oc2ccc(C[NH3+])cc2)ccn1	ZINC000043558768	175065270	/nfs/dbraw/zinc/06/52/70/175065270.db2.gz	MWOOZSDQWNBUOG-UHFFFAOYSA-N	1	0	257.293	1.692	50	0		CDAARO
CCCCCC[NH+]1CCC(n2cc(CO)nn2)CC1	ZINC000055041985	175567573	/nfs/dbraw/zinc/56/75/73/175567573.db2.gz	MPHGPPUZXPEYNW-UHFFFAOYSA-N	1	0	266.389	1.988	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)c2ccsc2)CC1	ZINC000064989813	175699957	/nfs/dbraw/zinc/69/99/57/175699957.db2.gz	FFZUDLSIXIKCOO-UHFFFAOYSA-N	1	0	268.382	1.589	50	0		CDAARO
CCNC(=O)NC[C@H]1CC[N@@H+](C2Cc3ccccc3C2)C1	ZINC000067713028	175786159	/nfs/dbraw/zinc/78/61/59/175786159.db2.gz	NCKSJFCKOOQPLW-CYBMUJFWSA-N	1	0	287.407	1.795	50	0		CDAARO
C[NH+]1CCC(CNC(=O)COCc2ccccc2)CC1	ZINC000067804261	175793572	/nfs/dbraw/zinc/79/35/72/175793572.db2.gz	KGKQDTURJBOKIX-UHFFFAOYSA-N	1	0	276.380	1.661	50	0		CDAARO
O=C(CN1CC[NH2+]CC1)NCc1ccc2sccc2c1	ZINC000071749714	176259566	/nfs/dbraw/zinc/25/95/66/176259566.db2.gz	TUUDYGUVNIAEDD-UHFFFAOYSA-N	1	0	289.404	1.423	50	0		CDAARO
COC(=O)[C@H](C[NH+]1CCCCC1)NC(=O)OC(C)(C)C	ZINC000071873608	176284446	/nfs/dbraw/zinc/28/44/46/176284446.db2.gz	WQQPQIUEXHEAKU-NSHDSACASA-N	1	0	286.372	1.539	50	0		CDAARO
O=C(C[C@H]1COCC[NH2+]1)NCc1ccc2c(c1)CCCO2	ZINC000072144780	176325042	/nfs/dbraw/zinc/32/50/42/176325042.db2.gz	IENAKKHJZLGRCR-AWEZNQCLSA-N	1	0	290.363	1.006	50	0		CDAARO
CCCc1cc(C(=O)N2CCC[C@@H]([NH3+])CC2)no1	ZINC000072153367	176328143	/nfs/dbraw/zinc/32/81/43/176328143.db2.gz	DNTXCEZEKYNEIY-SNVBAGLBSA-N	1	0	251.330	1.581	50	0		CDAARO
Cc1ccoc1C(=O)N1CCC[C@](O)(C[NH+](C)C)CC1	ZINC000072159016	176329567	/nfs/dbraw/zinc/32/95/67/176329567.db2.gz	YOPRVHDYOWWENW-OAHLLOKOSA-N	1	0	280.368	1.507	50	0		CDAARO
COCCNc1nc(C2CCCC2)nc2c1CC[NH2+]CC2	ZINC000072412425	176399113	/nfs/dbraw/zinc/39/91/13/176399113.db2.gz	REBCESGNTYBWQT-UHFFFAOYSA-N	1	0	290.411	1.881	50	0		CDAARO
O[C@]1(C[NH+]2CCCCC2)CCN(Cc2ccncc2)C1	ZINC000077503990	177276111	/nfs/dbraw/zinc/27/61/11/177276111.db2.gz	JOUJIJHPSIEXJL-INIZCTEOSA-N	1	0	275.396	1.504	50	0		CDAARO
C[N@@H+]1CC[C@H](NC(=O)c2ccc(Cl)cc2[O-])C1	ZINC000042375486	260185863	/nfs/dbraw/zinc/18/58/63/260185863.db2.gz	JUNRVGSGVKNRAC-VIFPVBQESA-N	1	0	254.717	1.480	50	0		CDAARO
C[C@H]1C[C@H](C(=O)N2CC[N@@H+]3C[C@H](O)C[C@H]3C2)CC(C)(C)C1	ZINC000655296011	424313760	/nfs/dbraw/zinc/31/37/60/424313760.db2.gz	KUDLAXRKMMEGNE-ZQDZILKHSA-N	1	0	294.439	1.726	50	0		CDAARO
C[C@@H]1C[N@H+](CC(C)(C)N2CCOCC2)C[C@@]1(O)C1CC1	ZINC000091988290	288143231	/nfs/dbraw/zinc/14/32/31/288143231.db2.gz	OCUUBMWGWYQRNB-CJNGLKHVSA-N	1	0	282.428	1.190	50	0		CDAARO
O=C([C@H]1CCCC[NH2+]1)N1CCC[C@@H](C(F)(F)F)C1	ZINC000037750004	280129481	/nfs/dbraw/zinc/12/94/81/280129481.db2.gz	GFZYGWFRPFUEFF-NXEZZACHSA-N	1	0	264.291	1.929	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)/C=C\c2c(F)cccc2F)C1	ZINC000255207697	289361369	/nfs/dbraw/zinc/36/13/69/289361369.db2.gz	ALAQADWFNWHIKY-JYESYGNLSA-N	1	0	266.291	1.928	50	0		CDAARO
Cc1nc(CCN(C)C(=O)[C@H](C)[NH+]2CCCCCC2)no1	ZINC000553306047	290110859	/nfs/dbraw/zinc/11/08/59/290110859.db2.gz	SNRNHPXFNXGHFP-LBPRGKRZSA-N	1	0	294.399	1.643	50	0		CDAARO
Cc1nc(C)c(C)c(NC[C@@H](O)C[NH+]2CCCCC2)n1	ZINC000091365226	293228710	/nfs/dbraw/zinc/22/87/10/293228710.db2.gz	NJHFZWVGXSMXKD-CQSZACIVSA-N	1	0	278.400	1.661	50	0		CDAARO
CO[C@H](C(=O)N1C[C@@H](C)[NH2+][C@H](C)C1)c1ccccc1	ZINC000246034815	294189097	/nfs/dbraw/zinc/18/90/97/294189097.db2.gz	PTSUVIJUOSNIQB-BZPMIXESSA-N	1	0	262.353	1.583	50	0		CDAARO
O=C(Cc1cnn(-c2ccccc2)c1)NC[C@H]1CCC[NH2+]1	ZINC000178719032	315958798	/nfs/dbraw/zinc/95/87/98/315958798.db2.gz	DXJWKIAQQVGYOB-CQSZACIVSA-N	1	0	284.363	1.283	50	0		CDAARO
CC(C)[C@H](CNC(=O)Cn1nc2ccccc2n1)[NH+](C)C	ZINC000534580360	328311468	/nfs/dbraw/zinc/31/14/68/328311468.db2.gz	IVKKDXSVMSYVIZ-AWEZNQCLSA-N	1	0	289.383	1.134	50	0		CDAARO
[NH3+][C@H]1[C@@H]2CC[C@H]1CN(C(=O)[C@H](O)C1CCCCC1)C2	ZINC000534632914	328332005	/nfs/dbraw/zinc/33/20/05/328332005.db2.gz	UCODLAGAERKAGG-ZOBORPQBSA-N	1	0	266.385	1.123	50	0		CDAARO
COc1cc(NCC2(C[NH+]3CCCC3)CC2)nc(OC)n1	ZINC000534634278	328333196	/nfs/dbraw/zinc/33/31/96/328333196.db2.gz	CWDMWJBKXCNLPI-UHFFFAOYSA-N	1	0	292.383	1.782	50	0		CDAARO
Cn1ccnc1C(=O)N[C@H](CC[NH+](C)C)c1ccccc1	ZINC000534639463	328335458	/nfs/dbraw/zinc/33/54/58/328335458.db2.gz	KEQGGMQKCHGXIG-CQSZACIVSA-N	1	0	286.379	1.843	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)N[C@H]1COC2(C1)CCCCC2	ZINC000534640854	328336070	/nfs/dbraw/zinc/33/60/70/328336070.db2.gz	BMCXMMHJJHLTKR-CQSZACIVSA-N	1	0	280.412	1.984	50	0		CDAARO
CC[C@@H](C[NH+](C)C)NC(=O)N(C)Cc1ccnc(C)c1	ZINC000534647367	328342849	/nfs/dbraw/zinc/34/28/49/328342849.db2.gz	ZEMPURSZHWRVKW-AWEZNQCLSA-N	1	0	278.400	1.872	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]C2CC[NH+](CC(=O)[O-])CC2)n1	ZINC000534647253	328342887	/nfs/dbraw/zinc/34/28/87/328342887.db2.gz	YUTUTSGWXBRUFF-LBPRGKRZSA-N	1	0	294.399	1.027	50	0		CDAARO
Fc1ccc(N2CC[C@@H]([NH2+]CCn3cncn3)C2)cc1	ZINC000534668543	328346304	/nfs/dbraw/zinc/34/63/04/328346304.db2.gz	LLVYYZVZIJRVNP-CYBMUJFWSA-N	1	0	275.331	1.286	50	0		CDAARO
COC[C@@H](O)C[NH2+][C@H](C)[C@H]1COc2ccccc21	ZINC000185576329	323392704	/nfs/dbraw/zinc/39/27/04/323392704.db2.gz	FEMHEBPCTAKINK-NTZNESFSSA-N	1	0	251.326	1.148	50	0		CDAARO
C[C@@H](C[NH+]1CCCC1)Nc1ncc(F)c(N(C)C)n1	ZINC001772703851	1159438921	/nfs/dbraw/zinc/43/89/21/1159438921.db2.gz	JRYKWTYSYUNESE-JTQLQIEISA-N	1	0	267.352	1.578	50	0		CDAARO
Cn1ccnc1CC[N@@H+]1CC[C@H](O)CC(C)(C)C1	ZINC000395364874	1159633426	/nfs/dbraw/zinc/63/34/26/1159633426.db2.gz	YPCXKSDYQDOKOW-LBPRGKRZSA-N	1	0	251.374	1.446	50	0		CDAARO
COCc1nc(C)cc(N2CC[N@H+](C)C(C)(C)C2)n1	ZINC000585092038	482826979	/nfs/dbraw/zinc/82/69/79/482826979.db2.gz	BYAPUQWCAAQJQN-UHFFFAOYSA-N	1	0	264.373	1.462	50	0		CDAARO
COc1ccc(C[N@@H+]2C[C@H](O)[C@@H](OC)C2)c(C)c1	ZINC000670436991	482975132	/nfs/dbraw/zinc/97/51/32/482975132.db2.gz	IMWUIBOZMGABQX-KBPBESRZSA-N	1	0	251.326	1.195	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN(C(=O)c2ccc(Cl)cn2)C1	ZINC000670444731	482992112	/nfs/dbraw/zinc/99/21/12/482992112.db2.gz	BKAQJFJQSVFWSI-LLVKDONJSA-N	1	0	297.786	1.385	50	0		CDAARO
Fc1ccc(OC2CC[NH+](CCn3cnnc3)CC2)cc1	ZINC000670456108	483033507	/nfs/dbraw/zinc/03/35/07/483033507.db2.gz	MKHROTLKDWBVSS-UHFFFAOYSA-N	1	0	290.342	1.961	50	0		CDAARO
CC[NH+]1CCN(Cc2ncnn2-c2ccc(C)cc2)CC1	ZINC000670456161	483034624	/nfs/dbraw/zinc/03/46/24/483034624.db2.gz	AXCKKWGTSYGHAY-UHFFFAOYSA-N	1	0	285.395	1.713	50	0		CDAARO
Cc1nc(CN2CCC([NH+](C)C)CC2)n(C)c1C	ZINC000670459226	483041017	/nfs/dbraw/zinc/04/10/17/483041017.db2.gz	TUFIORKSAJEXHW-UHFFFAOYSA-N	1	0	250.390	1.563	50	0		CDAARO
CC1(C)CCC[C@@H]([NH2+]CCc2nc(N)cc(=O)[nH]2)C1	ZINC000670463562	483054382	/nfs/dbraw/zinc/05/43/82/483054382.db2.gz	ZYURYBPJGRDMPU-SNVBAGLBSA-N	1	0	264.373	1.865	50	0		CDAARO
Cn1nc(C(N)=O)c2c1CC[N@H+](C[C@@H]1CC=CCC1)C2	ZINC000670468959	483061138	/nfs/dbraw/zinc/06/11/38/483061138.db2.gz	KRPMTSKVDUDMTO-LLVKDONJSA-N	1	0	274.368	1.233	50	0		CDAARO
COc1ccc(O)cc1C[N@@H+]1CC[C@H](C(C)(C)O)C1	ZINC000670469486	483064640	/nfs/dbraw/zinc/06/46/40/483064640.db2.gz	AASZCPLCUDSUAK-LBPRGKRZSA-N	1	0	265.353	1.994	50	0		CDAARO
COCC1CC[NH+](Cc2c(CO)cnc(C)c2O)CC1	ZINC000670472126	483078670	/nfs/dbraw/zinc/07/86/70/483078670.db2.gz	KMLANVDVAOKJGS-UHFFFAOYSA-N	1	0	280.368	1.446	50	0		CDAARO
Cc1ncc(CO)c(C[N@@H+]2CC[C@H](O)CC(C)(C)C2)c1O	ZINC000670472798	483081750	/nfs/dbraw/zinc/08/17/50/483081750.db2.gz	GTLJQIHQAIACIZ-ZDUSSCGKSA-N	1	0	294.395	1.571	50	0		CDAARO
CCCc1nc(NCCC[N@@H+]2CCCC[C@H]2CO)no1	ZINC000670474176	483083259	/nfs/dbraw/zinc/08/32/59/483083259.db2.gz	KSXUMKQJDPXUSQ-LBPRGKRZSA-N	1	0	282.388	1.671	50	0		CDAARO
COCCNC(=O)N1CCC[C@@H]([NH2+]Cc2ccccc2)C1	ZINC000083911524	483219125	/nfs/dbraw/zinc/21/91/25/483219125.db2.gz	XJOVKYKLFUHYGY-OAHLLOKOSA-N	1	0	291.395	1.597	50	0		CDAARO
C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=S)NC1CC1	ZINC000084697504	483313890	/nfs/dbraw/zinc/31/38/90/483313890.db2.gz	XMNLAYJWJNEKLD-GHMZBOCLSA-N	1	0	255.431	1.733	50	0		CDAARO
C[C@H](C[N@@H+]1CCC[C@H](C)C1)NC(=S)NC1CC1	ZINC000084697505	483313914	/nfs/dbraw/zinc/31/39/14/483313914.db2.gz	XMNLAYJWJNEKLD-WDEREUQCSA-N	1	0	255.431	1.733	50	0		CDAARO
CC[C@H]1CN(C(=O)c2nc(C)ncc2Cl)C[C@@H]1[NH+](C)C	ZINC000084735548	483320300	/nfs/dbraw/zinc/32/03/00/483320300.db2.gz	BZQMGPDBQLHRLG-JQWIXIFHSA-N	1	0	296.802	1.851	50	0		CDAARO
CC(C)C[NH+]1CCN(C(=O)c2csc(N)n2)CC1	ZINC000055187817	519725324	/nfs/dbraw/zinc/72/53/24/519725324.db2.gz	BBHMYYHFPZMJPT-UHFFFAOYSA-N	1	0	268.386	1.139	50	0		CDAARO
C[NH+]1CCN(CCOCCOc2ccccc2)CC1	ZINC000022033903	523903519	/nfs/dbraw/zinc/90/35/19/523903519.db2.gz	KOCGGNHEUHFWFS-UHFFFAOYSA-N	1	0	264.369	1.329	50	0		CDAARO
Cc1ccc(C[NH2+]CCCSc2nnnn2C)cc1	ZINC000004993794	524574942	/nfs/dbraw/zinc/57/49/42/524574942.db2.gz	CTINQLBTDIXOMG-UHFFFAOYSA-N	1	0	277.397	1.791	50	0		CDAARO
CC[N@H+](C)CCNC(=O)c1ccn(C2CCCC2)n1	ZINC000096476107	527800276	/nfs/dbraw/zinc/80/02/76/527800276.db2.gz	FXANPYXFLKQPCZ-UHFFFAOYSA-N	1	0	264.373	1.680	50	0		CDAARO
CCN(CC)C(=O)Nc1cnn(CC[NH+](C)C)c1	ZINC000096447204	528047004	/nfs/dbraw/zinc/04/70/04/528047004.db2.gz	VJORNFZCTFBARA-UHFFFAOYSA-N	1	0	253.350	1.318	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNc1nc2ccccc2c(=O)[nH]1	ZINC000097994933	529105911	/nfs/dbraw/zinc/10/59/11/529105911.db2.gz	VTCBYSNYPAAOCV-NSHDSACASA-N	1	0	272.352	1.819	50	0		CDAARO
CC(C)[C@@H]([NH3+])C1(O)CCN(C(=O)OC(C)(C)C)CC1	ZINC000958528835	614117370	/nfs/dbraw/zinc/11/73/70/614117370.db2.gz	WFQSEHNXRWRGCT-LLVKDONJSA-N	1	0	272.389	1.732	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@](O)([C@@H]([NH3+])C2CC2)C1	ZINC000958528667	613975548	/nfs/dbraw/zinc/97/55/48/613975548.db2.gz	YNRQQSMQLYYSCJ-SMDDNHRTSA-N	1	0	270.373	1.486	50	0		CDAARO
C[N@@H+](Cc1cncnc1)C[C@H]1CC(=O)N(C(C)(C)C)C1	ZINC000952964168	616095337	/nfs/dbraw/zinc/09/53/37/616095337.db2.gz	OAEXGAQUGZIOOE-GFCCVEGCSA-N	1	0	276.384	1.555	50	0		CDAARO
CN1CCC[C@](O)(C[NH2+]Cc2cccc3ccccc32)C1=O	ZINC000012198217	695511995	/nfs/dbraw/zinc/51/19/95/695511995.db2.gz	MMYGTFAURTYPGB-SFHVURJKSA-N	1	0	298.386	1.913	50	0		CDAARO
Cc1nc2c(c(N3C[C@@H]4CC=CC[C@@H]4C3)n1)CC[NH2+]CC2	ZINC000065398523	695810089	/nfs/dbraw/zinc/81/00/89/695810089.db2.gz	NANLNDMZXNIVSX-OKILXGFUSA-N	1	0	284.407	1.876	50	0		CDAARO
O[C@@H]1CCCC[C@@H]1[NH+]1CCN(c2ccccn2)CC1	ZINC000037490803	695866383	/nfs/dbraw/zinc/86/63/83/695866383.db2.gz	LYOQPSGCAAWIMC-UONOGXRCSA-N	1	0	261.369	1.507	50	0		CDAARO
COc1cccc(CC[C@@H]2CCC[N@@H+](C(CO)CO)C2)c1	ZINC000071771485	724194908	/nfs/dbraw/zinc/19/49/08/724194908.db2.gz	DOZJALHNHNLKPO-HNNXBMFYSA-N	1	0	293.407	1.693	50	0		CDAARO
CCc1[nH]nc2c1CN(CC[N@@H+]1C[C@H]3CC[C@@H]1C3)CC2	ZINC000244884402	724678405	/nfs/dbraw/zinc/67/84/05/724678405.db2.gz	YLSJYGJHZXTWPD-QWHCGFSZSA-N	1	0	274.412	1.815	50	0		CDAARO
COCC(=O)N1CCC[C@@H]2C[N@H+](CCC(C)C)CC[C@H]21	ZINC000014988406	725326470	/nfs/dbraw/zinc/32/64/70/725326470.db2.gz	KREXSOMVIYICPC-HUUCEWRRSA-N	1	0	282.428	1.992	50	0		CDAARO
Cc1cnn(CCCNC(=O)C(C)(C)[NH+]2CCCC2)c1	ZINC000426395935	725368356	/nfs/dbraw/zinc/36/83/56/725368356.db2.gz	JWEKGSNCYBHDHQ-UHFFFAOYSA-N	1	0	278.400	1.572	50	0		CDAARO
Cc1ncn(C)c1C(=O)NCCNc1cc(C)cc[nH+]1	ZINC000426552017	725439852	/nfs/dbraw/zinc/43/98/52/725439852.db2.gz	NUIQSFPMGUBZGT-UHFFFAOYSA-N	1	0	273.340	1.274	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000193269211	725707444	/nfs/dbraw/zinc/70/74/44/725707444.db2.gz	KHDHDRVFYYDYGM-GFCCVEGCSA-N	1	0	268.382	1.231	50	0		CDAARO
OC[C@@H]1CCC[N@H+](CCNCc2cnccc2Cl)C1	ZINC000952868637	910415952	/nfs/dbraw/zinc/41/59/52/910415952.db2.gz	BVZZVAIXCAJLCF-GFCCVEGCSA-N	1	0	283.803	1.529	50	0		CDAARO
CCn1nnc(C)c1CN1Cc2c[nH]nc2C[C@H](C)C1	ZINC000952884042	910457916	/nfs/dbraw/zinc/45/79/16/910457916.db2.gz	SEYKCEGZTCMNLZ-JTQLQIEISA-N	1	0	274.372	1.524	50	0		CDAARO
CCC1CCC(CNC(=O)[C@@]2([NH3+])CC[C@H](O)C2)CC1	ZINC000952884279	910458017	/nfs/dbraw/zinc/45/80/17/910458017.db2.gz	XTXQQAOIFVBRIA-NSOJWWLLSA-N	1	0	268.401	1.561	50	0		CDAARO
Cc1cccc(C[NH2+]CCN2CCCC[C@@H]2CO)n1	ZINC000952976182	910522771	/nfs/dbraw/zinc/52/27/71/910522771.db2.gz	MTLLPRYBVVWULZ-OAHLLOKOSA-N	1	0	263.385	1.326	50	0		CDAARO
CC[N@H+](C)[C@@H](C)CCNC(=O)N1CC(c2ccncc2)C1	ZINC000823065550	925666670	/nfs/dbraw/zinc/66/66/70/925666670.db2.gz	LXKLDZUMBQJCPK-ZDUSSCGKSA-N	1	0	290.411	1.921	50	0		CDAARO
CC(C)[C@@H](O)C(=O)N(C)Cc1ccc2c(c1)C[N@@H+](C)C2	ZINC000823806406	925730403	/nfs/dbraw/zinc/73/04/03/925730403.db2.gz	RPWNDIPJBWOZIC-OAHLLOKOSA-N	1	0	276.380	1.607	50	0		CDAARO
Cn1c(Sc2ccncc2)nnc1C1CC[NH2+]CC1	ZINC000825631139	925874680	/nfs/dbraw/zinc/87/46/80/925874680.db2.gz	FQYKMHVDOIFICC-UHFFFAOYSA-N	1	0	275.381	1.828	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)N[C@H]1CC[C@H](O)CC1	ZINC000828865323	926202522	/nfs/dbraw/zinc/20/25/22/926202522.db2.gz	LFNUILXQKSYECC-JHJVBQTASA-N	1	0	254.374	1.281	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@@H]1C(=O)NC1(CO)CCSCC1	ZINC000585120797	930991945	/nfs/dbraw/zinc/99/19/45/930991945.db2.gz	LTRSAISANGHLAB-LLVKDONJSA-N	1	0	286.441	1.234	50	0		CDAARO
CCc1c(C)noc1NC(=O)[C@]1(C)CC[N@H+](C)C1	ZINC001529119351	968986974	/nfs/dbraw/zinc/98/69/74/968986974.db2.gz	FNRRWOOVVOKJHB-CYBMUJFWSA-N	1	0	251.330	1.826	50	0		CDAARO
OCC1CC[NH+]([C@H]2CCN(c3ccccc3)C2)CC1	ZINC001506412505	975153794	/nfs/dbraw/zinc/15/37/94/975153794.db2.gz	ZHLDQLCMXUMVIE-INIZCTEOSA-N	1	0	260.381	1.970	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CCCn2ccnc2)n1	ZINC001506416663	975155253	/nfs/dbraw/zinc/15/52/53/975155253.db2.gz	KLMBRDKOHTWFQS-CYBMUJFWSA-N	1	0	261.373	1.765	50	0		CDAARO
C[C@H](CNC(=O)[C@H](C)[NH+]1CCCCCC1)Cn1ccnc1	ZINC000096446805	230374817	/nfs/dbraw/zinc/37/48/17/230374817.db2.gz	HBFKEXVBNRJNAD-CABCVRRESA-N	1	0	292.427	1.900	50	0		CDAARO
Cc1nnc(CN2CC[N@@H+](C)CC23CCCCC3)o1	ZINC000096455364	230377190	/nfs/dbraw/zinc/37/71/90/230377190.db2.gz	OAIZZTLIQOAEBR-UHFFFAOYSA-N	1	0	264.373	1.828	50	0		CDAARO
COc1cccc([C@@H]2C[C@@H]2C(=O)N2CC[NH2+]C[C@H]2C)c1	ZINC000124351194	187134113	/nfs/dbraw/zinc/13/41/13/187134113.db2.gz	YNGHHRANQQACSL-UGFHNGPFSA-N	1	0	274.364	1.619	50	0		CDAARO
CCc1nnc(CNC(=O)CC2CC[NH+](CC)CC2)s1	ZINC000095530952	185004583	/nfs/dbraw/zinc/00/45/83/185004583.db2.gz	QGMJMBADTSKEQU-UHFFFAOYSA-N	1	0	296.440	1.839	50	0		CDAARO
COc1ccc(C[NH2+][C@H](CCO)C2CCOCC2)cn1	ZINC000095943048	185037135	/nfs/dbraw/zinc/03/71/35/185037135.db2.gz	XNAPIFXNJFYSTK-CQSZACIVSA-N	1	0	280.368	1.357	50	0		CDAARO
COc1ccc2oc(C[NH2+]C(C)(CO)CO)cc2c1	ZINC000095997190	185061332	/nfs/dbraw/zinc/06/13/32/185061332.db2.gz	IKTDFFILAKFIIO-UHFFFAOYSA-N	1	0	265.309	1.274	50	0		CDAARO
c1cnn(CCC2CC[NH+](C[C@H]3COCCO3)CC2)c1	ZINC000241081848	361750743	/nfs/dbraw/zinc/75/07/43/361750743.db2.gz	YRAXYEBGKAGZFL-HNNXBMFYSA-N	1	0	279.384	1.401	50	0		CDAARO
C[C@@H](NC(=O)NC1CC[NH+](C)CC1)c1ccncc1F	ZINC000241634576	361753400	/nfs/dbraw/zinc/75/34/00/361753400.db2.gz	PNNOGVGHALLXSQ-SNVBAGLBSA-N	1	0	280.347	1.675	50	0		CDAARO
COC(=O)C1(C[NH2+]Cc2ccccc2F)CCOCC1	ZINC000195560548	342628573	/nfs/dbraw/zinc/62/85/73/342628573.db2.gz	FWYYCPDTBAREON-UHFFFAOYSA-N	1	0	281.327	1.885	50	0		CDAARO
Cc1ncccc1C[NH2+][C@H]1CCCCC[C@H]1C(N)=O	ZINC000195562104	342628601	/nfs/dbraw/zinc/62/86/01/342628601.db2.gz	OHKSSBGAJCFZEK-KGLIPLIRSA-N	1	0	261.369	1.914	50	0		CDAARO
CC(C)[NH+]1CCC(c2nc(CN3CCOCC3)no2)CC1	ZINC000096148611	185107461	/nfs/dbraw/zinc/10/74/61/185107461.db2.gz	APPPISMASWFBKD-UHFFFAOYSA-N	1	0	294.399	1.490	50	0		CDAARO
Nc1nc(NCCCc2cccnc2)cc([C@H]2C[C@@H](O)C2)[nH+]1	ZINC000244724653	361860040	/nfs/dbraw/zinc/86/00/40/361860040.db2.gz	MYCNUPGLZZZSKY-BETUJISGSA-N	1	0	299.378	1.737	50	0		CDAARO
C[N@H+](CCn1cc[nH]c1=O)Cc1ccc2nsnc2c1	ZINC000244724251	361860284	/nfs/dbraw/zinc/86/02/84/361860284.db2.gz	MQOSABVHHJPSAH-UHFFFAOYSA-N	1	0	289.364	1.313	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1cc(F)ccc1Cl	ZINC000097229381	342204879	/nfs/dbraw/zinc/20/48/79/342204879.db2.gz	LZXDNXIQJHKPAB-SECBINFHSA-N	1	0	294.779	1.885	50	0		CDAARO
Cc1cc(S(=O)(=O)N(C)C2CCC([NH3+])CC2)c(C)o1	ZINC000097235007	342205656	/nfs/dbraw/zinc/20/56/56/342205656.db2.gz	UYCYSPZERNQWGK-UHFFFAOYSA-N	1	0	286.397	1.787	50	0		CDAARO
CN(C[C@@H]1CCCCO1)[C@@H]1CCC[C@H]1S(C)(=O)=O	ZINC000245339366	342216319	/nfs/dbraw/zinc/21/63/19/342216319.db2.gz	SGQPAUNMPHTOCQ-YNEHKIRRSA-N	1	0	275.414	1.453	50	0		CDAARO
C[C@@H]([NH2+]C[C@H](c1ccco1)N1CCCC1)c1cnnn1C	ZINC000585134845	342215663	/nfs/dbraw/zinc/21/56/63/342215663.db2.gz	LVTGDIZJMGHJQX-TZMCWYRMSA-N	1	0	289.383	1.896	50	0		CDAARO
Cc1cc(S(=O)(=O)N[C@@H]2C[N@@H+](C)C[C@H]2C)ccc1F	ZINC000685939526	539045641	/nfs/dbraw/zinc/04/56/41/539045641.db2.gz	XKNJIQIIMXAVOD-ZWNOBZJWSA-N	1	0	286.372	1.363	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@H]2COc3ccccc32)C[C@H]1[NH+](C)C	ZINC000685939524	539045686	/nfs/dbraw/zinc/04/56/86/539045686.db2.gz	JYZXTYZNUKKJFX-VHDGCEQUSA-N	1	0	288.391	1.961	50	0		CDAARO
CC(C)N1C(=O)N[C@]2(CC[N@H+](CC3CCC3)C2)C1=O	ZINC000084597326	342265263	/nfs/dbraw/zinc/26/52/63/342265263.db2.gz	YISRXVVNELLTFS-AWEZNQCLSA-N	1	0	265.357	1.191	50	0		CDAARO
CCOc1ccc([C@@H]2C[C@H]2[NH2+]Cc2cnnn2C)cc1	ZINC000585118690	362037516	/nfs/dbraw/zinc/03/75/16/362037516.db2.gz	YIGOSHGQKJVJTF-LSDHHAIUSA-N	1	0	272.352	1.860	50	0		CDAARO
Cc1ccoc1C[NH2+][C@@H]1CCN(S(C)(=O)=O)C[C@H]1C	ZINC000252677491	342399757	/nfs/dbraw/zinc/39/97/57/342399757.db2.gz	YXNPSEWFILOMGP-VXGBXAGGSA-N	1	0	286.397	1.348	50	0		CDAARO
C[C@@H](C(=O)N(C)C1CCCCC1)[N@@H+]1CC[C@H](O)C1	ZINC000095435356	342431665	/nfs/dbraw/zinc/43/16/65/342431665.db2.gz	IXTMVQZSFCICEK-AAEUAGOBSA-N	1	0	254.374	1.233	50	0		CDAARO
CCOc1cc(C(=O)N2CC[C@@H](C[NH3+])C2)ccc1C	ZINC000178543703	362246962	/nfs/dbraw/zinc/24/69/62/362246962.db2.gz	KCFUFQRLFHEOPQ-LBPRGKRZSA-N	1	0	262.353	1.815	50	0		CDAARO
C[N@H+](CCNC(=O)[C@@H]1CCCOC1)Cc1ccc(F)cc1	ZINC000096451690	529916107	/nfs/dbraw/zinc/91/61/07/529916107.db2.gz	UFPLUBHHLNLWOG-CQSZACIVSA-N	1	0	294.370	1.800	50	0		CDAARO
CC(C)CNC(=O)NC(=O)[C@@H](C)SCC[NH+](C)C	ZINC000084544318	362266509	/nfs/dbraw/zinc/26/65/09/362266509.db2.gz	GHUSLGAGGUYVTB-SNVBAGLBSA-N	1	0	275.418	1.152	50	0		CDAARO
CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2cccnc2)[C@H](C)C1	ZINC000084779981	362271652	/nfs/dbraw/zinc/27/16/52/362271652.db2.gz	QEBKOQHVRPOVJF-HIFRSBDPSA-N	1	0	290.411	1.953	50	0		CDAARO
CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2cccnc2)[C@H](C)C1	ZINC000084779984	362272055	/nfs/dbraw/zinc/27/20/55/362272055.db2.gz	QEBKOQHVRPOVJF-UKRRQHHQSA-N	1	0	290.411	1.953	50	0		CDAARO
Cn1ccnc1C(=O)NC[C@H]1CC[N@@H+](C2CCCCC2)C1	ZINC000252478846	362384229	/nfs/dbraw/zinc/38/42/29/362384229.db2.gz	AVXZPFUVPREEMK-CYBMUJFWSA-N	1	0	290.411	1.805	50	0		CDAARO
CCc1nnc(CN(C)C[C@H]2CC[N@@H+](CC)C2)o1	ZINC000252481350	362385856	/nfs/dbraw/zinc/38/58/56/362385856.db2.gz	CJOBCQXLDYKQIW-LLVKDONJSA-N	1	0	252.362	1.406	50	0		CDAARO
C[C@H]1CN(C(=O)Cc2ccccc2Br)CC[NH2+]1	ZINC000084719038	178920620	/nfs/dbraw/zinc/92/06/20/178920620.db2.gz	YGZAZVQXFWYICQ-JTQLQIEISA-N	1	0	297.196	1.812	50	0		CDAARO
[NH3+]CCCCCCNC(=O)c1ccccc1-n1cnnc1	ZINC000097514452	185620742	/nfs/dbraw/zinc/62/07/42/185620742.db2.gz	OJHZTIXOVVNLIM-UHFFFAOYSA-N	1	0	287.367	1.516	50	0		CDAARO
Cc1ccccc1C[NH2+]CC1(C(N)=O)CCOCC1	ZINC000086250823	179256205	/nfs/dbraw/zinc/25/62/05/179256205.db2.gz	AKRQGOPOSILWTE-UHFFFAOYSA-N	1	0	262.353	1.367	50	0		CDAARO
COC(=O)c1c[nH]c(SCc2nccn2C)n1	ZINC000193543110	362934674	/nfs/dbraw/zinc/93/46/74/362934674.db2.gz	SNGYVVAYPSQDAE-UHFFFAOYSA-N	1	0	252.299	1.222	50	0		CDAARO
C[C@@H](Cn1ccnc1)[NH2+]CC(C)(C)N1CCCC1	ZINC000584896518	349358129	/nfs/dbraw/zinc/35/81/29/349358129.db2.gz	LBXAKDMITGSSEB-ZDUSSCGKSA-N	1	0	250.390	1.736	50	0		CDAARO
CCOCCC(=O)N(C)C[C@H]1CC[N@H+](C)C1(C)C	ZINC000584887489	349345086	/nfs/dbraw/zinc/34/50/86/349345086.db2.gz	GJEUOABMLMQDAV-GFCCVEGCSA-N	1	0	256.390	1.602	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN(C(=O)c2ccncc2Cl)C1	ZINC000584896807	349358426	/nfs/dbraw/zinc/35/84/26/349358426.db2.gz	OXKQQOSKAMRELY-NSHDSACASA-N	1	0	297.786	1.385	50	0		CDAARO
CCOC(=O)N1CC[C@H]([NH2+]CCn2ccnc2C)C1	ZINC000584888074	349346482	/nfs/dbraw/zinc/34/64/82/349346482.db2.gz	XYBWXCHDSGRXRX-LBPRGKRZSA-N	1	0	266.345	1.012	50	0		CDAARO
CC[NH+](CC)[C@@H]1CCN(C(=O)Nc2cccnn2)C1	ZINC000089967863	179893796	/nfs/dbraw/zinc/89/37/96/179893796.db2.gz	YXFXAFVXHKSCJI-LLVKDONJSA-N	1	0	263.345	1.425	50	0		CDAARO
CC1(C(=O)N2CCC[C@@H](C[NH+]3CCCC3)C2)COC1	ZINC000584897771	349359250	/nfs/dbraw/zinc/35/92/50/349359250.db2.gz	HYDDKUGSYVDQJT-ZDUSSCGKSA-N	1	0	266.385	1.357	50	0		CDAARO
Cc1ccccc1CN1CCN(C2CC[NH2+]CC2)C1=O	ZINC000091499808	180174858	/nfs/dbraw/zinc/17/48/58/180174858.db2.gz	IUORBQMUQQJZDO-UHFFFAOYSA-N	1	0	273.380	1.985	50	0		CDAARO
CCn1cc(C(=O)N2C[C@H]([NH+](C)C)[C@@H](C(C)C)C2)cn1	ZINC000091644641	180215050	/nfs/dbraw/zinc/21/50/50/180215050.db2.gz	DFEZYAJVBVPYKY-KGLIPLIRSA-N	1	0	278.400	1.561	50	0		CDAARO
CC1(C)C[N@H+](CC(=O)NCCc2ccccc2)C[C@]1(C)O	ZINC000091943117	180290017	/nfs/dbraw/zinc/29/00/17/180290017.db2.gz	LDOFJLDKRCXNNH-KRWDZBQOSA-N	1	0	290.407	1.438	50	0		CDAARO
CC(C)[C@H]1CN(S(=O)(=O)N2CCCCCC2)C[C@@H]1[NH3+]	ZINC000091914833	180285833	/nfs/dbraw/zinc/28/58/33/180285833.db2.gz	AUJFOVUYOIQFHI-OLZOCXBDSA-N	1	0	289.445	1.022	50	0		CDAARO
CCn1c(Cn2ccnc2C)nnc1C1CC[NH+](C)CC1	ZINC000092046105	180310832	/nfs/dbraw/zinc/31/08/32/180310832.db2.gz	FMYNLKVELRESNE-UHFFFAOYSA-N	1	0	288.399	1.660	50	0		CDAARO
CC1=C[C@H](C)[C@@H]2C(=O)N(Cc3ccc[n+](C)c3)C(=O)[C@H]2C1	ZINC000105747006	186069676	/nfs/dbraw/zinc/06/96/76/186069676.db2.gz	PYBDZRRKYOKDCJ-QEJZJMRPSA-N	1	0	285.367	1.598	50	0		CDAARO
O=C(NC[C@@H]1CCC[NH2+]1)[C@@H]1CSc2ccccc21	ZINC000092239278	180351019	/nfs/dbraw/zinc/35/10/19/180351019.db2.gz	YNHMBSBXVYSPSK-CMPLNLGQSA-N	1	0	262.378	1.744	50	0		CDAARO
CC[C@H]1CN(Cc2cc(C)on2)CC[N@@H+]1C[C@H](C)O	ZINC000106906703	186149384	/nfs/dbraw/zinc/14/93/84/186149384.db2.gz	GSVZITIQDWVRKN-FZMZJTMJSA-N	1	0	267.373	1.260	50	0		CDAARO
CCCC[N@@H+]1CCCC[C@H]1CNC(=O)NC[C@H]1CCOC1	ZINC000106847948	186141674	/nfs/dbraw/zinc/14/16/74/186141674.db2.gz	CHYJKRZWTAWBNW-CABCVRRESA-N	1	0	297.443	1.977	50	0		CDAARO
C[NH+](C)[C@H]1CCN([C@H]2CCCN(CC(C)(C)C)C2=O)C1	ZINC000583650931	366007229	/nfs/dbraw/zinc/00/72/29/366007229.db2.gz	CYZVTJOBSLETAL-KBPBESRZSA-N	1	0	281.444	1.659	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1cc(Br)no1	ZINC000583651167	366008235	/nfs/dbraw/zinc/00/82/35/366008235.db2.gz	ILETUCHKKINPJE-UHFFFAOYSA-N	1	0	290.161	1.509	50	0		CDAARO
O=c1ccc(N2CC[NH+](Cc3ccccc3)CC2)n[nH]1	ZINC000034124899	363007774	/nfs/dbraw/zinc/00/77/74/363007774.db2.gz	XRBIDNDPWPZTIL-UHFFFAOYSA-N	1	0	270.336	1.504	50	0		CDAARO
COC(=O)[C@]1(C[NH3+])C[C@]12CCN(C(=O)OC(C)(C)C)C2	ZINC000260106103	351202415	/nfs/dbraw/zinc/20/24/15/351202415.db2.gz	GXIZSJFUUBKNJU-UONOGXRCSA-N	1	0	284.356	1.135	50	0		CDAARO
Cn1nccc1CCC(=O)N1CCC([NH+]2CCCC2)CC1	ZINC000120016104	186869594	/nfs/dbraw/zinc/86/95/94/186869594.db2.gz	FFRNAOVJJCSCIM-UHFFFAOYSA-N	1	0	290.411	1.440	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@H]1NC(=O)c1ccc(F)c(F)c1F	ZINC000094184054	363241929	/nfs/dbraw/zinc/24/19/29/363241929.db2.gz	HSIKYTHLJKUCGT-GMSGAONNSA-N	1	0	272.270	1.974	50	0		CDAARO
CC1CC[NH+](C[C@@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000000568045	355917049	/nfs/dbraw/zinc/91/70/49/355917049.db2.gz	PCRLUFLYQKUTQV-CYBMUJFWSA-N	1	0	293.363	1.887	50	0		CDAARO
C[C@@H](O)C[NH+](Cc1cccc(Cl)c1)C[C@@H](C)O	ZINC000000042119	355881265	/nfs/dbraw/zinc/88/12/65/355881265.db2.gz	FRGASYAUZXLUDE-GHMZBOCLSA-N	1	0	257.761	1.904	50	0		CDAARO
CCOC(=O)c1cc(C(=O)OCC)c(C)[n+](C)c1C	ZINC000002519725	355972560	/nfs/dbraw/zinc/97/25/60/355972560.db2.gz	BZWIZGKGPWOKCZ-UHFFFAOYSA-N	1	0	266.317	1.481	50	0		CDAARO
O=c1ccc(-c2cccs2)nn1C1CC[NH2+]CC1	ZINC000004343368	356028484	/nfs/dbraw/zinc/02/84/84/356028484.db2.gz	JXLJIFNULQJUMY-UHFFFAOYSA-N	1	0	261.350	1.896	50	0		CDAARO
CCOc1ccc(Cl)cc1C[NH2+]CCOCCO	ZINC000010435714	356258259	/nfs/dbraw/zinc/25/82/59/356258259.db2.gz	FQVFOISDGFPJEK-UHFFFAOYSA-N	1	0	273.760	1.837	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1C	ZINC000014190361	356379086	/nfs/dbraw/zinc/37/90/86/356379086.db2.gz	DKLBPLAMIHXGIV-RYUDHWBXSA-N	1	0	277.368	1.798	50	0		CDAARO
OC[C@@H]1CCC[N@H+](Cc2cc(F)cc3c2OCOC3)C1	ZINC000016047121	356429945	/nfs/dbraw/zinc/42/99/45/356429945.db2.gz	PFJHBDFPOOKYCC-LLVKDONJSA-N	1	0	281.327	1.897	50	0		CDAARO
CSc1ccc(C[NH2+]CCN2CCOCC2)cc1	ZINC000019370621	356482381	/nfs/dbraw/zinc/48/23/81/356482381.db2.gz	WSHZTYITHLMQTA-UHFFFAOYSA-N	1	0	266.410	1.830	50	0		CDAARO
CC[NH+]1CCN(Cc2cc(OC)cc(OC)c2)CC1	ZINC000019606513	356493213	/nfs/dbraw/zinc/49/32/13/356493213.db2.gz	MWHOFQJOSWHBLX-UHFFFAOYSA-N	1	0	264.369	1.841	50	0		CDAARO
C[N@@H+]1CCCN(Cc2nc(Cc3ccccc3)no2)CC1	ZINC000019742650	356498946	/nfs/dbraw/zinc/49/89/46/356498946.db2.gz	XUITVZZOBRQHBZ-UHFFFAOYSA-N	1	0	286.379	1.798	50	0		CDAARO
O=C1C[C@@H]([NH+]2CCCCC2)C(=O)N1Cc1ccccc1	ZINC000019770960	356501266	/nfs/dbraw/zinc/50/12/66/356501266.db2.gz	LFFMNEGDAQZGMW-CQSZACIVSA-N	1	0	272.348	1.800	50	0		CDAARO
c1csc(CC[NH+]2CCN(c3cnccn3)CC2)c1	ZINC000020911746	356556863	/nfs/dbraw/zinc/55/68/63/356556863.db2.gz	NCANXLHSJZTUOM-UHFFFAOYSA-N	1	0	274.393	1.903	50	0		CDAARO
CCc1ccc(CN(C)Cc2nc(N)nc(N)n2)cc1	ZINC000024032001	356651902	/nfs/dbraw/zinc/65/19/02/356651902.db2.gz	VVXQGUUGQZTXKW-UHFFFAOYSA-N	1	0	272.356	1.230	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)C1	ZINC000247129378	356668830	/nfs/dbraw/zinc/66/88/30/356668830.db2.gz	NMCQEBHVPJQZPZ-GAFUQQFSSA-N	1	0	280.318	1.876	50	0		CDAARO
O=C(CC[N@@H+]1CCc2sccc2C1)NC1CC1	ZINC000026913242	356701331	/nfs/dbraw/zinc/70/13/31/356701331.db2.gz	VOMVLZXWIRLZGI-UHFFFAOYSA-N	1	0	250.367	1.775	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(Cc2cccc(F)c2)C[C@H]1C	ZINC000247193981	356732000	/nfs/dbraw/zinc/73/20/00/356732000.db2.gz	OKARWRQJPPENGS-OLZOCXBDSA-N	1	0	266.360	1.713	50	0		CDAARO
Cc1ccccc1C[N@@H+]1CCCN(CCC(N)=O)CC1	ZINC000030534867	356749928	/nfs/dbraw/zinc/74/99/28/356749928.db2.gz	MOCONQZWSPMEEY-UHFFFAOYSA-N	1	0	275.396	1.378	50	0		CDAARO
COc1cccc(/C(C)=C\C(=O)N2CC[NH2+][C@@H](C)C2)c1	ZINC000255627018	356805370	/nfs/dbraw/zinc/80/53/70/356805370.db2.gz	ONPBGYAGLNTYHJ-SUIFULHWSA-N	1	0	274.364	1.919	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+]1C[C@@H]1C(C)=CCC[C@H]1C	ZINC000261361240	356852451	/nfs/dbraw/zinc/85/24/51/356852451.db2.gz	GVMYSEUEEJARIT-RQJABVFESA-N	1	0	267.369	1.587	50	0		CDAARO
Cc1ccccc1[C@H](O)CNC(=O)[C@H]1CC[C@H]([NH3+])C1	ZINC000269215435	356891471	/nfs/dbraw/zinc/89/14/71/356891471.db2.gz	JSNJIIRXFLSJHM-SGMGOOAPSA-N	1	0	262.353	1.272	50	0		CDAARO
C[C@@H]1CCC[N@@H+]1CC(=O)NC[C@H](O)c1ccc(Cl)cc1	ZINC000095416572	357303295	/nfs/dbraw/zinc/30/32/95/357303295.db2.gz	PRUTUVHMMTWGAR-RISCZKNCSA-N	1	0	296.798	1.974	50	0		CDAARO
CSC[C@H](C)C(=O)N1CC[NH+](C2CCOCC2)CC1	ZINC000175833655	357379726	/nfs/dbraw/zinc/37/97/26/357379726.db2.gz	JEOKVXUHJLQGAX-LBPRGKRZSA-N	1	0	286.441	1.309	50	0		CDAARO
COc1cc(C[NH2+]C2CCN(C)CC2)cc(OC)c1	ZINC000016663241	357531562	/nfs/dbraw/zinc/53/15/62/357531562.db2.gz	PRZRZTXSOFKCNJ-UHFFFAOYSA-N	1	0	264.369	1.888	50	0		CDAARO
Cc1cccnc1NCC[NH2+][C@H](C)C(=O)NC1CCCC1	ZINC000065385653	357534494	/nfs/dbraw/zinc/53/44/94/357534494.db2.gz	IAGCYRXSWHBCEL-CYBMUJFWSA-N	1	0	290.411	1.839	50	0		CDAARO
Cc1cc(F)ccc1NC(=O)C[NH2+]CCN1CCOC1=O	ZINC000065394276	357535838	/nfs/dbraw/zinc/53/58/38/357535838.db2.gz	NAMIGRVROAMKMA-UHFFFAOYSA-N	1	0	295.314	1.114	50	0		CDAARO
Cc1cc(C[C@H](C)NC(=O)C2CC[NH+](C(C)C)CC2)[nH]n1	ZINC000065494017	357544887	/nfs/dbraw/zinc/54/48/87/357544887.db2.gz	RPLQXNBWFAMGCA-LBPRGKRZSA-N	1	0	292.427	1.886	50	0		CDAARO
CCNc1ccnc(NCC2([NH+](C)C)CCOCC2)n1	ZINC000065504048	357545306	/nfs/dbraw/zinc/54/53/06/357545306.db2.gz	JUNZFNWCIQPKPC-UHFFFAOYSA-N	1	0	279.388	1.431	50	0		CDAARO
CC(C)NC(=O)c1ccc(OC[C@@H]2CCC[NH2+]2)cc1	ZINC000066323498	357562074	/nfs/dbraw/zinc/56/20/74/357562074.db2.gz	YIUPUTILHKMYEB-ZDUSSCGKSA-N	1	0	262.353	1.956	50	0		CDAARO
C[N@@H+]1CCC[C@H](CNC(=O)CCOc2ccccc2)C1	ZINC000067771160	357626687	/nfs/dbraw/zinc/62/66/87/357626687.db2.gz	JLBIEBJTKJKYST-CQSZACIVSA-N	1	0	276.380	1.914	50	0		CDAARO
CO[C@H](C)[C@H](C)NC(=O)N[C@@H]1CC[N@H+](CC2CCCC2)C1	ZINC000188207428	357602268	/nfs/dbraw/zinc/60/22/68/357602268.db2.gz	BFIVBXCDDGYCJB-GZBFAFLISA-N	1	0	297.443	1.974	50	0		CDAARO
COc1ccc(CCCC(=O)N2CC[C@H](C[NH3+])C2)cc1	ZINC000067514983	357611601	/nfs/dbraw/zinc/61/16/01/357611601.db2.gz	GVMOMCUMFNQYAY-CQSZACIVSA-N	1	0	276.380	1.825	50	0		CDAARO
Cc1nccn1-c1ccccc1C[NH2+][C@H](C)Cn1cncn1	ZINC000067676508	357617456	/nfs/dbraw/zinc/61/74/56/357617456.db2.gz	OHKZLTHVAFFTPC-CYBMUJFWSA-N	1	0	296.378	1.951	50	0		CDAARO
Cc1nc[nH]c1C(=O)NCC[C@@H]1C[N@H+](CC(C)C)CCO1	ZINC000067869175	357634233	/nfs/dbraw/zinc/63/42/33/357634233.db2.gz	QLBYHAJKSAFJSQ-CYBMUJFWSA-N	1	0	294.399	1.195	50	0		CDAARO
COCCCN(C(=O)c1ocnc1C)C1CC[NH+](C)CC1	ZINC000072475416	357838142	/nfs/dbraw/zinc/83/81/42/357838142.db2.gz	IQTUIHXGNZFIMX-UHFFFAOYSA-N	1	0	295.383	1.556	50	0		CDAARO
CSCCCNc1ncnc2c1CC[NH2+]CC2	ZINC000072479354	357838967	/nfs/dbraw/zinc/83/89/67/357838967.db2.gz	JETHUAOYZQLZTQ-UHFFFAOYSA-N	1	0	252.387	1.330	50	0		CDAARO
CNC(=O)CN1CCC([NH2+][C@H]2CC(C)(C)C[C@H]2C)CC1	ZINC000192390563	283316645	/nfs/dbraw/zinc/31/66/45/283316645.db2.gz	HSMCYSGKMPADFU-OCCSQVGLSA-N	1	0	281.444	1.611	50	0		CDAARO
Cc1cc(F)c(S(=O)(=O)NC(C)(C)C[NH3+])cc1F	ZINC000097229436	358043237	/nfs/dbraw/zinc/04/32/37/358043237.db2.gz	ZVNDWLHCIUARED-UHFFFAOYSA-N	1	0	278.324	1.289	50	0		CDAARO
[NH3+][C@@H]1CCCCN(C(=O)CCn2cc(Cl)cn2)C1	ZINC000082097347	358146764	/nfs/dbraw/zinc/14/67/64/358146764.db2.gz	UIYPROOSFWBGLO-LLVKDONJSA-N	1	0	270.764	1.266	50	0		CDAARO
CCC[C@@H]1CN(Cc2cnc(COC)nc2)C[C@H]1[NH+](C)C	ZINC000082109730	358147980	/nfs/dbraw/zinc/14/79/80/358147980.db2.gz	FDLTVANBXJPCOU-HUUCEWRRSA-N	1	0	292.427	1.785	50	0		CDAARO
O=C(CCO)N1C[C@H]2CC[C@@H]1C[N@H+](Cc1ccccc1)C2	ZINC000091434322	358513946	/nfs/dbraw/zinc/51/39/46/358513946.db2.gz	SBIDUYHVSUITAP-JKSUJKDBSA-N	1	0	288.391	1.492	50	0		CDAARO
NC(=O)c1cn(-c2ccccc2)nc1[C@@H]1CCC[NH2+]C1	ZINC000216652168	283388368	/nfs/dbraw/zinc/38/83/68/283388368.db2.gz	NXXFERNANCMBDS-LLVKDONJSA-N	1	0	270.336	1.438	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNc2ncc(C)cn2)C1	ZINC000095356323	358683237	/nfs/dbraw/zinc/68/32/37/358683237.db2.gz	UNPULOMBZJLOEA-LBPRGKRZSA-N	1	0	250.346	1.165	50	0		CDAARO
CCCc1nnc(N2CCC(CO)(C[NH+](C)C)CC2)o1	ZINC000095386585	358691326	/nfs/dbraw/zinc/69/13/26/358691326.db2.gz	BJCMGDNGHDUIQR-UHFFFAOYSA-N	1	0	282.388	1.163	50	0		CDAARO
CC[NH+](CC)[C@H]1CCN(C(=O)c2cnc(C)nc2)C1	ZINC000097370473	358771329	/nfs/dbraw/zinc/77/13/29/358771329.db2.gz	LLHQGLGBSNHHNM-ZDUSSCGKSA-N	1	0	262.357	1.341	50	0		CDAARO
Cc1n[nH]c(C)c1C[N@@H+](C)[C@@H](C)Cc1cnccn1	ZINC000215992581	358913858	/nfs/dbraw/zinc/91/38/58/358913858.db2.gz	ZQAZZEUKICDJDN-JTQLQIEISA-N	1	0	259.357	1.880	50	0		CDAARO
CSc1ccccc1CN1CCOC[C@H]1CO	ZINC000215090972	358874482	/nfs/dbraw/zinc/87/44/82/358874482.db2.gz	UEIHYLXTIBJOOD-GFCCVEGCSA-N	1	0	253.367	1.602	50	0		CDAARO
COCCC1(C[N@@H+]2CCC[C@@H](C(N)=O)C2)CCC1	ZINC000095468536	358930453	/nfs/dbraw/zinc/93/04/53/358930453.db2.gz	BTRHVKSSIXXPBY-GFCCVEGCSA-N	1	0	254.374	1.391	50	0		CDAARO
Cc1ccc(C)c(CC(=O)N2CCN(C)[C@@H](CCO)C2)c1	ZINC000219201012	359082556	/nfs/dbraw/zinc/08/25/56/359082556.db2.gz	MIHJMLXLDFDHMS-INIZCTEOSA-N	1	0	290.407	1.371	50	0		CDAARO
CC(C)(C)Nc1nc(-n2ccnc2)nc(-n2ccnc2)n1	ZINC000000110724	359104507	/nfs/dbraw/zinc/10/45/07/359104507.db2.gz	DWCNGTIWLCBMOX-UHFFFAOYSA-N	1	0	284.327	1.453	50	0		CDAARO
CN1C(=O)[C@H]2C[N@H+](Cc3cccc(Cl)c3)C[C@H]2C1=O	ZINC000257175323	359053499	/nfs/dbraw/zinc/05/34/99/359053499.db2.gz	ARLLRHHGLPMUGC-TXEJJXNPSA-N	1	0	278.739	1.387	50	0		CDAARO
CN(CCCn1cccn1)c1cc(C2CC([NH3+])C2)ncn1	ZINC000222261340	359329130	/nfs/dbraw/zinc/32/91/30/359329130.db2.gz	IPEIVJVFZKKUKY-UHFFFAOYSA-N	1	0	286.383	1.404	50	0		CDAARO
C[C@H](C[NH+]1CCOCC1)C(=O)NCCCc1ccncc1	ZINC000223374415	359420577	/nfs/dbraw/zinc/42/05/77/359420577.db2.gz	SABYYYGDEIFCEV-CQSZACIVSA-N	1	0	291.395	1.099	50	0		CDAARO
Cc1nnc(SCCNC(=O)C[NH+]2CCCC2)s1	ZINC000223603208	359438097	/nfs/dbraw/zinc/43/80/97/359438097.db2.gz	ZSENUBKMWRWLHP-UHFFFAOYSA-N	1	0	286.426	1.151	50	0		CDAARO
COc1ccc(C[NH2+][C@H](C)C(=O)NC(C)C)cc1OC	ZINC000014169660	366536902	/nfs/dbraw/zinc/53/69/02/366536902.db2.gz	OPZNGSRXVQYALG-LLVKDONJSA-N	1	0	280.368	1.707	50	0		CDAARO
CCOC(=O)C[C@H]([NH2+]CC(=O)N(C)C)c1ccccc1C	ZINC000408524807	359934084	/nfs/dbraw/zinc/93/40/84/359934084.db2.gz	ZLUQTEVKSGAUMG-AWEZNQCLSA-N	1	0	292.379	1.667	50	0		CDAARO
CCOC[C@H](O)CN1CCC[C@H]1c1noc(C(C)C)n1	ZINC000257365431	359945260	/nfs/dbraw/zinc/94/52/60/359945260.db2.gz	LUOPUHVKELKBLT-NEPJUHHUSA-N	1	0	283.372	1.727	50	0		CDAARO
C[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)C1CCOCC1	ZINC000248153260	360415177	/nfs/dbraw/zinc/41/51/77/360415177.db2.gz	UWQPYIMAIHCPBB-UONOGXRCSA-N	1	0	266.385	1.498	50	0		CDAARO
O=C(Cn1nccc1[C@@H]1CCC[NH2+]C1)NCC(F)(F)F	ZINC000426498747	360677373	/nfs/dbraw/zinc/67/73/73/360677373.db2.gz	RIWHREULNRZVPR-SECBINFHSA-N	1	0	290.289	1.029	50	0		CDAARO
O=C1CCCN1c1ccc(CN2CC[C@H]3C[NH2+]C[C@H]32)cc1	ZINC000426550701	360683298	/nfs/dbraw/zinc/68/32/98/360683298.db2.gz	YEPQSUOASFQEFW-GOEBONIOSA-N	1	0	285.391	1.607	50	0		CDAARO
c1nc(NCCC[NH+]2CCCC2)cc([C@H]2CCOC2)n1	ZINC000426584096	360686574	/nfs/dbraw/zinc/68/65/74/360686574.db2.gz	SKAHHTWGJRMQOH-ZDUSSCGKSA-N	1	0	276.384	1.300	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@H](C(=O)NCCc2cc[nH]n2)C1	ZINC000426613710	360689930	/nfs/dbraw/zinc/68/99/30/360689930.db2.gz	ZVTPMBVWVWCKOL-LBPRGKRZSA-N	1	0	264.373	1.189	50	0		CDAARO
C[C@@H](CCC(=O)NCc1ccncc1)[NH+]1CCCC1	ZINC000426358686	360658800	/nfs/dbraw/zinc/65/88/00/360658800.db2.gz	XSVQCDZDPXALCM-ZDUSSCGKSA-N	1	0	261.369	1.962	50	0		CDAARO
C[NH+]1CCC(CCNc2cc([C@@H]3CCOC3)ncn2)CC1	ZINC000426471578	360673947	/nfs/dbraw/zinc/67/39/47/360673947.db2.gz	NYIOEWVXDWFOGL-CQSZACIVSA-N	1	0	290.411	1.546	50	0		CDAARO
[NH3+]CCOc1cccc(CC(=O)NCC2CCOCC2)c1	ZINC000426698518	360697287	/nfs/dbraw/zinc/69/72/87/360697287.db2.gz	XKUOVHMBMOGVFS-UHFFFAOYSA-N	1	0	292.379	1.109	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)c2ccnc(-n3ccnc3)c2)C1	ZINC000178606318	189130571	/nfs/dbraw/zinc/13/05/71/189130571.db2.gz	LKWNBWXIMUIUOW-ZDUSSCGKSA-N	1	0	285.351	1.091	50	0		CDAARO
Cc1nc(C(=O)NCC[NH+]2CCCC2)c(C)s1	ZINC000178985868	189159328	/nfs/dbraw/zinc/15/93/28/189159328.db2.gz	JOPZRHJVKGTQNN-UHFFFAOYSA-N	1	0	253.371	1.586	50	0		CDAARO
C[NH+]1CCC(C)(C(=O)N2CC(c3ccncc3)C2)CC1	ZINC000426535601	361004191	/nfs/dbraw/zinc/00/41/91/361004191.db2.gz	COBKKFCBLGIUSD-UHFFFAOYSA-N	1	0	273.380	1.739	50	0		CDAARO
O=C(C[C@@H]1CC[NH2+]C1)NCc1ccnc2ccccc12	ZINC000130829740	361008412	/nfs/dbraw/zinc/00/84/12/361008412.db2.gz	CYJMQEDYUHTDLL-LBPRGKRZSA-N	1	0	269.348	1.851	50	0		CDAARO
[NH3+][C@@H]1CCC[C@H]1C(=O)N1CCC(OC[C@H]2CCCO2)CC1	ZINC000299740394	200852492	/nfs/dbraw/zinc/85/24/92/200852492.db2.gz	ZFYPPXWUOYXYDQ-RBSFLKMASA-N	1	0	296.411	1.300	50	0		CDAARO
COC(=O)[C@@H]([N@@H+]1CC[C@]2(CCOC2)C1)C1(OC)CCC1	ZINC000253431594	291259766	/nfs/dbraw/zinc/25/97/66/291259766.db2.gz	WKFBEGMBGKWGJN-OCCSQVGLSA-N	1	0	283.368	1.210	50	0		CDAARO
Cn1c(C[NH3+])nnc1SCCCC(F)(F)F	ZINC000123681198	361595102	/nfs/dbraw/zinc/59/51/02/361595102.db2.gz	XGNLXIWVIWFXIF-UHFFFAOYSA-N	1	0	254.281	1.708	50	0		CDAARO
Cc1ccc(C[N@@H+]2CC[C@@H](O)[C@@H](CO)C2)c(Cl)c1	ZINC000335649605	361707820	/nfs/dbraw/zinc/70/78/20/361707820.db2.gz	OFPKAIKJPPIOMA-TZMCWYRMSA-N	1	0	269.772	1.824	50	0		CDAARO
ClC1=CC[C@H]2C[N@H+](CCN3CCOCC3)C[C@H]2C1	ZINC000022863894	294100494	/nfs/dbraw/zinc/10/04/94/294100494.db2.gz	NTRSYCHJIBTEDS-QWHCGFSZSA-N	1	0	270.804	1.783	50	0		CDAARO
CC[C@@](C)(O)C[NH+]1CCC(Cn2cncn2)CC1	ZINC000189243794	189526840	/nfs/dbraw/zinc/52/68/40/189526840.db2.gz	QWHAXSXSRSVUIY-CYBMUJFWSA-N	1	0	252.362	1.151	50	0		CDAARO
Cc1cnccc1CC[NH2+][C@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000293603047	370709259	/nfs/dbraw/zinc/70/92/59/370709259.db2.gz	LGSJUNCURCYXLE-GJZGRUSLSA-N	1	0	296.436	1.878	50	0		CDAARO
O=C1CCC(=O)N1CC[N@@H+]1CCSC2(CCCCC2)C1	ZINC000098018898	364972819	/nfs/dbraw/zinc/97/28/19/364972819.db2.gz	LJEXZBJAJOXQOH-UHFFFAOYSA-N	1	0	296.436	1.887	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1C(=O)/C=C\c1nccs1	ZINC000098055876	365009789	/nfs/dbraw/zinc/00/97/89/365009789.db2.gz	YKZFLZQIXRUOKJ-XOULXFPDSA-N	1	0	251.355	1.319	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)c1ccc[nH]c1=O	ZINC000249688793	365161682	/nfs/dbraw/zinc/16/16/82/365161682.db2.gz	ISHUTIKLFBYREX-ZIAGYGMSSA-N	1	0	289.379	1.876	50	0		CDAARO
CCS(=O)(=O)C[C@H](C)[NH2+][C@@H]1CC(C)(C)OC1(C)C	ZINC000089635937	366891332	/nfs/dbraw/zinc/89/13/32/366891332.db2.gz	LXGZOTHIHGFQDF-WDEREUQCSA-N	1	0	277.430	1.745	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@H]1NS(=O)(=O)c1ccc(F)cc1F	ZINC000094345688	367465619	/nfs/dbraw/zinc/46/56/19/367465619.db2.gz	IYXWKDHMGWXYCZ-GZMMTYOYSA-N	1	0	290.335	1.241	50	0		CDAARO
CN1CCN(C)[C@@H](CNC(=O)c2sccc2Cl)C1	ZINC000286191875	368722387	/nfs/dbraw/zinc/72/23/87/368722387.db2.gz	XNSAZNOHYWIPCW-VIFPVBQESA-N	1	0	287.816	1.377	50	0		CDAARO
CC1(C)CC(NC(=O)CN2CCCC2=O)CC(C)(C)[NH2+]1	ZINC000003683999	370601985	/nfs/dbraw/zinc/60/19/85/370601985.db2.gz	DYLYKYPHNZAKDO-UHFFFAOYSA-N	1	0	281.400	1.034	50	0		CDAARO
O[C@@H](c1cccnc1)c1ccc2c(c1)C[NH2+]CCO2	ZINC000299761185	372746867	/nfs/dbraw/zinc/74/68/67/372746867.db2.gz	WAAABGQHUSHHSL-OAHLLOKOSA-N	1	0	256.305	1.645	50	0		CDAARO
C[NH+](C)CC(C)(C)CN1CC[C@H]2OCc3cnnn3[C@H]2C1	ZINC000299761742	372746979	/nfs/dbraw/zinc/74/69/79/372746979.db2.gz	YVUPCVCRLZRFFY-UONOGXRCSA-N	1	0	293.415	1.012	50	0		CDAARO
COc1ccc(NC(=O)NC[C@]2(O)CC[NH2+]C2)cc1Cl	ZINC000299782377	372759455	/nfs/dbraw/zinc/75/94/55/372759455.db2.gz	VPRZQAHPZJMUKG-ZDUSSCGKSA-N	1	0	299.758	1.195	50	0		CDAARO
O=C(NC[C@]1(O)CC[NH2+]C1)c1cccc(-c2ccncc2)c1	ZINC000299790750	372764084	/nfs/dbraw/zinc/76/40/84/372764084.db2.gz	BPBYGWNNLDFJLS-KRWDZBQOSA-N	1	0	297.358	1.203	50	0		CDAARO
CC(C)NC(=O)[C@@H]1C[C@@H]([NH3+])CN1Cc1ccccc1Cl	ZINC000299789138	372764491	/nfs/dbraw/zinc/76/44/91/372764491.db2.gz	RSBUAJNZHHOAQN-OCCSQVGLSA-N	1	0	295.814	1.766	50	0		CDAARO
C[NH+](C)CC[C@@H](NC(=O)c1cn[nH]n1)c1ccccc1	ZINC000299794775	372766015	/nfs/dbraw/zinc/76/60/15/372766015.db2.gz	KKMZYHHTRKTJHE-GFCCVEGCSA-N	1	0	273.340	1.228	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)N(C)C[C@H]1CC[N@@H+](C(C)C)C1	ZINC000299795000	372766683	/nfs/dbraw/zinc/76/66/83/372766683.db2.gz	KLAWRGKWNSRGJR-CQSZACIVSA-N	1	0	292.427	1.758	50	0		CDAARO
Cc1nc([C@H]2CCCN(Cc3nnc(C)s3)C2)no1	ZINC000299801074	372771460	/nfs/dbraw/zinc/77/14/60/372771460.db2.gz	VLHCHFFLMUFUAP-JTQLQIEISA-N	1	0	279.369	1.918	50	0		CDAARO
CCn1c(CN(C)CC(F)(F)F)nnc1[C@H]1C[C@@H]([NH3+])C1	ZINC000244723996	189910804	/nfs/dbraw/zinc/91/08/04/189910804.db2.gz	MLQMYRPAFBQSCY-DTORHVGOSA-N	1	0	291.321	1.497	50	0		CDAARO
C[C@H](C(=O)N1CCCC1)[N@H+](C)CC1(CO)CCC1	ZINC000670449734	483010290	/nfs/dbraw/zinc/01/02/90/483010290.db2.gz	LDNSIKKOMBCZFY-GFCCVEGCSA-N	1	0	254.374	1.092	50	0		CDAARO
C[C@@H](O)c1ncc(C[NH2+][C@@H](CO)Cc2ccccc2)s1	ZINC000253427592	373734638	/nfs/dbraw/zinc/73/46/38/373734638.db2.gz	GGKGJNKEMWJMGD-DGCLKSJQSA-N	1	0	292.404	1.890	50	0		CDAARO
O=C(NCC[NH+]1CCC(O)CC1)Nc1ccccc1Cl	ZINC000206610272	374179800	/nfs/dbraw/zinc/17/98/00/374179800.db2.gz	XCJVLNGDRVNEQH-UHFFFAOYSA-N	1	0	297.786	1.918	50	0		CDAARO
Cc1ccccc1CC(=O)N1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1	ZINC000248666922	374249279	/nfs/dbraw/zinc/24/92/79/374249279.db2.gz	WVMZCRDWAHFHFL-KKUMJFAQSA-N	1	0	258.365	1.733	50	0		CDAARO
COC(=O)[C@]1(C)C[C@H](CO)[C@@H](c2ccccc2F)N1C	ZINC000012336741	374491831	/nfs/dbraw/zinc/49/18/31/374491831.db2.gz	ZMRSHGSKTLXEPR-DGFSRKRXSA-N	1	0	281.327	1.743	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+][C@H](C)Cn2cncn2)C12CCCC2	ZINC000108329848	412824383	/nfs/dbraw/zinc/82/43/83/412824383.db2.gz	YFSPACUHLLVHFM-MGPQQGTHSA-N	1	0	278.400	1.994	50	0		CDAARO
CC1(C)CCC[NH2+][C@@H]1CNS(=O)(=O)CC1CCCC1	ZINC000252479335	189974854	/nfs/dbraw/zinc/97/48/54/189974854.db2.gz	BDEFGTXKYJATTH-CYBMUJFWSA-N	1	0	288.457	1.874	50	0		CDAARO
CC[NH+]1CCC(CC(=O)N(C)Cc2noc(C)n2)CC1	ZINC000095375285	374892899	/nfs/dbraw/zinc/89/28/99/374892899.db2.gz	NBIFXONSRUYNRZ-UHFFFAOYSA-N	1	0	280.372	1.458	50	0		CDAARO
CCOc1nnc(CN2CCC([NH+](C)C)CC2)s1	ZINC000095389970	374899974	/nfs/dbraw/zinc/89/99/74/374899974.db2.gz	AZCFNWANQDBGBJ-UHFFFAOYSA-N	1	0	270.402	1.463	50	0		CDAARO
CC[C@@H](O)C[NH+]1CCC(N(C)CC(F)F)CC1	ZINC000095415751	374918332	/nfs/dbraw/zinc/91/83/32/374918332.db2.gz	OKBOGWADLJBTMB-LLVKDONJSA-N	1	0	250.333	1.419	50	0		CDAARO
COC[C@H]([NH2+]Cc1nnc2n1CCCCC2)C1CC1	ZINC000095419400	374919496	/nfs/dbraw/zinc/91/94/96/374919496.db2.gz	AJMFQSIGOPVUHA-LBPRGKRZSA-N	1	0	264.373	1.519	50	0		CDAARO
CC[C@@H](CO)[NH+]1CCN(C(=O)CCC(F)(F)F)CC1	ZINC000095443519	374944614	/nfs/dbraw/zinc/94/46/14/374944614.db2.gz	OUYWQMVHWVWFAZ-JTQLQIEISA-N	1	0	282.306	1.244	50	0		CDAARO
C[NH+](C)C1CN(C(=O)Nc2cnc(-c3ccccc3)nc2)C1	ZINC000097049398	375141426	/nfs/dbraw/zinc/14/14/26/375141426.db2.gz	FHBPNYKCDDZETO-UHFFFAOYSA-N	1	0	297.362	1.921	50	0		CDAARO
C[C@H]1CCCN(CN2c3ccccc3C(=O)C2=O)C1	ZINC000057462877	375506347	/nfs/dbraw/zinc/50/63/47/375506347.db2.gz	YYXPSJQEBJOVPN-NSHDSACASA-N	1	0	258.321	1.905	50	0		CDAARO
COc1ccc(OCCOC[C@H](O)C[NH2+]C(C)C)cc1	ZINC000003055221	375523447	/nfs/dbraw/zinc/52/34/47/375523447.db2.gz	GNUILBHUSDZDSY-CYBMUJFWSA-N	1	0	283.368	1.450	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N[C@H]1CC[NH2+]C[C@@H]1C	ZINC000262811703	190063281	/nfs/dbraw/zinc/06/32/81/190063281.db2.gz	YFUYOUUCPCWPGO-AAEUAGOBSA-N	1	0	282.409	1.525	50	0		CDAARO
COCC(=O)N[C@H]1CCC[N@H+](CCc2ccccc2)C1	ZINC000012715695	377013004	/nfs/dbraw/zinc/01/30/04/377013004.db2.gz	XLPMMNJSSGLKTH-HNNXBMFYSA-N	1	0	276.380	1.456	50	0		CDAARO
Cc1ccc(C(=O)NC[C@H]2CCN(Cc3c[nH]cn3)C2)cn1	ZINC000067934977	377316358	/nfs/dbraw/zinc/31/63/58/377316358.db2.gz	ITHSZWQTEZETJW-CYBMUJFWSA-N	1	0	299.378	1.365	50	0		CDAARO
CN(CC[N@H+](C)CCN1CCOCC1)c1ccccc1	ZINC000089346229	377835756	/nfs/dbraw/zinc/83/57/56/377835756.db2.gz	VEFVIZWMXKLDRM-UHFFFAOYSA-N	1	0	277.412	1.387	50	0		CDAARO
CCC[N@@H+]1CCCN(C(=O)[C@@H]2CCC[C@H]2C(=O)OC)CC1	ZINC000245339391	378071391	/nfs/dbraw/zinc/07/13/91/378071391.db2.gz	SKKNDFREVVBXMM-ZIAGYGMSSA-N	1	0	296.411	1.520	50	0		CDAARO
[NH2+]=C1N[C@H](c2ccccc2)[C@@H](C(=O)c2ccccc2)N1	ZINC000000173757	169564153	/nfs/dbraw/zinc/56/41/53/169564153.db2.gz	HVZBMAKCDGCFLE-KGLIPLIRSA-N	1	0	265.316	1.897	50	0		CDAARO
C[C@@H]1CCCC[C@@H]1OCC(=O)N1CC[C@H]([NH3+])C[C@H]1C	ZINC000408519235	296341532	/nfs/dbraw/zinc/34/15/32/296341532.db2.gz	ZSWFHFLWXXYNAK-MQYQWHSLSA-N	1	0	268.401	1.920	50	0		CDAARO
CN(CC[N@H+](C)C1CC1)C(=O)/C=C\COCC(F)(F)F	ZINC000493093878	253368173	/nfs/dbraw/zinc/36/81/73/253368173.db2.gz	KMPOLIMHQWUVIR-ARJAWSKDSA-N	1	0	294.317	1.674	50	0		CDAARO
COC(=O)[C@H]1[C@H]2CCC[N@@H+]2C2(CCCCC2)[C@@H]1C(=O)OC	ZINC000006657989	390171845	/nfs/dbraw/zinc/17/18/45/390171845.db2.gz	YLAUEXHRCZFZSL-AGIUHOORSA-N	1	0	295.379	1.746	50	0		CDAARO
CCCc1nnc(N2CCC(C[NH+](C)C)CC2)o1	ZINC000095386880	184963183	/nfs/dbraw/zinc/96/31/83/184963183.db2.gz	VHWFCFPADSPMJO-UHFFFAOYSA-N	1	0	252.362	1.800	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCCN(Cc2ccc(F)cc2)C1=O	ZINC000012762676	390205659	/nfs/dbraw/zinc/20/56/59/390205659.db2.gz	MBFKQAZCRDNBPB-OAHLLOKOSA-N	1	0	280.343	1.241	50	0		CDAARO
CC[C@@H]1c2ccsc2CC[N@H+]1CCC(=O)NC(=O)NC	ZINC000030224527	390271023	/nfs/dbraw/zinc/27/10/23/390271023.db2.gz	WNUZGBSUFHGJIL-LLVKDONJSA-N	1	0	295.408	1.903	50	0		CDAARO
COC[C@@H](O)C[N@H+](C)[C@H](C)C(=O)NC1CCC(C)CC1	ZINC000096424641	390516190	/nfs/dbraw/zinc/51/61/90/390516190.db2.gz	QWCXMQZOFXRKJP-HHTDUIENSA-N	1	0	286.416	1.009	50	0		CDAARO
CC(C)[N@H+](C)CC(=O)NC[C@]1(C)CCCC[C@@H]1O	ZINC000096450848	390522216	/nfs/dbraw/zinc/52/22/16/390522216.db2.gz	LAHTXJTZEGNJJI-JSGCOSHPSA-N	1	0	256.390	1.384	50	0		CDAARO
C[C@@H]1CN(C(=O)c2scnc2C(C)(C)C)CC[NH2+]1	ZINC000188467816	390959052	/nfs/dbraw/zinc/95/90/52/390959052.db2.gz	CAMAYFJFVFQYDS-SECBINFHSA-N	1	0	267.398	1.875	50	0		CDAARO
COCCn1ccnc1[C@@H]1CCC[N@H+](CCOC)C1	ZINC000091486374	390890057	/nfs/dbraw/zinc/89/00/57/390890057.db2.gz	SFTOKYKMXWQANN-CYBMUJFWSA-N	1	0	267.373	1.355	50	0		CDAARO
CO[C@]1(C)C[C@@H](NC(=O)[C@]2(C)CC[NH2+]C2)C1(C)C	ZINC000430070099	391215527	/nfs/dbraw/zinc/21/55/27/391215527.db2.gz	WTPORTZLMROTLY-LERXQTSPSA-N	1	0	254.374	1.306	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1Cn1c(=O)[nH]c2ccccc2c1=O	ZINC000025464131	391820329	/nfs/dbraw/zinc/82/03/29/391820329.db2.gz	OJCZDAMNWBYHOJ-NSHDSACASA-N	1	0	273.336	1.174	50	0		CDAARO
CC[N@H+](CCNC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)C1CC1	ZINC000089969206	392542300	/nfs/dbraw/zinc/54/23/00/392542300.db2.gz	OORQDLFNZISJDB-MJBXVCDLSA-N	1	0	295.427	1.583	50	0		CDAARO
c1nn(-c2ccccc2)c2ncnc(N3CC[NH2+]CC3)c12	ZINC000000410942	285592362	/nfs/dbraw/zinc/59/23/62/285592362.db2.gz	PITKIAQOOXYBTN-UHFFFAOYSA-N	1	0	280.335	1.225	50	0		CDAARO
C[C@@]1(C[NH3+])CCN(C(=O)c2cccc3c2OCCO3)C1	ZINC000261836853	140396325	/nfs/dbraw/zinc/39/63/25/140396325.db2.gz	VFUKHUMHSOLQIB-HNNXBMFYSA-N	1	0	276.336	1.269	50	0		CDAARO
CC1(C)[C@H]2CCC[C@H]2[C@@H]1[NH2+]C[C@@H](O)Cn1ccnn1	ZINC000658035944	413145899	/nfs/dbraw/zinc/14/58/99/413145899.db2.gz	SOZVOPLAWFBJEP-NDBYEHHHSA-N	1	0	264.373	1.053	50	0		CDAARO
CN1CCN([C@@H]2CCCC[N@H+](CC3CCC3)C2)CC1	ZINC000104376994	397942469	/nfs/dbraw/zinc/94/24/69/397942469.db2.gz	PNBQRUDBVSWRIF-MRXNPFEDSA-N	1	0	265.445	1.888	50	0		CDAARO
CCN(CC)c1ncnc(N(CC)C[C@H]2CCCO2)c1N	ZINC000103409862	397900194	/nfs/dbraw/zinc/90/01/94/397900194.db2.gz	KXWBARGRJMRUSY-GFCCVEGCSA-N	1	0	293.415	1.910	50	0		CDAARO
C[C@@H]1CCC[C@@H]1[NH2+]Cc1cnc(N2CCOCC2)nc1	ZINC000105505295	398042282	/nfs/dbraw/zinc/04/22/82/398042282.db2.gz	DHZRXRMSZDDLFI-OCCSQVGLSA-N	1	0	276.384	1.591	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1Cc1cc(-n2ccnc2)cs1	ZINC000097162634	397981304	/nfs/dbraw/zinc/98/13/04/397981304.db2.gz	XMRSIAUBHYTSKP-LLVKDONJSA-N	1	0	262.382	1.728	50	0		CDAARO
COc1ccccc1C[C@H](C)[NH2+]C[C@H](C)N1CCOCC1	ZINC000097016489	286499123	/nfs/dbraw/zinc/49/91/23/286499123.db2.gz	GYVMXFPDPHNRQI-GJZGRUSLSA-N	1	0	292.423	1.937	50	0		CDAARO
NC(=O)C1CC[NH+](CCC(=O)Nc2ccccc2)CC1	ZINC000004685626	169998563	/nfs/dbraw/zinc/99/85/63/169998563.db2.gz	LHUOZONHYJIECL-UHFFFAOYSA-N	1	0	275.352	1.213	50	0		CDAARO
Cc1nnc(NCC[C@H](C)N2CC[NH+](C)CC2)s1	ZINC000534664746	411828658	/nfs/dbraw/zinc/82/86/58/411828658.db2.gz	DOQINULUMWAXQW-JTQLQIEISA-N	1	0	269.418	1.284	50	0		CDAARO
COc1cc(C)ccc1OCCN1CC[NH2+]CC1	ZINC000019728625	170845749	/nfs/dbraw/zinc/84/57/49/170845749.db2.gz	QFCDVXRNAHWCPY-UHFFFAOYSA-N	1	0	250.342	1.288	50	0		CDAARO
Cc1cccc(S(=O)(=O)N2CCC[C@H]2C[NH3+])c1	ZINC000020182678	171046183	/nfs/dbraw/zinc/04/61/83/171046183.db2.gz	MXKUOJRSHKMXOZ-NSHDSACASA-N	1	0	254.355	1.107	50	0		CDAARO
COc1cc(CN2CCC[N@H+](C)CC2)cc2c1OCO2	ZINC000022454754	171388152	/nfs/dbraw/zinc/38/81/52/171388152.db2.gz	QVRJVARFBGHPKE-UHFFFAOYSA-N	1	0	278.352	1.561	50	0		CDAARO
Clc1ccc2oc(CN3CC[NH2+]CC3)nc2c1	ZINC000035505405	172238950	/nfs/dbraw/zinc/23/89/50/172238950.db2.gz	XOSAHUHKNAYBLP-UHFFFAOYSA-N	1	0	251.717	1.886	50	0		CDAARO
[NH3+]CCCN(C1CC1)S(=O)(=O)c1cccc(F)c1	ZINC000036731626	172663044	/nfs/dbraw/zinc/66/30/44/172663044.db2.gz	DZPQEWHRLYSXDU-UHFFFAOYSA-N	1	0	272.345	1.328	50	0		CDAARO
CSCc1ccc(C[NH2+]CCCN2CCOCC2)o1	ZINC000037232360	173051192	/nfs/dbraw/zinc/05/11/92/173051192.db2.gz	UHVNXCOOMIBJKG-UHFFFAOYSA-N	1	0	284.425	1.955	50	0		CDAARO
C[C@@H]1CCCCN1c1ccc(N2CC[NH2+]CC2)nn1	ZINC000206578948	287279114	/nfs/dbraw/zinc/27/91/14/287279114.db2.gz	VLKSPZOYXAWCRH-GFCCVEGCSA-N	1	0	261.373	1.265	50	0		CDAARO
COc1ccccc1[C@@H]1C[C@H]1C(=O)N1CC[NH2+]CC1	ZINC000038478363	174141769	/nfs/dbraw/zinc/14/17/69/174141769.db2.gz	GHTGTRWTBIXSFW-QWHCGFSZSA-N	1	0	260.337	1.231	50	0		CDAARO
[NH3+]CCOc1ccc2nnc(-c3ccc(F)cc3)n2n1	ZINC000038478045	174142126	/nfs/dbraw/zinc/14/21/26/174142126.db2.gz	KSEAZCACFHUSAG-UHFFFAOYSA-N	1	0	273.271	1.268	50	0		CDAARO
Cc1cc(NC(=O)[C@H]2CCC[NH2+]2)ccc1N1CCCC1=O	ZINC000040429439	174259573	/nfs/dbraw/zinc/25/95/73/174259573.db2.gz	FDNKXQNCYYMNFZ-CYBMUJFWSA-N	1	0	287.363	1.812	50	0		CDAARO
Cc1ccc(NC(=O)[C@H](C)[NH2+]CC(C)(C)CO)cc1	ZINC000065370279	175722724	/nfs/dbraw/zinc/72/27/24/175722724.db2.gz	NDXNWRNYNUPONA-LBPRGKRZSA-N	1	0	264.369	1.930	50	0		CDAARO
O=C(CC[NH2+]C[C@H]1CCCC[C@H]1O)NCc1ccco1	ZINC000065373615	175724029	/nfs/dbraw/zinc/72/40/29/175724029.db2.gz	JKELVGXMCOIDMX-TZMCWYRMSA-N	1	0	280.368	1.427	50	0		CDAARO
COc1ccc(CCNc2cc(CC[NH3+])ncn2)cc1	ZINC000067788553	175791488	/nfs/dbraw/zinc/79/14/88/175791488.db2.gz	GLHWSKPUXZMVEC-UHFFFAOYSA-N	1	0	272.352	1.641	50	0		CDAARO
Cc1ccc(OCC[N@@H+]2CC[C@H](CO)[C@@H](O)C2)c(Cl)c1	ZINC000072125408	176320759	/nfs/dbraw/zinc/32/07/59/176320759.db2.gz	BWMMEHFVZJHDFW-OCCSQVGLSA-N	1	0	299.798	1.702	50	0		CDAARO
c1cc2c(ncnc2NC[C@@H]2C[NH2+]CCOC2)s1	ZINC000072152121	176327532	/nfs/dbraw/zinc/32/75/32/176327532.db2.gz	MGXRBMIVLLJDGW-VIFPVBQESA-N	1	0	264.354	1.339	50	0		CDAARO
Cc1n[nH]c(C)c1CCC(=O)N1CCC[C@@H]([NH+](C)C)CC1	ZINC000072157799	176329208	/nfs/dbraw/zinc/32/92/08/176329208.db2.gz	CVSZLPIEASINCV-CQSZACIVSA-N	1	0	292.427	1.902	50	0		CDAARO
O=C(CC[N@@H+]1C[C@@H]2CC[C@H]1C2)N1CCn2cncc2C1	ZINC000072169973	176332399	/nfs/dbraw/zinc/33/23/99/176332399.db2.gz	GMAXEFOYVPWIGE-OLZOCXBDSA-N	1	0	274.368	1.100	50	0		CDAARO
Clc1ccc(-c2nnn(C[C@H]3CC[NH2+]C3)n2)cc1	ZINC000072343402	176371649	/nfs/dbraw/zinc/37/16/49/176371649.db2.gz	WHGVEINTAZNTCC-VIFPVBQESA-N	1	0	263.732	1.603	50	0		CDAARO
Cc1cc(C(=O)N2CCCC[C@@H]2CC[NH+](C)C)on1	ZINC000072421087	176401105	/nfs/dbraw/zinc/40/11/05/176401105.db2.gz	YSVYFQKRLQQSBF-GFCCVEGCSA-N	1	0	265.357	1.929	50	0		CDAARO
CN(Cc1nc(-c2ccncc2)no1)C[C@H]1CC[NH2+]C1	ZINC000077519453	177277416	/nfs/dbraw/zinc/27/74/16/177277416.db2.gz	RMESZVDONGYPLK-NSHDSACASA-N	1	0	273.340	1.173	50	0		CDAARO
CCc1ccccc1S(=O)(=O)NC1(C[NH3+])CCOCC1	ZINC000528057369	270757109	/nfs/dbraw/zinc/75/71/09/270757109.db2.gz	UNWSDAKSIGGFAK-UHFFFAOYSA-N	1	0	298.408	1.035	50	0		CDAARO
O=C(C[C@H]1C[NH2+]CCO1)N1CCC[C@@H]1c1ccccc1	ZINC000091299515	274977675	/nfs/dbraw/zinc/97/76/75/274977675.db2.gz	WMYVKKFCIFSXOQ-LSDHHAIUSA-N	1	0	274.364	1.729	50	0		CDAARO
CC[NH+](CC)CCN1C(=O)[C@@H]2CC(Cl)=CC[C@@H]2C1=O	ZINC000020792563	276098173	/nfs/dbraw/zinc/09/81/73/276098173.db2.gz	ZHKYUMGEZLEDND-NWDGAFQWSA-N	1	0	284.787	1.846	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1Cn1c(=O)cnc2ccccc21	ZINC000095392179	276175539	/nfs/dbraw/zinc/17/55/39/276175539.db2.gz	ZUUYLUFBWAMYDI-GFCCVEGCSA-N	1	0	257.337	1.881	50	0		CDAARO
COC(=O)[C@]12CCC[C@@H]1C[N@H+](CC(=O)N1CCCCC1)C2	ZINC000097082976	277146642	/nfs/dbraw/zinc/14/66/42/277146642.db2.gz	HYCDTQQMPGYENK-CJNGLKHVSA-N	1	0	294.395	1.274	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@@]2(C[C@@H](C[NH3+])CO2)C1	ZINC000091303593	277185759	/nfs/dbraw/zinc/18/57/59/277185759.db2.gz	CYIJGWKOFZHWLD-SMDDNHRTSA-N	1	0	270.373	1.751	50	0		CDAARO
COc1ccc2c(c1)C[C@H]([NH2+][C@@H]1CCC(=O)N(C)C1)CC2	ZINC000095973399	277966905	/nfs/dbraw/zinc/96/69/05/277966905.db2.gz	LNDSQGSRLYSFMA-HUUCEWRRSA-N	1	0	288.391	1.763	50	0		CDAARO
CC(C)n1cnnc1CN(C)C[C@H]1CCC[NH2+]C1	ZINC000077487173	278140671	/nfs/dbraw/zinc/14/06/71/278140671.db2.gz	FDQZWRMGOIXBRW-LBPRGKRZSA-N	1	0	251.378	1.290	50	0		CDAARO
C[C@@H]1C[C@H]1C(=O)NC[C@H](Cc1ccccc1)[NH+](C)C	ZINC000105884194	279006506	/nfs/dbraw/zinc/00/65/06/279006506.db2.gz	JCSYCQLPDLIYJS-VHDGCEQUSA-N	1	0	260.381	1.932	50	0		CDAARO
CCOC(=O)[C@@H]1C[NH2+]CCc2c3ccccc3[nH]c21	ZINC000071781439	279598584	/nfs/dbraw/zinc/59/85/84/279598584.db2.gz	CTOZCCZDPQNZFT-GFCCVEGCSA-N	1	0	258.321	1.960	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@H](C[NH3+])c2ccccc2)C[C@H](C)O1	ZINC000269263570	280375206	/nfs/dbraw/zinc/37/52/06/280375206.db2.gz	SOAQWOOXMRAHPK-NWANDNLSSA-N	1	0	276.380	1.755	50	0		CDAARO
Cc1ccccc1[C@H](CN1CCOCC1)[NH2+]C[C@@H](C)O	ZINC000183277764	281383809	/nfs/dbraw/zinc/38/38/09/281383809.db2.gz	ZUAQQTDNDIILLT-ZBFHGGJFSA-N	1	0	278.396	1.339	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)/C=C\c2ccnc3ccccc23)C1	ZINC000255054901	289352912	/nfs/dbraw/zinc/35/29/12/289352912.db2.gz	RFTPGSMEPGPQLE-CFHLNLSMSA-N	1	0	267.332	1.808	50	0		CDAARO
[NH3+]C[C@H](NC(=O)c1ccc2c(c1)OCCCO2)C1CC1	ZINC000178170436	315948846	/nfs/dbraw/zinc/94/88/46/315948846.db2.gz	IRQINUWJOPZAKK-LBPRGKRZSA-N	1	0	276.336	1.315	50	0		CDAARO
CCc1ccc(C(=O)N[C@H]2COC[C@@H]2[NH+]2CCCCC2)[nH]1	ZINC000534581250	328311944	/nfs/dbraw/zinc/31/19/44/328311944.db2.gz	FXERWBFBUXVXBN-GJZGRUSLSA-N	1	0	291.395	1.560	50	0		CDAARO
Cc1nc(N2C[C@@H]3CC[NH2+][C@@H]3C2)nc2c1CCCC2	ZINC000534582525	328312346	/nfs/dbraw/zinc/31/23/46/328312346.db2.gz	RXHMMAHTBNOWKJ-SMDDNHRTSA-N	1	0	258.369	1.462	50	0		CDAARO
Cc1cnc(C)c(NCCC[NH+]2CCC(C(N)=O)CC2)n1	ZINC000534586378	328315514	/nfs/dbraw/zinc/31/55/14/328315514.db2.gz	XHMPWANEUIIYBP-UHFFFAOYSA-N	1	0	291.399	1.093	50	0		CDAARO
C[C@H](CN1CCCCCC1)[NH2+]CCc1ncc[nH]1	ZINC000534588325	328316633	/nfs/dbraw/zinc/31/66/33/328316633.db2.gz	SFQOKZROCFMZAY-CYBMUJFWSA-N	1	0	250.390	1.806	50	0		CDAARO
CC[NH+]1CCC(CC(=O)NCC2(COC)CC2)CC1	ZINC000534589564	328317484	/nfs/dbraw/zinc/31/74/84/328317484.db2.gz	QFAMBRUWWXRRLI-UHFFFAOYSA-N	1	0	268.401	1.651	50	0		CDAARO
CCN(CC)C[C@H](C)[NH2+]Cc1cccc(CO)c1	ZINC000534649999	328336568	/nfs/dbraw/zinc/33/65/68/328336568.db2.gz	HFOGTANLVBJBMY-ZDUSSCGKSA-N	1	0	250.386	1.999	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@H](CNC(=O)C2(C)COC2)C1	ZINC000534661894	328349770	/nfs/dbraw/zinc/34/97/70/328349770.db2.gz	IADSMCIWEAJARE-LLVKDONJSA-N	1	0	254.374	1.260	50	0		CDAARO
CN(C(=O)[C@@H]([NH3+])c1ccccc1)[C@H]1CCSC1	ZINC000037175059	326918198	/nfs/dbraw/zinc/91/81/98/326918198.db2.gz	CXSIIEMTTWJLEK-RYUDHWBXSA-N	1	0	250.367	1.650	50	0		CDAARO
CC[NH+](CC)CCCNc1nnc(CN(C)C)o1	ZINC001772708737	1159443416	/nfs/dbraw/zinc/44/34/16/1159443416.db2.gz	JDDILGNPNZEBAH-UHFFFAOYSA-N	1	0	255.366	1.275	50	0		CDAARO
CCc1[nH+]c(N)nc(N2CCC[C@H](NC(C)=O)C2)c1C	ZINC001772711846	1159445449	/nfs/dbraw/zinc/44/54/49/1159445449.db2.gz	GHSWFQZUSGMERK-NSHDSACASA-N	1	0	277.372	1.035	50	0		CDAARO
Cc1cc(C(=O)NCCn2c(C)c[nH+]c2C2CC2)n(C)n1	ZINC000581813093	1159460429	/nfs/dbraw/zinc/46/04/29/1159460429.db2.gz	ZJAAFLNWVDUBEL-UHFFFAOYSA-N	1	0	287.367	1.541	50	0		CDAARO
OC[C@H]1CN(Cc2ccncc2)C[C@H]1C[NH+]1CCCC1	ZINC000091738540	482579325	/nfs/dbraw/zinc/57/93/25/482579325.db2.gz	GWDMGSAGADRXKH-HZPDHXFCSA-N	1	0	275.396	1.218	50	0		CDAARO
Cn1ncc2c1ncnc2N[C@@H]1C[C@@H]([NH+](C)C)C1(C)C	ZINC000585092407	482828571	/nfs/dbraw/zinc/82/85/71/482828571.db2.gz	VJRQKINAHPVSQX-GHMZBOCLSA-N	1	0	274.372	1.504	50	0		CDAARO
C[C@H](Cn1cccn1)[NH2+]CCCn1ccccc1=O	ZINC000670438660	482981797	/nfs/dbraw/zinc/98/17/97/482981797.db2.gz	JUELQOWZNPCYLJ-CYBMUJFWSA-N	1	0	260.341	1.113	50	0		CDAARO
CCc1nccn1CCC(=O)NC[C@@]1(C)CC[N@H+](C)C1	ZINC000670443009	482990177	/nfs/dbraw/zinc/99/01/77/482990177.db2.gz	JGGAAAIOURIQGK-OAHLLOKOSA-N	1	0	278.400	1.294	50	0		CDAARO
Nc1ncc(C[N@@H+]2CCC[C@@H](c3ccncn3)C2)s1	ZINC000670461277	483043434	/nfs/dbraw/zinc/04/34/34/483043434.db2.gz	LQQJPCNUQDNZII-SNVBAGLBSA-N	1	0	275.381	1.895	50	0		CDAARO
Cc1cc2cc(C[NH2+]CCNS(C)(=O)=O)oc2cc1C	ZINC000096453972	534089776	/nfs/dbraw/zinc/08/97/76/534089776.db2.gz	SCGHBPPCHMTCON-UHFFFAOYSA-N	1	0	296.392	1.688	50	0		CDAARO
O=C(NCCCOC1CCCC1)[C@H]1CC12CC[NH2+]CC2	ZINC000238059355	527682216	/nfs/dbraw/zinc/68/22/16/527682216.db2.gz	ZGQQJYXFZMWFKK-CQSZACIVSA-N	1	0	280.412	1.842	50	0		CDAARO
Cc1cccc(NCCN2CCN(c3ncccn3)CC2)n1	ZINC000097096677	567903978	/nfs/dbraw/zinc/90/39/78/567903978.db2.gz	LQKNXFOEUVJOQB-UHFFFAOYSA-N	1	0	298.394	1.414	50	0		CDAARO
C[C@@H]1CN(C(=O)CN2CCC[C@@H]2c2ccc[nH]2)C[C@H](C)O1	ZINC000076091384	567904468	/nfs/dbraw/zinc/90/44/68/567904468.db2.gz	JYPSGYZOLPBPHL-VNHYZAJKSA-N	1	0	291.395	1.787	50	0		CDAARO
C[C@H](SC1=[NH+]CCN1)C(=O)Nc1ccc(F)cc1	ZINC000001994514	574930747	/nfs/dbraw/zinc/93/07/47/574930747.db2.gz	NMJVRKOTIYNGJZ-QMMMGPOBSA-N	1	0	267.329	1.845	50	0		CDAARO
CN(C)c1ccc(C[NH2+]CCN2CCCC[C@H]2CO)cn1	ZINC000952990741	616015616	/nfs/dbraw/zinc/01/56/16/616015616.db2.gz	SVULJBRTAAHXJN-HNNXBMFYSA-N	1	0	292.427	1.084	50	0		CDAARO
Cn1ccc(C(=O)NC[C@H]2C[NH2+]Cc3ccccc32)n1	ZINC000888101042	617765100	/nfs/dbraw/zinc/76/51/00/617765100.db2.gz	RIQAHAJLWFWCRF-GFCCVEGCSA-N	1	0	270.336	1.037	50	0		CDAARO
OC[C@@H](O)C1CC[NH+](CCCOCc2ccccc2)CC1	ZINC001772709142	1159443232	/nfs/dbraw/zinc/44/32/32/1159443232.db2.gz	MLHWWUJRDNBHCL-QGZVFWFLSA-N	1	0	293.407	1.659	50	0		CDAARO
COC[C@@H]1[C@H](C(=O)NCCc2ccccn2)CCC[N@@H+]1C	ZINC000581813310	1159460876	/nfs/dbraw/zinc/46/08/76/1159460876.db2.gz	UZWROEYTFNNTFI-HUUCEWRRSA-N	1	0	291.395	1.097	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3cncs3)C[C@@H]2O)[nH]n1	ZINC001704301159	1177680159	/nfs/dbraw/zinc/68/01/59/1177680159.db2.gz	NBZFUZYXBWGFPR-MFKMUULPSA-N	1	0	278.381	1.210	50	0		CDAARO
CC(C)(CN(CCO)Cc1ncc[nH]1)[NH+]1CCCCC1	ZINC001704308332	1177682105	/nfs/dbraw/zinc/68/21/05/1177682105.db2.gz	HUOGOYGGISRJEG-UHFFFAOYSA-N	1	0	280.416	1.469	50	0		CDAARO
Cc1nc2c(c(N[C@H]3CCCOC3)n1)CC[NH2+]CC2	ZINC000063882666	726014215	/nfs/dbraw/zinc/01/42/15/726014215.db2.gz	CSZBMSVEZOUJQE-NSHDSACASA-N	1	0	262.357	1.064	50	0		CDAARO
Cc1nnc(CN2C[C@H]([NH+](C)C)[C@@H](C(C)C)C2)s1	ZINC000092099482	726175439	/nfs/dbraw/zinc/17/54/39/726175439.db2.gz	GJZFHIJKGVRVTI-NEPJUHHUSA-N	1	0	268.430	1.865	50	0		CDAARO
O[C@@H]1CN(C2CC[NH+](Cc3ccco3)CC2)C[C@H]1F	ZINC000952965258	726398729	/nfs/dbraw/zinc/39/87/29/726398729.db2.gz	SYRWMFUMYQZEAP-ZIAGYGMSSA-N	1	0	268.332	1.259	50	0		CDAARO
COc1cc(C[N@H+]2CCc3nncn3CC2)ccc1O	ZINC000020600350	727257794	/nfs/dbraw/zinc/25/77/94/727257794.db2.gz	WEPNYWQUVDUXSX-UHFFFAOYSA-N	1	0	274.324	1.051	50	0		CDAARO
Cc1cccc(C[NH2+]CCN2CCCC[C@H]2CO)n1	ZINC000952976174	727423278	/nfs/dbraw/zinc/42/32/78/727423278.db2.gz	MTLLPRYBVVWULZ-HNNXBMFYSA-N	1	0	263.385	1.326	50	0		CDAARO
O=C(C1CCOCC1)N1CCC[N@@H+](C2CCC2)CC1	ZINC000827763698	727469400	/nfs/dbraw/zinc/46/94/00/727469400.db2.gz	IZAAPMQJLVNSIE-UHFFFAOYSA-N	1	0	266.385	1.500	50	0		CDAARO
CCc1[nH+]c(N)nc(N(C)C[C@H]2CCCCO2)c1C	ZINC000091326269	727878909	/nfs/dbraw/zinc/87/89/09/727878909.db2.gz	ZRMYCWYZXWFRMC-LLVKDONJSA-N	1	0	264.373	1.935	50	0		CDAARO
c1nnc2n1CC[N@@H+](Cc1ccc3ncccc3c1)CC2	ZINC000019744468	728369927	/nfs/dbraw/zinc/36/99/27/728369927.db2.gz	CICXGCWAUPVOMW-UHFFFAOYSA-N	1	0	279.347	1.885	50	0		CDAARO
Cc1nc2c(c(N[C@@H]3CCCOC3)n1)CC[NH2+]CC2	ZINC000063882665	728372309	/nfs/dbraw/zinc/37/23/09/728372309.db2.gz	CSZBMSVEZOUJQE-LLVKDONJSA-N	1	0	262.357	1.064	50	0		CDAARO
Cc1nc(CO[C@H]2CCC[N@@H+](C3CCN(C)CC3)C2)no1	ZINC000675017052	899873180	/nfs/dbraw/zinc/87/31/80/899873180.db2.gz	PGFMDQZGKGAMCA-AWEZNQCLSA-N	1	0	294.399	1.453	50	0		CDAARO
NC(=O)[C@@H]1C[N@H+](Cc2cscn2)C[C@H]1c1ccccc1	ZINC000585087182	902252158	/nfs/dbraw/zinc/25/21/58/902252158.db2.gz	ZZFWXNHUOWPZEJ-UONOGXRCSA-N	1	0	287.388	1.844	50	0		CDAARO
COc1nccnc1N[C@H]1C[N@H+](C(C)C)C[C@@H]1OC	ZINC001506417039	909133141	/nfs/dbraw/zinc/13/31/41/909133141.db2.gz	KFGMORYNVNPUAJ-QWRGUYRKSA-N	1	0	266.345	1.005	50	0		CDAARO
COC(C)(C)C[NH2+]C[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000952995735	910584133	/nfs/dbraw/zinc/58/41/33/910584133.db2.gz	XGIYNPGJSVGZCQ-CYBMUJFWSA-N	1	0	261.362	1.094	50	0		CDAARO
CC[N@@H+]1CCN(Cc2nc(C)c(C)n2C)CC1(C)C	ZINC000823112201	925672869	/nfs/dbraw/zinc/67/28/69/925672869.db2.gz	RIBHHUODEGXESN-UHFFFAOYSA-N	1	0	264.417	1.953	50	0		CDAARO
CN1CCCC[C@@H]1C[NH2+]C1CSCCSC1	ZINC000823778030	925728962	/nfs/dbraw/zinc/72/89/62/925728962.db2.gz	ZUHKLOVPWFNHNS-GFCCVEGCSA-N	1	0	260.472	1.909	50	0		CDAARO
Cc1nccn1C[C@H](C)[NH2+]Cc1cccc(CO)c1	ZINC000828827575	926194205	/nfs/dbraw/zinc/19/42/05/926194205.db2.gz	GJTVCIWCBGZKFV-LBPRGKRZSA-N	1	0	259.353	1.862	50	0		CDAARO
C[N@@H+]1CCC[C@H]1COc1nccc(C(F)(F)F)n1	ZINC000585651008	932836251	/nfs/dbraw/zinc/83/62/51/932836251.db2.gz	IFSKLILCKCWFCF-QMMMGPOBSA-N	1	0	261.247	1.968	50	0		CDAARO
COC1(OC)CC[C@@H]1[NH2+][C@@H]1CCN(c2ncccc2F)C1	ZINC000864097258	934606745	/nfs/dbraw/zinc/60/67/45/934606745.db2.gz	RAMMOLPSMPDHBX-YPMHNXCESA-N	1	0	295.358	1.541	50	0		CDAARO
Cc1nncn1CCN1CCC[C@@]2(CC[N@@H+](C)C2)C1	ZINC001506397505	975147705	/nfs/dbraw/zinc/14/77/05/975147705.db2.gz	SHGOLWXLDFAVCQ-AWEZNQCLSA-N	1	0	263.389	1.004	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+][C@H]1CC[C@H](O)CC1	ZINC001506396901	975148018	/nfs/dbraw/zinc/14/80/18/975148018.db2.gz	ONUSJHJZNLICPZ-JHJVBQTASA-N	1	0	251.374	1.727	50	0		CDAARO
O=C([C@H]1C=CC[NH2+]1)N1CCOc2ccc(Cl)cc2C1	ZINC001506400549	975148881	/nfs/dbraw/zinc/14/88/81/975148881.db2.gz	KMAWLNFRIBHVRI-GFCCVEGCSA-N	1	0	278.739	1.589	50	0		CDAARO
CC(C)Oc1cc(NC[C@@H]2CCCC[N@@H+]2C)nc(N)n1	ZINC001506418568	975156730	/nfs/dbraw/zinc/15/67/30/975156730.db2.gz	ZYUGCNAAGIAJTD-NSHDSACASA-N	1	0	279.388	1.742	50	0		CDAARO
CNC(=O)C[C@H]1CC[N@H+](Cc2cncn2CC(C)C)C1	ZINC001506424314	975159541	/nfs/dbraw/zinc/15/95/41/975159541.db2.gz	BQSWLDBEVOOJML-CYBMUJFWSA-N	1	0	278.400	1.497	50	0		CDAARO
COc1cc2cc(CC[NH3+])c(=O)[nH]c2cc1Cl	ZINC000011980451	230370826	/nfs/dbraw/zinc/37/08/26/230370826.db2.gz	PHGNWRLCKFWWMD-UHFFFAOYSA-N	1	0	252.701	1.691	50	0		CDAARO
COC[C@H](C)[NH2+]CC(=O)N[C@@H](C)CCc1ccccc1	ZINC000002632890	230367406	/nfs/dbraw/zinc/36/74/06/230367406.db2.gz	QBNZJZNDRPVDEX-KBPBESRZSA-N	1	0	278.396	1.748	50	0		CDAARO
C[N@@H+]1CC[C@](C)(Cn2cnc3ccc(F)cc3c2=O)C1	ZINC000584902261	341986821	/nfs/dbraw/zinc/98/68/21/341986821.db2.gz	HNGRHIPAPUTGJR-HNNXBMFYSA-N	1	0	275.327	1.877	50	0		CDAARO
CN(CC[NH+]1CCCC1)C(=O)CSc1ccccn1	ZINC000584902629	341986920	/nfs/dbraw/zinc/98/69/20/341986920.db2.gz	AHQMMEHJXLZULI-UHFFFAOYSA-N	1	0	279.409	1.728	50	0		CDAARO
CO[C@H]1[C@@H]2CC[C@H]1CN(C(=O)CC1CC[NH2+]CC1)C2	ZINC000584903793	341994006	/nfs/dbraw/zinc/99/40/06/341994006.db2.gz	BIOQMYAPRZANEQ-NHAGDIPZSA-N	1	0	266.385	1.260	50	0		CDAARO
C[C@H]([C@H](C)O)[NH+]1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000095964836	185045740	/nfs/dbraw/zinc/04/57/40/185045740.db2.gz	STCDWRMUHCPXON-YCPHGPKFSA-N	1	0	278.396	1.107	50	0		CDAARO
C[NH2+]C[C@@H](C)CNC(=O)CCc1cccc(F)c1	ZINC000095971600	185049015	/nfs/dbraw/zinc/04/90/15/185049015.db2.gz	VOZQSSBJCRQHGL-LLVKDONJSA-N	1	0	252.333	1.730	50	0		CDAARO
Cc1cc(CCNC(=O)[C@H]2CCC[NH2+]2)ccc1F	ZINC000095996574	185061003	/nfs/dbraw/zinc/06/10/03/185061003.db2.gz	YHHWSBXTOLEVJM-CYBMUJFWSA-N	1	0	250.317	1.545	50	0		CDAARO
c1ccn2c(c1)nnc2C[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCC2	ZINC000096003517	185061744	/nfs/dbraw/zinc/06/17/44/185061744.db2.gz	HAJSXVJANHZYEY-GLQYFDAESA-N	1	0	284.363	1.777	50	0		CDAARO
C[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1cc(C2CC2)on1	ZINC000242048177	361754504	/nfs/dbraw/zinc/75/45/04/361754504.db2.gz	VTLVMMTYWMZGIG-PWSUYJOCSA-N	1	0	275.352	1.861	50	0		CDAARO
COc1cc(C[NH+]2CCC(n3cncn3)CC2)ccc1O	ZINC000194973802	342612043	/nfs/dbraw/zinc/61/20/43/342612043.db2.gz	BLBJRJPQBOQLBC-UHFFFAOYSA-N	1	0	288.351	1.829	50	0		CDAARO
C[NH+](C)CC(=O)N1CCc2[nH]c(-c3ccccc3)nc2C1	ZINC000096141837	185106946	/nfs/dbraw/zinc/10/69/46/185106946.db2.gz	GCWBZFNKPOQRMD-UHFFFAOYSA-N	1	0	284.363	1.523	50	0		CDAARO
CC(C)(C)[C@@H]([NH2+]Cc1cnn(C(C)(C)C)c1)C(N)=O	ZINC000195573613	342628821	/nfs/dbraw/zinc/62/88/21/342628821.db2.gz	MQPOELQSGZLIGT-NSHDSACASA-N	1	0	266.389	1.628	50	0		CDAARO
Cc1ccc([C@H]([NH2+]CC(=O)NC(N)=O)c2ccccc2)cc1	ZINC000096714510	185110331	/nfs/dbraw/zinc/11/03/31/185110331.db2.gz	LAVCCBLQNRHSQR-MRXNPFEDSA-N	1	0	297.358	1.869	50	0		CDAARO
Cc1nnsc1CN(C)C[C@@H](C)[NH+]1CCCC1	ZINC000244601810	361853793	/nfs/dbraw/zinc/85/37/93/361853793.db2.gz	DSBITIJCVQVWGM-SNVBAGLBSA-N	1	0	254.403	1.763	50	0		CDAARO
CC(C)[NH+]1CCN(c2cc([C@H]3C[C@@H](O)C3)ncn2)CC1	ZINC000244633678	361855175	/nfs/dbraw/zinc/85/51/75/361855175.db2.gz	GHOGUDXVTAEYDY-BETUJISGSA-N	1	0	276.384	1.245	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCN(c2ccncc2Cl)CC1	ZINC000097234185	342205385	/nfs/dbraw/zinc/20/53/85/342205385.db2.gz	FOPKWEDFJCODFN-LLVKDONJSA-N	1	0	282.775	1.121	50	0		CDAARO
CN(C)C(=O)[C@H]1CC[C@H](C[NH2+]C2Cc3ccccc3C2)O1	ZINC000097033465	185155547	/nfs/dbraw/zinc/15/55/47/185155547.db2.gz	UMSTUHBHFYQIIF-HZPDHXFCSA-N	1	0	288.391	1.379	50	0		CDAARO
CCc1nn(C)cc1C[N@H+](C)C1(CO)CCSCC1	ZINC000097033947	185155848	/nfs/dbraw/zinc/15/58/48/185155848.db2.gz	GSVXROHXZMNMKL-UHFFFAOYSA-N	1	0	283.441	1.672	50	0		CDAARO
Cc1ccccc1[C@H](O)CNC(=O)[C@@H](C)[C@H](C)[NH3+]	ZINC000249090436	539066865	/nfs/dbraw/zinc/06/68/65/539066865.db2.gz	SPRVIHKWFOFDIB-GMXVVIOVSA-N	1	0	250.342	1.128	50	0		CDAARO
NC(=O)C1([NH2+]Cc2ccc(OC[C@@H]3CCCO3)cc2)CC1	ZINC000183820413	539145435	/nfs/dbraw/zinc/14/54/35/539145435.db2.gz	FKRQACTYHOBEQE-AWEZNQCLSA-N	1	0	290.363	1.352	50	0		CDAARO
C[C@H](C(=O)NC(=O)NC1CC1)[N@@H+]1CC[C@H]2CCCC[C@@H]2C1	ZINC000108987313	349766336	/nfs/dbraw/zinc/76/63/36/349766336.db2.gz	YKSYXOUHZNRPLC-JHJVBQTASA-N	1	0	293.411	1.875	50	0		CDAARO
CO[C@]1(C[NH2+]Cc2nncn2-c2ccccc2)CCOC1	ZINC000585117840	362046313	/nfs/dbraw/zinc/04/63/13/362046313.db2.gz	ZJQOHSYBMAQSFF-HNNXBMFYSA-N	1	0	288.351	1.162	50	0		CDAARO
CC(C)OCC[NH+]1CCN(c2cc(CO)ccn2)CC1	ZINC000585132901	362057697	/nfs/dbraw/zinc/05/76/97/362057697.db2.gz	FPVWYRBARNSJSI-UHFFFAOYSA-N	1	0	279.384	1.121	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CCC[C@@H](C(=O)c2ccc(F)cc2)C1	ZINC000127020239	187276125	/nfs/dbraw/zinc/27/61/25/187276125.db2.gz	IHYGCNDBKHHEPY-UKRRQHHQSA-N	1	0	295.354	1.728	50	0		CDAARO
CC[N@H+](CCNS(=O)(=O)CC)Cc1ccccc1	ZINC000084774777	362272518	/nfs/dbraw/zinc/27/25/18/362272518.db2.gz	QQBUUPVDDIHDSE-UHFFFAOYSA-N	1	0	270.398	1.448	50	0		CDAARO
COc1cc(Br)ccc1C(=O)N1CC[NH2+]CC1	ZINC000127212992	187289649	/nfs/dbraw/zinc/28/96/49/187289649.db2.gz	KSRKYFWHVWXVRZ-UHFFFAOYSA-N	1	0	299.168	1.503	50	0		CDAARO
COC(=O)C[C@]1(C(=O)OC)CC[N@H+](Cc2ccccc2)C1	ZINC000398595432	345573354	/nfs/dbraw/zinc/57/33/54/345573354.db2.gz	RWDLITXDVOCOBQ-MRXNPFEDSA-N	1	0	291.347	1.615	50	0		CDAARO
CC(C)Oc1ccc(C(=O)NCC[NH2+]C(C)(C)C)cn1	ZINC000084622034	178905657	/nfs/dbraw/zinc/90/56/57/178905657.db2.gz	HBIXEOFMZYLSSK-UHFFFAOYSA-N	1	0	279.384	1.987	50	0		CDAARO
CCOC(=O)[C@@]12C[NH2+]C[C@@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000051943470	346372632	/nfs/dbraw/zinc/37/26/32/346372632.db2.gz	LWIRXZLYPPQKOS-QMTHXVAHSA-N	1	0	284.356	1.006	50	0		CDAARO
CCc1nnc2n1C[C@@H](C[NH2+]Cc1cc(C)on1)CC2	ZINC000089296395	346755127	/nfs/dbraw/zinc/75/51/27/346755127.db2.gz	WRUDAYWVEZKJTG-LLVKDONJSA-N	1	0	275.356	1.489	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2c(F)cc(F)cc2F)C1	ZINC000086997974	179377236	/nfs/dbraw/zinc/37/72/36/179377236.db2.gz	XVTUELJZXWQLCJ-MRVPVSSYSA-N	1	0	272.270	1.785	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)c2sccc2OC)C1	ZINC000128861422	187394691	/nfs/dbraw/zinc/39/46/91/187394691.db2.gz	VCERHUAVSXBMOW-VIFPVBQESA-N	1	0	254.355	1.581	50	0		CDAARO
CC(C)C[N@@H+]1CCN(C(=O)CC2CCC2)C[C@@H]1CCO	ZINC000584893661	349353234	/nfs/dbraw/zinc/35/32/34/349353234.db2.gz	HFBQOBAGUGUGMC-HNNXBMFYSA-N	1	0	282.428	1.728	50	0		CDAARO
Cc1ccc(Cl)cc1S(=O)(=O)N1CCC([NH3+])CC1	ZINC000036753761	362946025	/nfs/dbraw/zinc/94/60/25/362946025.db2.gz	VIZOYQJOFQZTDQ-UHFFFAOYSA-N	1	0	288.800	1.760	50	0		CDAARO
CC[C@H](O)C1CCN(C(=O)CCC[NH+]2CCCC2)CC1	ZINC000584898157	349360153	/nfs/dbraw/zinc/36/01/53/349360153.db2.gz	KEPKBHSVCSTVBO-HNNXBMFYSA-N	1	0	282.428	1.872	50	0		CDAARO
CCOCC[NH2+]Cc1cc(=O)c2cc(C)ccc2[nH]1	ZINC000091643293	180214229	/nfs/dbraw/zinc/21/42/29/180214229.db2.gz	BMEBFOBJIWJEHK-UHFFFAOYSA-N	1	0	260.337	1.963	50	0		CDAARO
COc1cccc(Cc2nsc(N3CC[NH2+]CC3)n2)c1	ZINC000091695934	180229511	/nfs/dbraw/zinc/22/95/11/180229511.db2.gz	VITPKHYCLSPTJG-UHFFFAOYSA-N	1	0	290.392	1.547	50	0		CDAARO
COCC[C@@]1(CO)CCC[N@H+](CCCn2ccnc2)C1	ZINC000091877170	180278892	/nfs/dbraw/zinc/27/88/92/180278892.db2.gz	FRMRYJTYLUUVNV-HNNXBMFYSA-N	1	0	281.400	1.384	50	0		CDAARO
Cn1cc(C[N@@H+]2CCC[C@](CO)(CC3CC3)C2)cn1	ZINC000092062077	180315170	/nfs/dbraw/zinc/31/51/70/180315170.db2.gz	MZJCEBVRVJDOHZ-HNNXBMFYSA-N	1	0	263.385	1.795	50	0		CDAARO
CCc1c(C)nc(C)nc1N1C[C@H](CO)[C@H](C[NH+](C)C)C1	ZINC000092019742	180307907	/nfs/dbraw/zinc/30/79/07/180307907.db2.gz	BMXWLVHCBADEQL-ZIAGYGMSSA-N	1	0	292.427	1.262	50	0		CDAARO
Cc1nc2ccsc2c(NC[C@@H]2C[NH2+]CCOC2)n1	ZINC000092098482	180325091	/nfs/dbraw/zinc/32/50/91/180325091.db2.gz	BPTIKMCUXAYSHP-JTQLQIEISA-N	1	0	278.381	1.648	50	0		CDAARO
CCO[C@H](CC)C(=O)N1C[C@@H]2CCCC[N@@H+]2C[C@H]1C	ZINC000252512208	350385986	/nfs/dbraw/zinc/38/59/86/350385986.db2.gz	OBYQYPIBXJNZMM-HZSPNIEDSA-N	1	0	268.401	1.887	50	0		CDAARO
Cc1nonc1C[N@H+]1CC[C@@]2(C1)CCCN(C(C)C)C2=O	ZINC000092077494	180318956	/nfs/dbraw/zinc/31/89/56/180318956.db2.gz	LHUFXAOCEXYZER-OAHLLOKOSA-N	1	0	292.383	1.601	50	0		CDAARO
CCc1noc(C)c1C(=O)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065385399	362968435	/nfs/dbraw/zinc/96/84/35/362968435.db2.gz	CBYBLGVYLPPGKE-MNOVXSKESA-N	1	0	263.341	1.512	50	0		CDAARO
C[C@H](Cn1cccn1)[NH2+][C@@H]1CCN(CC(F)(F)F)C1=O	ZINC000111229651	186371930	/nfs/dbraw/zinc/37/19/30/186371930.db2.gz	CLAOWZILUPQXHT-NXEZZACHSA-N	1	0	290.289	1.024	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@@]1(C)CCC[NH2+]C1	ZINC000111668794	186439219	/nfs/dbraw/zinc/43/92/19/186439219.db2.gz	BPPDUOHFXXCSPI-ZDUSSCGKSA-N	1	0	267.398	1.800	50	0		CDAARO
COCC1(C(=O)N[C@@H]2C[NH+]3CCC2CC3)CCC1	ZINC000065407262	363100545	/nfs/dbraw/zinc/10/05/45/363100545.db2.gz	YIWPHURPBYMMOG-GFCCVEGCSA-N	1	0	252.358	1.014	50	0		CDAARO
Cc1nc(C)c(C[NH2+]CC[C@]2(O)CCCOC2)o1	ZINC000628325822	363160983	/nfs/dbraw/zinc/16/09/83/363160983.db2.gz	GLPSJXAUAYNCPP-CYBMUJFWSA-N	1	0	254.330	1.313	50	0		CDAARO
COCC[NH2+]CCOCCOc1cc(C)cc(C)c1	ZINC000002975026	538148483	/nfs/dbraw/zinc/14/84/83/538148483.db2.gz	JKKPQHLQXGMXTJ-UHFFFAOYSA-N	1	0	267.369	1.935	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C1CCN(c2ccccn2)CC1	ZINC000036932235	363294613	/nfs/dbraw/zinc/29/46/13/363294613.db2.gz	DSKOBDCEOGLQNE-UHFFFAOYSA-N	1	0	271.368	1.872	50	0		CDAARO
Cc1ccc(CC(=O)NCC2=CC[N@H+](C)CC2)cc1O	ZINC000271811288	191340978	/nfs/dbraw/zinc/34/09/78/191340978.db2.gz	KWIMVDSESQYMPP-UHFFFAOYSA-N	1	0	274.364	1.621	50	0		CDAARO
COc1ccccc1/C(C)=C\C(=O)N1CC[NH2+]CC1	ZINC000255164304	356004085	/nfs/dbraw/zinc/00/40/85/356004085.db2.gz	AVJORUYQYZUFQK-QXMHVHEDSA-N	1	0	260.337	1.530	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)N2CCC3(CCOCC3)CC2)C1	ZINC000584901751	355956174	/nfs/dbraw/zinc/95/61/74/355956174.db2.gz	HTVFDOGLZBSCNI-QWHCGFSZSA-N	1	0	266.385	1.533	50	0		CDAARO
COc1ccc(/C(C)=C\C(=O)N2CC[NH2+]C[C@H]2C)cc1	ZINC000255050009	355967424	/nfs/dbraw/zinc/96/74/24/355967424.db2.gz	MPAWJQFOGLVZLA-KXXVWKPMSA-N	1	0	274.364	1.919	50	0		CDAARO
COc1ccc2c3c1O[C@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)[N@@H+](C)CC[C@]314	ZINC000003806721	356010104	/nfs/dbraw/zinc/01/01/04/356010104.db2.gz	OROGSEYTTFOCAN-DNJOTXNNSA-N	1	0	299.370	1.501	50	0	biogenic,fda	CDAARO
OC[C@H]1CCCC[N@@H+]1C[C@@H](O)COc1ccc(Cl)cc1	ZINC000004021679	356016254	/nfs/dbraw/zinc/01/62/54/356016254.db2.gz	WMTGSWKPLDSFKN-ZIAGYGMSSA-N	1	0	299.798	1.927	50	0		CDAARO
O=C(NC[C@@H]1CC[N@@H+](C2CC2)C1)NC1Cc2ccccc2C1	ZINC000097377450	356102339	/nfs/dbraw/zinc/10/23/39/356102339.db2.gz	NKGXFMXEGSHQJS-ZDUSSCGKSA-N	1	0	299.418	1.937	50	0		CDAARO
CCOC(=O)[C@H]1CCC[N@H+](Cc2c(C)nn(C)c2C)C1	ZINC000012396449	356297925	/nfs/dbraw/zinc/29/79/25/356297925.db2.gz	GOIRYYLSXYPTOE-ZDUSSCGKSA-N	1	0	279.384	1.812	50	0		CDAARO
C[C@@H]1C[C@H](N(C)Cc2ccc3c(c2)OCO3)C(=O)O1	ZINC000032860212	356397813	/nfs/dbraw/zinc/39/78/13/356397813.db2.gz	PPMUJXFSSJKPAP-KOLCDFICSA-N	1	0	263.293	1.551	50	0		CDAARO
O=C(COc1ccc2ccccc2c1)N1CC[NH2+]CC1	ZINC000019518290	356489778	/nfs/dbraw/zinc/48/97/78/356489778.db2.gz	CPHFYPIHYVHCAM-UHFFFAOYSA-N	1	0	270.332	1.650	50	0		CDAARO
O=C(Cc1ccc(Br)cc1)N1CC[NH2+]CC1	ZINC000019255806	356477935	/nfs/dbraw/zinc/47/79/35/356477935.db2.gz	OCEWJIGTFAIWNC-UHFFFAOYSA-N	1	0	283.169	1.423	50	0		CDAARO
CCC[NH+]1CCC([N@@H+]2CCC[C@H](C(=O)[O-])C2)CC1	ZINC000019735613	356498251	/nfs/dbraw/zinc/49/82/51/356498251.db2.gz	DZRSRWZRQUUFNV-LBPRGKRZSA-N	1	0	254.374	1.657	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COc2cc(C)ccc2C)CC1	ZINC000019770756	356501171	/nfs/dbraw/zinc/50/11/71/356501171.db2.gz	AOIXIPPQTHHDSX-INIZCTEOSA-N	1	0	292.423	1.681	50	0		CDAARO
[NH3+][C@H](Cc1ccccc1)C(=O)NCc1ccncc1	ZINC000020012723	356521870	/nfs/dbraw/zinc/52/18/70/356521870.db2.gz	HDEOFZSPKFJXQI-CQSZACIVSA-N	1	0	255.321	1.268	50	0		CDAARO
CC(C)C(=O)N1CCC(C[NH3+])(C(F)(F)F)CC1	ZINC000725264660	538455652	/nfs/dbraw/zinc/45/56/52/538455652.db2.gz	CMISLPZCYDCOKH-UHFFFAOYSA-N	1	0	252.280	1.772	50	0		CDAARO
Cc1nnc([C@H](C)N(C)CC2CC[NH+](C[C@H](C)O)CC2)o1	ZINC000247101340	356651809	/nfs/dbraw/zinc/65/18/09/356651809.db2.gz	IEJXQQYEQRQNOH-RYUDHWBXSA-N	1	0	296.415	1.464	50	0		CDAARO
C[C@H](c1ccccc1)[N@H+](C)CC(=O)N1CCNC1=O	ZINC000024685529	356658941	/nfs/dbraw/zinc/65/89/41/356658941.db2.gz	HWCNTQIVXIWJHV-LLVKDONJSA-N	1	0	261.325	1.231	50	0		CDAARO
C[C@@H](c1ccccc1)[N@H+](C)CC(=O)N1CCNC1=O	ZINC000024685533	356659253	/nfs/dbraw/zinc/65/92/53/356659253.db2.gz	HWCNTQIVXIWJHV-NSHDSACASA-N	1	0	261.325	1.231	50	0		CDAARO
CN1CCN(C(=O)CCC(=O)c2ccc(F)cc2)CC1	ZINC000025702636	356681777	/nfs/dbraw/zinc/68/17/77/356681777.db2.gz	JISPYCVOTAXLGG-UHFFFAOYSA-N	1	0	278.327	1.563	50	0		CDAARO
C[C@H]1CCCC[C@H]1NC(=O)CN1CCC2(CC1)OCCO2	ZINC000026933598	356700923	/nfs/dbraw/zinc/70/09/23/356700923.db2.gz	MPKVAKHQQUZQHR-UONOGXRCSA-N	1	0	296.411	1.520	50	0		CDAARO
Cc1cc(NC(=O)CN2CC[NH+](C3CCCC3)CC2)on1	ZINC000027120143	356703839	/nfs/dbraw/zinc/70/38/39/356703839.db2.gz	AZKZOSTXFGZXND-UHFFFAOYSA-N	1	0	292.383	1.482	50	0		CDAARO
CCCC[N@H+](C)CCC(=O)Nc1sccc1C(N)=O	ZINC000028851900	356727392	/nfs/dbraw/zinc/72/73/92/356727392.db2.gz	UNRNGDBXBLWOAE-UHFFFAOYSA-N	1	0	283.397	1.908	50	0		CDAARO
C[C@H](C[NH2+]CC1(C(N)=O)CCOCC1)c1ccccc1	ZINC000194204820	358513207	/nfs/dbraw/zinc/51/32/07/358513207.db2.gz	RDOPRXDDJUGELO-CYBMUJFWSA-N	1	0	276.380	1.662	50	0		CDAARO
C[NH+]1CCC(NC(=O)CCc2ccccc2F)CC1	ZINC000047837480	357166399	/nfs/dbraw/zinc/16/63/99/357166399.db2.gz	XIYAGACNMPANSS-UHFFFAOYSA-N	1	0	264.344	1.969	50	0		CDAARO
COC(=O)CC(=O)[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000048623180	357193270	/nfs/dbraw/zinc/19/32/70/357193270.db2.gz	SXQVHCRWMOYTMU-CYBMUJFWSA-N	1	0	261.321	1.641	50	0		CDAARO
COc1cc(NC(=N)NC(N)=[NH2+])c(OC)cc1Cl	ZINC000000569252	357267118	/nfs/dbraw/zinc/26/71/18/357267118.db2.gz	QAEAOPAEELIHIZ-UHFFFAOYSA-N	1	0	271.708	1.187	50	0		CDAARO
CN(C)[C@@H](C[NH2+][C@@H]1CC(C)(C)OC1(C)C)c1cnn(C)c1	ZINC000096477913	357491895	/nfs/dbraw/zinc/49/18/95/357491895.db2.gz	VCBNADBPQYUKLA-UONOGXRCSA-N	1	0	294.443	1.959	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(NC[C@H]2CCS(=O)(=O)C2)c1C	ZINC000065374552	357533217	/nfs/dbraw/zinc/53/32/17/357533217.db2.gz	FRQALKKOBIWGNO-LLVKDONJSA-N	1	0	298.412	1.006	50	0		CDAARO
C[C@@H](CO)[NH2+]CC(=O)Nc1ccc(F)c(F)c1F	ZINC000065385450	357534055	/nfs/dbraw/zinc/53/40/55/357534055.db2.gz	CIIRRYWKDLSFCD-LURJTMIESA-N	1	0	262.231	1.013	50	0		CDAARO
COC(=O)C(C)(C)NC(=O)CC[C@@H]1CCCC[N@@H+]1C	ZINC000065381505	357534132	/nfs/dbraw/zinc/53/41/32/357534132.db2.gz	SKMSIBVDQCQPGL-NSHDSACASA-N	1	0	270.373	1.319	50	0		CDAARO
C[C@@H]1CNC(=O)CC[N@@H+]1Cc1ccccc1Cn1cccn1	ZINC000067675595	357617758	/nfs/dbraw/zinc/61/77/58/357617758.db2.gz	FRCNIMOTGJYDQM-CQSZACIVSA-N	1	0	298.390	1.642	50	0		CDAARO
OCC1(O)CC[NH+](CCc2nc3cc(F)ccc3[nH]2)CC1	ZINC000067846760	357631052	/nfs/dbraw/zinc/63/10/52/357631052.db2.gz	PNCDNKUACKWIPS-UHFFFAOYSA-N	1	0	293.342	1.064	50	0		CDAARO
COCC(=O)NC[C@H](c1ccccc1C)[NH+](C)C	ZINC000067934814	357638509	/nfs/dbraw/zinc/63/85/09/357638509.db2.gz	JGDJKOXVVLEVJK-CYBMUJFWSA-N	1	0	250.342	1.360	50	0		CDAARO
COc1c(F)cc(CNC[C@@]2(O)CCC[NH2+]C2)cc1F	ZINC000072432953	357834550	/nfs/dbraw/zinc/83/45/50/357834550.db2.gz	KFRUWTJHOUQHMQ-CQSZACIVSA-N	1	0	286.322	1.178	50	0		CDAARO
CCNC(=O)NC(=O)C[NH2+][C@H](C)c1ccc(Cl)s1	ZINC000097111511	357986606	/nfs/dbraw/zinc/98/66/06/357986606.db2.gz	SUYOPVFXXSETTQ-SSDOTTSWSA-N	1	0	289.788	1.898	50	0		CDAARO
Cc1cc(N2CC[C@@H](CNc3ccccn3)C2)nc(N)[nH+]1	ZINC000097200868	358188819	/nfs/dbraw/zinc/18/88/19/358188819.db2.gz	SJBSXYWSINWTSP-LBPRGKRZSA-N	1	0	284.367	1.701	50	0		CDAARO
[NH3+]C1CCN(c2ncc(Br)cn2)CC1	ZINC000082662262	358183428	/nfs/dbraw/zinc/18/34/28/358183428.db2.gz	RFJNGTFGFAUBGJ-UHFFFAOYSA-N	1	0	257.135	1.167	50	0		CDAARO
OCC[C@@H]1C[NH2+]CCN1Cc1ccc(Cl)c(F)c1	ZINC000085207964	358255464	/nfs/dbraw/zinc/25/54/64/358255464.db2.gz	CGFUXCFWUHUPBB-LLVKDONJSA-N	1	0	272.751	1.635	50	0		CDAARO
[NH3+][C@@H](Cc1ccccc1)C(=O)N1CC[C@@]2(CCOC2)C1	ZINC000195542489	358559769	/nfs/dbraw/zinc/55/97/69/358559769.db2.gz	CJNPDKPSMKLDTL-GOEBONIOSA-N	1	0	274.364	1.195	50	0		CDAARO
Cc1nc(C)c(C)c(N2CC[C@]3(CC[N@@H+](C)C3)C2)n1	ZINC000095360270	358684219	/nfs/dbraw/zinc/68/42/19/358684219.db2.gz	PVSSIRAMKSKHEQ-HNNXBMFYSA-N	1	0	260.385	1.934	50	0		CDAARO
CCc1cc(NC[C@H](O)C[NH+]2CCCCC2)ncn1	ZINC000095360081	358684750	/nfs/dbraw/zinc/68/47/50/358684750.db2.gz	GJSABSWTHBFVFP-ZDUSSCGKSA-N	1	0	264.373	1.298	50	0		CDAARO
CC(C)c1ccnc(NC[C@H](O)C[NH+]2CCCC2)n1	ZINC000095361599	358685425	/nfs/dbraw/zinc/68/54/25/358685425.db2.gz	OAEOCMIBNYBONA-LBPRGKRZSA-N	1	0	264.373	1.469	50	0		CDAARO
Cc1ncnc(NC[C@H](C)N2CC[NH+](C)CC2)c1C	ZINC000095381424	358690470	/nfs/dbraw/zinc/69/04/70/358690470.db2.gz	SRNJJOYEKLGICC-NSHDSACASA-N	1	0	263.389	1.141	50	0		CDAARO
CCCCSc1nc(N)cc(NC[C@]2(O)CC[NH2+]C2)n1	ZINC000095387430	358691281	/nfs/dbraw/zinc/69/12/81/358691281.db2.gz	HZSAPSOVKDRWKL-ZDUSSCGKSA-N	1	0	297.428	1.087	50	0		CDAARO
CCc1[nH]nc(C(=O)N2CC([N@@H+]3CCCC[C@H]3C)C2)c1C	ZINC000097272548	358764310	/nfs/dbraw/zinc/76/43/10/358764310.db2.gz	IGDVXNPZVKPWGK-LLVKDONJSA-N	1	0	290.411	1.979	50	0		CDAARO
COc1ccc2ccccc2c1CNCC[NH2+]C[C@@H](C)O	ZINC000096318716	358732348	/nfs/dbraw/zinc/73/23/48/358732348.db2.gz	FIYUUQWXOFFGNT-CYBMUJFWSA-N	1	0	288.391	1.908	50	0		CDAARO
C[N@H+]1C[C@H]2CN(Cc3cccc(C(=O)[O-])c3)C[C@H]2C1	ZINC000097446869	358777744	/nfs/dbraw/zinc/77/77/44/358777744.db2.gz	DXDGQVDOHBRWNN-OKILXGFUSA-N	1	0	260.337	1.378	50	0		CDAARO
Cc1cc(C)c(NC(=O)N[C@@H]2CC[NH2+]C[C@H]2O)c(Cl)c1	ZINC000097572153	358785858	/nfs/dbraw/zinc/78/58/58/358785858.db2.gz	ISLQRYGPSDNZPR-VXGBXAGGSA-N	1	0	297.786	1.801	50	0		CDAARO
CCc1nccc(C[NH+]2CCC3(CC2)OCCC[C@H]3O)n1	ZINC000215725215	358900225	/nfs/dbraw/zinc/90/02/25/358900225.db2.gz	OMBDERKIZDNFHE-CQSZACIVSA-N	1	0	291.395	1.545	50	0		CDAARO
Cc1c[nH]nc1CN1CCC(CN2CCCCC2=O)CC1	ZINC000290477751	366528841	/nfs/dbraw/zinc/52/88/41/366528841.db2.gz	QPOOJKUDKJSTEC-UHFFFAOYSA-N	1	0	290.411	1.943	50	0		CDAARO
Cc1ccc(OC[C@H](O)CN2CC[NH+](C)CC2)c(C)c1	ZINC000022026867	359014711	/nfs/dbraw/zinc/01/47/11/359014711.db2.gz	DSPCKQXDWMAMSS-OAHLLOKOSA-N	1	0	278.396	1.291	50	0		CDAARO
CC[C@@H]1CCCC[N@@H+]1CC(=O)NCc1nccn1C	ZINC000221246468	359221237	/nfs/dbraw/zinc/22/12/37/359221237.db2.gz	IPAYFAWOLGZSSI-GFCCVEGCSA-N	1	0	264.373	1.301	50	0		CDAARO
Cc1ccc(O[C@H]2COCC[C@H]2[NH2+]C(C)C)cn1	ZINC000223745753	359451927	/nfs/dbraw/zinc/45/19/27/359451927.db2.gz	CHYYQNWOBRLQDY-KGLIPLIRSA-N	1	0	250.342	1.924	50	0		CDAARO
C[NH+](C)C[C@H]1CCN(CC(=O)NCC2CCCCC2)C1	ZINC000113516563	359454012	/nfs/dbraw/zinc/45/40/12/359454012.db2.gz	MRJMMBWGEOCFFY-OAHLLOKOSA-N	1	0	281.444	1.566	50	0		CDAARO
CCc1c(C)nn(CCNC(=O)[C@@H]([NH3+])[C@@H](C)CC)c1C	ZINC000223601660	359438169	/nfs/dbraw/zinc/43/81/69/359438169.db2.gz	BZHNOXJCFLHBDZ-HZMBPMFUSA-N	1	0	280.416	1.552	50	0		CDAARO
O=C1C[C@H](C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)CN1	ZINC000585094495	482830095	/nfs/dbraw/zinc/83/00/95/482830095.db2.gz	RNWVYRUULWSLRB-UWVGGRQHSA-N	1	0	264.291	1.787	50	0		CDAARO
Cc1n[nH]cc1C(=O)N(CC[NH+](C)C)Cc1ccco1	ZINC000089544385	360396382	/nfs/dbraw/zinc/39/63/82/360396382.db2.gz	SKQBFUIQYWYFGP-UHFFFAOYSA-N	1	0	276.340	1.515	50	0		CDAARO
CN(C[C@H]1CCC[N@H+](C)C1)C(=O)CC[C@H]1CCCO1	ZINC000248149924	360407432	/nfs/dbraw/zinc/40/74/32/360407432.db2.gz	SZARMDOUCQGESJ-UONOGXRCSA-N	1	0	268.401	1.746	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(C[C@H](O)c2cccc(F)c2)C[C@H]1C	ZINC000248318304	360494785	/nfs/dbraw/zinc/49/47/85/360494785.db2.gz	OIERGGADFLJKQW-WWGRRREGSA-N	1	0	296.386	1.246	50	0		CDAARO
CC[C@H](C)[N@H+](C)CCNC(=O)[C@H]1COc2ccccc2O1	ZINC000248220568	360461249	/nfs/dbraw/zinc/46/12/49/360461249.db2.gz	HTBQDJJBNWYZOG-SWLSCSKDSA-N	1	0	292.379	1.673	50	0		CDAARO
Cc1ccc(OCCS(=O)(=O)N2CCC[C@H]([NH3+])C2)cc1	ZINC000426477464	360567527	/nfs/dbraw/zinc/56/75/27/360567527.db2.gz	WYNSDUZFJZJLCV-ZDUSSCGKSA-N	1	0	298.408	1.127	50	0		CDAARO
O=C(c1cncn1-c1ccc(F)cc1)N1CC[NH2+]CC1	ZINC000178342484	189108674	/nfs/dbraw/zinc/10/86/74/189108674.db2.gz	XKNSTMNWNACPOQ-UHFFFAOYSA-N	1	0	274.299	1.057	50	0		CDAARO
O=C(NC[C@@H]1C[C@H](F)C[NH2+]1)c1conc1-c1ccccc1	ZINC000426511697	360678752	/nfs/dbraw/zinc/67/87/52/360678752.db2.gz	OZHNPBFMBUCLAV-RYUDHWBXSA-N	1	0	289.310	1.771	50	0		CDAARO
C[NH2+]CCCC(=O)Nc1cccc2c1OCCO2	ZINC000178439985	189116458	/nfs/dbraw/zinc/11/64/58/189116458.db2.gz	ZMDXEKZDDAJUOM-UHFFFAOYSA-N	1	0	250.298	1.396	50	0		CDAARO
Cc1cc(CNC(=O)N2CCC[C@]3(CC[NH2+]C3)C2)[nH]n1	ZINC000426589742	360686418	/nfs/dbraw/zinc/68/64/18/360686418.db2.gz	ICOGOXTXSIPUBR-CQSZACIVSA-N	1	0	277.372	1.003	50	0		CDAARO
Cc1nc(C(F)(F)F)ncc1CN1CC[C@@H]([NH3+])C1	ZINC000426431951	360669647	/nfs/dbraw/zinc/66/96/47/360669647.db2.gz	OEIUZOFDMFMVMZ-SECBINFHSA-N	1	0	260.263	1.337	50	0		CDAARO
C[NH+](C)Cc1ccc(-c2nc(N)nc3nc[nH]c32)cc1	ZINC000426715802	360698852	/nfs/dbraw/zinc/69/88/52/360698852.db2.gz	BSJCLXWKURLFMU-UHFFFAOYSA-N	1	0	268.324	1.494	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)c2ccnc(-n3ccnc3)c2)C1	ZINC000178606305	189130757	/nfs/dbraw/zinc/13/07/57/189130757.db2.gz	LKWNBWXIMUIUOW-CYBMUJFWSA-N	1	0	285.351	1.091	50	0		CDAARO
COc1ccc(CCC(=O)N2CC[C@@H](C[NH3+])C2)cc1F	ZINC000178526351	189123900	/nfs/dbraw/zinc/12/39/00/189123900.db2.gz	ONDHPENOJOXNOV-LBPRGKRZSA-N	1	0	280.343	1.574	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2ccc(-n3cncn3)c(C)c2)C1	ZINC000179028660	189163157	/nfs/dbraw/zinc/16/31/57/189163157.db2.gz	BTNOMECOJGTQQG-CYBMUJFWSA-N	1	0	299.378	1.257	50	0		CDAARO
[NH3+]Cc1ccc(C(=O)N[C@@H]2CCC[C@H]3OCC[C@H]32)cc1	ZINC000262353989	360957100	/nfs/dbraw/zinc/95/71/00/360957100.db2.gz	ZHUZKEZCFHWMKK-RRFJBIMHSA-N	1	0	274.364	1.833	50	0		CDAARO
CC[C@@H](O)C[N@H+](C)C[C@@H]1CC(c2ccccc2)=NO1	ZINC000036146527	361139213	/nfs/dbraw/zinc/13/92/13/361139213.db2.gz	PGUBUSZXBGFZBV-KGLIPLIRSA-N	1	0	262.353	1.882	50	0		CDAARO
CO[C@H]1CCN(C(=O)c2cccc(C[NH+](C)C)c2)C1	ZINC000360979007	361615071	/nfs/dbraw/zinc/61/50/71/361615071.db2.gz	JBEHEHDSBNOYLL-AWEZNQCLSA-N	1	0	262.353	1.609	50	0		CDAARO
NC(=O)N1CCC([NH2+]Cc2ccccc2Cl)CC1	ZINC000037198981	363801896	/nfs/dbraw/zinc/80/18/96/363801896.db2.gz	OXRRVHXQPWESMJ-UHFFFAOYSA-N	1	0	267.760	1.973	50	0		CDAARO
Cc1nc2ccccn2c1CN1CC[N@@H+](C)[C@H](CCO)C1	ZINC000042628392	364602849	/nfs/dbraw/zinc/60/28/49/364602849.db2.gz	VWHKOZYKCBKVFS-CQSZACIVSA-N	1	0	288.395	1.141	50	0		CDAARO
Cc1nnc(NC(=O)[C@H]2CCc3nc[nH]c3C2)s1	ZINC000034503882	364871944	/nfs/dbraw/zinc/87/19/44/364871944.db2.gz	LSCLYVBBOFSTDM-ZETCQYMHSA-N	1	0	263.326	1.313	50	0		CDAARO
COCCN(Cc1ccccc1F)C(=O)C[C@H]1CC[NH2+]C1	ZINC000215589937	189696132	/nfs/dbraw/zinc/69/61/32/189696132.db2.gz	VUKYTUXPYANFNH-CYBMUJFWSA-N	1	0	294.370	1.800	50	0		CDAARO
O[C@@H]1CCCC[C@@H]1[NH+]1CCN(Cc2cscn2)CC1	ZINC000089764778	366931094	/nfs/dbraw/zinc/93/10/94/366931094.db2.gz	CXDOATPSQASQCR-UONOGXRCSA-N	1	0	281.425	1.564	50	0		CDAARO
C[NH+]1CCN(CCNC(=O)N2CCc3ccccc32)CC1	ZINC000252495427	367642560	/nfs/dbraw/zinc/64/25/60/367642560.db2.gz	OQDNZFGVMTYSJK-UHFFFAOYSA-N	1	0	288.395	1.006	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]C[C@H]2COC3(CCOCC3)O2)C1	ZINC000252512198	367683380	/nfs/dbraw/zinc/68/33/80/367683380.db2.gz	NZKLOQYHBFZNMP-AGIUHOORSA-N	1	0	255.358	1.687	50	0		CDAARO
Fc1ccc(N2CCN(CC[NH2+]CC3CC3)CC2)cc1	ZINC000037613588	369351485	/nfs/dbraw/zinc/35/14/85/369351485.db2.gz	WVAREUBHVHBPFG-UHFFFAOYSA-N	1	0	277.387	1.947	50	0		CDAARO
CO[C@H]1C[N@H+](CCSc2ccccc2)C[C@@H]1O	ZINC000670441780	482986870	/nfs/dbraw/zinc/98/68/70/482986870.db2.gz	NKRFJEVWIKESCL-STQMWFEESA-N	1	0	253.367	1.470	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1NC(=O)Cc1c(C)noc1C	ZINC000299767550	372750262	/nfs/dbraw/zinc/75/02/62/372750262.db2.gz	HUYBWOYUKDYSJB-KBPBESRZSA-N	1	0	295.383	1.058	50	0		CDAARO
CCc1ccc(NC(=O)N[C@@H]2C[NH2+]CC[C@H]2O)cc1	ZINC000299802830	372773556	/nfs/dbraw/zinc/77/35/56/372773556.db2.gz	QUGOYNDYBVOVDG-CHWSQXEVSA-N	1	0	263.341	1.093	50	0		CDAARO
O=C([C@@H]1CC[NH2+]C1)N1CCc2c1cc(F)cc2F	ZINC000253429991	373734204	/nfs/dbraw/zinc/73/42/04/373734204.db2.gz	DNTCBXJWXONKLN-MRVPVSSYSA-N	1	0	252.264	1.463	50	0		CDAARO
COC(=O)c1ccc(NC(=O)[C@H]2CCC[NH2+]C2)c(F)c1	ZINC000253430965	373744198	/nfs/dbraw/zinc/74/41/98/373744198.db2.gz	GGOBECMPEMVUNQ-JTQLQIEISA-N	1	0	280.299	1.550	50	0		CDAARO
Cc1ccc(O)c(C[NH2+]C2CCN(C(=O)C(C)C)CC2)n1	ZINC000112716579	374227515	/nfs/dbraw/zinc/22/75/15/374227515.db2.gz	CSYQAWHMUUQNTG-UHFFFAOYSA-N	1	0	291.395	1.832	50	0		CDAARO
C[C@@H](C[NH2+][C@@H]1CCc2ncnn2C1)c1ccccc1	ZINC000095398045	374902198	/nfs/dbraw/zinc/90/21/98/374902198.db2.gz	HORPZXGPBLYPGO-GXTWGEPZSA-N	1	0	256.353	1.986	50	0		CDAARO
C[C@@H](C(=O)NCC(F)(F)F)[N@H+](C)C[C@@H]1CCCCO1	ZINC000095430178	374933074	/nfs/dbraw/zinc/93/30/74/374933074.db2.gz	UMGFQTBMGKDCLS-UWVGGRQHSA-N	1	0	282.306	1.554	50	0		CDAARO
Cc1oc(-c2ccco2)nc1CC(=O)N1CC([NH+](C)C)C1	ZINC000095448388	374947840	/nfs/dbraw/zinc/94/78/40/374947840.db2.gz	ZFTMNSRESXNDPY-UHFFFAOYSA-N	1	0	289.335	1.558	50	0		CDAARO
CCOC(=O)C1(NC(=O)[C@@H]2CC=CCC2)CC[NH+](C)CC1	ZINC000095446985	374948573	/nfs/dbraw/zinc/94/85/73/374948573.db2.gz	JANQIRLVKXMAJY-CYBMUJFWSA-N	1	0	294.395	1.486	50	0		CDAARO
COC[C@H](O)C[N@H+](C)[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000096406963	375097121	/nfs/dbraw/zinc/09/71/21/375097121.db2.gz	POXWKYDMCKRORJ-HUUCEWRRSA-N	1	0	292.379	1.121	50	0		CDAARO
CCOc1ccccc1N1CC[NH+]([C@@H](C)[C@H](C)O)CC1	ZINC000095964817	375043314	/nfs/dbraw/zinc/04/33/14/375043314.db2.gz	VGSSTNKXKXDXKU-KBPBESRZSA-N	1	0	278.396	1.977	50	0		CDAARO
CC[NH+](CC)CCCNC(=O)N1CCOCC[C@@H]1C	ZINC000095985089	375048586	/nfs/dbraw/zinc/04/85/86/375048586.db2.gz	UPMWRLPBKBBEFB-ZDUSSCGKSA-N	1	0	271.405	1.539	50	0		CDAARO
COc1ccc(CNC(=O)C[NH2+][C@H]2CCCSC2)cc1	ZINC000097084504	375146260	/nfs/dbraw/zinc/14/62/60/375146260.db2.gz	DTIXNKNKTGHZLK-ZDUSSCGKSA-N	1	0	294.420	1.797	50	0		CDAARO
CCn1cc(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cn1	ZINC000027938207	375163286	/nfs/dbraw/zinc/16/32/86/375163286.db2.gz	CHNIIRGPJLGRIA-UHFFFAOYSA-N	1	0	278.400	1.942	50	0		CDAARO
CC/C(C)=C/CC[N@@H+]1CCN(C(C)=O)C[C@H](O)C1	ZINC000670440469	542011384	/nfs/dbraw/zinc/01/13/84/542011384.db2.gz	YQUBSGDAYUCTFH-TZWLIRKLSA-N	1	0	254.374	1.258	50	0		CDAARO
NC(=O)c1cncc(-c2cc(F)cc3c2O[C@H](C[NH3+])C3)c1	ZINC000067587382	377169622	/nfs/dbraw/zinc/16/96/22/377169622.db2.gz	JTMAOLJKCAEEBI-LBPRGKRZSA-N	1	0	287.294	1.249	50	0		CDAARO
CCc1cc(NC(=O)[C@H]2C[C@H](OC)C[NH2+]2)ccc1C	ZINC000189326904	377237989	/nfs/dbraw/zinc/23/79/89/377237989.db2.gz	CTQPSZFHQVJVAK-UONOGXRCSA-N	1	0	262.353	1.873	50	0		CDAARO
Cc1nnc([C@@H](C)N2CCCC[C@H]2CN2CCOCC2)o1	ZINC000245289573	378046143	/nfs/dbraw/zinc/04/61/43/378046143.db2.gz	CTIXUAKXMOYDNX-OCCSQVGLSA-N	1	0	294.399	1.626	50	0		CDAARO
C[C@@H]1C[NH+](CCCNC(=O)c2cccc(=O)[nH]2)C[C@@H](C)O1	ZINC000278632857	194076859	/nfs/dbraw/zinc/07/68/59/194076859.db2.gz	NHDAFKSFAMYBNQ-VXGBXAGGSA-N	1	0	293.367	1.016	50	0		CDAARO
Cc1ncsc1C(=O)N[C@@H](CO)C[NH+]1CCCCC1	ZINC000288644406	197135424	/nfs/dbraw/zinc/13/54/24/197135424.db2.gz	XQOYYPFFSHVJHP-LLVKDONJSA-N	1	0	283.397	1.028	50	0		CDAARO
COCCN(Cc1ccc(OC)cc1)C(=O)[C@@H](C)[NH+](C)C	ZINC000426529265	256860572	/nfs/dbraw/zinc/86/05/72/256860572.db2.gz	KHXFDYGUWOSJEX-CYBMUJFWSA-N	1	0	294.395	1.620	50	0		CDAARO
C[C@H](O)[C@H]1C[C@H](C)CC[N@@H+]1CC(=O)NCC1CCC1	ZINC000239882258	256868605	/nfs/dbraw/zinc/86/86/05/256868605.db2.gz	DASODIWMXPICSN-MBNYWOFBSA-N	1	0	268.401	1.384	50	0		CDAARO
Cc1ccc(S(=O)(=O)[C@@H](C[NH3+])c2cccnc2)cc1	ZINC000007951973	390180049	/nfs/dbraw/zinc/18/00/49/390180049.db2.gz	LIZZJJAHNUGKEJ-AWEZNQCLSA-N	1	0	276.361	1.864	50	0		CDAARO
Nc1nc2nc3ccc(Br)cc3c-2[nH][nH+]1	ZINC000012404614	390202799	/nfs/dbraw/zinc/20/27/99/390202799.db2.gz	SKMXJAYVKYKOOR-UHFFFAOYSA-N	1	0	264.086	1.851	50	0		CDAARO
Cn1ncc(N[C@H]2CC[N@H+](CC3CC3)C2)c(Cl)c1=O	ZINC000095394081	184965514	/nfs/dbraw/zinc/96/55/14/184965514.db2.gz	GWBMNLHTMFVLNZ-JTQLQIEISA-N	1	0	282.775	1.330	50	0		CDAARO
CC[C@H](CNC(=O)c1cccnc1OC)[NH+]1CCCC1	ZINC000032661150	390206654	/nfs/dbraw/zinc/20/66/54/390206654.db2.gz	DWXADNQKDMSWJD-GFCCVEGCSA-N	1	0	277.368	1.694	50	0		CDAARO
Cc1ccsc1[C@H](C)[NH2+]CC1(C(N)=O)CCOCC1	ZINC000095420233	184976082	/nfs/dbraw/zinc/97/60/82/184976082.db2.gz	RGFSIZUMMLLOEA-NSHDSACASA-N	1	0	282.409	1.989	50	0		CDAARO
COc1ccccc1OCCN1CC[NH2+][C@H](C)C1	ZINC000033359728	390389570	/nfs/dbraw/zinc/38/95/70/390389570.db2.gz	WKKSBZMLDRMLNH-GFCCVEGCSA-N	1	0	250.342	1.368	50	0		CDAARO
Cc1cnc(C)c(N2CCC([N@@H+]3CCC[C@@H](O)C3)CC2)n1	ZINC000077354302	390810002	/nfs/dbraw/zinc/81/00/02/390810002.db2.gz	NOQJCTHOWJTYAB-OAHLLOKOSA-N	1	0	290.411	1.519	50	0		CDAARO
Cc1cc(F)c(C(=O)N2CC[NH2+][C@H](C)C2)cc1F	ZINC000188413287	390958023	/nfs/dbraw/zinc/95/80/23/390958023.db2.gz	ZEGALCCAEFVQPI-SECBINFHSA-N	1	0	254.280	1.707	50	0		CDAARO
CC(C)([NH3+])C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O	ZINC000236808150	391272243	/nfs/dbraw/zinc/27/22/43/391272243.db2.gz	HPTCIQKFFJFADK-UHFFFAOYSA-N	1	0	263.219	1.070	50	0		CDAARO
CC1(C)C[C@H]([NH2+]Cc2ccc(S(C)(=O)=O)s2)CO1	ZINC000418010398	391289316	/nfs/dbraw/zinc/28/93/16/391289316.db2.gz	JPSUKORVFQYMMX-VIFPVBQESA-N	1	0	289.422	1.809	50	0		CDAARO
CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CCN(CCO)[C@H](C)C1	ZINC000191124159	391460263	/nfs/dbraw/zinc/46/02/63/391460263.db2.gz	MCBRYWMFVAXSKK-XHSDSOJGSA-N	1	0	266.429	1.977	50	0		CDAARO
COCCNC(=O)[C@H]1CC[C@H](C)[N@H+](Cc2cccnc2)C1	ZINC000096403442	393178918	/nfs/dbraw/zinc/17/89/18/393178918.db2.gz	HRAOFMBZFWIFNZ-ZFWWWQNUSA-N	1	0	291.395	1.445	50	0		CDAARO
Cc1ccc([C@@H]2CC[N@H+](CCCS(N)(=O)=O)C2)c(C)c1	ZINC000280467403	393151659	/nfs/dbraw/zinc/15/16/59/393151659.db2.gz	OSUDFLZXBIOYTM-CQSZACIVSA-N	1	0	296.436	1.771	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NC[C@H](O)C1CCCC1	ZINC000096421740	393185109	/nfs/dbraw/zinc/18/51/09/393185109.db2.gz	JINBCWRTWVCLPR-CABCVRRESA-N	1	0	282.428	1.917	50	0		CDAARO
C[NH+]1CCN(c2ccc(-c3ccnc(N)n3)cc2)CC1	ZINC000002508390	134640341	/nfs/dbraw/zinc/64/03/41/134640341.db2.gz	QLUMPXNBZQGDEZ-UHFFFAOYSA-N	1	0	269.352	1.478	50	0		CDAARO
Cc1nn2c(CN3CC[C@@](C)(C[NH3+])C3)c(C)nc2s1	ZINC000261615182	140363237	/nfs/dbraw/zinc/36/32/37/140363237.db2.gz	CQAUHUZMNGZLEM-ZDUSSCGKSA-N	1	0	279.413	1.578	50	0		CDAARO
COC(=O)CN1CCC([NH2+][C@@H]2CCc3ccccc32)CC1	ZINC000097095360	397958373	/nfs/dbraw/zinc/95/83/73/397958373.db2.gz	XWSCTMLAVNKLSS-MRXNPFEDSA-N	1	0	288.391	1.901	50	0		CDAARO
C[C@@H]1COCCN1C(=O)N[C@H]1CC[N@@H+](C2CCCC2)C1	ZINC000098012580	398004344	/nfs/dbraw/zinc/00/43/44/398004344.db2.gz	GYLVUZDOUYTMPK-OLZOCXBDSA-N	1	0	281.400	1.434	50	0		CDAARO
Cc1cc(C)n(CCC[NH2+][C@H](C)Cn2cccn2)n1	ZINC000121821722	147384280	/nfs/dbraw/zinc/38/42/80/147384280.db2.gz	AFEFZDDVOMLLOI-CYBMUJFWSA-N	1	0	261.373	1.765	50	0		CDAARO
COC(=O)[C@]12C[N@H+](C[C@@H]3CCC=CO3)C[C@H]1COCC2	ZINC000373485428	160204868	/nfs/dbraw/zinc/20/48/68/160204868.db2.gz	NSIQDNNPLNRRRF-KCQAQPDRSA-N	1	0	281.352	1.191	50	0		CDAARO
COCCCNC(=S)N1CC[NH+](C2CCCCC2)CC1	ZINC000002872693	169839310	/nfs/dbraw/zinc/83/93/10/169839310.db2.gz	IPRQUSVHUAERMY-UHFFFAOYSA-N	1	0	299.484	1.848	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@@H](CO)C2)cc2c1OCO2	ZINC000004948195	170044445	/nfs/dbraw/zinc/04/44/45/170044445.db2.gz	URPGSBSFLHUJNG-LLVKDONJSA-N	1	0	279.336	1.628	50	0		CDAARO
O=Cc1cn(C[C@H](O)C[NH+]2CCCC2)c2ccccc12	ZINC000005520924	170107575	/nfs/dbraw/zinc/10/75/75/170107575.db2.gz	ZAQTVTPMMVNLTJ-CQSZACIVSA-N	1	0	272.348	1.911	50	0		CDAARO
[NH2+]=C1Nc2nc3ccccc3n2C2(CCSCC2)N1	ZINC000006650291	170222211	/nfs/dbraw/zinc/22/22/11/170222211.db2.gz	UVCMWRPMIHQGII-UHFFFAOYSA-N	1	0	273.365	1.766	50	0		CDAARO
COc1ccc(CNC(=O)[C@H](C)[NH2+]C(C)C)cc1	ZINC000007985945	170311964	/nfs/dbraw/zinc/31/19/64/170311964.db2.gz	RMNMJQVNSHEDSH-NSHDSACASA-N	1	0	250.342	1.698	50	0		CDAARO
COc1ccc(OCCCC(=O)NCC[NH+](C)C)cc1	ZINC000010111694	170397828	/nfs/dbraw/zinc/39/78/28/170397828.db2.gz	HFSAMNANPWBWDE-UHFFFAOYSA-N	1	0	280.368	1.532	50	0		CDAARO
COc1ccc(N2C(=O)C[C@@H]([NH2+]C(C)C)C2=O)cc1	ZINC000020064523	170981917	/nfs/dbraw/zinc/98/19/17/170981917.db2.gz	YOYGBCWYYDSYND-GFCCVEGCSA-N	1	0	262.309	1.325	50	0		CDAARO
Cc1cc(S(=O)(=O)NC2CC[NH2+]CC2)ccc1F	ZINC000020272028	171126665	/nfs/dbraw/zinc/12/66/65/171126665.db2.gz	VRGZCCRUCBDKOC-UHFFFAOYSA-N	1	0	272.345	1.164	50	0		CDAARO
O=c1cc(CN2CC[NH2+]CC2)c2cc3c(cc2o1)CCC3	ZINC000020358830	171158041	/nfs/dbraw/zinc/15/80/41/171158041.db2.gz	IMQQTQMUNUXNKX-UHFFFAOYSA-N	1	0	284.359	1.687	50	0		CDAARO
OCc1cn(CC2CC[NH+](C3CCSCC3)CC2)nn1	ZINC000020868031	171276955	/nfs/dbraw/zinc/27/69/55/171276955.db2.gz	GTRAZNYNTNTRRB-UHFFFAOYSA-N	1	0	296.440	1.378	50	0		CDAARO
CNC(=O)CN1CCC([NH2+]Cc2ccc(F)cc2F)CC1	ZINC000035273397	172093193	/nfs/dbraw/zinc/09/31/93/172093193.db2.gz	SHUMLLIAYRXDCY-UHFFFAOYSA-N	1	0	297.349	1.265	50	0		CDAARO
CCOc1cc2c(cc1C[NH2+][C@H](C)CO)O[C@@H](C)C2	ZINC000035603845	172291494	/nfs/dbraw/zinc/29/14/94/172291494.db2.gz	YPNWKUOFHVPGPO-MNOVXSKESA-N	1	0	265.353	1.879	50	0		CDAARO
COc1ccc(CN(C)C(=O)[C@@H]2CCC[NH2+]2)cc1F	ZINC000037497768	173236595	/nfs/dbraw/zinc/23/65/95/173236595.db2.gz	MRDKGINDIVRJRE-LBPRGKRZSA-N	1	0	266.316	1.545	50	0		CDAARO
COc1cccc(C[NH2+]CCCS(C)(=O)=O)c1OC	ZINC000038047127	174056901	/nfs/dbraw/zinc/05/69/01/174056901.db2.gz	OGKFLICQTCKCHQ-UHFFFAOYSA-N	1	0	287.381	1.228	50	0		CDAARO
COc1ccc([C@H]2C[C@@H]2C(=O)N2CC[NH2+]CC2)cc1	ZINC000038478358	174142012	/nfs/dbraw/zinc/14/20/12/174142012.db2.gz	FYOXQDYKWMVTEZ-KGLIPLIRSA-N	1	0	260.337	1.231	50	0		CDAARO
CC[C@H](O)CNc1cc(C2CC[NH2+]CC2)nc(C)n1	ZINC000067724059	175786803	/nfs/dbraw/zinc/78/68/03/175786803.db2.gz	XRIZIEQWPZYWOT-LBPRGKRZSA-N	1	0	264.373	1.435	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N(C)CCc2cn[nH]c2)c1C	ZINC000067742918	175788426	/nfs/dbraw/zinc/78/84/26/175788426.db2.gz	JVWHAQVPUXGYJZ-UHFFFAOYSA-N	1	0	274.372	1.561	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)CCc1ccc(F)cc1	ZINC000071572202	176198056	/nfs/dbraw/zinc/19/80/56/176198056.db2.gz	YLUAGXKFYDAFDW-NSHDSACASA-N	1	0	250.317	1.579	50	0		CDAARO
[NH3+]CC(=O)N1CCC[C@@H](Nc2ccc(F)cc2)C1	ZINC000072125478	176320497	/nfs/dbraw/zinc/32/04/97/176320497.db2.gz	WCSYTFRIMRFRLC-GFCCVEGCSA-N	1	0	251.305	1.187	50	0		CDAARO
OC[C@@]1(O)CCC[N@H+](CCOc2ccc(Cl)cc2)C1	ZINC000072127410	176321049	/nfs/dbraw/zinc/32/10/49/176321049.db2.gz	PKFJJILLZOBTSD-CQSZACIVSA-N	1	0	285.771	1.538	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCCN(C(=O)c2c(F)cccc2F)C1	ZINC000072154322	176327780	/nfs/dbraw/zinc/32/77/80/176327780.db2.gz	MHFRFYFZKYNJTC-HNNXBMFYSA-N	1	0	298.333	1.494	50	0		CDAARO
CN(CCCO)C(=O)c1cccc(CC2CC[NH2+]CC2)c1	ZINC000072158468	176329525	/nfs/dbraw/zinc/32/95/25/176329525.db2.gz	DYYOUTHPNVDVLE-UHFFFAOYSA-N	1	0	290.407	1.683	50	0		CDAARO
COc1ccc(/C=C/C[N@@H+]2CCOC[C@H](CO)C2)cc1	ZINC000077300385	177250355	/nfs/dbraw/zinc/25/03/55/177250355.db2.gz	XHEVSPFAUWVDED-FAAWYNLUSA-N	1	0	277.364	1.649	50	0		CDAARO
C(c1nc2c(s1)CCCC2)N1CC[C@H]2C[NH2+]C[C@H]21	ZINC000077338873	177253824	/nfs/dbraw/zinc/25/38/24/177253824.db2.gz	HRBSHSMXMZCVKL-CMPLNLGQSA-N	1	0	263.410	1.816	50	0		CDAARO
C[C@@H]1CCC[C@H]([NH+]2CCN(S(C)(=O)=O)CC2)C1	ZINC000019841823	287463738	/nfs/dbraw/zinc/46/37/38/287463738.db2.gz	FINFRFMKIIFPAO-NEPJUHHUSA-N	1	0	260.403	1.142	50	0		CDAARO
CN(C)C(=O)C(C)(C)[NH2+]CC(=O)N1CCCCCCC1	ZINC000114457966	424517245	/nfs/dbraw/zinc/51/72/45/424517245.db2.gz	MKADIVKEQZBDQU-UHFFFAOYSA-N	1	0	283.416	1.236	50	0		CDAARO
CC[N@@H+]1CC[C@@H](N(C)C(=O)NCCOC)[C@@H](C)C1	ZINC000107158837	279396538	/nfs/dbraw/zinc/39/65/38/279396538.db2.gz	QIZKGDFRTXFGEZ-NWDGAFQWSA-N	1	0	257.378	1.005	50	0		CDAARO
COc1ccc2c(C)nc(N3[C@@H]4CC[C@H]3C[NH2+]C4)nc2c1	ZINC000067770433	274120918	/nfs/dbraw/zinc/12/09/18/274120918.db2.gz	QOOOLCBDHYJSQE-TXEJJXNPSA-N	1	0	284.363	1.887	50	0		CDAARO
CN(C)c1cccc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)c1	ZINC000091644881	276804295	/nfs/dbraw/zinc/80/42/95/276804295.db2.gz	GBNXCSZHEGUYOV-CABCVRRESA-N	1	0	273.380	1.562	50	0		CDAARO
C[NH+]1CCC2(CC1)OCCN2C(=O)c1ccco1	ZINC000013684325	277036384	/nfs/dbraw/zinc/03/63/84/277036384.db2.gz	GSUAYGXPVMNCCF-UHFFFAOYSA-N	1	0	250.298	1.174	50	0		CDAARO
C[NH+]1CCN(c2nc3nc(=S)[nH]c(=S)c-3c[nH]2)CC1	ZINC000020432165	277115073	/nfs/dbraw/zinc/11/50/73/277115073.db2.gz	OQRJCOUKHYDSTF-UHFFFAOYSA-N	1	0	294.409	1.123	50	0		CDAARO
COC(=O)[C@]12C[N@H+](Cc3cnc[nH]3)C[C@H]1CCCC2	ZINC000283935429	277147256	/nfs/dbraw/zinc/14/72/56/277147256.db2.gz	AASDIRMVZKNKEZ-BXUZGUMPSA-N	1	0	263.341	1.575	50	0		CDAARO
CC(C)(C)OC(=O)N1CCO[C@@]2(CCC[NH2+]C2)C1	ZINC000091303968	277189836	/nfs/dbraw/zinc/18/98/36/277189836.db2.gz	WPWQOZQQBMPUIV-CYBMUJFWSA-N	1	0	256.346	1.376	50	0		CDAARO
CC(C)C[C@](C)(C[NH3+])NS(=O)(=O)c1ccccc1	ZINC000095431222	277510407	/nfs/dbraw/zinc/51/04/07/277510407.db2.gz	UBZGWJWNQSFDAZ-CYBMUJFWSA-N	1	0	270.398	1.728	50	0		CDAARO
CC(C)[C@H]([NH3+])C(=O)N1CCOC2(C1)CCCCCC2	ZINC000182519615	277903301	/nfs/dbraw/zinc/90/33/01/277903301.db2.gz	RSPJWQHRIQPSBQ-ZDUSSCGKSA-N	1	0	268.401	1.922	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@@H]1NC(=O)c1cccc(F)c1F	ZINC000091496331	278049007	/nfs/dbraw/zinc/04/90/07/278049007.db2.gz	HLXHBEOZAOBXQR-KWQFWETISA-N	1	0	254.280	1.835	50	0		CDAARO
C[C@H]1CCCN(C(=O)c2ncncc2Cl)[C@H]1C[NH3+]	ZINC000179222232	278340696	/nfs/dbraw/zinc/34/06/96/278340696.db2.gz	MFVATGFOGLJSML-WPRPVWTQSA-N	1	0	268.748	1.329	50	0		CDAARO
CC[N@H+](C[C@@H]1CCOC1)[C@H]1CCN(C(C)C)C1=O	ZINC000245339328	279222116	/nfs/dbraw/zinc/22/21/16/279222116.db2.gz	SBWYTIXEQAKAIP-STQMWFEESA-N	1	0	254.374	1.354	50	0		CDAARO
CCn1cc(C(=O)N(C)[C@@H]2CC[NH2+]C2)c(C(C)C)n1	ZINC000299738740	288694906	/nfs/dbraw/zinc/69/49/06/288694906.db2.gz	FTBNOEQMAHFJND-LLVKDONJSA-N	1	0	264.373	1.460	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]C[C@@H]1CC(=O)N(C)[C@@H]1c1ccccc1	ZINC000096003203	288892510	/nfs/dbraw/zinc/89/25/10/288892510.db2.gz	MPSXSWRTXIHNIJ-NZUILWFCSA-N	1	0	288.391	1.973	50	0		CDAARO
NC(=O)c1cccnc1-c1cccc2c1CC[NH2+]C2	ZINC000071755218	303348961	/nfs/dbraw/zinc/34/89/61/303348961.db2.gz	MBGQASHWWFQLIS-UHFFFAOYSA-N	1	0	253.305	1.493	50	0		CDAARO
CCc1cccc(C)c1NC(=O)NC[C@@H]1CC[NH2+]C[C@H]1O	ZINC000534579850	328311150	/nfs/dbraw/zinc/31/11/50/328311150.db2.gz	DNLMCZJBEWFNAY-UONOGXRCSA-N	1	0	291.395	1.649	50	0		CDAARO
Cc1n[nH]c(C)c1CCCNC(=O)[C@@H]1CC12CC[NH2+]CC2	ZINC000534587330	328316150	/nfs/dbraw/zinc/31/61/50/328316150.db2.gz	NETSEKQRVQEERN-AWEZNQCLSA-N	1	0	290.411	1.465	50	0		CDAARO
O=C([C@H]1C=CC[NH2+]1)N1CC=C(c2ccccc2)CC1	ZINC000534659556	328342228	/nfs/dbraw/zinc/34/22/28/328342228.db2.gz	VYRSVBMOFWNCSE-OAHLLOKOSA-N	1	0	254.333	1.830	50	0		CDAARO
O=C(CN1C[C@H]2CC[C@@H](C1)[NH2+]C2)NCC1CCCCC1	ZINC000534655247	328339699	/nfs/dbraw/zinc/33/96/99/328339699.db2.gz	BFQVNAQZWWSZLL-GJZGRUSLSA-N	1	0	279.428	1.367	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@H]2C(=O)Nc3cc(F)c(F)cc3C(=O)N2C1	ZINC000534664722	328344786	/nfs/dbraw/zinc/34/47/86/328344786.db2.gz	HXCOFCPAEGOBMF-KRTXAFLBSA-N	1	0	295.289	1.062	50	0		CDAARO
O=C(C[NH+]1CCCCCCC1)NCC[C@@H]1CCOC1	ZINC000534671777	328348129	/nfs/dbraw/zinc/34/81/29/328348129.db2.gz	LIZYQILIEMOCKR-CQSZACIVSA-N	1	0	268.401	1.795	50	0		CDAARO
CC(C)[C@H](CNC(=O)CCc1cn[nH]c1)[NH+](C)C	ZINC000534662750	328350711	/nfs/dbraw/zinc/35/07/11/328350711.db2.gz	ZMSDEPQTEZPDLQ-LBPRGKRZSA-N	1	0	252.362	1.045	50	0		CDAARO
O=C(Nc1nc(-c2cccs2)ns1)[C@@H]1CCC[NH2+]1	ZINC000183098219	323319604	/nfs/dbraw/zinc/31/96/04/323319604.db2.gz	GYQDAPZOCXPFED-ZETCQYMHSA-N	1	0	280.378	1.957	50	0		CDAARO
COc1cc(N2CC[NH+](CC[C@H]3CCCO3)CC2)ncn1	ZINC000189977194	323476842	/nfs/dbraw/zinc/47/68/42/323476842.db2.gz	VKWLLDFGHHGQRL-CYBMUJFWSA-N	1	0	292.383	1.176	50	0		CDAARO
COCCCNC(=O)C[N@@H+]1CCS[C@@H]2CCCC[C@@H]21	ZINC000176928479	329179949	/nfs/dbraw/zinc/17/99/49/329179949.db2.gz	VWAYERBHOGOFSH-QWHCGFSZSA-N	1	0	286.441	1.499	50	0		CDAARO
CN1CCCNC(=O)C12CC[NH+](C[C@H]1CC=CCC1)CC2	ZINC000670439029	482983210	/nfs/dbraw/zinc/98/32/10/482983210.db2.gz	GGDUQUGUJFMEJN-HNNXBMFYSA-N	1	0	291.439	1.629	50	0		CDAARO
C[C@@H](CN1CCCCC1)[NH2+]CCc1nc(C2CC2)no1	ZINC000670445431	482993680	/nfs/dbraw/zinc/99/36/80/482993680.db2.gz	ZOYMCLNGDGFNFZ-LBPRGKRZSA-N	1	0	278.400	1.954	50	0		CDAARO
CCc1cnc(C)nc1NCCC[N@@H+]1CCC[C@@H](O)C1	ZINC000670446671	482998059	/nfs/dbraw/zinc/99/80/59/482998059.db2.gz	NDDNRXRJIYHWRF-CQSZACIVSA-N	1	0	278.400	1.606	50	0		CDAARO
Cc1nnc(N(C)CCCC[NH+]2CCOCC2)s1	ZINC000670450620	483009197	/nfs/dbraw/zinc/00/91/97/483009197.db2.gz	GNGUJAMRWVKAQC-UHFFFAOYSA-N	1	0	270.402	1.395	50	0		CDAARO
OCc1ccc2c(c1)C[N@@H+](CC[C@H]1CCOC1)CCO2	ZINC000670450045	483011722	/nfs/dbraw/zinc/01/17/22/483011722.db2.gz	FWOQKXBZLPYFSQ-ZDUSSCGKSA-N	1	0	277.364	1.800	50	0		CDAARO
COCCN(C)CC(=O)N[C@H](C)c1csc(C)n1	ZINC000670452231	483021160	/nfs/dbraw/zinc/02/11/60/483021160.db2.gz	KVMWDGUDHXIEHK-SECBINFHSA-N	1	0	271.386	1.207	50	0		CDAARO
O=C1CN(CC[C@H]2CCOC2)CCN1C1CCCCC1	ZINC000670454101	483025124	/nfs/dbraw/zinc/02/51/24/483025124.db2.gz	HQWGZSSWWZYMDW-AWEZNQCLSA-N	1	0	280.412	1.890	50	0		CDAARO
C[N@@H+](Cc1cnc(N)s1)C[C@@H]1CC(=O)N(C(C)(C)C)C1	ZINC000670455265	483030975	/nfs/dbraw/zinc/03/09/75/483030975.db2.gz	KHWJGDMEHAJNFR-JTQLQIEISA-N	1	0	296.440	1.804	50	0		CDAARO
Cc1ncn(C)c1C(=O)NC[C@@H]1CCC[N@H+]1C(C)C	ZINC000670456842	483035800	/nfs/dbraw/zinc/03/58/00/483035800.db2.gz	ZLZCTLWQNARNMI-LBPRGKRZSA-N	1	0	264.373	1.331	50	0		CDAARO
OC1(c2ccccn2)CC[NH+]([C@H]2CCSC2)CC1	ZINC000670458515	483039565	/nfs/dbraw/zinc/03/95/65/483039565.db2.gz	CSZPLGGAZVNDNQ-LBPRGKRZSA-N	1	0	264.394	1.871	50	0		CDAARO
C[C@H](CS(C)(=O)=O)[NH2+]Cc1ccc(-c2ncon2)cc1	ZINC000670461875	483049731	/nfs/dbraw/zinc/04/97/31/483049731.db2.gz	DGAQGRPTCRWRAY-SNVBAGLBSA-N	1	0	295.364	1.259	50	0		CDAARO
OC[C@@H]1CCC[N@H+](CCNc2ncnc3[nH]ccc32)C1	ZINC000670465048	483055525	/nfs/dbraw/zinc/05/55/25/483055525.db2.gz	LYXTUQYOGOFMOR-LLVKDONJSA-N	1	0	275.356	1.074	50	0		CDAARO
O=C(C1CCC1)N1CCC[N@H+](C[C@@H]2CCC(=O)O2)CC1	ZINC000670467598	483059644	/nfs/dbraw/zinc/05/96/44/483059644.db2.gz	NUTRWENJSMOPMK-ZDUSSCGKSA-N	1	0	280.368	1.026	50	0		CDAARO
C[C@@]1(C(N)=O)CCCC[N@@H+]1Cc1ccc2c[nH]nc2c1	ZINC000680484035	483633816	/nfs/dbraw/zinc/63/38/16/483633816.db2.gz	GFAVPPLNDDBVRW-HNNXBMFYSA-N	1	0	272.352	1.793	50	0		CDAARO
COc1cc(F)c(C(=O)N(C)[C@H]2CC[NH2+]C2)cc1OC	ZINC000179053948	522561384	/nfs/dbraw/zinc/56/13/84/522561384.db2.gz	SZYAJEWXRGUIJU-VIFPVBQESA-N	1	0	282.315	1.277	50	0		CDAARO
CCOC(=O)N1CCC([NH2+][C@@H](C)CSC)CC1	ZINC000096494298	528958089	/nfs/dbraw/zinc/95/80/89/528958089.db2.gz	AGVHPBIXGDRULH-JTQLQIEISA-N	1	0	260.403	1.948	50	0		CDAARO
C[C@@H]1CCN[C@H]([C@@H]2CC[C@@H](C(F)(F)F)NC2)[C@@H]1[NH3+]	ZINC000757216245	574908178	/nfs/dbraw/zinc/90/81/78/574908178.db2.gz	ZLMYRHUJGGZDCW-KAMPLNKDSA-N	1	0	265.323	1.242	50	0		CDAARO
COc1ccc(NC(=O)[C@H]2CCC[NH2+]2)cc1C(=O)N(C)C	ZINC000952991777	617270901	/nfs/dbraw/zinc/27/09/01/617270901.db2.gz	SKFALIGRRKDGEV-GFCCVEGCSA-N	1	0	291.351	1.088	50	0		CDAARO
CC(C)(C)OC(=O)C1CCN(CC2=[NH+]CCCN2)CC1	ZINC000952992165	613963334	/nfs/dbraw/zinc/96/33/34/613963334.db2.gz	BCSQUNHBUTXJSW-UHFFFAOYSA-N	1	0	281.400	1.432	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1C(=O)NC1(COC)CCCC1	ZINC000952977774	615143555	/nfs/dbraw/zinc/14/35/55/615143555.db2.gz	OKWCIWHPXKZUGP-LBPRGKRZSA-N	1	0	254.374	1.546	50	0		CDAARO
CCOc1ccc(CN(CC)C(=O)[C@H]2CC[NH2+]2)cc1	ZINC000952964277	615510098	/nfs/dbraw/zinc/51/00/98/615510098.db2.gz	PAWGKNMMUXDALL-CQSZACIVSA-N	1	0	262.353	1.796	50	0		CDAARO
Cc1cnn(C[C@H](C)[NH2+]Cc2cc3n(n2)CCCC3)c1	ZINC000888094326	617754240	/nfs/dbraw/zinc/75/42/40/617754240.db2.gz	IBFILJRNCLKOQI-ZDUSSCGKSA-N	1	0	273.384	1.903	50	0		CDAARO
COC(=O)[C@H](C[NH2+][C@@H](C)CCn1cccn1)CC1CC1	ZINC000952963282	616601153	/nfs/dbraw/zinc/60/11/53/616601153.db2.gz	FPHRKFDHDZBHKI-JSGCOSHPSA-N	1	0	279.384	1.841	50	0		CDAARO
CCc1ccccc1OCCN1C[C@@H]2C[NH2+]C[C@@]2(CO)C1	ZINC001772705228	1159439667	/nfs/dbraw/zinc/43/96/67/1159439667.db2.gz	GAWAPFNLOXJMJS-RDJZCZTQSA-N	1	0	290.407	1.142	50	0		CDAARO
O=C(C[N@H+]1CCC[C@]2(CCC[C@H]2O)C1)N1CCCC1	ZINC001704299442	1177679867	/nfs/dbraw/zinc/67/98/67/1177679867.db2.gz	PUGHHIJLXIUXAW-UKRRQHHQSA-N	1	0	266.385	1.236	50	0		CDAARO
Cc1cc(C[C@@H]2CN(c3ncnc4[nH]ccc43)C[C@H]2O)n[nH]1	ZINC001704303628	1177680613	/nfs/dbraw/zinc/68/06/13/1177680613.db2.gz	MRDMMIAXHYUBJJ-ZWNOBZJWSA-N	1	0	298.350	1.029	50	0		CDAARO
C[N@@H+]1Cc2ccccc2C[C@@H]1CNc1ncccn1	ZINC000032577552	728774442	/nfs/dbraw/zinc/77/44/42/728774442.db2.gz	QTXAALCRFIVEBX-CQSZACIVSA-N	1	0	254.337	1.945	50	0		CDAARO
CCS(=O)(=O)CCNc1nc(N(C)C)[nH+]c(C)c1C	ZINC000065405459	728465438	/nfs/dbraw/zinc/46/54/38/728465438.db2.gz	IHMPHQPELQMGSL-UHFFFAOYSA-N	1	0	286.401	1.006	50	0		CDAARO
CCCO[C@@H]1CCC[N@@H+](C2CCN(C(C)=O)CC2)C1	ZINC000032540636	728590489	/nfs/dbraw/zinc/59/04/89/728590489.db2.gz	GJHPDGHSLDFOFQ-OAHLLOKOSA-N	1	0	268.401	1.888	50	0		CDAARO
Cc1nc[nH]c1C[NH2+][C@H]1CCCN(C(=O)c2ccco2)C1	ZINC000952968487	729355091	/nfs/dbraw/zinc/35/50/91/729355091.db2.gz	MEILGBGQVFKRLQ-LBPRGKRZSA-N	1	0	288.351	1.706	50	0		CDAARO
O=C([C@H]1CCC[N@H+](Cc2ccco2)C1)N1CCCOCC1	ZINC000019781779	730391094	/nfs/dbraw/zinc/39/10/94/730391094.db2.gz	NMKZKQHOLGJYCO-AWEZNQCLSA-N	1	0	292.379	1.741	50	0		CDAARO
CC(C)n1ccnc1C[NH2+][C@H]1CCNC(=O)CC1	ZINC000692907871	901378432	/nfs/dbraw/zinc/37/84/32/901378432.db2.gz	XILIKKWPVZMGOM-LLVKDONJSA-N	1	0	250.346	1.222	50	0		CDAARO
CC1=NO[C@@](C)(C(=O)Nc2nnc(CC[NH+](C)C)s2)C1	ZINC001506413801	909046723	/nfs/dbraw/zinc/04/67/23/909046723.db2.gz	VXGUHHUPFAGJMX-GFCCVEGCSA-N	1	0	297.384	1.136	50	0		CDAARO
Cc1noc(C)c1[C@@H](C)NC(=O)N1CC[NH+]2CCC1CC2	ZINC000952845198	910401999	/nfs/dbraw/zinc/40/19/99/910401999.db2.gz	FAWOWGGJTHFWKI-SNVBAGLBSA-N	1	0	292.383	1.842	50	0		CDAARO
CO[C@H]1COC[C@@H]1[NH2+]Cc1cnc(-c2ccco2)nc1	ZINC000952860092	910413514	/nfs/dbraw/zinc/41/35/14/910413514.db2.gz	DORGGLOHSXWPOL-AAEUAGOBSA-N	1	0	275.308	1.240	50	0		CDAARO
[NH3+][C@@H]1CCc2ccccc2N(Cc2nncs2)C1	ZINC000952876647	910436150	/nfs/dbraw/zinc/43/61/50/910436150.db2.gz	DCSKWEMMDPXEHG-LLVKDONJSA-N	1	0	260.366	1.818	50	0		CDAARO
CC[C@@H](C)C[NH+]1CCC(O)(c2nccn2C)CC1	ZINC000952883014	910450889	/nfs/dbraw/zinc/45/08/89/910450889.db2.gz	SYXFDULLRJQLGF-GFCCVEGCSA-N	1	0	251.374	1.750	50	0		CDAARO
CCO[C@@H](CC[NH+](C)C)CNC(=O)NCc1nocc1C	ZINC000952883723	910455621	/nfs/dbraw/zinc/45/56/21/910455621.db2.gz	OXDQYJUWRDFBOH-LBPRGKRZSA-N	1	0	298.387	1.139	50	0		CDAARO
C[C@H](C(N)=O)[NH+]1CCC(CNC(=O)c2ccccc2)CC1	ZINC000952976943	910526302	/nfs/dbraw/zinc/52/63/02/910526302.db2.gz	NQNOJWOTKCIKKI-GFCCVEGCSA-N	1	0	289.379	1.002	50	0		CDAARO
C[C@@H](CS(C)(=O)=O)N1CCC(C[NH+]2CCCC2)CC1	ZINC000821740679	925590607	/nfs/dbraw/zinc/59/06/07/925590607.db2.gz	YCTHRDWWLZQORB-ZDUSSCGKSA-N	1	0	288.457	1.227	50	0		CDAARO
Cc1nccn1C[C@H](C)N1CCC[N@@H+](C(C)C)CC1	ZINC000821751095	925594072	/nfs/dbraw/zinc/59/40/72/925594072.db2.gz	FVOCEUJMMVOGSE-AWEZNQCLSA-N	1	0	264.417	1.996	50	0		CDAARO
CNC(=O)[C@H]1CC[C@H](CNc2cc(C)[nH+]c(N)n2)CC1	ZINC000823830702	925736180	/nfs/dbraw/zinc/73/61/80/925736180.db2.gz	QAIXBDIXINUQCY-XYPYZODXSA-N	1	0	277.372	1.332	50	0		CDAARO
Cc1ncc(C(=O)NCCN2CCc3ccccc3C2)cn1	ZINC000825276861	925860649	/nfs/dbraw/zinc/86/06/49/925860649.db2.gz	XLMSSMWWVBEGHS-UHFFFAOYSA-N	1	0	296.374	1.573	50	0		CDAARO
CC(C)CC[N@@H+]1CC[C@H](CO)[C@H](NC(=O)C2CC2)C1	ZINC000581799346	927200181	/nfs/dbraw/zinc/20/01/81/927200181.db2.gz	RBFFTHYDBHHEMD-ZIAGYGMSSA-N	1	0	268.401	1.242	50	0		CDAARO
C[C@H](c1nc2cc(Cl)ccc2[nH]1)N(C)C[C@H](O)[C@H](C)O	ZINC000585117051	930971088	/nfs/dbraw/zinc/97/10/88/930971088.db2.gz	PWBWDRJZJOMYTR-ZDMBXUJBSA-N	1	0	297.786	1.951	50	0		CDAARO
CC[N@H+](C[C@H](O)[C@@H](C)O)[C@H](C)c1cccc(OC)c1	ZINC000585117091	930978120	/nfs/dbraw/zinc/97/81/20/930978120.db2.gz	QODUOPBZWMCNTC-JMSVASOKSA-N	1	0	267.369	1.820	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@@H]1CNc1cc(C(N)=O)ccn1	ZINC001506396937	975147877	/nfs/dbraw/zinc/14/78/77/975147877.db2.gz	PPMQRPUOVFTGDI-GFCCVEGCSA-N	1	0	262.357	1.465	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN(c2ncccc2F)C1	ZINC001506412178	975154056	/nfs/dbraw/zinc/15/40/56/975154056.db2.gz	MSYLGCVTMXLLJZ-LLVKDONJSA-N	1	0	253.321	1.235	50	0		CDAARO
C[C@@H](C[NH+]1CCCCCC1)N1C[C@@H]2C[C@@H](O)[C@@H](O)C[C@@H]2C1	ZINC001506411685	975154307	/nfs/dbraw/zinc/15/43/07/975154307.db2.gz	JTWJLOVBNYSZSG-SIRPWMCASA-N	1	0	296.455	1.315	50	0		CDAARO
Cc1nc(N)nc(N2CCOC[C@H](C[NH+](C)C)C2)c1Cl	ZINC001506415367	975155822	/nfs/dbraw/zinc/15/58/22/975155822.db2.gz	XOUDWSOMHZNUCY-SNVBAGLBSA-N	1	0	299.806	1.035	50	0		CDAARO
CC(C)Oc1cc(NC[C@H]2CCCC[N@@H+]2C)nc(N)n1	ZINC001506418567	975157487	/nfs/dbraw/zinc/15/74/87/975157487.db2.gz	ZYUGCNAAGIAJTD-LLVKDONJSA-N	1	0	279.388	1.742	50	0		CDAARO
Cn1ccnc1-c1ccc(N2CC[N@H+](C)C(C)(C)C2)nn1	ZINC001506422758	975158162	/nfs/dbraw/zinc/15/81/62/975158162.db2.gz	USPBENYTAMTYJT-UHFFFAOYSA-N	1	0	286.383	1.408	50	0		CDAARO
CSc1nc(NCCc2noc(C(C)C)n2)cc(N)[nH+]1	ZINC001506423321	975159300	/nfs/dbraw/zinc/15/93/00/975159300.db2.gz	VSWZWALEGZNROQ-UHFFFAOYSA-N	1	0	294.384	1.942	50	0		CDAARO
Cc1nc(N2C[C@H](O)[C@@H]([NH+](C)C)C2)ccc1Cl	ZINC001506426654	975161029	/nfs/dbraw/zinc/16/10/29/975161029.db2.gz	UCHJTSHHFXYZAH-QWRGUYRKSA-N	1	0	255.749	1.155	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CC(=O)N2CCCC2)n1	ZINC001506429359	975162164	/nfs/dbraw/zinc/16/21/64/975162164.db2.gz	TZWDSAFRSGPPOG-LBPRGKRZSA-N	1	0	264.373	1.100	50	0		CDAARO
Nc1nc(NCc2cccnc2)cc(C2CC([NH3+])C2)n1	ZINC000220559314	230397669	/nfs/dbraw/zinc/39/76/69/230397669.db2.gz	ZWNBFMNORSMUFR-UHFFFAOYSA-N	1	0	270.340	1.271	50	0		CDAARO
Nc1cc[nH+]cc1-c1cccc(C(=O)N[C@H]2CCOC2)c1	ZINC000426567191	230423158	/nfs/dbraw/zinc/42/31/58/230423158.db2.gz	ZPTQQHKKRIOTMK-ZDUSSCGKSA-N	1	0	283.331	1.680	50	0		CDAARO
NC(=O)[C@@H]1CCCC[C@H]1[NH2+]Cc1nc2c(s1)CCC2	ZINC000097375104	342002742	/nfs/dbraw/zinc/00/27/42/342002742.db2.gz	UCNUUPGJDPIZHZ-NXEZZACHSA-N	1	0	279.409	1.766	50	0		CDAARO
C[C@H](C1CC1)N(C(=O)C[NH2+][C@@H](CO)C1CC1)C1CC1	ZINC000095941348	185035797	/nfs/dbraw/zinc/03/57/97/185035797.db2.gz	AAOWXUJORDKYJQ-YGRLFVJLSA-N	1	0	266.385	1.136	50	0		CDAARO
CC1CCC(NC(=O)C[NH2+][C@@H](CO)C2CC2)CC1	ZINC000095941345	185036132	/nfs/dbraw/zinc/03/61/32/185036132.db2.gz	BULOPMOBLQEEBZ-GDKBPFBDSA-N	1	0	254.374	1.042	50	0		CDAARO
Cn1ccnc1[C@@H](NC(=O)C[N@H+](C)C1CC1)c1ccccc1	ZINC000095955442	185041509	/nfs/dbraw/zinc/04/15/09/185041509.db2.gz	IIFMFAKNZHFZQI-INIZCTEOSA-N	1	0	298.390	1.720	50	0		CDAARO
Brc1cnc(OC[C@@H]2CCC[NH2+]2)nc1	ZINC000082662680	178151403	/nfs/dbraw/zinc/15/14/03/178151403.db2.gz	IFSWJXNUJUHKLE-QMMMGPOBSA-N	1	0	258.119	1.370	50	0		CDAARO
COCCOc1ccc(C[NH2+][C@H](C)[C@H](C)COC)cn1	ZINC000095995515	185060170	/nfs/dbraw/zinc/06/01/70/185060170.db2.gz	GISCFEXRJDXMER-CHWSQXEVSA-N	1	0	282.384	1.867	50	0		CDAARO
CCc1ccc(S(=O)(=O)N2CC[C@@H]([NH3+])C2)cc1CC	ZINC000095996579	185061331	/nfs/dbraw/zinc/06/13/31/185061331.db2.gz	MILFXDLBQWNWQW-CYBMUJFWSA-N	1	0	282.409	1.533	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@@H](C)c1ccc(Cl)s1	ZINC000096013974	185066299	/nfs/dbraw/zinc/06/62/99/185066299.db2.gz	VSLKSXANHIQCKU-QMMMGPOBSA-N	1	0	296.845	1.991	50	0		CDAARO
C[C@@H](CNC(=O)NCCC1(O)CCC1)[NH+]1CCC(C)CC1	ZINC000241926469	361754636	/nfs/dbraw/zinc/75/46/36/361754636.db2.gz	UGKXNQOPZKTUHB-AWEZNQCLSA-N	1	0	297.443	1.711	50	0		CDAARO
CCCC[C@H]([NH3+])C(=O)N1CC[C@@H]2OCCC[C@@H]2C1	ZINC000195554456	342625865	/nfs/dbraw/zinc/62/58/65/342625865.db2.gz	MJKATVHZWBRJMN-AGIUHOORSA-N	1	0	254.374	1.531	50	0		CDAARO
COc1cccc([C@H](C)[NH2+][C@@H](C)C(=O)N[C@@H]2CCOC2)c1	ZINC000195577526	342628905	/nfs/dbraw/zinc/62/89/05/342628905.db2.gz	JUKDHODNBFBQFD-SGMGOOAPSA-N	1	0	292.379	1.639	50	0		CDAARO
CN1CCC([NH2+][C@H]2CC(=O)N(c3ccccc3)C2)CC1	ZINC000095421058	539087987	/nfs/dbraw/zinc/08/79/87/539087987.db2.gz	HJRYYHHUJLMNMN-AWEZNQCLSA-N	1	0	273.380	1.476	50	0		CDAARO
Cc1ncsc1CC[N@@H+](C)C[C@@H](C)N1CCOCC1	ZINC000243893233	361829170	/nfs/dbraw/zinc/82/91/70/361829170.db2.gz	APQJEIBXFXBQQS-GFCCVEGCSA-N	1	0	283.441	1.647	50	0		CDAARO
C[N@H+](CCn1cncn1)C[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000244715734	361858019	/nfs/dbraw/zinc/85/80/19/361858019.db2.gz	LBEZEJUFBVILEA-CYBMUJFWSA-N	1	0	291.399	1.001	50	0		CDAARO
CC(C)=CCC/C(C)=C\C[NH2+]C[C@H](O)CN1CCOCC1	ZINC000096878877	342178632	/nfs/dbraw/zinc/17/86/32/342178632.db2.gz	YDVLBLYSTSGULM-UGIZUQJLSA-N	1	0	296.455	1.962	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@H]1NC(=O)C[C@@H](O)c1ccccc1	ZINC000585136736	342216011	/nfs/dbraw/zinc/21/60/11/342216011.db2.gz	QYLBBEAQZSIIMX-NCZKRNLISA-N	1	0	276.380	1.613	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C/C=C/c2ccccn2)C[C@@H]1n1ccnn1	ZINC000685941008	539045932	/nfs/dbraw/zinc/04/59/32/539045932.db2.gz	NOZFOHDGMHUJRY-KJKYUDHTSA-N	1	0	298.394	1.173	50	0		CDAARO
O=c1nc(N2CC[NH2+]CC2)[nH]c2sc3c(c21)CCCC3	ZINC000585152319	342226336	/nfs/dbraw/zinc/22/63/36/342226336.db2.gz	OTTVSWPPMDDNRS-UHFFFAOYSA-N	1	0	290.392	1.685	50	0		CDAARO
CCn1ccnc1CN1CCC[C@@H]([NH+](C)C)CC1	ZINC000097743657	529567700	/nfs/dbraw/zinc/56/77/00/529567700.db2.gz	XLOFURRFVXYWOS-CYBMUJFWSA-N	1	0	250.390	1.819	50	0		CDAARO
Cc1noc([C@@H]2C[N@@H+](CC3CCSCC3)CCN2C)n1	ZINC000585117808	362046513	/nfs/dbraw/zinc/04/65/13/362046513.db2.gz	XIWRJIKHCRIGKH-ZDUSSCGKSA-N	1	0	296.440	1.810	50	0		CDAARO
COCc1ccccc1C(=O)NCC[NH+]1CCCC1	ZINC000036391869	362049702	/nfs/dbraw/zinc/04/97/02/362049702.db2.gz	SZVRWMJLBBPQQA-UHFFFAOYSA-N	1	0	262.353	1.659	50	0		CDAARO
Cc1nnc(CN2CCC([NH+]3CCOCC3)CC2)s1	ZINC000585123458	362053392	/nfs/dbraw/zinc/05/33/92/362053392.db2.gz	XIOWTIPKECWXIH-UHFFFAOYSA-N	1	0	282.413	1.143	50	0		CDAARO
NC(=[NH2+])c1ccc(-n2cccn2)c(Br)c1	ZINC000169207663	342359483	/nfs/dbraw/zinc/35/94/83/342359483.db2.gz	DKAHTHGOKJGRIJ-UHFFFAOYSA-N	1	0	265.114	1.919	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)C[C@H]2OCCc3ccccc32)C1	ZINC000179017687	362250871	/nfs/dbraw/zinc/25/08/71/362250871.db2.gz	QMQSZZOCLQXWSE-XJKSGUPXSA-N	1	0	288.391	1.758	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)c2c(F)cc(F)cc2F)C1	ZINC000086997898	362295197	/nfs/dbraw/zinc/29/51/97/362295197.db2.gz	VGQJZNFXUPAQCX-MRVPVSSYSA-N	1	0	258.243	1.667	50	0		CDAARO
CN(C(=O)Cc1ccccc1Br)[C@H]1CC[NH2+]C1	ZINC000084719072	362270196	/nfs/dbraw/zinc/27/01/96/362270196.db2.gz	KKBUMLHJYVKKOF-NSHDSACASA-N	1	0	297.196	1.812	50	0		CDAARO
CC[N@H+](CCC(=O)OC)C1CN(C(=O)OC(C)(C)C)C1	ZINC000084774724	362271475	/nfs/dbraw/zinc/27/14/75/362271475.db2.gz	VEHZOMKOWWQWGY-UHFFFAOYSA-N	1	0	286.372	1.491	50	0		CDAARO
CC[N@@H+]1CC[C@H](N(C)C(=O)NCc2ccncc2)[C@H](C)C1	ZINC000084779985	362271971	/nfs/dbraw/zinc/27/19/71/362271971.db2.gz	LMHPIRAAAZWFLV-HIFRSBDPSA-N	1	0	290.411	1.953	50	0		CDAARO
Cc1cnccc1C[NH+]1CCC2(CC1)OCCC[C@H]2O	ZINC000252479970	362383506	/nfs/dbraw/zinc/38/35/06/362383506.db2.gz	BQXYTMKNEZRXAQ-OAHLLOKOSA-N	1	0	276.380	1.896	50	0		CDAARO
[NH3+]C1(Cc2cccc(Cl)c2)CCS(=O)(=O)CC1	ZINC000255190463	362493626	/nfs/dbraw/zinc/49/36/26/362493626.db2.gz	XJKVDFNOEACAOE-UHFFFAOYSA-N	1	0	273.785	1.789	50	0		CDAARO
CC(=O)OC[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1O	ZINC000242688548	345179631	/nfs/dbraw/zinc/17/96/31/345179631.db2.gz	VSGFDXSAMDSNKW-HUUCEWRRSA-N	1	0	263.337	1.433	50	0		CDAARO
Cc1cccnc1NC(=O)N[C@@H]1CC[N@@H+](C2CC2)C1	ZINC000049029540	345596173	/nfs/dbraw/zinc/59/61/73/345596173.db2.gz	KYELXJWOTKYGQE-LLVKDONJSA-N	1	0	260.341	1.748	50	0		CDAARO
CNS(=O)(=O)CC[NH2+]C[C@H]1C(C)=CCC[C@@H]1C	ZINC000190301540	290756717	/nfs/dbraw/zinc/75/67/17/290756717.db2.gz	RRRROPMCVRZLQF-RYUDHWBXSA-N	1	0	260.403	1.118	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)c2cc(C)cs2)CC1	ZINC000085468040	179073559	/nfs/dbraw/zinc/07/35/59/179073559.db2.gz	WRLGHSXBPTXVQO-UHFFFAOYSA-N	1	0	282.409	1.897	50	0		CDAARO
CC(=O)c1ccc2c(c1)N(CCC[NH+](C)C)C(=O)CO2	ZINC000019960519	136579459	/nfs/dbraw/zinc/57/94/59/136579459.db2.gz	IUKGZNWPQHSRDL-UHFFFAOYSA-N	1	0	276.336	1.566	50	0		CDAARO
C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)CCC(F)(F)F	ZINC000095440458	290805940	/nfs/dbraw/zinc/80/59/40/290805940.db2.gz	PDHJRNLSIOXPIL-IUCAKERBSA-N	1	0	252.280	1.880	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2cnc(N)s2)CCCCC1	ZINC000584885856	349344126	/nfs/dbraw/zinc/34/41/26/349344126.db2.gz	ANRRPCKOZHGZDD-UHFFFAOYSA-N	1	0	282.413	1.550	50	0		CDAARO
CCC[C@@H](Cn1cnc2cnccc2c1=O)[NH+](C)C	ZINC000584891616	349350873	/nfs/dbraw/zinc/35/08/73/349350873.db2.gz	PNGSSLNUOUYDRR-NSHDSACASA-N	1	0	260.341	1.522	50	0		CDAARO
CCC[NH+]1CCC(CCNC(=O)c2cnc(N)s2)CC1	ZINC000584897800	349359376	/nfs/dbraw/zinc/35/93/76/349359376.db2.gz	ABZFXLABOHZFAU-UHFFFAOYSA-N	1	0	296.440	1.798	50	0		CDAARO
CN(C)C(=O)[C@@H]1CN(C2CC(C)(C)[NH2+]C(C)(C)C2)CCO1	ZINC000584897873	349360161	/nfs/dbraw/zinc/36/01/61/349360161.db2.gz	WUCSYMCRQLHUBU-ZDUSSCGKSA-N	1	0	297.443	1.085	50	0		CDAARO
Cc1cc(=O)c(C(=O)N(C)C[C@H]2CCC[N@H+](C)C2)cn1C	ZINC000584899083	349360560	/nfs/dbraw/zinc/36/05/60/349360560.db2.gz	UNZYWYXUKPHZKJ-ZDUSSCGKSA-N	1	0	291.395	1.108	50	0		CDAARO
Cc1c[nH]c(C(=O)NCC[N@H+]2[C@H](C)CCC[C@@H]2C)n1	ZINC000584899536	349361410	/nfs/dbraw/zinc/36/14/10/349361410.db2.gz	RIUBWWGRLINFBA-TXEJJXNPSA-N	1	0	264.373	1.711	50	0		CDAARO
CCOc1ccccc1CC(=O)N1C[C@H]([NH3+])[C@@H](C2CC2)C1	ZINC000091289532	180121657	/nfs/dbraw/zinc/12/16/57/180121657.db2.gz	IMDQOVDTAWKRAY-CABCVRRESA-N	1	0	288.391	1.824	50	0		CDAARO
O=C(c1cc(-c2ccc(O)cc2)n[nH]1)N1[C@@H]2CC[C@H]1C[NH2+]C2	ZINC000091473877	180165383	/nfs/dbraw/zinc/16/53/83/180165383.db2.gz	ILCNFZDETAJKPC-TXEJJXNPSA-N	1	0	298.346	1.359	50	0		CDAARO
Cc1cc(C(=O)N2C[C@H]([NH3+])[C@@H](C(C)C)C2)c(=O)n(C)c1C	ZINC000091416546	180149621	/nfs/dbraw/zinc/14/96/21/180149621.db2.gz	FYHDQRWZWMNJSL-KGLIPLIRSA-N	1	0	291.395	1.057	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2cn(-c3ccccc3)nn2)C[C@@H]1[NH3+]	ZINC000091587111	180200609	/nfs/dbraw/zinc/20/06/09/180200609.db2.gz	HMMXEMHUSPHVCG-JSGCOSHPSA-N	1	0	299.378	1.467	50	0		CDAARO
CCC[N@@H+]1C[C@H]2CC[C@@H]1CN(C(=O)c1snnc1C)C2	ZINC000091651060	180216928	/nfs/dbraw/zinc/21/69/28/180216928.db2.gz	JMLIFOCQPNKAKM-VXGBXAGGSA-N	1	0	294.424	1.793	50	0		CDAARO
CCc1ccccc1OC1CN(C(=O)[C@H](C)[NH2+]C)C1	ZINC000092062265	180315470	/nfs/dbraw/zinc/31/54/70/180315470.db2.gz	FUDLBEXKSGBUKZ-NSHDSACASA-N	1	0	262.353	1.447	50	0		CDAARO
O=C(c1cccc(-n2cnnc2)c1)N1C[C@@H]2CCC[NH2+][C@@H]2C1	ZINC000092106943	180326753	/nfs/dbraw/zinc/32/67/53/180326753.db2.gz	VSARUZSGTMZHTM-DZGCQCFKSA-N	1	0	297.362	1.091	50	0		CDAARO
C[C@H](CNC(=O)COCC1CC1)[N@@H+]1CCC[C@H](C)C1	ZINC000106078839	186101795	/nfs/dbraw/zinc/10/17/95/186101795.db2.gz	ZQTCIXAXUGJTRP-QWHCGFSZSA-N	1	0	268.401	1.650	50	0		CDAARO
O=S(=O)(NCC[C@H]1CC[NH2+]C1)c1ccccc1F	ZINC000110796858	186325827	/nfs/dbraw/zinc/32/58/27/186325827.db2.gz	QKYXRKLSXWVABO-SNVBAGLBSA-N	1	0	272.345	1.104	50	0		CDAARO
COc1cc(Br)ccc1C(=O)N1CC[C@H]([NH3+])C1	ZINC000123917953	187114536	/nfs/dbraw/zinc/11/45/36/187114536.db2.gz	BKEHXOAJINEZIH-VIFPVBQESA-N	1	0	299.168	1.631	50	0		CDAARO
CCNc1ncc(C(=O)NC[C@@H]2CCC[N@@H+]2CC)cn1	ZINC000065527046	363302848	/nfs/dbraw/zinc/30/28/48/363302848.db2.gz	NMORGHFQIYMXPE-LBPRGKRZSA-N	1	0	277.372	1.123	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)[C@H]1COc2ccccc2O1	ZINC000000620319	355920243	/nfs/dbraw/zinc/92/02/43/355920243.db2.gz	LRULXWAWWPSUQB-CQSZACIVSA-N	1	0	276.336	1.038	50	0		CDAARO
COc1cc2c(cc1OC)[C@](C)(C(C)(C)O)[NH2+]CC2	ZINC000000129469	355890037	/nfs/dbraw/zinc/89/00/37/355890037.db2.gz	HEBRQFXLIJBZQU-OAHLLOKOSA-N	1	0	265.353	1.836	50	0		CDAARO
CC1(C)C[C@](O)(C[NH2+]Cc2ccc3c(c2)OCO3)CCO1	ZINC000000206548	355896482	/nfs/dbraw/zinc/89/64/82/355896482.db2.gz	YUFGVAYYXDAHKF-INIZCTEOSA-N	1	0	293.363	1.825	50	0	biogenic	CDAARO
[NH3+]CCNS(=O)(=O)c1cccc2c(Cl)cccc21	ZINC000002555126	355974612	/nfs/dbraw/zinc/97/46/12/355974612.db2.gz	ACIMRXKJKQGBGL-UHFFFAOYSA-N	1	0	284.768	1.730	50	0	in-vitro	CDAARO
C[NH+]1CCN(c2cc(-c3ccccc3)nc3ncnn32)CC1	ZINC000002585206	355977122	/nfs/dbraw/zinc/97/71/22/355977122.db2.gz	HIRZBMUCGYOVTR-UHFFFAOYSA-N	1	0	294.362	1.543	50	0		CDAARO
O=C(C1CC[NH+](Cc2ccccn2)CC1)N1CCOCC1	ZINC000004549445	356036257	/nfs/dbraw/zinc/03/62/57/356036257.db2.gz	OTFFRFHLYYEPQJ-UHFFFAOYSA-N	1	0	289.379	1.152	50	0		CDAARO
[NH3+][C@H]1CCCN(S(=O)(=O)c2cccc(Cl)c2F)C1	ZINC000036297263	356109409	/nfs/dbraw/zinc/10/94/09/356109409.db2.gz	KNUXIYACHFPDIH-QMMMGPOBSA-N	1	0	292.763	1.591	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H](C)c1cnn(C(C)C)c1	ZINC000097373427	356094593	/nfs/dbraw/zinc/09/45/93/356094593.db2.gz	RECDDTWIAFILCQ-NSHDSACASA-N	1	0	266.389	1.887	50	0		CDAARO
CC[NH+](CC)CCN/C=C1\c2ccccc2NC1=O	ZINC000019337235	356481349	/nfs/dbraw/zinc/48/13/49/356481349.db2.gz	VPMCHFPBJIURSH-ACCUITESSA-N	1	0	259.353	1.911	50	0		CDAARO
Cc1ccccc1NC(=O)CC[NH+]1CCN(C)CC1	ZINC000019888704	356514100	/nfs/dbraw/zinc/51/41/00/356514100.db2.gz	MPGLCBFXJIBSBI-UHFFFAOYSA-N	1	0	261.369	1.571	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc(F)c(F)c2)C[C@@H]1CCO	ZINC000019839291	356508512	/nfs/dbraw/zinc/50/85/12/356508512.db2.gz	WXGWRWJZTHPTCV-LBPRGKRZSA-N	1	0	270.323	1.463	50	0		CDAARO
O=C(C[NH2+]C[C@H]1CCCO1)Nc1cccc(F)c1	ZINC000020055622	356524240	/nfs/dbraw/zinc/52/42/40/356524240.db2.gz	VGLDXKUHHKZEQE-GFCCVEGCSA-N	1	0	252.289	1.533	50	0		CDAARO
CNC(=O)C1CC[NH+](C[C@@H](O)c2ccc(F)cc2)CC1	ZINC000025353953	356672965	/nfs/dbraw/zinc/67/29/65/356672965.db2.gz	ZXVVLAJHPBYMOF-CQSZACIVSA-N	1	0	280.343	1.317	50	0		CDAARO
CC1(C)CC(Nc2ccc3nncn3n2)CC(C)(C)[NH2+]1	ZINC000024990857	356665354	/nfs/dbraw/zinc/66/53/54/356665354.db2.gz	CJGMUPXZIDUXFP-UHFFFAOYSA-N	1	0	274.372	1.845	50	0		CDAARO
O=C(NCCC[N@@H+]1CCc2ccccc2C1)C1CC1	ZINC000032398839	356778756	/nfs/dbraw/zinc/77/87/56/356778756.db2.gz	ZKFXPQCVMBNNPV-UHFFFAOYSA-N	1	0	258.365	1.961	50	0		CDAARO
O=C(NC1CC[NH+](CCc2ccncc2)CC1)C1CC1	ZINC000030277534	356747948	/nfs/dbraw/zinc/74/79/48/356747948.db2.gz	XQOBNYCTLQMMFY-UHFFFAOYSA-N	1	0	273.380	1.615	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@H](OC2CC[NH2+]CC2)C1	ZINC000034959571	356825333	/nfs/dbraw/zinc/82/53/33/356825333.db2.gz	JVTZDQRIYKNYSF-GFCCVEGCSA-N	1	0	270.373	1.764	50	0		CDAARO
COC(=O)[C@H](CC(C)C)NC(=O)[C@H]([NH3+])Cc1ccccc1	ZINC000053194034	357284921	/nfs/dbraw/zinc/28/49/21/357284921.db2.gz	HGVNLOSOAISYIT-KGLIPLIRSA-N	1	0	292.379	1.260	50	0		CDAARO
Cc1cc(N[C@@H]2CCCN(c3ncccn3)C2)nc(N)[nH+]1	ZINC000052426979	357272681	/nfs/dbraw/zinc/27/26/81/357272681.db2.gz	HWFHUHKLNKEFLK-LLVKDONJSA-N	1	0	285.355	1.238	50	0		CDAARO
Cc1ccsc1C[N@H+](CC(C)C)C[C@@H](O)CO	ZINC000055576455	357335443	/nfs/dbraw/zinc/33/54/43/357335443.db2.gz	QNKNYULVZRSPOP-GFCCVEGCSA-N	1	0	257.399	1.868	50	0		CDAARO
CC(=O)NCCNc1cc(C)[nH+]c(N2CCCCC2)n1	ZINC000065380480	357533584	/nfs/dbraw/zinc/53/35/84/357533584.db2.gz	CRQMXCCNWKHVMT-UHFFFAOYSA-N	1	0	277.372	1.323	50	0		CDAARO
C[N@@H+]1CCCN(Cc2nnc(Cc3ccccc3)[nH]2)CC1	ZINC000065408236	357538682	/nfs/dbraw/zinc/53/86/82/357538682.db2.gz	WDHBPAFRQVODQE-UHFFFAOYSA-N	1	0	285.395	1.533	50	0		CDAARO
Cc1nnc(N2CCN(CC(C)(C)C[NH+](C)C)CC2)s1	ZINC000065436199	357541583	/nfs/dbraw/zinc/54/15/83/357541583.db2.gz	UULATDJKXIXNBT-UHFFFAOYSA-N	1	0	297.472	1.556	50	0		CDAARO
Cc1cc(NC[C@@H](O)c2cccnc2)nc(N2CCCC2)[nH+]1	ZINC000065432000	357541619	/nfs/dbraw/zinc/54/16/19/357541619.db2.gz	MABOEFUEQYUAFZ-CQSZACIVSA-N	1	0	299.378	1.926	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](C(=O)NCc2sccc2C)C1	ZINC000065503541	357545989	/nfs/dbraw/zinc/54/59/89/357545989.db2.gz	NGQZMEVXUNHGMK-GFCCVEGCSA-N	1	0	282.409	1.641	50	0		CDAARO
CCN(C[C@H]1CCCO1)c1cc(CC[NH3+])nc(C)n1	ZINC000067741567	357624041	/nfs/dbraw/zinc/62/40/41/357624041.db2.gz	IVFZHSWPFCKFQA-CYBMUJFWSA-N	1	0	264.373	1.292	50	0		CDAARO
CN(C)c1nc(-c2cccc3c2O[C@@H](C[NH3+])C3)ncc1F	ZINC000067447351	357609314	/nfs/dbraw/zinc/60/93/14/357609314.db2.gz	FTDLVARCPGDQLD-SNVBAGLBSA-N	1	0	288.326	1.611	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](NC(=O)c2cnc(Nc3ccccc3)nc2)C1	ZINC000067457865	357609519	/nfs/dbraw/zinc/60/95/19/357609519.db2.gz	NTEOOCNZTFBEKP-TZMCWYRMSA-N	1	0	297.362	1.830	50	0		CDAARO
CCc1ncc2c(n1)CN(C(=O)C[N@H+](C)C(C)C)C2	ZINC000067946414	357638247	/nfs/dbraw/zinc/63/82/47/357638247.db2.gz	KJFCGDATPJCZDT-UHFFFAOYSA-N	1	0	262.357	1.221	50	0		CDAARO
CCSCCn1ccnc1-c1cc2n(n1)CC[NH2+]C2	ZINC000072462632	357836956	/nfs/dbraw/zinc/83/69/56/357836956.db2.gz	NBIKIHAZRAGOEG-UHFFFAOYSA-N	1	0	277.397	1.603	50	0		CDAARO
Cc1ccc(S(=O)(=O)C[C@H](C)[NH2+][C@@H]2CCCOC2)cc1	ZINC000097113282	357982905	/nfs/dbraw/zinc/98/29/05/357982905.db2.gz	STBBBSOVXPAXJB-UONOGXRCSA-N	1	0	297.420	1.926	50	0		CDAARO
COCC[N@H+]1[C@H](C)CN(c2cncc(SC)n2)C[C@@H]1C	ZINC000097162961	358004934	/nfs/dbraw/zinc/00/49/34/358004934.db2.gz	BJJCZQXECRHJDN-TXEJJXNPSA-N	1	0	296.440	1.744	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2cc(F)cc(C(F)(F)F)c2)C[C@H]1O	ZINC000082097076	358147236	/nfs/dbraw/zinc/14/72/36/358147236.db2.gz	GKLXSCGMMZKLNC-VXGBXAGGSA-N	1	0	292.276	1.738	50	0		CDAARO
CC[C@@H]1CN(C(=O)Cc2cccnc2)CC[N@@H+]1C(C)C	ZINC000082120933	358147818	/nfs/dbraw/zinc/14/78/18/358147818.db2.gz	VIOKTBQYOHKPPW-OAHLLOKOSA-N	1	0	275.396	1.955	50	0		CDAARO
Cn1ccnc1-c1ccc(N2CCCC[C@@H]([NH3+])C2)nn1	ZINC000082121611	358148198	/nfs/dbraw/zinc/14/81/98/358148198.db2.gz	CKZMCKHFGFXDET-LLVKDONJSA-N	1	0	272.356	1.195	50	0		CDAARO
Cc1cc(C)cc(OCC(=O)N2CC[NH2+][C@H](C)C2)c1	ZINC000082162947	358150435	/nfs/dbraw/zinc/15/04/35/358150435.db2.gz	SOSWGPBKUBXIJT-CYBMUJFWSA-N	1	0	262.353	1.503	50	0		CDAARO
c1csc([C@@H]([NH2+]CCCn2ccnn2)c2ncc[nH]2)c1	ZINC000195115521	358551476	/nfs/dbraw/zinc/55/14/76/358551476.db2.gz	PUGSCPAVHKYJPX-GFCCVEGCSA-N	1	0	288.380	1.832	50	0		CDAARO
CCc1cnc(NCC[N@@H+]2CCC[C@@H](CO)C2)nc1	ZINC000095354988	358683501	/nfs/dbraw/zinc/68/35/01/358683501.db2.gz	LQACNSLGVALLHL-CYBMUJFWSA-N	1	0	264.373	1.155	50	0		CDAARO
O[C@]12CC[NH2+]C[C@H]1CN(c1ncc(Cl)cc1F)CC2	ZINC000095382017	358690564	/nfs/dbraw/zinc/69/05/64/358690564.db2.gz	AUYISKGSIPPNIF-ZANVPECISA-N	1	0	285.750	1.425	50	0		CDAARO
CC[NH+]1CCC(CC(=O)N[C@H](C)c2nnc(N)s2)CC1	ZINC000095500704	358695904	/nfs/dbraw/zinc/69/59/04/358695904.db2.gz	WDWXRBNWJJQJML-SECBINFHSA-N	1	0	297.428	1.420	50	0		CDAARO
Cc1c(NC(=O)N2CCCC[C@H]2C[NH3+])cccc1C(N)=O	ZINC000097301256	358765905	/nfs/dbraw/zinc/76/59/05/358765905.db2.gz	UVOKWIPPWDCXBW-NSHDSACASA-N	1	0	290.367	1.439	50	0		CDAARO
[NH3+]C[C@H]1CC[C@@H](C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)O1	ZINC000261998284	358724862	/nfs/dbraw/zinc/72/48/62/358724862.db2.gz	NGWPQOOVUIEPJD-DTVLGXAZSA-N	1	0	296.317	1.443	50	0		CDAARO
COC(=O)CCC[NH+]1CCC(O)(c2ccccc2)CC1	ZINC000185466151	358781440	/nfs/dbraw/zinc/78/14/40/358781440.db2.gz	GPKQRMORYAQAOV-UHFFFAOYSA-N	1	0	277.364	1.923	50	0		CDAARO
O=C(CCc1ccc(Cl)cc1)N1CC[NH2+]C[C@@H](O)C1	ZINC000097528858	358782363	/nfs/dbraw/zinc/78/23/63/358782363.db2.gz	XHUNFOFMXBJEBT-CYBMUJFWSA-N	1	0	282.771	1.065	50	0		CDAARO
CC[NH+](CC)[C@H]1CCN(C(=O)c2ncoc2C)C1	ZINC000097729584	358794787	/nfs/dbraw/zinc/79/47/87/358794787.db2.gz	BDSHMQVRUIZYKI-NSHDSACASA-N	1	0	251.330	1.539	50	0		CDAARO
Cc1nc(-c2ccccc2)[nH]c1C(=O)N1CC[NH2+]C[C@H]1C	ZINC000097732967	358795284	/nfs/dbraw/zinc/79/52/84/358795284.db2.gz	CVXIJDAIOGUNBJ-LLVKDONJSA-N	1	0	284.363	1.819	50	0		CDAARO
CC(C)O[C@@H](C)C(=O)N1CCN(c2cc[nH+]cc2)CC1	ZINC000097730178	358795465	/nfs/dbraw/zinc/79/54/65/358795465.db2.gz	HXGITLSJWNDRSA-ZDUSSCGKSA-N	1	0	277.368	1.544	50	0		CDAARO
COC(=O)[C@@H]1[C@H]2CCC[N@@H+]2C[C@]12c1ccccc1NC2=O	ZINC000012296507	358912694	/nfs/dbraw/zinc/91/26/94/358912694.db2.gz	SACUHBGXWYEFEY-WWGRRREGSA-N	1	0	286.331	1.144	50	0	biogenic	CDAARO
O=C(NC[C@@H]1CC[N@@H+](C2CCCCC2)C1)c1cn[nH]c1	ZINC000215451573	358889306	/nfs/dbraw/zinc/88/93/06/358889306.db2.gz	FHBROHGLDWYPLV-LBPRGKRZSA-N	1	0	276.384	1.794	50	0		CDAARO
Cc1n[nH]c(C)c1CCC[N@@H+](C)C[C@H]1CCOC1	ZINC000215808822	358904593	/nfs/dbraw/zinc/90/45/93/358904593.db2.gz	RSVACLBWTVYYHZ-CYBMUJFWSA-N	1	0	251.374	1.927	50	0		CDAARO
CCc1nccc(C[NH+]2CCC(c3nc(C)n[nH]3)CC2)n1	ZINC000216549372	358950323	/nfs/dbraw/zinc/95/03/23/358950323.db2.gz	JMVWZKSBDNQMPC-UHFFFAOYSA-N	1	0	286.383	1.845	50	0		CDAARO
CC[C@@H](NC(=O)CCC[NH+]1CCCC1)c1cnn(C)c1	ZINC000219448526	359098547	/nfs/dbraw/zinc/09/85/47/359098547.db2.gz	JYWQFSSPRRJVFN-CQSZACIVSA-N	1	0	278.400	1.863	50	0		CDAARO
Cc1nc([C@H]2C[C@@H]([NH2+]C3CCOCC3)C2)cc(=O)[nH]1	ZINC000219486078	359100548	/nfs/dbraw/zinc/10/05/48/359100548.db2.gz	KWQTXQPMZASISA-UMSPYCQHSA-N	1	0	263.341	1.093	50	0		CDAARO
C[N@H+](CCO)C1CCN(c2ncnc3sccc32)CC1	ZINC000032576244	359218587	/nfs/dbraw/zinc/21/85/87/359218587.db2.gz	UJFSRZHTQDLHGG-UHFFFAOYSA-N	1	0	292.408	1.584	50	0		CDAARO
O=C(c1ccco1)N1CCC[C@H](C[NH+]2CCOCC2)CC1	ZINC000257182207	359444464	/nfs/dbraw/zinc/44/44/64/359444464.db2.gz	OUXTXFJIOLFLQY-AWEZNQCLSA-N	1	0	292.379	1.854	50	0		CDAARO
Cc1cc(N2CCN(C(=O)Cc3ccccn3)CC2)cc[nH+]1	ZINC000223954130	359479069	/nfs/dbraw/zinc/47/90/69/359479069.db2.gz	PTADZUHERZSNJH-UHFFFAOYSA-N	1	0	296.374	1.676	50	0		CDAARO
O[C@@H]1CCOC2(CC[NH+](Cc3ccco3)CC2)C1	ZINC000257191531	359586541	/nfs/dbraw/zinc/58/65/41/359586541.db2.gz	QOXVOIQQNMFHCC-GFCCVEGCSA-N	1	0	251.326	1.786	50	0		CDAARO
CCNC(=O)N1CCC(Cn2c(C)c[nH+]c2C)CC1	ZINC000409420016	360229373	/nfs/dbraw/zinc/22/93/73/360229373.db2.gz	RHXAYPKLZNUTGP-UHFFFAOYSA-N	1	0	264.373	1.941	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1[C@H]1CCN(C(=O)c2ccnn2C)C1	ZINC000409421160	360230162	/nfs/dbraw/zinc/23/01/62/360230162.db2.gz	SHGXJXQKDSIPCF-ZDUSSCGKSA-N	1	0	299.378	1.890	50	0		CDAARO
O=C(NCC(F)(F)F)N[C@H]1CC[N@@H+]2CCC[C@H]2C1	ZINC000095950731	360323447	/nfs/dbraw/zinc/32/34/47/360323447.db2.gz	BRKOMTFIDAWSSG-IUCAKERBSA-N	1	0	265.279	1.475	50	0		CDAARO
CCOc1cc(N2C[C@H]3CCC[N@@H+]3C[C@@H]2C)ncn1	ZINC000124649903	360386052	/nfs/dbraw/zinc/38/60/52/360386052.db2.gz	MJZDZZNIWDKGKD-NWDGAFQWSA-N	1	0	262.357	1.548	50	0		CDAARO
Cc1nc[nH]c1CNC(=O)CC[C@H](C)[NH+]1CCCC1	ZINC000426491019	360575097	/nfs/dbraw/zinc/57/50/97/360575097.db2.gz	HAAGQLSXXGZPHA-NSHDSACASA-N	1	0	264.373	1.599	50	0		CDAARO
CS[C@H](C(=O)N1CC[C@H]([NH3+])C1)c1ccccc1	ZINC000178271830	189101734	/nfs/dbraw/zinc/10/17/34/189101734.db2.gz	PZLYPYPMRIUDGD-RYUDHWBXSA-N	1	0	250.367	1.650	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)[C@@H](C)n2ccnc2C)CC1	ZINC000426511568	360678623	/nfs/dbraw/zinc/67/86/23/360678623.db2.gz	FEQUVORSKVQMEI-GFCCVEGCSA-N	1	0	278.400	1.743	50	0		CDAARO
Cc1nc(C)c(CSc2nnc(C[NH3+])n2C)s1	ZINC000426518639	360680075	/nfs/dbraw/zinc/68/00/75/360680075.db2.gz	CQTJHXRLGCLYAY-UHFFFAOYSA-N	1	0	269.399	1.639	50	0		CDAARO
c1nc(NCC[NH+]2CCCCC2)cc([C@H]2CCOC2)n1	ZINC000426582882	360685812	/nfs/dbraw/zinc/68/58/12/360685812.db2.gz	UBWPZAHFQMNCQJ-ZDUSSCGKSA-N	1	0	276.384	1.300	50	0		CDAARO
Cc1ccc(OCC(=O)N2CC[C@H](C[NH3+])C2)cc1C	ZINC000178534913	189125192	/nfs/dbraw/zinc/12/51/92/189125192.db2.gz	DHEKFWLHSWEPHZ-CYBMUJFWSA-N	1	0	262.353	1.489	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)CCOc2ccccc2F)C1	ZINC000178977792	189158831	/nfs/dbraw/zinc/15/88/31/189158831.db2.gz	KNYWCXSVLMERAA-LBPRGKRZSA-N	1	0	280.343	1.663	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)Cc2cc(F)ccc2F)C1	ZINC000178987596	189159410	/nfs/dbraw/zinc/15/94/10/189159410.db2.gz	WLSHAHXVBUHLFS-SNVBAGLBSA-N	1	0	268.307	1.575	50	0		CDAARO
COc1ccccc1/C(C)=C/C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179103253	189169867	/nfs/dbraw/zinc/16/98/67/189169867.db2.gz	MCPLYNCXVBIVTG-XSNHNAGMSA-N	1	0	274.364	1.919	50	0		CDAARO
CN(C(=O)c1cc(C(C)(C)C)nn1C)[C@@H]1CC[NH2+]C1	ZINC000179108409	189170085	/nfs/dbraw/zinc/17/00/85/189170085.db2.gz	LLUHGLJFIVKYAA-SNVBAGLBSA-N	1	0	264.373	1.152	50	0		CDAARO
CC[C@H]1C[N@@H+]2CCC[C@H]2CN1S(=O)(=O)c1cccnc1	ZINC000246878801	360960882	/nfs/dbraw/zinc/96/08/82/360960882.db2.gz	GMAGAYSUHSJNRA-STQMWFEESA-N	1	0	295.408	1.329	50	0		CDAARO
Cn1c(SC[C@@H]2CCOC2)nnc1C1CC[NH2+]CC1	ZINC000426551786	361012643	/nfs/dbraw/zinc/01/26/43/361012643.db2.gz	JZZNABBFDNBYCH-SNVBAGLBSA-N	1	0	282.413	1.411	50	0		CDAARO
COCCC[N@@H+]1CC[C@@H](CNC(=O)c2cc[nH]c2C)C1	ZINC000426571852	361019335	/nfs/dbraw/zinc/01/93/35/361019335.db2.gz	WWSKROFWWLLKMB-ZDUSSCGKSA-N	1	0	279.384	1.411	50	0		CDAARO
NC(=O)c1cncc(-c2cc3c(c(F)c2)O[C@H](C[NH3+])C3)c1	ZINC000299794981	200876394	/nfs/dbraw/zinc/87/63/94/200876394.db2.gz	LCMUEBXJGZNRBM-LBPRGKRZSA-N	1	0	287.294	1.249	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)CCCn1cncn1	ZINC000248145589	361274378	/nfs/dbraw/zinc/27/43/78/361274378.db2.gz	RTZWUGMDIFUEPE-ZIAGYGMSSA-N	1	0	291.399	1.144	50	0		CDAARO
O=S(=O)(NC1CC[NH2+]CC1)c1ccc(F)cc1Cl	ZINC000036286038	361424486	/nfs/dbraw/zinc/42/44/86/361424486.db2.gz	QGOZLAWSZKFQOY-UHFFFAOYSA-N	1	0	292.763	1.509	50	0		CDAARO
C[C@H]([NH2+][C@@H]1CCCN(c2ccn(C)n2)C1=O)[C@@H]1CCCO1	ZINC000183781855	189367737	/nfs/dbraw/zinc/36/77/37/189367737.db2.gz	PKDVEXAPQXECKH-XQQFMLRXSA-N	1	0	292.383	1.073	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N(C)C1CC[NH2+]CC1	ZINC000036299960	361489857	/nfs/dbraw/zinc/48/98/57/361489857.db2.gz	SQLKMJSICVBNPR-UHFFFAOYSA-N	1	0	286.372	1.507	50	0		CDAARO
Nc1nn2c([n+]1=Nc1ccccc1)=NC(c1ccccc1)C2	ZINC000006754107	283681878	/nfs/dbraw/zinc/68/18/78/283681878.db2.gz	LSMOSUMTGAMCAW-UHFFFAOYSA-N	1	0	291.338	1.762	50	0		CDAARO
O=C1C[C@H](N2CCC[C@@H](CO)C2)C(=O)N1c1ccccc1	ZINC000169684006	361594317	/nfs/dbraw/zinc/59/43/17/361594317.db2.gz	PVCRKXOBTWKTQB-OCCSQVGLSA-N	1	0	288.347	1.023	50	0		CDAARO
CN(Cc1ccc(F)cc1Cl)C(=O)[C@H]1C[NH2+]CCO1	ZINC000187716150	189474632	/nfs/dbraw/zinc/47/46/32/189474632.db2.gz	ILKJAWMKXDQALG-GFCCVEGCSA-N	1	0	286.734	1.426	50	0		CDAARO
CSc1ccc(CNC(=O)NC[C@@H]2C[NH2+]CCO2)cc1	ZINC000417250775	364342922	/nfs/dbraw/zinc/34/29/22/364342922.db2.gz	GMEAEHAOVPAFAN-LBPRGKRZSA-N	1	0	295.408	1.196	50	0		CDAARO
CSc1ccc2c(c1)CCN(C(=O)[C@@H]1CC[NH2+]C1)C2	ZINC000216433317	189704547	/nfs/dbraw/zinc/70/45/47/189704547.db2.gz	FXXKEMIOGMCKSN-GFCCVEGCSA-N	1	0	276.405	1.903	50	0		CDAARO
c1ccc(CN2CCC[N@@H+](C[C@@H]3CCOC3)CC2)nc1	ZINC000216522480	189705010	/nfs/dbraw/zinc/70/50/10/189705010.db2.gz	CUUWAPMNXINYBJ-HNNXBMFYSA-N	1	0	275.396	1.626	50	0		CDAARO
O=C(N1CCC[C@H](C2CC[NH2+]CC2)C1)C(F)(F)F	ZINC000390822120	283891207	/nfs/dbraw/zinc/89/12/07/283891207.db2.gz	GUNMZMXOTPEPKA-JTQLQIEISA-N	1	0	264.291	1.787	50	0		CDAARO
CCC(=O)N1CC[C@H]([NH2+]Cc2ncc[nH]2)[C@H](CC)C1	ZINC000089948779	366976352	/nfs/dbraw/zinc/97/63/52/366976352.db2.gz	UOVWEDSHSYVXLW-NEPJUHHUSA-N	1	0	264.373	1.536	50	0		CDAARO
OC[C@@H]1C[C@@H](O)C[N@@H+]1C[C@H]1CCC2(CCCCC2)O1	ZINC000252539859	367813460	/nfs/dbraw/zinc/81/34/60/367813460.db2.gz	ONVICQYWLIWPIY-BFHYXJOUSA-N	1	0	269.385	1.296	50	0		CDAARO
CCOc1cccc(C[NH2+]CCSc2nnnn2C)c1	ZINC000002181776	368072200	/nfs/dbraw/zinc/07/22/00/368072200.db2.gz	LBVIGGKNGVUACW-UHFFFAOYSA-N	1	0	293.396	1.491	50	0		CDAARO
C[NH+]1CCC(CCNS(=O)(=O)CC2CCCC2)CC1	ZINC000360226552	368185021	/nfs/dbraw/zinc/18/50/21/368185021.db2.gz	DBRJYUMVEOIELP-UHFFFAOYSA-N	1	0	288.457	1.828	50	0		CDAARO
C[C@@H]1CN(S(C)(=O)=O)CC[C@H]1[NH2+]Cc1ccco1	ZINC000252670913	371449956	/nfs/dbraw/zinc/44/99/56/371449956.db2.gz	MAUTVROELVZHPM-ZYHUDNBSSA-N	1	0	272.370	1.039	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)C(N)=O)c1csc2ccccc21	ZINC000575621649	372060172	/nfs/dbraw/zinc/06/01/72/372060172.db2.gz	QCMWGWGONNSUMM-NSHDSACASA-N	1	0	291.376	1.106	50	0		CDAARO
O[C@@H](c1ccncc1)c1ccc2c(c1)C[NH2+]CCO2	ZINC000299792856	372766702	/nfs/dbraw/zinc/76/67/02/372766702.db2.gz	GMBFDJPLINYQNX-HNNXBMFYSA-N	1	0	256.305	1.645	50	0		CDAARO
COc1ccnc(C[NH2+][C@H]2CCC[C@@]2(C)CO)c1OC	ZINC000241447053	189904701	/nfs/dbraw/zinc/90/47/01/189904701.db2.gz	NQTKSJYJWGMUTO-ZFWWWQNUSA-N	1	0	280.368	1.740	50	0		CDAARO
COc1cccc(C[NH+]2CCC3(CC2)C[C@H](O)CCO3)n1	ZINC000253412197	373720407	/nfs/dbraw/zinc/72/04/07/373720407.db2.gz	QEKWCQPAZNNJKI-CQSZACIVSA-N	1	0	292.379	1.596	50	0		CDAARO
CCc1cc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3[NH2+]2)on1	ZINC000253369821	373676933	/nfs/dbraw/zinc/67/69/33/373676933.db2.gz	IKWNUZXGTOKNGZ-GDLCADMTSA-N	1	0	277.368	1.774	50	0		CDAARO
O[C@@H](Cc1ccccc1)C[N@@H+]1CCC12CCOCC2	ZINC000253393974	373683384	/nfs/dbraw/zinc/68/33/84/373683384.db2.gz	XWEMKWHKTHGNDZ-HNNXBMFYSA-N	1	0	261.365	1.845	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)Cc1ccc(F)cc1F	ZINC000095067609	373707374	/nfs/dbraw/zinc/70/73/74/373707374.db2.gz	VEZUAFQJLDNAGK-SECBINFHSA-N	1	0	254.280	1.328	50	0		CDAARO
COC[C@@H]1C[N@H+](Cc2ccc(C)cn2)C[C@H]1C(=O)N(C)C	ZINC000253412910	373721910	/nfs/dbraw/zinc/72/19/10/373721910.db2.gz	SLFZDXXDBTUSRK-DZGCQCFKSA-N	1	0	291.395	1.173	50	0		CDAARO
COc1cc(CN2C[C@H](C)O[C@]3(CCOC3)C2)ccc1O	ZINC000253426114	373733992	/nfs/dbraw/zinc/73/39/92/373733992.db2.gz	FUIGFZQMSNWVRF-BLLLJJGKSA-N	1	0	293.363	1.781	50	0		CDAARO
COCC1CCN(C(=O)[C@@H](C[NH3+])CC(C)C)CC1	ZINC000094700473	374445951	/nfs/dbraw/zinc/44/59/51/374445951.db2.gz	ULIRZTWDKHWVBZ-CYBMUJFWSA-N	1	0	256.390	1.492	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@@H](CC(N)=O)C2)cc1	ZINC000093809128	374786384	/nfs/dbraw/zinc/78/63/84/374786384.db2.gz	NOXCQFMCIHCWCE-ZDUSSCGKSA-N	1	0	262.353	1.783	50	0		CDAARO
CCC1(CC)C[N@@H+]([C@@H](C)C(=O)NC(=O)NC)CCS1	ZINC000390834050	374851491	/nfs/dbraw/zinc/85/14/91/374851491.db2.gz	QYAAOLZROJZXIP-JTQLQIEISA-N	1	0	287.429	1.438	50	0		CDAARO
C[C@@H](CNC(=O)c1ccn2c[nH+]cc2c1)Cn1cccn1	ZINC000095432809	374934918	/nfs/dbraw/zinc/93/49/18/374934918.db2.gz	UISKQWNDUMPRBP-LBPRGKRZSA-N	1	0	283.335	1.597	50	0		CDAARO
CCCC[C@@H]([NH3+])C(=O)N1CC[C@H](Oc2cccnc2)C1	ZINC000095466800	374961922	/nfs/dbraw/zinc/96/19/22/374961922.db2.gz	DMHWQAQTDLBLIY-UONOGXRCSA-N	1	0	277.368	1.579	50	0		CDAARO
COc1cc(C)c(C[NH2+][C@@H](C(N)=O)C(C)C)cc1OC	ZINC000095409297	374910968	/nfs/dbraw/zinc/91/09/68/374910968.db2.gz	IAWCDCJGAXHNIW-CQSZACIVSA-N	1	0	280.368	1.612	50	0		CDAARO
O=C(NCC[NH2+][C@H]1CCCSC1)c1cccs1	ZINC000097084492	375145964	/nfs/dbraw/zinc/14/59/64/375145964.db2.gz	DYJIFFFXDZGLDA-JTQLQIEISA-N	1	0	270.423	1.963	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]CCS(=O)(=O)Cc1ccccc1	ZINC000097160132	375151258	/nfs/dbraw/zinc/15/12/58/375151258.db2.gz	NHIUHIBWJNHHOL-UHFFFAOYSA-N	1	0	293.392	1.423	50	0		CDAARO
NC(=O)[C@@H](c1ccccc1)[NH+]1CCC(c2cn[nH]c2)CC1	ZINC000097202714	375156625	/nfs/dbraw/zinc/15/66/25/375156625.db2.gz	LQFISMSZDKUQPR-OAHLLOKOSA-N	1	0	284.363	1.816	50	0		CDAARO
[NH3+]C[C@@H]1CCCCN1C(=O)COc1cccc(F)c1	ZINC000299740116	375201078	/nfs/dbraw/zinc/20/10/78/375201078.db2.gz	VYQCFNPFLNQQIW-LBPRGKRZSA-N	1	0	266.316	1.544	50	0		CDAARO
O[C@H](COCc1ccccc1)C[NH+]1CCSCC1	ZINC000002692787	375297973	/nfs/dbraw/zinc/29/79/73/375297973.db2.gz	DLFCGTJJFSAPML-AWEZNQCLSA-N	1	0	267.394	1.613	50	0		CDAARO
C[NH+](C)CC(C)(C)CNC1C[C@H]2CC[C@@H](C1)[N@H+]2C	ZINC000003683608	375781620	/nfs/dbraw/zinc/78/16/20/375781620.db2.gz	BXNZKYSFVBMRQS-AGUYFDCRSA-N	1	0	253.434	1.789	50	0		CDAARO
CCCn1ccnc1C[NH2+]C1CCN(C(C)=O)CC1	ZINC000061877980	375824290	/nfs/dbraw/zinc/82/42/90/375824290.db2.gz	ZTSLJHQGOSGRCT-UHFFFAOYSA-N	1	0	264.373	1.394	50	0		CDAARO
C[NH2+][C@@H](C)CNC(=O)c1cc(-c2ccccc2)on1	ZINC000261800476	190044515	/nfs/dbraw/zinc/04/45/15/190044515.db2.gz	RRBSEYUKJOSMLY-JTQLQIEISA-N	1	0	259.309	1.679	50	0		CDAARO
Cc1ccc(CN2CC[NH2+]C[C@@H]2[C@H](C)O)cc1F	ZINC000585657560	376359908	/nfs/dbraw/zinc/35/99/08/376359908.db2.gz	ATGXCDYQDUKQRG-SMDDNHRTSA-N	1	0	252.333	1.289	50	0		CDAARO
C[C@@H](C(=O)N1Cc2cnc(C(C)(C)C)nc2C1)[NH+](C)C	ZINC000067432014	377074187	/nfs/dbraw/zinc/07/41/87/377074187.db2.gz	MCEURBZYNHKDCS-JTQLQIEISA-N	1	0	276.384	1.566	50	0		CDAARO
[NH3+]CC(=O)N1CCC[C@H](c2n[nH]cc2Cc2ccccc2)C1	ZINC000067742686	377235621	/nfs/dbraw/zinc/23/56/21/377235621.db2.gz	VHCYKCQCEJIZRI-AWEZNQCLSA-N	1	0	298.390	1.665	50	0		CDAARO
COCCN1C[C@@H](Cc2cccc3c(N)cc[nH+]c23)CC1=O	ZINC000244723865	377792836	/nfs/dbraw/zinc/79/28/36/377792836.db2.gz	MIYAGNIVFHFXPR-LBPRGKRZSA-N	1	0	299.374	1.854	50	0		CDAARO
O=C(NC[C@@H]1CC[N@@H+](C2CCCCC2)C1)c1nnc[nH]1	ZINC000244882430	377797799	/nfs/dbraw/zinc/79/77/99/377797799.db2.gz	XRMUIWBUANYJRY-NSHDSACASA-N	1	0	277.372	1.189	50	0		CDAARO
CC(C)(C)[NH+]1CCN(C(=O)[C@H]2[C@@H]3CCC[C@@H]32)CC1	ZINC000245289843	378047562	/nfs/dbraw/zinc/04/75/62/378047562.db2.gz	FMUBQRNDEBFXOV-ITGUQSILSA-N	1	0	250.386	1.975	50	0		CDAARO
CC[C@@H](C)[NH2+]C[C@H](O)COCCOc1ccc(F)cc1	ZINC000041690312	379451657	/nfs/dbraw/zinc/45/16/57/379451657.db2.gz	DMADYEFBULAUGA-OCCSQVGLSA-N	1	0	285.359	1.970	50	0		CDAARO
Cc1nn(C)c(C)c1CN(C)c1cc(CC[NH3+])nc(C)n1	ZINC000071278783	379560381	/nfs/dbraw/zinc/56/03/81/379560381.db2.gz	HFSHWXVHWKHVAF-UHFFFAOYSA-N	1	0	288.399	1.273	50	0		CDAARO
CCOC(=O)CCC[n+]1c(C)n(N)c2ccccc21	ZINC000000386946	169626474	/nfs/dbraw/zinc/62/64/74/169626474.db2.gz	RBGVUVYUWWPRCR-UHFFFAOYSA-N	1	0	262.333	1.294	50	0		CDAARO
CCC[C@H]([NH2+]CCNC(=O)c1ccn[nH]1)C1CCC1	ZINC000453193056	252280948	/nfs/dbraw/zinc/28/09/48/252280948.db2.gz	DCYFYXLFUZFYHD-LBPRGKRZSA-N	1	0	264.373	1.698	50	0		CDAARO
C[C@@H]1CCCN(S(=O)(=O)c2cccs2)[C@H]1C[NH3+]	ZINC000252192230	296399584	/nfs/dbraw/zinc/39/95/84/296399584.db2.gz	RTSAILULKVQTTI-ZJUUUORDSA-N	1	0	274.411	1.496	50	0		CDAARO
CC[NH+]1CCC(CNC(=O)c2cnc(C(C)=O)s2)CC1	ZINC000664034080	413037344	/nfs/dbraw/zinc/03/73/44/413037344.db2.gz	OKEJDHUKVHWOJV-UHFFFAOYSA-N	1	0	295.408	1.807	50	0		CDAARO
Cc1ncccc1C(=O)N1CCC(OCCC[NH3+])CC1	ZINC000094649336	184835126	/nfs/dbraw/zinc/83/51/26/184835126.db2.gz	SRRUEWYPCCOTIB-UHFFFAOYSA-N	1	0	277.368	1.360	50	0		CDAARO
Cc1ccc(OCC(=O)OCCC[NH+](C)C)cc1	ZINC000002813450	390145512	/nfs/dbraw/zinc/14/55/12/390145512.db2.gz	GVNQHJVQOHPGBH-UHFFFAOYSA-N	1	0	251.326	1.869	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)c2ccc(C)cc2F)C1	ZINC000094919020	184892726	/nfs/dbraw/zinc/89/27/26/184892726.db2.gz	VVNSJLCVTXCWOL-LLVKDONJSA-N	1	0	250.317	1.958	50	0		CDAARO
COC[C@@H](O)C[N@H+](C)[C@@H](C)C(=O)NC1CCC(C)CC1	ZINC000096424642	390516079	/nfs/dbraw/zinc/51/60/79/390516079.db2.gz	QWCXMQZOFXRKJP-YIOUJQMASA-N	1	0	286.416	1.009	50	0		CDAARO
CCn1c(CC2CC[NH2+]CC2)nn(CCCCCF)c1=O	ZINC000065532716	390552596	/nfs/dbraw/zinc/55/25/96/390552596.db2.gz	BYCVOFFERKOIQZ-UHFFFAOYSA-N	1	0	298.406	1.747	50	0		CDAARO
Cc1cc(NC[C@@H](O)CO)c2cc(F)ccc2[nH+]1	ZINC000097103086	390791279	/nfs/dbraw/zinc/79/12/79/390791279.db2.gz	RKNLYZXLCAYPLF-SNVBAGLBSA-N	1	0	250.273	1.447	50	0		CDAARO
CCOC(=O)[C@H]1C[NH2+]C[C@]12CCN(C(=O)OC(C)(C)C)C2	ZINC000091303165	390889270	/nfs/dbraw/zinc/88/92/70/390889270.db2.gz	LKKYIMUKDUHHII-ABAIWWIYSA-N	1	0	298.383	1.396	50	0		CDAARO
O=C(CC[N@H+]1CC[C@](O)(CO)C1)Nc1cccc(Cl)c1	ZINC000244794845	391044505	/nfs/dbraw/zinc/04/45/05/391044505.db2.gz	QUZBDJNMHZTXMN-CQSZACIVSA-N	1	0	298.770	1.098	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@H]2CCOc3ccccc32)C1	ZINC000104201385	391496149	/nfs/dbraw/zinc/49/61/49/391496149.db2.gz	IRKBBIUKQDYPGS-AAEUAGOBSA-N	1	0	260.337	1.360	50	0		CDAARO
C[C@@H]1CN(C(=O)CN2CCC[C@H]2c2ccc[nH]2)C[C@@H](C)O1	ZINC000257365156	391651024	/nfs/dbraw/zinc/65/10/24/391651024.db2.gz	JYPSGYZOLPBPHL-NFAWXSAZSA-N	1	0	291.395	1.787	50	0		CDAARO
CC(C)NC(=O)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCN(C3CC3)C2)C1	ZINC000095968095	393155832	/nfs/dbraw/zinc/15/58/32/393155832.db2.gz	PSRNQYBYGGQHTJ-RBSFLKMASA-N	1	0	293.455	1.896	50	0		CDAARO
O=C(NC1CC1)[C@@H](c1ccccc1)[N@@H+]1CCC[C@@H](O)C1	ZINC000195493494	393225669	/nfs/dbraw/zinc/22/56/69/393225669.db2.gz	LMBJYSVHWGCCDF-HUUCEWRRSA-N	1	0	274.364	1.463	50	0		CDAARO
O=C(c1ccc2n[nH]cc2c1)N1CC[NH+](CC2CC2)CC1	ZINC000095350595	147113989	/nfs/dbraw/zinc/11/39/89/147113989.db2.gz	SAISKORUVNHXNT-UHFFFAOYSA-N	1	0	284.363	1.731	50	0		CDAARO
CCO[C@@H]1C[C@H](N(C)C(=O)[C@H]2CC[C@@H]([NH3+])C2)C1(C)C	ZINC000299738618	286329208	/nfs/dbraw/zinc/32/92/08/286329208.db2.gz	CVWOUGYGGJKVLG-QNWHQSFQSA-N	1	0	268.401	1.776	50	0		CDAARO
COc1cc2c(cc1C[N@H+](C)C[C@H]1CCOC1)OCO2	ZINC000355386767	157020542	/nfs/dbraw/zinc/02/05/42/157020542.db2.gz	RCIUAXICEYHDBP-LLVKDONJSA-N	1	0	279.336	1.892	50	0		CDAARO
COc1ccccc1OCC[NH2+]C[C@H]1CCCO1	ZINC000003315096	169877641	/nfs/dbraw/zinc/87/76/41/169877641.db2.gz	UVJQBHRCKMVDEU-GFCCVEGCSA-N	1	0	251.326	1.843	50	0		CDAARO
COc1ccc(C(=O)N2CC[N@@H+]3CCC[C@@H]3C2)cc1	ZINC000006006299	170168143	/nfs/dbraw/zinc/16/81/43/170168143.db2.gz	RLLOORQJPCSRPE-CYBMUJFWSA-N	1	0	260.337	1.615	50	0		CDAARO
C[NH+](C)CCNS(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000007612650	170293528	/nfs/dbraw/zinc/29/35/28/170293528.db2.gz	BBXFEUSPHQCCOR-UHFFFAOYSA-N	1	0	297.207	1.833	50	0		CDAARO
CCOc1c(C[NH2+]C(C)(C)CO)cccc1OC	ZINC000008253453	170326984	/nfs/dbraw/zinc/32/69/84/170326984.db2.gz	SWYGQVHGTOLXHB-UHFFFAOYSA-N	1	0	253.342	1.954	50	0		CDAARO
COc1cc(OC)c(OC)cc1C[NH2+]C[C@@H](C)O	ZINC000008535059	170339251	/nfs/dbraw/zinc/33/92/51/170339251.db2.gz	QFSGNPGPNXEZOJ-SECBINFHSA-N	1	0	255.314	1.183	50	0		CDAARO
COc1ccccc1OC[C@@H](O)C[NH2+]C1CCCC1	ZINC000008844713	170357451	/nfs/dbraw/zinc/35/74/51/170357451.db2.gz	QBFYTUOJUHHBLM-ZDUSSCGKSA-N	1	0	265.353	1.967	50	0		CDAARO
Cc1ccccc1OCCC[NH2+]CCN1CCOCC1	ZINC000020482294	171222930	/nfs/dbraw/zinc/22/29/30/171222930.db2.gz	JAZBRPXWTFLCJU-UHFFFAOYSA-N	1	0	278.396	1.686	50	0		CDAARO
[NH3+]Cc1ccc(CS(=O)(=O)NC2CCCCC2)cc1	ZINC000020554810	171249613	/nfs/dbraw/zinc/24/96/13/171249613.db2.gz	MXRUPLHPQAXXNJ-UHFFFAOYSA-N	1	0	282.409	1.897	50	0		CDAARO
O=C(Cn1cncn1)NC[C@@H](c1ccccc1)[NH+]1CCCC1	ZINC000032903746	171759307	/nfs/dbraw/zinc/75/93/07/171759307.db2.gz	XYIZKVCUJPQCOL-HNNXBMFYSA-N	1	0	299.378	1.231	50	0		CDAARO
CCOC(=O)[C@H](C[NH3+])c1ccc(OC)c(OC)c1	ZINC000035287639	172106216	/nfs/dbraw/zinc/10/62/16/172106216.db2.gz	SVBYEXVSRYCLDO-SNVBAGLBSA-N	1	0	253.298	1.309	50	0		CDAARO
COC(=O)c1ccc(COC[C@H]2CCC[NH2+]C2)cc1	ZINC000042782954	174878917	/nfs/dbraw/zinc/87/89/17/174878917.db2.gz	AYJVPFIHTHNGHQ-ZDUSSCGKSA-N	1	0	263.337	1.989	50	0		CDAARO
[NH3+]C[C@H](CO)Cc1cc(Br)ccc1F	ZINC000063065166	175681775	/nfs/dbraw/zinc/68/17/75/175681775.db2.gz	FXMFLRPYJWJVET-SSDOTTSWSA-N	1	0	262.122	1.698	50	0		CDAARO
[NH3+]C1(COc2ccc(Br)cc2)COC1	ZINC000071654932	176242221	/nfs/dbraw/zinc/24/22/21/176242221.db2.gz	NQNWWCMNLZJDTN-UHFFFAOYSA-N	1	0	258.115	1.556	50	0		CDAARO
COc1ccc(CCN(C)[C@H]2CCC[NH2+]C2)cc1OC	ZINC000071712045	176248811	/nfs/dbraw/zinc/24/88/11/176248811.db2.gz	CHIUWQICDAPELM-AWEZNQCLSA-N	1	0	278.396	1.930	50	0		CDAARO
C[NH2+]CC(=O)N(C)Cc1ccccc1C(F)(F)F	ZINC000071765591	176261631	/nfs/dbraw/zinc/26/16/31/176261631.db2.gz	RIURKYDEYQEHRF-UHFFFAOYSA-N	1	0	260.259	1.883	50	0		CDAARO
CCCc1cc(N2[C@@H]3CC[C@H]2C[NH2+]C3)n2nccc2n1	ZINC000072448534	176404546	/nfs/dbraw/zinc/40/45/46/176404546.db2.gz	SLVSRPLBLUCYNE-BETUJISGSA-N	1	0	271.368	1.622	50	0		CDAARO
CC(C)c1noc([C@H]2CCCN2C(=O)Cn2ccnc2)n1	ZINC000077343118	177254761	/nfs/dbraw/zinc/25/47/61/177254761.db2.gz	OWYUDLKCMKHCEW-LLVKDONJSA-N	1	0	289.339	1.753	50	0		CDAARO
CO[C@@]1(C)C[C@@H](NC(=O)C2([NH+](C)C)CCC2)C1(C)C	ZINC000119492258	424546762	/nfs/dbraw/zinc/54/67/62/424546762.db2.gz	SNOAXNGKAPAXDL-RISCZKNCSA-N	1	0	268.401	1.791	50	0		CDAARO
C[C@@H]1C[C@@H](C[NH3+])CN1C(=O)c1cccc2[nH]ncc21	ZINC000261623413	274385086	/nfs/dbraw/zinc/38/50/86/274385086.db2.gz	CELBKIFQXGOIQI-ZJUUUORDSA-N	1	0	258.325	1.372	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1Cn1ncc2ccccc2c1=O	ZINC000095378792	276187984	/nfs/dbraw/zinc/18/79/84/276187984.db2.gz	JHIWODQGDGOHCN-ZDUSSCGKSA-N	1	0	257.337	1.881	50	0		CDAARO
COC(=O)[C@@]12CCC[C@H]1C[N@H+](CC(=O)N1CCCCC1)C2	ZINC000097082977	277114880	/nfs/dbraw/zinc/11/48/80/277114880.db2.gz	HYCDTQQMPGYENK-XJKSGUPXSA-N	1	0	294.395	1.274	50	0		CDAARO
CNC(=O)N1c2ccc(C)cc2[C@H]2C[N@@H+](C)CC[C@@H]21	ZINC000004007188	277234631	/nfs/dbraw/zinc/23/46/31/277234631.db2.gz	ZLLYQMRMDBRZGG-OCCSQVGLSA-N	1	0	259.353	1.942	50	0		CDAARO
CS(=O)(=O)c1cc(Cl)ccc1N1CC[NH2+]CC1	ZINC000000154117	278118193	/nfs/dbraw/zinc/11/81/93/278118193.db2.gz	RJEDJYJNERXVNE-UHFFFAOYSA-N	1	0	274.773	1.153	50	0		CDAARO
C[C@@H](O)C[N@@H+](Cc1ccc(Cl)cc1)C[C@H](C)O	ZINC000000279198	278394370	/nfs/dbraw/zinc/39/43/70/278394370.db2.gz	DOJAOHHKXIRUFD-PHIMTYICSA-N	1	0	257.761	1.904	50	0		CDAARO
C[C@@H]1CSC[C@@H]1[NH2+][C@@H]1CCCN(c2ccn(C)n2)C1=O	ZINC000285118295	278870606	/nfs/dbraw/zinc/87/06/06/278870606.db2.gz	NBAXENSERLTGBO-UTUOFQBUSA-N	1	0	294.424	1.257	50	0		CDAARO
ClC1=CC[C@H]2C[N@H+](CCN3CCOCC3)C[C@@H]2C1	ZINC000022939980	279290132	/nfs/dbraw/zinc/29/01/32/279290132.db2.gz	NTRSYCHJIBTEDS-STQMWFEESA-N	1	0	270.804	1.783	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)C[C@H]1OCCc2ccccc21	ZINC000124615395	288316613	/nfs/dbraw/zinc/31/66/13/288316613.db2.gz	IQAVOOPKGCYWIG-IUODEOHRSA-N	1	0	274.364	1.511	50	0		CDAARO
Cc1nc(C)c(C(=O)N2CCCC[C@H]([NH+](C)C)C2)o1	ZINC000082146658	281857217	/nfs/dbraw/zinc/85/72/17/281857217.db2.gz	QEXSLHNFLZWWTP-LBPRGKRZSA-N	1	0	265.357	1.848	50	0		CDAARO
Cc1nc(C)c(C)c(NC[C@H](O)C[NH+]2CCCCC2)n1	ZINC000091365225	281867457	/nfs/dbraw/zinc/86/74/57/281867457.db2.gz	NJHFZWVGXSMXKD-AWEZNQCLSA-N	1	0	278.400	1.661	50	0		CDAARO
COc1cc(/C=C\C(=O)N2CC[C@H]([NH3+])C2)cc(OC)c1	ZINC000255135532	289358544	/nfs/dbraw/zinc/35/85/44/289358544.db2.gz	ITOXYTFNLNZTQD-MVZIDQBPSA-N	1	0	276.336	1.277	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@H]1CCC[NH2+][C@H]1C	ZINC000091496927	301617044	/nfs/dbraw/zinc/61/70/44/301617044.db2.gz	QDJCZGJAGSHCQR-JQWIXIFHSA-N	1	0	286.372	1.553	50	0		CDAARO
O=C(NCC1CCCCC1)N1C[C@@H]2CC[C@H]1C[NH2+]C2	ZINC000534575280	328309957	/nfs/dbraw/zinc/30/99/57/328309957.db2.gz	BWXKKHIDNPFJBP-KGLIPLIRSA-N	1	0	265.401	1.960	50	0		CDAARO
CC1(C(=O)N[C@H]2COC[C@@H]2[NH+]2CCCC2)CCCCC1	ZINC000534580402	328311621	/nfs/dbraw/zinc/31/16/21/328311621.db2.gz	BRVVDNTWXXZAHQ-KBPBESRZSA-N	1	0	280.412	1.936	50	0		CDAARO
CC(=O)N1CCC[C@H]([NH2+]C2CSCCSC2)C1	ZINC000534590024	328317533	/nfs/dbraw/zinc/31/75/33/328317533.db2.gz	IHAJOSYZZHPYBL-NSHDSACASA-N	1	0	274.455	1.436	50	0		CDAARO
O=C([O-])Cc1ccc(C[N@H+]2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)cc1	ZINC000534646677	328330474	/nfs/dbraw/zinc/33/04/74/328330474.db2.gz	VDXSWYOZOWBRTM-GEEKYZPCSA-N	1	0	286.375	1.496	50	0		CDAARO
Cc1ccnc(CC(=O)NC[C@@H](C(C)C)[NH+](C)C)c1	ZINC000534660346	328342391	/nfs/dbraw/zinc/34/23/91/328342391.db2.gz	BDVWYFXVTNEXDW-AWEZNQCLSA-N	1	0	263.385	1.635	50	0		CDAARO
CCCC(=O)N1CCC([NH2+]CCc2ncc[nH]2)CC1	ZINC000534667428	328345885	/nfs/dbraw/zinc/34/58/85/328345885.db2.gz	LXYBQHHBPLVYDJ-UHFFFAOYSA-N	1	0	264.373	1.333	50	0		CDAARO
Cc1ccc2c(c1C)NC(=O)CN(CC[NH+](C)C)C2=O	ZINC000534667828	328346210	/nfs/dbraw/zinc/34/62/10/328346210.db2.gz	GKGUTRUMMUKXGW-UHFFFAOYSA-N	1	0	275.352	1.259	50	0		CDAARO
CC1(C)C[C@@H]([NH2+]CC(=O)Nc2ccncc2)C(C)(C)O1	ZINC000119675737	323208656	/nfs/dbraw/zinc/20/86/56/323208656.db2.gz	WSDBPGPVBSLZII-GFCCVEGCSA-N	1	0	277.368	1.956	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@H](C)[C@H]2CCOC2)cc1	ZINC000095988358	328524635	/nfs/dbraw/zinc/52/46/35/328524635.db2.gz	NMWJCNOCOSBYLI-RISCZKNCSA-N	1	0	263.337	1.988	50	0		CDAARO
CC(=O)c1ccc(OCCCN2CC[NH+](C)CC2)cc1	ZINC000020327193	326862197	/nfs/dbraw/zinc/86/21/97/326862197.db2.gz	LQZLOKNBUXFPSP-UHFFFAOYSA-N	1	0	276.380	1.906	50	0		CDAARO
CCOc1ccc(C[NH+]2CCC([C@H](O)CO)CC2)cn1	ZINC001772712449	1159447020	/nfs/dbraw/zinc/44/70/20/1159447020.db2.gz	MPAYAFQZBLSFST-CQSZACIVSA-N	1	0	280.368	1.046	50	0		CDAARO
CSCCN1CCN(C(=O)C[NH+]2CCCCCC2)CC1	ZINC000670441819	482987076	/nfs/dbraw/zinc/98/70/76/482987076.db2.gz	IBLPUINYRKJADS-UHFFFAOYSA-N	1	0	299.484	1.370	50	0		CDAARO
Cc1cccc(F)c1C(=O)NCC[N@@H+]1CCCC[C@@H]1CO	ZINC000670445484	482992741	/nfs/dbraw/zinc/99/27/41/482992741.db2.gz	JFQLBDBCVADWTK-CYBMUJFWSA-N	1	0	294.370	1.711	50	0		CDAARO
CCC(CC)C(=O)N1CCOC[C@H](C[NH+](C)C)C1	ZINC000670453954	483024096	/nfs/dbraw/zinc/02/40/96/483024096.db2.gz	QFVBPWYMXOLKBN-GFCCVEGCSA-N	1	0	256.390	1.459	50	0		CDAARO
Cc1ccc(N2CCC([N@@H+]3CCCNC(=O)C3)CC2)cc1	ZINC000670464150	483052897	/nfs/dbraw/zinc/05/28/97/483052897.db2.gz	JUVWHLNJDAFMRF-UHFFFAOYSA-N	1	0	287.407	1.786	50	0		CDAARO
CN(CCOCC1CC1)C(=O)N[C@@H]1CCC[N@H+](C)C1	ZINC000083877764	483216225	/nfs/dbraw/zinc/21/62/25/483216225.db2.gz	XVPIPPWJRUFQSQ-CYBMUJFWSA-N	1	0	269.389	1.149	50	0		CDAARO
CC[C@@H](O)[C@@H]1CCCC[N@@H+]1CCS(=O)(=O)C(C)C	ZINC000084727061	483318760	/nfs/dbraw/zinc/31/87/60/483318760.db2.gz	OUPGIODOULTFSY-QWHCGFSZSA-N	1	0	277.430	1.435	50	0		CDAARO
CC[C@H]1CN(S(C)(=O)=O)CC[C@@H]1[NH2+]Cc1ccco1	ZINC000084736397	483321514	/nfs/dbraw/zinc/32/15/14/483321514.db2.gz	BDUXNQPJVJORBJ-AAEUAGOBSA-N	1	0	286.397	1.429	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)C1CC1)c1ccc2c(c1)OCO2	ZINC000012196018	522068131	/nfs/dbraw/zinc/06/81/31/522068131.db2.gz	LUKIKVXDADEBRE-GFCCVEGCSA-N	1	0	276.336	1.544	50	0		CDAARO
COC(=O)[C@H]1C[C@@H]([NH+]2CCc3ccccc3CC2)[C@@H](O)C1	ZINC000245281259	570304198	/nfs/dbraw/zinc/30/41/98/570304198.db2.gz	ALBKJDCBTBGXHD-XHSDSOJGSA-N	1	0	289.375	1.400	50	0		CDAARO
CCOC1CCN(C(=O)[C@@H](CC)[N@H+](C)CC)CC1	ZINC000952990599	615228295	/nfs/dbraw/zinc/22/82/95/615228295.db2.gz	ZPPOPWSRDUVVQG-CYBMUJFWSA-N	1	0	256.390	1.744	50	0		CDAARO
CCc1ncnc(N2CC([NH2+]C3CCC3)C2)c1F	ZINC000952995273	615780376	/nfs/dbraw/zinc/78/03/76/615780376.db2.gz	GWDZEDDFAURDDJ-UHFFFAOYSA-N	1	0	250.321	1.509	50	0		CDAARO
C[NH+](C)CCCOc1ccc(CN2C[C@@H](O)[C@H](F)C2)cc1	ZINC000952976601	615884641	/nfs/dbraw/zinc/88/46/41/615884641.db2.gz	LGIHPKVUSWGJLI-HZPDHXFCSA-N	1	0	296.386	1.532	50	0		CDAARO
O=C([O-])CC[C@@]12C[NH2+]C[C@@H]1CN(Cc1ccsc1)C2	ZINC001772700511	1159436896	/nfs/dbraw/zinc/43/68/96/1159436896.db2.gz	FXJQHCWEJKENTJ-OCCSQVGLSA-N	1	0	280.393	1.634	50	0		CDAARO
CC(C)(C[N@@H+]1C[C@@H]2COCC[C@]2(CO)C1)N1CCCCC1	ZINC001772711245	1159445033	/nfs/dbraw/zinc/44/50/33/1159445033.db2.gz	XMWFETVRWGMRCK-NVXWUHKLSA-N	1	0	296.455	1.582	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3ccc(F)cc3)C[C@H]2O)[nH]n1	ZINC001704352337	1177699055	/nfs/dbraw/zinc/69/90/55/1177699055.db2.gz	CWEIAWINOAWCSY-CZUORRHYSA-N	1	0	289.354	1.893	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNc1nc(C)c(C)cc1C(N)=O	ZINC001704352049	1177699213	/nfs/dbraw/zinc/69/92/13/1177699213.db2.gz	WJVKYOSTRVZQEP-LBPRGKRZSA-N	1	0	276.384	1.694	50	0		CDAARO
COC1(OC)CC[C@H]1[NH2+]CCNC(=O)c1cccc(C)c1	ZINC000864097349	730470794	/nfs/dbraw/zinc/47/07/94/730470794.db2.gz	TZVQJYKJINQYTE-CQSZACIVSA-N	1	0	292.379	1.466	50	0		CDAARO
Cc1ncc2c(c1-c1noc(CN3CCCC3)n1)CC[NH2+]C2	ZINC000020773754	731476960	/nfs/dbraw/zinc/47/69/60/731476960.db2.gz	NGLVKBJUWYYRFO-UHFFFAOYSA-N	1	0	299.378	1.682	50	0		CDAARO
CC1(NC(=O)c2ccc(N3CCCC3)nc2)CC[NH2+]CC1	ZINC000193356475	732415528	/nfs/dbraw/zinc/41/55/28/732415528.db2.gz	PMBWQSAMXWEWBO-UHFFFAOYSA-N	1	0	288.395	1.554	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1CCNCc1cnccc1Cl	ZINC000952860197	910411537	/nfs/dbraw/zinc/41/15/37/910411537.db2.gz	HNQBQTLAUKRGNF-ZDUSSCGKSA-N	1	0	283.803	1.671	50	0		CDAARO
CCCc1nc(NCC[N@@H+]2CCCC[C@H]2CO)no1	ZINC000952871786	910424440	/nfs/dbraw/zinc/42/44/40/910424440.db2.gz	BELCGMKBHQEKFA-NSHDSACASA-N	1	0	268.361	1.281	50	0		CDAARO
CC(C)C1=NO[C@H](C(=O)N2CC([NH+]3CCCCC3)C2)C1	ZINC000952874050	910429867	/nfs/dbraw/zinc/42/98/67/910429867.db2.gz	UADOMZNXVSQQFK-AWEZNQCLSA-N	1	0	279.384	1.484	50	0		CDAARO
CCn1nnc(C)c1CN1Cc2c[nH]nc2C[C@@H](C)C1	ZINC000952884043	910459784	/nfs/dbraw/zinc/45/97/84/910459784.db2.gz	SEYKCEGZTCMNLZ-SNVBAGLBSA-N	1	0	274.372	1.524	50	0		CDAARO
CCO[C@H]1CN(C)C[C@@H]1[NH2+]C1Cc2ccccc2C1	ZINC000823350064	925686804	/nfs/dbraw/zinc/68/68/04/925686804.db2.gz	CSJHIVYSLOKIDO-HOTGVXAUSA-N	1	0	260.381	1.463	50	0		CDAARO
C[C@@H]1CN(C(=O)CCC[NH+]2CCCC2)CCN1C	ZINC000823795801	925733204	/nfs/dbraw/zinc/73/32/04/925733204.db2.gz	WMZFMNRDVLKEMA-CYBMUJFWSA-N	1	0	253.390	1.025	50	0		CDAARO
CN(C)C(=O)[C@@H]1CN(CCCc2ccco2)CCO1	ZINC000827790972	925964163	/nfs/dbraw/zinc/96/41/63/925964163.db2.gz	PKRLBCVNZWCWEI-ZDUSSCGKSA-N	1	0	266.341	1.001	50	0		CDAARO
OC[C@@H]1CCCCN1CC[NH2+]C1Cc2ccccc2C1	ZINC000828710913	926168444	/nfs/dbraw/zinc/16/84/44/926168444.db2.gz	PSFPTIATHGUZCR-KRWDZBQOSA-N	1	0	274.408	1.590	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1CCCNc1ccncc1F	ZINC000828710957	926168798	/nfs/dbraw/zinc/16/87/98/926168798.db2.gz	RHYCFMJWYUEHTG-GFCCVEGCSA-N	1	0	267.348	1.291	50	0		CDAARO
COc1ccc(C(=O)N2CC[C@H](CO)[C@H]([NH+](C)C)C2)cc1	ZINC000581797970	927199658	/nfs/dbraw/zinc/19/96/58/927199658.db2.gz	AYZBQEHDVOPZLB-UKRRQHHQSA-N	1	0	292.379	1.080	50	0		CDAARO
C[NH2+]CC1CCN(C(=O)c2scnc2Cl)CC1	ZINC000585086663	930889351	/nfs/dbraw/zinc/88/93/51/930889351.db2.gz	CFNQGWZCOVQYHH-UHFFFAOYSA-N	1	0	273.789	1.868	50	0		CDAARO
O=C(NC1(CO)CCSCC1)[C@H]1CC[C@H]2CCCC[N@@H+]21	ZINC000585122211	930987925	/nfs/dbraw/zinc/98/79/25/930987925.db2.gz	QWNZUBFGTWXJAR-CHWSQXEVSA-N	1	0	298.452	1.378	50	0		CDAARO
Cn1ccc(C(=O)N[C@@H]2C[C@H]([NH+](C)C)C23CCC3)n1	ZINC000585127617	931011761	/nfs/dbraw/zinc/01/17/61/931011761.db2.gz	FMEVUGRAGYXFMJ-NEPJUHHUSA-N	1	0	262.357	1.023	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CN1CCC(c2nnc[nH]2)CC1	ZINC000243893005	937583607	/nfs/dbraw/zinc/58/36/07/937583607.db2.gz	ANJNSDVIPKNAPN-ZDUSSCGKSA-N	1	0	263.389	1.468	50	0		CDAARO
Cn1ccnc1CC[N@@H+]1CCC[C@H](c2cc(=O)[nH]cn2)C1	ZINC001506402448	975150600	/nfs/dbraw/zinc/15/06/00/975150600.db2.gz	NOXRADWJASNUSB-LBPRGKRZSA-N	1	0	287.367	1.338	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]Cc2nnc3ccccn32)n1	ZINC001506405838	975152200	/nfs/dbraw/zinc/15/22/00/975152200.db2.gz	ICVRNTSHMTZVND-LBPRGKRZSA-N	1	0	284.367	1.721	50	0		CDAARO
CC[C@H](OC)C(=O)Nc1nnc(CC[NH+](C)C)s1	ZINC001506407418	975152562	/nfs/dbraw/zinc/15/25/62/975152562.db2.gz	RWLJHLLEFVMBKO-QMMMGPOBSA-N	1	0	272.374	1.006	50	0		CDAARO
OC[C@H](C[NH2+]C1CSCCSC1)Cc1ccco1	ZINC001506410497	975152790	/nfs/dbraw/zinc/15/27/90/975152790.db2.gz	UHSTXQCQJJVGMS-NSHDSACASA-N	1	0	287.450	1.869	50	0		CDAARO
CC(C)=CCC[N@H+]1CCCN(CC(=O)N(C)C)CC1	ZINC001506412809	975154796	/nfs/dbraw/zinc/15/47/96/975154796.db2.gz	FJNIUQBKCXTGPM-UHFFFAOYSA-N	1	0	267.417	1.439	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H]1CN(c1cc(C(N)=O)ccn1)C2	ZINC001506421589	975158191	/nfs/dbraw/zinc/15/81/91/975158191.db2.gz	KBAKUHNMOHTQGS-AAEUAGOBSA-N	1	0	274.368	1.101	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1ncccc1C(N)=O	ZINC001506424204	975159252	/nfs/dbraw/zinc/15/92/52/975159252.db2.gz	ZIXZNKJJCRWOOW-NSHDSACASA-N	1	0	262.357	1.467	50	0		CDAARO
CCc1c(C)noc1NC(=O)[C@@H]([NH3+])CCSC	ZINC001506427261	975160997	/nfs/dbraw/zinc/16/09/97/975160997.db2.gz	LHZRSDVCIIGGIA-VIFPVBQESA-N	1	0	257.359	1.564	50	0		CDAARO
C(C1CC1)N1CC[NH+](C2CSCCSC2)CC1	ZINC001506430400	975161945	/nfs/dbraw/zinc/16/19/45/975161945.db2.gz	ZZTMHBDKGPZSPA-UHFFFAOYSA-N	1	0	272.483	1.863	50	0		CDAARO
C[C@H]([NH2+]CC(=O)N1CCC(C)CC1)C1CCOCC1	ZINC000096492014	230382790	/nfs/dbraw/zinc/38/27/90/230382790.db2.gz	DQLKYYFJCWLOHB-ZDUSSCGKSA-N	1	0	268.401	1.650	50	0		CDAARO
CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@@H](C)O)C1	ZINC000192444853	342467995	/nfs/dbraw/zinc/46/79/95/342467995.db2.gz	ICYDOALFAYLIBQ-OLZOCXBDSA-N	1	0	285.432	1.567	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)CCOc1ccc(F)cc1	ZINC000124396575	187135976	/nfs/dbraw/zinc/13/59/76/187135976.db2.gz	WOKAWRHZDNLJGW-LLVKDONJSA-N	1	0	266.316	1.415	50	0		CDAARO
COc1cccn(C[C@@H]2CC[N@@H+](C(C)C)C2)c1=O	ZINC000095529116	185005219	/nfs/dbraw/zinc/00/52/19/185005219.db2.gz	PLYYYMFIMWNHDP-GFCCVEGCSA-N	1	0	250.342	1.587	50	0		CDAARO
CC(C)c1ccc([C@@H]([NH3+])CNS(C)(=O)=O)cc1	ZINC000095972610	185049225	/nfs/dbraw/zinc/04/92/25/185049225.db2.gz	MTPVEGLFMUSMEF-LBPRGKRZSA-N	1	0	256.371	1.359	50	0		CDAARO
O=C1[C@H]([NH2+][C@H]2CCOC2)CCN1CCCc1ccccc1	ZINC000095983713	185054425	/nfs/dbraw/zinc/05/44/25/185054425.db2.gz	RPSWKEMQYYHKNI-JKSUJKDBSA-N	1	0	288.391	1.599	50	0		CDAARO
C[C@@H]1[C@@H](NC(=O)c2cc(-c3ccco3)n[nH]2)CCC[N@@H+]1C	ZINC000096010244	185064519	/nfs/dbraw/zinc/06/45/19/185064519.db2.gz	CMQDWAOFWFXWCP-MNOVXSKESA-N	1	0	288.351	1.882	50	0		CDAARO
CCCC[N@H+](C)CCNC(=O)N1CCO[C@@H](C)[C@H]1C	ZINC000241588418	361753283	/nfs/dbraw/zinc/75/32/83/361753283.db2.gz	PDAJBIUDMKJSQW-OLZOCXBDSA-N	1	0	271.405	1.537	50	0		CDAARO
O=C(C[C@H]1CCCO1)N1CCC[C@H]1C1CC[NH2+]CC1	ZINC000087212163	539086992	/nfs/dbraw/zinc/08/69/92/539086992.db2.gz	ILRKOBGDQHCLNE-KGLIPLIRSA-N	1	0	266.385	1.546	50	0		CDAARO
COc1ccccc1/C=C/C[N@H+](C[C@@H](C)O)C[C@H](C)O	ZINC000012383469	342050787	/nfs/dbraw/zinc/05/07/87/342050787.db2.gz	OJFZEASPESTSEJ-FZBZROKSSA-N	1	0	279.380	1.772	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)[C@H](C)Cc1ccccc1Cl	ZINC000195553988	342625821	/nfs/dbraw/zinc/62/58/21/342625821.db2.gz	SBSGREQCZXQENQ-SWHYSGLUSA-N	1	0	296.798	1.622	50	0		CDAARO
CCCc1nn(CCC[NH+]2CCCCC2)c(=O)o1	ZINC000195576229	342628829	/nfs/dbraw/zinc/62/88/29/342628829.db2.gz	SKZJLNILVILMNA-UHFFFAOYSA-N	1	0	253.346	1.665	50	0		CDAARO
[NH3+]Cc1cc(C(=O)N[C@@H]2CCC[C@@H]3OCC[C@H]32)co1	ZINC000249067883	361836716	/nfs/dbraw/zinc/83/67/16/361836716.db2.gz	JKCHHYXZWKSVSL-XQQFMLRXSA-N	1	0	264.325	1.426	50	0		CDAARO
CNC(=O)[C@H]1CCCC[N@@H+]1CCC(=O)Nc1cccnc1	ZINC000244796083	361864853	/nfs/dbraw/zinc/86/48/53/361864853.db2.gz	RSLFWINVJFEKKO-CYBMUJFWSA-N	1	0	290.367	1.011	50	0		CDAARO
Cn1cc(CCNc2cc([C@H]3C[C@@H]([NH3+])C3)ncn2)cn1	ZINC000244712733	361858743	/nfs/dbraw/zinc/85/87/43/361858743.db2.gz	KVWVJYPRHBCLBE-TXEJJXNPSA-N	1	0	272.356	1.069	50	0		CDAARO
COC1CCN(CC[NH2+][C@@H](C)c2cccnc2)CC1	ZINC000092766916	361927401	/nfs/dbraw/zinc/92/74/01/361927401.db2.gz	ZKXBRLUBNVCCCE-ZDUSSCGKSA-N	1	0	263.385	1.843	50	0		CDAARO
C[C@@H]1CC[NH2+][C@@H](C)[C@H]1NC(=O)CCc1ccon1	ZINC000585136702	342216089	/nfs/dbraw/zinc/21/60/89/342216089.db2.gz	PXCILHJJNGFJOY-NRUUGDAUSA-N	1	0	251.330	1.110	50	0		CDAARO
C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)C[C@H]1CSCCS1	ZINC000245339214	539041486	/nfs/dbraw/zinc/04/14/86/539041486.db2.gz	RFGFFKOVVZHFNM-UTUOFQBUSA-N	1	0	288.482	1.776	50	0		CDAARO
C[C@@H]1C[C@@H](NCc2ccc3[nH]c(=O)[nH]c3c2)CC[N@@H+]1C	ZINC000585139879	342218583	/nfs/dbraw/zinc/21/85/83/342218583.db2.gz	GXSHNWUNOQWPRM-PWSUYJOCSA-N	1	0	274.368	1.841	50	0		CDAARO
[NH3+]CCCn1cc(-c2cncc(Br)c2)nn1	ZINC000125200261	539083580	/nfs/dbraw/zinc/08/35/80/539083580.db2.gz	QCKCZYNKAKWUNK-UHFFFAOYSA-N	1	0	282.145	1.451	50	0		CDAARO
NC(=O)C1([NH2+]Cc2ccc(OC[C@H]3CCCO3)cc2)CC1	ZINC000183820430	539145444	/nfs/dbraw/zinc/14/54/44/539145444.db2.gz	FKRQACTYHOBEQE-CQSZACIVSA-N	1	0	290.363	1.352	50	0		CDAARO
CCC[NH+]1CCN(C(=O)c2c[nH]c(=O)c(Cl)c2)CC1	ZINC000054056898	539160614	/nfs/dbraw/zinc/16/06/14/539160614.db2.gz	COSHDEIBJVWFFA-UHFFFAOYSA-N	1	0	283.759	1.196	50	0		CDAARO
CS(=O)(=O)N1CCC[C@@H]([NH2+]C[C@H]2CC=CCC2)C1	ZINC000095433928	342431727	/nfs/dbraw/zinc/43/17/27/342431727.db2.gz	OHUFSIHPLHFGNN-QWHCGFSZSA-N	1	0	272.414	1.356	50	0		CDAARO
C[N@@H+]1CC[C@@H]2CCN(C(=O)Nc3nccs3)[C@@H]2C1	ZINC000095995028	342431885	/nfs/dbraw/zinc/43/18/85/342431885.db2.gz	YIIYOZHSONORBC-NXEZZACHSA-N	1	0	266.370	1.701	50	0		CDAARO
Cc1cnn(-c2ccc(C(=O)N3CC[C@H](C[NH3+])C3)cc2)c1	ZINC000178540765	362244918	/nfs/dbraw/zinc/24/49/18/362244918.db2.gz	LBRLPZRDEHYEMZ-CYBMUJFWSA-N	1	0	284.363	1.602	50	0		CDAARO
CC(C)(O)CNC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1	ZINC000084326007	362262730	/nfs/dbraw/zinc/26/27/30/362262730.db2.gz	WAOIKLBQAPICMK-LBPRGKRZSA-N	1	0	254.374	1.281	50	0		CDAARO
CCCNc1ccccc1NC(=O)[C@@H]1CN(C)CCO1	ZINC000190140843	362338087	/nfs/dbraw/zinc/33/80/87/362338087.db2.gz	ZKURXMRHXKSOAK-AWEZNQCLSA-N	1	0	277.368	1.778	50	0		CDAARO
C[NH+]1CCC(CCC(=O)NCCc2cccc(=O)[nH]2)CC1	ZINC000426387613	530048745	/nfs/dbraw/zinc/04/87/45/530048745.db2.gz	HNLMAOCAILVIMC-UHFFFAOYSA-N	1	0	291.395	1.568	50	0		CDAARO
O=C(Cc1ccccc1)Nc1ccnn1C1CC[NH2+]CC1	ZINC000601012399	345006407	/nfs/dbraw/zinc/00/64/07/345006407.db2.gz	FNDMUIWAKNYHAF-UHFFFAOYSA-N	1	0	284.363	1.989	50	0		CDAARO
C[C@@H]1OCC[C@H]1[NH2+]C(C)(C)C(=O)NCC1CCCC1	ZINC000097038413	185510888	/nfs/dbraw/zinc/51/08/88/185510888.db2.gz	FQAWYFXJPXQMLB-WCQYABFASA-N	1	0	268.401	1.838	50	0		CDAARO
CCCC[C@H](C(N)=O)[N@@H+]1CCC[C@@H]1[C@@H]1CCCN1C(C)=O	ZINC000095381626	345116588	/nfs/dbraw/zinc/11/65/88/345116588.db2.gz	DZJJBYHRPXAQOC-RRFJBIMHSA-N	1	0	295.427	1.506	50	0		CDAARO
Cc1ccc(Cl)c(O[C@H](C)C(=O)N[C@H]2CC[NH2+]C2)c1	ZINC000127554372	187315089	/nfs/dbraw/zinc/31/50/89/187315089.db2.gz	DMKJWGPVLUJZNC-MNOVXSKESA-N	1	0	282.771	1.894	50	0		CDAARO
Cc1cccc(-c2ncnc(N3CC[NH+](C)CC3)c2N)c1	ZINC000096282109	136519990	/nfs/dbraw/zinc/51/99/90/136519990.db2.gz	WUIKAEUWLIVUQR-UHFFFAOYSA-N	1	0	283.379	1.786	50	0		CDAARO
Cn1cc([C@@H]2OCC[C@H]2C[NH2+]C2CCSCC2)cn1	ZINC000089755279	347612131	/nfs/dbraw/zinc/61/21/31/347612131.db2.gz	CDPJRLBBJYIPRA-SMDDNHRTSA-N	1	0	281.425	1.983	50	0		CDAARO
CCc1cc(N2CC[NH+]([C@@H]3CCSC3)CC2)ncn1	ZINC000584884922	349343442	/nfs/dbraw/zinc/34/34/42/349343442.db2.gz	BBLGQKNPUKFFPN-CYBMUJFWSA-N	1	0	278.425	1.667	50	0		CDAARO
COCC1(CNC(=O)[C@@H]2CC23CC[NH2+]CC3)CCCC1	ZINC000584888872	349347419	/nfs/dbraw/zinc/34/74/19/349347419.db2.gz	NWNRNVWWOFSDDC-ZDUSSCGKSA-N	1	0	280.412	1.699	50	0		CDAARO
C[C@@H](NC1CC[NH+](Cc2ccco2)CC1)c1ncnn1C	ZINC000584895481	349355926	/nfs/dbraw/zinc/35/59/26/349355926.db2.gz	KLEJXGREYUTABD-GFCCVEGCSA-N	1	0	289.383	1.723	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CC2(CO)CCOCC2)n1	ZINC000584899015	349360486	/nfs/dbraw/zinc/36/04/86/349360486.db2.gz	PGJLFBBNHBUXMZ-CYBMUJFWSA-N	1	0	281.400	1.267	50	0		CDAARO
O=C(Nc1ccc(OC(F)(F)F)cc1)C1C[NH2+]C1	ZINC000090035449	179908842	/nfs/dbraw/zinc/90/88/42/179908842.db2.gz	OVUAOFIHYJSQON-UHFFFAOYSA-N	1	0	260.215	1.743	50	0		CDAARO
Cc1noc(C)c1C(=O)N1CCCSC[C@H]1C[NH+](C)C	ZINC000090700193	180027720	/nfs/dbraw/zinc/02/77/20/180027720.db2.gz	JYDIMUBTRBKNHC-GFCCVEGCSA-N	1	0	297.424	1.801	50	0		CDAARO
CN(C)c1cccc(C(=O)N2C[C@H]3CC[C@H](C[N@H+]3C)C2)c1	ZINC000091365216	180142127	/nfs/dbraw/zinc/14/21/27/180142127.db2.gz	MYCRNSHJTQWWMQ-CZUORRHYSA-N	1	0	287.407	1.919	50	0		CDAARO
COC(=O)c1ccc([C@H](C)[N@@H+]2CC[C@H](CO)C2)o1	ZINC000091580868	180199021	/nfs/dbraw/zinc/19/90/21/180199021.db2.gz	FVHYPWRDZVATQR-UWVGGRQHSA-N	1	0	253.298	1.441	50	0		CDAARO
Cc1cc[nH+]c(NCCN2C[C@]3(CCOC3)CCC2=O)c1	ZINC000091664845	180220862	/nfs/dbraw/zinc/22/08/62/180220862.db2.gz	GLFZTVGJCQDCDH-MRXNPFEDSA-N	1	0	289.379	1.831	50	0		CDAARO
Cc1cnn(CCNC(=O)CC[C@H]2CCC[N@@H+](C)C2)c1	ZINC000091713324	180231214	/nfs/dbraw/zinc/23/12/14/180231214.db2.gz	SZQZPJLUNPGSAT-CQSZACIVSA-N	1	0	278.400	1.430	50	0		CDAARO
CSCC(=O)N1C[C@H]([NH3+])[C@@H](c2ccc(C)o2)C1	ZINC000091737972	180243712	/nfs/dbraw/zinc/24/37/12/180243712.db2.gz	SSSGECATILRFFE-UWVGGRQHSA-N	1	0	254.355	1.204	50	0		CDAARO
CCOc1ccc(CC(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)cc1	ZINC000091943911	180290312	/nfs/dbraw/zinc/29/03/12/180290312.db2.gz	WJYMHBJZCLJJMS-CVEARBPZSA-N	1	0	288.391	1.824	50	0		CDAARO
O[C@@H](Cn1cccn1)C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1	ZINC000106107124	186102261	/nfs/dbraw/zinc/10/22/61/186102261.db2.gz	AAEAUHRZMQCGTD-RBSFLKMASA-N	1	0	263.385	1.756	50	0		CDAARO
Cc1cnn([C@H](C)[C@H](C)[NH2+][C@H](C)C(=O)N2CCCC2)c1	ZINC000106669186	186130544	/nfs/dbraw/zinc/13/05/44/186130544.db2.gz	BBBVQDNRUWSLAN-BFHYXJOUSA-N	1	0	278.400	1.742	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(NCc2csc(N)n2)c1C	ZINC000065489813	363289107	/nfs/dbraw/zinc/28/91/07/363289107.db2.gz	MZYRLFIAWDSTRG-UHFFFAOYSA-N	1	0	278.385	1.810	50	0		CDAARO
C[C@@H](C(=O)Nc1ccccc1)[N@@H+]1CCC[C@@H](C(N)=O)C1	ZINC000013116949	358491128	/nfs/dbraw/zinc/49/11/28/358491128.db2.gz	ROPNVYRSPYBUGY-NWDGAFQWSA-N	1	0	275.352	1.211	50	0		CDAARO
CC(=O)O[C@H]1CSc2n(C)c3ccccc3[n+]2C1	ZINC000000432644	355910877	/nfs/dbraw/zinc/91/08/77/355910877.db2.gz	YTQDXMMOEXRDMZ-SNVBAGLBSA-N	1	0	263.342	1.503	50	0		CDAARO
Cc1cc(Cl)c(N2CC[NH2+]CC2)cc1S(C)(=O)=O	ZINC000000154110	355891581	/nfs/dbraw/zinc/89/15/81/355891581.db2.gz	IOKUKMHISOHDDU-UHFFFAOYSA-N	1	0	288.800	1.462	50	0		CDAARO
COc1ccc(CC[NH2+]Cc2cnn(C)c2)cc1OC	ZINC000002536438	355973432	/nfs/dbraw/zinc/97/34/32/355973432.db2.gz	VERBIGHHZHOEEN-UHFFFAOYSA-N	1	0	275.352	1.770	50	0		CDAARO
OCC[NH2+]CCOCCOc1ccc(Cl)cc1	ZINC000002981134	355990158	/nfs/dbraw/zinc/99/01/58/355990158.db2.gz	MBEQJQWNKPAFBU-UHFFFAOYSA-N	1	0	259.733	1.317	50	0		CDAARO
CC[NH2+]CC(=O)Nc1ccc(Br)cc1	ZINC000003287181	355998338	/nfs/dbraw/zinc/99/83/38/355998338.db2.gz	NNHHHIOJLWFPBX-UHFFFAOYSA-N	1	0	257.131	1.997	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C1CCN(C(=O)C(C)C)CC1	ZINC000037142675	363459688	/nfs/dbraw/zinc/45/96/88/363459688.db2.gz	YOYDODNLHLVHTB-UHFFFAOYSA-N	1	0	264.373	1.455	50	0		CDAARO
Cc1c(-c2cc(C(F)(F)F)nn2CCC[NH3+])cnn1C	ZINC000012396005	356297424	/nfs/dbraw/zinc/29/74/24/356297424.db2.gz	PPEPMGYYGOOAGJ-UHFFFAOYSA-N	1	0	287.289	1.960	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)c1ccc(Cl)c(F)c1	ZINC000195554067	363462263	/nfs/dbraw/zinc/46/22/63/363462263.db2.gz	ZWSXYRZJTSTVLH-QWRGUYRKSA-N	1	0	272.707	1.196	50	0		CDAARO
NC(=O)CSc1n[nH]cc2c3cc(F)ccc3nc1-2	ZINC000032752883	356358683	/nfs/dbraw/zinc/35/86/83/356358683.db2.gz	HXRLJFRMSWELQM-UHFFFAOYSA-N	1	0	276.296	1.828	50	0		CDAARO
CN(Cc1ccc2ccccc2c1)Cc1nc(N)nc(N)n1	ZINC000032751468	356358953	/nfs/dbraw/zinc/35/89/53/356358953.db2.gz	PNXPPMPSHSHRAZ-UHFFFAOYSA-N	1	0	294.362	1.821	50	0		CDAARO
C[C@@H]1CN(c2ccc(S(C)(=O)=O)cc2F)CC[NH2+]1	ZINC000015443656	356416666	/nfs/dbraw/zinc/41/66/66/356416666.db2.gz	GIUNKEHKYNKZGE-SECBINFHSA-N	1	0	272.345	1.027	50	0		CDAARO
NC(=O)CC[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2	ZINC000016344657	356436861	/nfs/dbraw/zinc/43/68/61/356436861.db2.gz	SPRIQBWEEGSRDV-ZDUSSCGKSA-N	1	0	290.363	1.860	50	0		CDAARO
CCOc1c(C[NH2+]CCN2CCOCC2)cccc1OC	ZINC000019370668	356482504	/nfs/dbraw/zinc/48/25/04/356482504.db2.gz	LASKUZJJSWKSJM-UHFFFAOYSA-N	1	0	294.395	1.516	50	0		CDAARO
C[NH+]1CCN(CCC(=O)Nc2ccccc2F)CC1	ZINC000019590029	356493300	/nfs/dbraw/zinc/49/33/00/356493300.db2.gz	PLPVSFIRDWSXLH-UHFFFAOYSA-N	1	0	265.332	1.402	50	0		CDAARO
COc1ccc(N2C(=O)C[C@@H]([NH2+]C3CCCC3)C2=O)cc1	ZINC000019790629	356503740	/nfs/dbraw/zinc/50/37/40/356503740.db2.gz	KPYXNGHCODTBBE-CQSZACIVSA-N	1	0	288.347	1.859	50	0		CDAARO
CN(C)S(=O)(=O)NCc1ccc(C[NH+]2CCCC2)cc1	ZINC000027961130	356715574	/nfs/dbraw/zinc/71/55/74/356715574.db2.gz	XTZWGZLYYPJVMN-UHFFFAOYSA-N	1	0	297.424	1.178	50	0		CDAARO
CCOC(=O)COc1ccc([C@@H](C)[NH3+])cc1OC	ZINC000032627545	356783585	/nfs/dbraw/zinc/78/35/85/356783585.db2.gz	NWMQAQZETMHQDC-SECBINFHSA-N	1	0	253.298	1.657	50	0		CDAARO
CCc1nnsc1C(=O)N1CCC2(CC[NH2+]CC2)CC1	ZINC000071589559	356919270	/nfs/dbraw/zinc/91/92/70/356919270.db2.gz	SEFLZRBTHCCXEJ-UHFFFAOYSA-N	1	0	294.424	1.706	50	0		CDAARO
[NH3+]Cc1nnc(-c2ccc(Br)cc2)[nH]1	ZINC000054363732	357318669	/nfs/dbraw/zinc/31/86/69/357318669.db2.gz	YCPMYQCFQXLMLH-UHFFFAOYSA-N	1	0	253.103	1.693	50	0		CDAARO
C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]1CCS(=O)(=O)C1	ZINC000095419613	357334197	/nfs/dbraw/zinc/33/41/97/357334197.db2.gz	MYZKRBHRNFAQKZ-WDEREUQCSA-N	1	0	279.471	1.931	50	0		CDAARO
Cn1cc(C[NH2+]Cc2ccc(N3CCCC3=O)cc2)cn1	ZINC000015581107	357454494	/nfs/dbraw/zinc/45/44/94/357454494.db2.gz	MCZDHADTCRJEJR-UHFFFAOYSA-N	1	0	284.363	1.837	50	0		CDAARO
C[NH2+]Cc1n[nH]c(=O)n1-c1ccccc1-c1ccccc1	ZINC000065369773	357532256	/nfs/dbraw/zinc/53/22/56/357532256.db2.gz	ZVTLMWBQQRKJFO-UHFFFAOYSA-N	1	0	280.331	1.947	50	0		CDAARO
CCCn1ncc(C(=O)NCc2ccc(C[NH3+])cc2)c1C	ZINC000065376390	357533497	/nfs/dbraw/zinc/53/34/97/357533497.db2.gz	VOYFCGYEFSBDQG-UHFFFAOYSA-N	1	0	286.379	1.990	50	0		CDAARO
CNc1ccnc(N(C)C[C@@H]2CCC[N@H+](CCOC)C2)n1	ZINC000065396811	357536474	/nfs/dbraw/zinc/53/64/74/357536474.db2.gz	JYUKITHCNMJTRX-ZDUSSCGKSA-N	1	0	293.415	1.313	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]CCSc2nc[nH]n2)CC1	ZINC000065420328	357540038	/nfs/dbraw/zinc/54/00/38/357540038.db2.gz	NKACWMQISXIKJO-UHFFFAOYSA-N	1	0	299.400	1.107	50	0		CDAARO
COC[C@@H](C)[NH2+]CC1(N2CCOCC2)CCCCC1	ZINC000065431216	357541243	/nfs/dbraw/zinc/54/12/43/357541243.db2.gz	LSUSEXQABXELOZ-CQSZACIVSA-N	1	0	270.417	1.646	50	0		CDAARO
Cc1cc(N2CCO[C@@H](C[NH3+])C2)nc(-c2ccccc2)n1	ZINC000065460487	357543234	/nfs/dbraw/zinc/54/32/34/357543234.db2.gz	GPXWEWGKQVMWII-AWEZNQCLSA-N	1	0	284.363	1.616	50	0		CDAARO
CN(CCO)C(=O)[C@@H]1CCC[N@@H+](C2CCCCC2)C1	ZINC000065531824	357548336	/nfs/dbraw/zinc/54/83/36/357548336.db2.gz	AELQOWYMFNMFSW-CYBMUJFWSA-N	1	0	268.401	1.482	50	0		CDAARO
NC(=O)CC[N@@H+]1CCc2[nH]nc(-c3ccccc3F)c2C1	ZINC000067674820	357618224	/nfs/dbraw/zinc/61/82/24/357618224.db2.gz	LLYHKKJFDUNBSN-UHFFFAOYSA-N	1	0	288.326	1.449	50	0		CDAARO
COc1ccc2[nH]c(C[NH2+][C@@H](C)Cn3ccnc3)nc2c1	ZINC000067724481	357621487	/nfs/dbraw/zinc/62/14/87/357621487.db2.gz	SLHJFNVHNOGVOR-NSHDSACASA-N	1	0	285.351	1.946	50	0		CDAARO
COc1ccccc1OCC(=O)NCC1CC[NH+](C)CC1	ZINC000023013833	357646234	/nfs/dbraw/zinc/64/62/34/357646234.db2.gz	PIRDMUXGWCPMJV-UHFFFAOYSA-N	1	0	292.379	1.532	50	0		CDAARO
OCC1(O)CC[NH+](Cc2ccc(-c3cc[nH]n3)s2)CC1	ZINC000067878329	357634219	/nfs/dbraw/zinc/63/42/19/357634219.db2.gz	QKWYEUNZBWRBDZ-UHFFFAOYSA-N	1	0	293.392	1.457	50	0		CDAARO
CC(C)c1nccc(CN2CCC[C@](O)(C[NH+](C)C)C2)n1	ZINC000072426452	357834683	/nfs/dbraw/zinc/83/46/83/357834683.db2.gz	LUCRZHFPGAYSHQ-INIZCTEOSA-N	1	0	292.427	1.489	50	0		CDAARO
[NH3+]Cc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1	ZINC000075662219	357954607	/nfs/dbraw/zinc/95/46/07/357954607.db2.gz	UOUYBVGEQIDDMW-UHFFFAOYSA-N	1	0	259.309	1.514	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@H](C)c1ccc(C)o1	ZINC000097111301	357986437	/nfs/dbraw/zinc/98/64/37/357986437.db2.gz	FHHSFXBDEZGMJX-SNVBAGLBSA-N	1	0	260.359	1.178	50	0		CDAARO
CCCc1cc(NC(=O)N2CCC[N@H+](C)CC2)n(C)n1	ZINC000097235705	358050492	/nfs/dbraw/zinc/05/04/92/358050492.db2.gz	VOCKQSPPRRZUJX-UHFFFAOYSA-N	1	0	279.388	1.542	50	0		CDAARO
Cc1cc2ncc([C@H](C)[NH2+][C@@H]3C=C[C@H](CO)C3)c(C)n2n1	ZINC000195558626	358564525	/nfs/dbraw/zinc/56/45/25/358564525.db2.gz	XXFVQPVDNZNPPC-FPMFFAJLSA-N	1	0	286.379	1.934	50	0		CDAARO
CCCCSc1nc(N)cc(N[C@@H]2CC[NH2+]C[C@H]2O)n1	ZINC000095360386	358684257	/nfs/dbraw/zinc/68/42/57/358684257.db2.gz	VRJRQOMIHRKRIA-NXEZZACHSA-N	1	0	297.428	1.086	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1C1CN(C(=O)c2cc(C3CC3)n[nH]2)C1	ZINC000095362933	358685479	/nfs/dbraw/zinc/68/54/79/358685479.db2.gz	KYQBLAUDROWPTF-NSHDSACASA-N	1	0	288.395	1.986	50	0		CDAARO
C[N@@H+]1CCC[C@@H](Cn2c(=O)cnc3ccccc32)C1	ZINC000095379374	358689302	/nfs/dbraw/zinc/68/93/02/358689302.db2.gz	IQUCAXHUEXKDMS-GFCCVEGCSA-N	1	0	257.337	1.738	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1CC(=O)NCCNc1cccnc1	ZINC000097394011	358772981	/nfs/dbraw/zinc/77/29/81/358772981.db2.gz	VNINAVWPEKPVBA-CYBMUJFWSA-N	1	0	262.357	1.094	50	0		CDAARO
c1cncc(-n2nc(C3CCOCC3)nc2[C@H]2CCC[NH2+]2)c1	ZINC000097475414	358779181	/nfs/dbraw/zinc/77/91/81/358779181.db2.gz	LHQACXGVVBFIHJ-CQSZACIVSA-N	1	0	299.378	1.981	50	0		CDAARO
[NH3+]C[C@@H]1CCCCN1C(=O)c1ccccc1-n1cnnc1	ZINC000097480178	358780049	/nfs/dbraw/zinc/78/00/49/358780049.db2.gz	DPXNQLNTYGOQNW-LBPRGKRZSA-N	1	0	285.351	1.221	50	0		CDAARO
Cc1nccn1CC[N@@H+](C)Cc1cnc(NC(C)C)nc1	ZINC000215395655	358886899	/nfs/dbraw/zinc/88/68/99/358886899.db2.gz	NHMOIVKUMTZAQU-UHFFFAOYSA-N	1	0	288.399	1.934	50	0		CDAARO
O=C(Cc1ccccc1Br)N1CC[NH2+]CC1	ZINC000084683049	358959979	/nfs/dbraw/zinc/95/99/79/358959979.db2.gz	SPGXPPOPRLIXSZ-UHFFFAOYSA-N	1	0	283.169	1.423	50	0		CDAARO
CCNC(=O)NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1C	ZINC000012775848	359004607	/nfs/dbraw/zinc/00/46/07/359004607.db2.gz	KEEOPGVHSKSFMK-RYUDHWBXSA-N	1	0	277.368	1.880	50	0		CDAARO
C[C@@H](CNC(=O)c1cnc2ccccc2n1)n1ccnc1	ZINC000219522573	359102917	/nfs/dbraw/zinc/10/29/17/359102917.db2.gz	OJMLAPDRORBQBK-NSHDSACASA-N	1	0	281.319	1.817	50	0		CDAARO
O=C([C@@H](O)Cc1ccccc1)N1CC([NH+]2CCCCC2)C1	ZINC000222672754	359364569	/nfs/dbraw/zinc/36/45/69/359364569.db2.gz	JOONMBAFYIPGED-INIZCTEOSA-N	1	0	288.391	1.287	50	0		CDAARO
CCCn1cc(CNC(=O)C[NH+]2CCCC2)cn1	ZINC000223448234	359426480	/nfs/dbraw/zinc/42/64/80/359426480.db2.gz	AJVAELMECDDPPL-UHFFFAOYSA-N	1	0	250.346	1.005	50	0		CDAARO
CCCCOCC(=O)N1CCN(c2cc[nH+]c(C)c2)CC1	ZINC000223010557	359392735	/nfs/dbraw/zinc/39/27/35/359392735.db2.gz	SZCNCSSKUQWOEZ-UHFFFAOYSA-N	1	0	291.395	1.855	50	0		CDAARO
Cc1nc(CCN(C)C(=O)CC[N@@H+]2C[C@@H]3CC[C@H]2C3)no1	ZINC000223660495	359444425	/nfs/dbraw/zinc/44/44/25/359444425.db2.gz	KWEYSVLBZOUKDB-OLZOCXBDSA-N	1	0	292.383	1.253	50	0		CDAARO
NC(=O)c1ccc[n+](-c2ccc(Br)cc2)c1	ZINC000000343395	359548991	/nfs/dbraw/zinc/54/89/91/359548991.db2.gz	SYCGGYNPTVKBOJ-UHFFFAOYSA-O	1	0	278.129	1.825	50	0		CDAARO
c1cc(CN2CC[C@]3(CC[NH2+]C3)C2)c2c(c1)OCCO2	ZINC000261943030	359592177	/nfs/dbraw/zinc/59/21/77/359592177.db2.gz	DZSWMFWNFBXRIO-INIZCTEOSA-N	1	0	274.364	1.643	50	0		CDAARO
Cc1ccc(O)c(C(=O)N2CC[C@H]3CC[C@@H](C2)[NH2+]3)c1	ZINC000065399108	360093995	/nfs/dbraw/zinc/09/39/95/360093995.db2.gz	ZAIAEPXOYIBECJ-NEPJUHHUSA-N	1	0	260.337	1.667	50	0		CDAARO
CCCCNC(=O)C[N@H+](C)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C	ZINC000248139677	360402169	/nfs/dbraw/zinc/40/21/69/360402169.db2.gz	BIBJTIVMFSUSRC-BNOWGMLFSA-N	1	0	268.401	1.648	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)COCC1CC1	ZINC000248161100	360414972	/nfs/dbraw/zinc/41/49/72/360414972.db2.gz	XNUWMFQFZFQJSD-ZIAGYGMSSA-N	1	0	266.385	1.498	50	0		CDAARO
COCCN1CC[N@H+](Cc2cccc(C)c2)CCC1=O	ZINC000012003159	360498688	/nfs/dbraw/zinc/49/86/88/360498688.db2.gz	MVCDVDNRKLRTBO-UHFFFAOYSA-N	1	0	276.380	1.676	50	0		CDAARO
O=C(c1cc(Cl)c[nH]1)N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000426501760	360677939	/nfs/dbraw/zinc/67/79/39/360677939.db2.gz	LWYFLWMEZQSZTH-SKWLPYGWSA-N	1	0	265.744	1.491	50	0		CDAARO
Cn1ccc(C(=O)NC[C@@H]2CC[N@@H+](C3CCCCC3)C2)n1	ZINC000426541484	360682240	/nfs/dbraw/zinc/68/22/40/360682240.db2.gz	PNDBXGMXQBYYHM-ZDUSSCGKSA-N	1	0	290.411	1.805	50	0		CDAARO
O=C(CCc1cn[nH]c1)NC1CC[NH+](C2CCCC2)CC1	ZINC000426621887	360690014	/nfs/dbraw/zinc/69/00/14/360690014.db2.gz	ZFENKIRVAVUDIL-UHFFFAOYSA-N	1	0	290.411	1.866	50	0		CDAARO
Cc1cccn2c(F)c(C(=O)NCc3nccn3C)nc12	ZINC000426369836	360659863	/nfs/dbraw/zinc/65/98/63/360659863.db2.gz	BXKQUMOWQTVQGE-UHFFFAOYSA-N	1	0	287.298	1.445	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)/C=C/c2c(F)cccc2F)C1	ZINC000178538932	189125436	/nfs/dbraw/zinc/12/54/36/189125436.db2.gz	VNGMZBHCFYBFKI-ORAHPGNNSA-N	1	0	266.291	1.785	50	0		CDAARO
Cc1cc(C)c(OCC(=O)N2CC[C@H](C[NH3+])C2)c(C)c1	ZINC000178566040	189127684	/nfs/dbraw/zinc/12/76/84/189127684.db2.gz	OWKQMLGOBQSHSQ-CQSZACIVSA-N	1	0	276.380	1.798	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2ccc3nccn3c2)C1	ZINC000178982864	189159682	/nfs/dbraw/zinc/15/96/82/189159682.db2.gz	HUIGQSMURBRHPU-NSHDSACASA-N	1	0	258.325	1.016	50	0		CDAARO
CN1CCCN(S(=O)(=O)c2ccccc2F)CC1	ZINC000035085322	361226091	/nfs/dbraw/zinc/22/60/91/361226091.db2.gz	OCXBHEQEVZYNGC-UHFFFAOYSA-N	1	0	272.345	1.152	50	0		CDAARO
Cc1cnc(C(=O)N2CC[C@H](Oc3ccncc3)C2)cn1	ZINC000121170771	361284274	/nfs/dbraw/zinc/28/42/74/361284274.db2.gz	ITNCSLJWTOIJSI-ZDUSSCGKSA-N	1	0	284.319	1.474	50	0		CDAARO
COc1ccccc1OCC(=O)NCCC[NH+]1CCCC1	ZINC000013672965	361414329	/nfs/dbraw/zinc/41/43/29/361414329.db2.gz	INDALOBYKDIIHA-UHFFFAOYSA-N	1	0	292.379	1.676	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N2CCC(C[NH3+])CC2)c1	ZINC000036296758	361461040	/nfs/dbraw/zinc/46/10/40/361461040.db2.gz	CDXRGVUOCONQBT-UHFFFAOYSA-N	1	0	286.372	1.494	50	0		CDAARO
CNC(=O)CN1CCC([NH2+][C@@H]2CC(C)(C)C[C@H]2C)CC1	ZINC000192390568	361658182	/nfs/dbraw/zinc/65/81/82/361658182.db2.gz	HSMCYSGKMPADFU-TZMCWYRMSA-N	1	0	281.444	1.611	50	0		CDAARO
CC(=O)c1ccc(N2CCN(C[C@@H](C)O)C[C@H]2C)nc1	ZINC000192799440	363995378	/nfs/dbraw/zinc/99/53/78/363995378.db2.gz	JALYUSJFNXSZPO-VXGBXAGGSA-N	1	0	277.368	1.176	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1CCC[C@@H](C(C)(C)C(=O)OC)C1	ZINC000093298007	364404804	/nfs/dbraw/zinc/40/48/04/364404804.db2.gz	YIVYIIJBQIDVHB-VXGBXAGGSA-N	1	0	257.374	1.669	50	0		CDAARO
C[C@H]1CCCN(C(=O)COCc2ccccc2)[C@@H]1C[NH3+]	ZINC000179223992	364988656	/nfs/dbraw/zinc/98/86/56/364988656.db2.gz	UHCUIRKGARCZSB-DZGCQCFKSA-N	1	0	276.380	1.789	50	0		CDAARO
C[C@@H](C1CC1)[N@H+](CC(=O)NC(=O)NC1CC1)C1CC1	ZINC000031654649	365242156	/nfs/dbraw/zinc/24/21/56/365242156.db2.gz	SGVOLZCBOLAOAX-VIFPVBQESA-N	1	0	265.357	1.238	50	0		CDAARO
O=C(C[C@@H]1C[NH2+]CCO1)N1CCC[C@@H]1c1ccccc1	ZINC000091299513	283861409	/nfs/dbraw/zinc/86/14/09/283861409.db2.gz	WMYVKKFCIFSXOQ-HUUCEWRRSA-N	1	0	274.364	1.729	50	0		CDAARO
C[C@@H](C(=O)NCc1ccccc1F)N1CC[N@H+](C)C[C@@H]1C	ZINC000089938891	366972120	/nfs/dbraw/zinc/97/21/20/366972120.db2.gz	HZQYFSLSFFMKDW-STQMWFEESA-N	1	0	293.386	1.466	50	0		CDAARO
CC[C@H](C(=O)NCc1cnn(C)c1)[NH+](CC)CC	ZINC000089941889	366974477	/nfs/dbraw/zinc/97/44/77/366974477.db2.gz	JBCGNLNWXLEJRF-GFCCVEGCSA-N	1	0	252.362	1.157	50	0		CDAARO
O=C(NC1(c2ccccc2)CCC1)[C@]1(F)CC[NH2+]C1	ZINC000253432205	283913090	/nfs/dbraw/zinc/91/30/90/283913090.db2.gz	JEUMUEQRSPYCAZ-AWEZNQCLSA-N	1	0	262.328	1.884	50	0		CDAARO
CCCC[C@H]([NH2+][C@@H]1CCN(C(=O)C2CC2)C[C@H]1C)C(N)=O	ZINC000252517941	367743946	/nfs/dbraw/zinc/74/39/46/367743946.db2.gz	VLLIJJKZNOCNLT-BNOWGMLFSA-N	1	0	295.427	1.267	50	0		CDAARO
O=C([C@H]1C[NH2+]CCO1)N1CCC[C@@H]1Cc1cccc(F)c1	ZINC000178432225	296137750	/nfs/dbraw/zinc/13/77/50/296137750.db2.gz	PBRHLMGNCQBTSJ-HUUCEWRRSA-N	1	0	292.354	1.348	50	0		CDAARO
COc1ccccc1C[NH2+]C[C@@]1(OC)CCOC1	ZINC000122936652	371168536	/nfs/dbraw/zinc/16/85/36/371168536.db2.gz	XMBKFXTYUAZGCQ-AWEZNQCLSA-N	1	0	251.326	1.590	50	0		CDAARO
Cc1nccc(C2CCN(C(=O)C[NH+]3CCCC3)CC2)n1	ZINC000299773195	372751928	/nfs/dbraw/zinc/75/19/28/372751928.db2.gz	DAZBFFDRMCBGRQ-UHFFFAOYSA-N	1	0	288.395	1.587	50	0		CDAARO
Cc1cc(C)cc(NC(=O)NC[C@@]2(O)CC[NH2+]C2)c1	ZINC000299774103	372752007	/nfs/dbraw/zinc/75/20/07/372752007.db2.gz	AFSKKXNPLRFAEG-CQSZACIVSA-N	1	0	263.341	1.149	50	0		CDAARO
Cc1nc(CN2CCN(CC(C)C)C(=O)[C@H]2C)[nH]c1C	ZINC000299781352	372757036	/nfs/dbraw/zinc/75/70/36/372757036.db2.gz	DNUOUGZPEJTBSA-CYBMUJFWSA-N	1	0	278.400	1.715	50	0		CDAARO
C[NH+](C)CC[C@H](NC(=O)C1(CO)CC1)c1ccccc1	ZINC000299794156	372766277	/nfs/dbraw/zinc/76/62/77/372766277.db2.gz	JXJJZRFKVMAEKV-AWEZNQCLSA-N	1	0	276.380	1.568	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@H](CNC(=O)CCc2cn[nH]c2)C1	ZINC000299798391	372769549	/nfs/dbraw/zinc/76/95/49/372769549.db2.gz	RODJATATOMVEQO-CYBMUJFWSA-N	1	0	278.400	1.579	50	0		CDAARO
Cc1nc(-c2cccc(C(=O)N3CCC[C@H]3CO)c2)c[nH]1	ZINC000299800414	372771395	/nfs/dbraw/zinc/77/13/95/372771395.db2.gz	SIXKFFIGTQMKDB-AWEZNQCLSA-N	1	0	285.347	1.982	50	0		CDAARO
O=C([C@H]1CCCO1)N1CCC([NH+]2CCCCC2)CC1	ZINC000058936909	372843998	/nfs/dbraw/zinc/84/39/98/372843998.db2.gz	HBVVLJMOOMYCOQ-CQSZACIVSA-N	1	0	266.385	1.642	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)Cc2ccc(F)cc2F)C1	ZINC000095067596	373707300	/nfs/dbraw/zinc/70/73/00/373707300.db2.gz	BCPUSQIRGLUDIJ-VIFPVBQESA-N	1	0	254.280	1.315	50	0		CDAARO
CC[N@@H+]1CC[C@H]2[C@@H](C1)OCCN2C(=O)Cc1ccsc1	ZINC000253416424	373726739	/nfs/dbraw/zinc/72/67/39/373726739.db2.gz	VXQYEWILSPELCL-UONOGXRCSA-N	1	0	294.420	1.612	50	0		CDAARO
COC[C@](C)(CO)[NH2+]CCC(=O)Nc1cccc(F)c1	ZINC000639955870	373808098	/nfs/dbraw/zinc/80/80/98/373808098.db2.gz	SPIXGSZHZZUKBR-AWEZNQCLSA-N	1	0	284.331	1.141	50	0		CDAARO
Cn1ccsc1=NC(=O)c1ccc(C[NH+](C)C)cc1	ZINC000254293292	374015376	/nfs/dbraw/zinc/01/53/76/374015376.db2.gz	SKMDODCKFXTYGB-UHFFFAOYSA-N	1	0	275.377	1.889	50	0		CDAARO
CC[N@@H+]1CC[C@H](N(C)CC(=O)NCc2cccc(C)c2)C1	ZINC000095395072	374901124	/nfs/dbraw/zinc/90/11/24/374901124.db2.gz	NDCFNWMCWSOXBI-INIZCTEOSA-N	1	0	289.423	1.637	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+]C2CCN(C(N)=O)CC2)C12CCC2	ZINC000095423214	374923610	/nfs/dbraw/zinc/92/36/10/374923610.db2.gz	SWZGEPMRPCSIBZ-CHWSQXEVSA-N	1	0	281.400	1.467	50	0		CDAARO
CCc1noc(CN(C)C(=O)[C@@H]([NH3+])Cc2ccccc2)n1	ZINC000095426497	374927360	/nfs/dbraw/zinc/92/73/60/374927360.db2.gz	GLXPLJFXTFQLBC-LBPRGKRZSA-N	1	0	288.351	1.160	50	0		CDAARO
CCN(Cc1ccccc1)C(=O)[C@H](C)[N@@H+]1CC[C@@](C)(O)C1	ZINC000095431461	374932234	/nfs/dbraw/zinc/93/22/34/374932234.db2.gz	BCKSAFNNSDBULF-WMLDXEAASA-N	1	0	290.407	1.880	50	0		CDAARO
CC[C@@H](C)[N@H+](C)CCNC(=O)c1sc(N(C)C)nc1C	ZINC000095453126	374952120	/nfs/dbraw/zinc/95/21/20/374952120.db2.gz	YSJDVCBGLMRPQB-SNVBAGLBSA-N	1	0	298.456	1.978	50	0		CDAARO
NC(=O)c1ccc(N2CC[NH+](C[C@H]3CCCO3)CC2)cc1	ZINC000096410355	375097497	/nfs/dbraw/zinc/09/74/97/375097497.db2.gz	UORLNMCBCLIMGU-OAHLLOKOSA-N	1	0	289.379	1.087	50	0		CDAARO
O=C1CC[C@@H]([NH2+][C@@H]2CCCOc3ccccc32)CN1	ZINC000096477782	375105432	/nfs/dbraw/zinc/10/54/32/375105432.db2.gz	RJLMKNUWBGBLOZ-DGCLKSJQSA-N	1	0	260.337	1.769	50	0		CDAARO
Cn1cc(C2CC[NH+]([C@@H](C(N)=O)c3ccccc3)CC2)cn1	ZINC000097203158	375157069	/nfs/dbraw/zinc/15/70/69/375157069.db2.gz	LOTRIMWLBSHQPD-MRXNPFEDSA-N	1	0	298.390	1.826	50	0		CDAARO
Cc1c(F)cccc1S(=O)(=O)N[C@@H]1CCC[NH2+]C1	ZINC000299739829	375199345	/nfs/dbraw/zinc/19/93/45/375199345.db2.gz	RRCYVYBLFSAAKW-SNVBAGLBSA-N	1	0	272.345	1.164	50	0		CDAARO
CC(C)COc1ccccc1CNC(=O)[C@@H]1C[C@@H](O)C[NH2+]1	ZINC000299747024	375207489	/nfs/dbraw/zinc/20/74/89/375207489.db2.gz	BWELRUUBCSAIJX-KGLIPLIRSA-N	1	0	292.379	1.060	50	0		CDAARO
COCC[N@H+](C)CCCNC(=O)Nc1ccccc1	ZINC000031096414	375738805	/nfs/dbraw/zinc/73/88/05/375738805.db2.gz	GKURCXVPZBOVHG-UHFFFAOYSA-N	1	0	265.357	1.776	50	0		CDAARO
CC(C)c1ncc(CN2CC[N@@H+]3CCC[C@H]3C2)cn1	ZINC000244633407	376032708	/nfs/dbraw/zinc/03/27/08/376032708.db2.gz	GCLANQFQVKSWNC-AWEZNQCLSA-N	1	0	260.385	1.880	50	0		CDAARO
CC(C)[N@H+](C)CCOC(=O)[C@@H]1COc2ccccc2O1	ZINC000001831255	376104558	/nfs/dbraw/zinc/10/45/58/376104558.db2.gz	UZOJAUDXMLMQMM-AWEZNQCLSA-N	1	0	279.336	1.710	50	0		CDAARO
Cc1nn(C)c(C)c1CCC(=O)N1CCC[N@H+](C)CC1	ZINC000032862223	377420748	/nfs/dbraw/zinc/42/07/48/377420748.db2.gz	CFUYDFXHDLNJNA-UHFFFAOYSA-N	1	0	278.400	1.134	50	0		CDAARO
CN(CC[NH+](C)C)C(=O)NC[C@H]1CCO[C@@H]1C(C)(C)C	ZINC000190243393	377575589	/nfs/dbraw/zinc/57/55/89/377575589.db2.gz	VBPZCOSREOGSSJ-OLZOCXBDSA-N	1	0	285.432	1.641	50	0		CDAARO
CCc1nsc(N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)n1	ZINC000089295519	377812816	/nfs/dbraw/zinc/81/28/16/377812816.db2.gz	CAMFXUKTQGIFLS-ZJUUUORDSA-N	1	0	252.387	1.773	50	0		CDAARO
COCC[N@@H+]1CC[C@H](OC(C)=O)[C@@H]2CCCC[C@@H]21	ZINC000015319288	285060522	/nfs/dbraw/zinc/06/05/22/285060522.db2.gz	COHAZZNQVVNWKS-RDBSUJKOSA-N	1	0	255.358	1.829	50	0		CDAARO
CC(C)(CO)[NH2+]C[C@@H](O)c1cc(Cl)c(N)c(Cl)c1	ZINC000003602673	390149613	/nfs/dbraw/zinc/14/96/13/390149613.db2.gz	BWURCANZQUYPLR-SNVBAGLBSA-N	1	0	293.194	1.970	50	0	in-vitro	CDAARO
COc1ccc(S(=O)(=O)C2CCC([NH3+])CC2)cc1	ZINC000055143897	390488914	/nfs/dbraw/zinc/48/89/14/390488914.db2.gz	CGEKUKDVDWKUMZ-UHFFFAOYSA-N	1	0	269.366	1.739	50	0		CDAARO
Cc1cc(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@H](C)n2cccn2)on1	ZINC000106845457	291961943	/nfs/dbraw/zinc/96/19/43/291961943.db2.gz	FMENYFCGJOUBQL-SRVKXCTJSA-N	1	0	291.355	1.746	50	0		CDAARO
CC(C)([NH3+])C[N@@H+]1CC[C@@H](Cc2cccc(C(=O)[O-])c2)C1	ZINC000091411667	390889886	/nfs/dbraw/zinc/88/98/86/390889886.db2.gz	MKLFGAMXUZCXDK-ZDUSSCGKSA-N	1	0	276.380	1.987	50	0		CDAARO
CN1CCN(C(=O)[C@@H]2CC[C@H]([NH3+])C2)c2ccc(F)cc21	ZINC000262634458	391327439	/nfs/dbraw/zinc/32/74/39/391327439.db2.gz	GNLHQXDNZUOFGV-PWSUYJOCSA-N	1	0	277.343	1.736	50	0		CDAARO
C[C@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)N[C@H]1CCCC[C@@H]1C	ZINC000241157318	391680741	/nfs/dbraw/zinc/68/07/41/391680741.db2.gz	JWTQRGCFTWKXTK-AJNGGQMLSA-N	1	0	282.428	1.917	50	0		CDAARO
c1nnn2c1CO[C@@H]1CC[N@@H+](C3CCCCC3)C[C@@H]12	ZINC000299764546	391721400	/nfs/dbraw/zinc/72/14/00/391721400.db2.gz	IYBQBIJUVJFMIL-UONOGXRCSA-N	1	0	262.357	1.756	50	0		CDAARO
Cc1cnc(C[N@@H+]2CCCC[C@H]2CN2CCOCC2)cn1	ZINC000336835886	392117171	/nfs/dbraw/zinc/11/71/71/392117171.db2.gz	KCKMOBHFSLRSEH-INIZCTEOSA-N	1	0	290.411	1.472	50	0		CDAARO
COc1ccc(CCC(=O)N2CCC[C@H]2C[NH3+])cc1F	ZINC000262591662	131237383	/nfs/dbraw/zinc/23/73/83/131237383.db2.gz	FKHDETXBQUPJFZ-LBPRGKRZSA-N	1	0	280.343	1.717	50	0		CDAARO
CCc1nc(CN2CCN(c3cc[nH+]cc3C)CC2)no1	ZINC000192607975	140143098	/nfs/dbraw/zinc/14/30/98/140143098.db2.gz	LOJTXUYJFWLKPL-UHFFFAOYSA-N	1	0	287.367	1.658	50	0		CDAARO
CCO[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCC[NH2+]2)C1(C)C	ZINC000261804674	286328702	/nfs/dbraw/zinc/32/87/02/286328702.db2.gz	WEEHSGKQHDRZLP-GRYCIOLGSA-N	1	0	254.374	1.400	50	0		CDAARO
COCCC[NH2+]C1(C(N)=O)C2CC3CC(C2)CC1C3	ZINC000408520235	292362782	/nfs/dbraw/zinc/36/27/82/292362782.db2.gz	GQICQQSAJQCJMC-UHFFFAOYSA-N	1	0	266.385	1.293	50	0		CDAARO
CCS(=O)(=O)NCC[NH2+][C@@H]1CC[C@H](C)C[C@H]1C	ZINC000241515669	286687198	/nfs/dbraw/zinc/68/71/98/286687198.db2.gz	OGXCHLIVQXYDQI-QJPTWQEYSA-N	1	0	262.419	1.340	50	0		CDAARO
Cc1nnc(C[N@@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)s1	ZINC000660691092	413376979	/nfs/dbraw/zinc/37/69/79/413376979.db2.gz	FWPVOWQPAXHOME-IJLUTSLNSA-N	1	0	267.398	1.972	50	0		CDAARO
C[C@@H](c1ccccc1Cl)N1CC[NH+](CCC(N)=O)CC1	ZINC000029690543	287150464	/nfs/dbraw/zinc/15/04/64/287150464.db2.gz	ATQXCDMPOLNUDO-LBPRGKRZSA-N	1	0	295.814	1.894	50	0		CDAARO
COc1ccc(CC(=O)NCCC[NH+](C)C)cc1OC	ZINC000005508970	170105365	/nfs/dbraw/zinc/10/53/65/170105365.db2.gz	IKHBSTWGQNBAMR-UHFFFAOYSA-N	1	0	280.368	1.314	50	0		CDAARO
CCCC[NH2+]CC(=O)Nc1sc2c(c1C(N)=O)CCC2	ZINC000006510557	170208290	/nfs/dbraw/zinc/20/82/90/170208290.db2.gz	ACRQOCFVBPVKCX-UHFFFAOYSA-N	1	0	295.408	1.664	50	0		CDAARO
NC(=[NH2+])N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000006590923	170217405	/nfs/dbraw/zinc/21/74/05/170217405.db2.gz	UUCVVJKCLYKUIH-UHFFFAOYSA-N	1	0	282.775	1.230	50	0		CDAARO
CCCN(CC1CC1)C(=O)CSc1nc(N)cc(N)[nH+]1	ZINC000006785896	170243651	/nfs/dbraw/zinc/24/36/51/170243651.db2.gz	CVTMMVJMXVYHCC-UHFFFAOYSA-N	1	0	295.412	1.382	50	0		CDAARO
NC(=O)C1CC[NH+](Cc2ccc(-n3cccn3)cc2)CC1	ZINC000006849191	170248675	/nfs/dbraw/zinc/24/86/75/170248675.db2.gz	CYBYQTVCUUBTMI-UHFFFAOYSA-N	1	0	284.363	1.570	50	0		CDAARO
CCOC(=O)c1ccc(OC[C@H](O)C[NH+]2CCCC2)cc1	ZINC000007003913	170261506	/nfs/dbraw/zinc/26/15/06/170261506.db2.gz	QSIJDHUHRZXWCM-CQSZACIVSA-N	1	0	293.363	1.699	50	0		CDAARO
COc1ccc(C(=O)NCCC[NH+]2CCCC2)cc1	ZINC000010449998	170407204	/nfs/dbraw/zinc/40/72/04/170407204.db2.gz	NGWHBVCKJQHMJP-UHFFFAOYSA-N	1	0	262.353	1.911	50	0		CDAARO
O=C(NCCc1ccc2c(c1)OCCO2)[C@@H]1CCC[NH2+]C1	ZINC000019408364	170788276	/nfs/dbraw/zinc/78/82/76/170788276.db2.gz	IPMDRCKWFSHAMP-CYBMUJFWSA-N	1	0	290.363	1.116	50	0		CDAARO
COC(=O)c1ccc(CNC(=O)[C@@H]2CCCC[N@@H+]2C)cc1	ZINC000020783911	171272637	/nfs/dbraw/zinc/27/26/37/171272637.db2.gz	LPDJVNFTBGTQCQ-AWEZNQCLSA-N	1	0	290.363	1.574	50	0		CDAARO
Cc1ncc2c(c1-c1noc(Cn3ccnc3)n1)CC[NH2+]C2	ZINC000020859192	171276227	/nfs/dbraw/zinc/27/62/27/171276227.db2.gz	JDGWELQAQFDMHZ-UHFFFAOYSA-N	1	0	296.334	1.331	50	0		CDAARO
COc1ccc2c(c1)C=C(C(=O)NCC[NH+](C)C)CO2	ZINC000021941841	171338113	/nfs/dbraw/zinc/33/81/13/171338113.db2.gz	UXZHLTIIMLMOSQ-UHFFFAOYSA-N	1	0	276.336	1.149	50	0		CDAARO
COc1ccc(OCC(=O)NCC2CC[NH+](C)CC2)cc1	ZINC000023013842	171406540	/nfs/dbraw/zinc/40/65/40/171406540.db2.gz	FYUXEAJSSAZXGL-UHFFFAOYSA-N	1	0	292.379	1.532	50	0		CDAARO
CN1CCC([N@H+](C)Cc2ccc3c(c2)OCO3)CC1	ZINC000035334644	172131611	/nfs/dbraw/zinc/13/16/11/172131611.db2.gz	ZUCOJIJCKVVZRQ-UHFFFAOYSA-N	1	0	262.353	1.941	50	0		CDAARO
CCC[C@H]([NH3+])C(=O)N1CCN(Cc2ccccc2)CC1	ZINC000035686535	172354258	/nfs/dbraw/zinc/35/42/58/172354258.db2.gz	AUUXFJKBQQASPH-HNNXBMFYSA-N	1	0	275.396	1.458	50	0		CDAARO
CCOc1ccccc1C(=O)N(CC)[C@H]1CC[NH2+]C1	ZINC000037539934	173261303	/nfs/dbraw/zinc/26/13/03/173261303.db2.gz	STWIAEOHFDUIDC-LBPRGKRZSA-N	1	0	262.353	1.909	50	0		CDAARO
COc1ccccc1/C=C/CN1CC[NH2+]C[C@@H]1CCO	ZINC000038534543	174144704	/nfs/dbraw/zinc/14/47/04/174144704.db2.gz	YAISVYPTRHXCFH-DRDHIDPGSA-N	1	0	276.380	1.365	50	0		CDAARO
CCc1c(C)sc2c1c(N)nc(=O)n2CC[NH+](C)C	ZINC000040268049	174218343	/nfs/dbraw/zinc/21/83/43/174218343.db2.gz	UBWXNTHYFVSZSE-UHFFFAOYSA-N	1	0	280.397	1.473	50	0		CDAARO
C[NH+](C)CCCNC(=O)C(=O)Nc1cc(Cl)ccc1O	ZINC000040268044	174218656	/nfs/dbraw/zinc/21/86/56/174218656.db2.gz	JVRXXYOJMOWFNP-UHFFFAOYSA-N	1	0	299.758	1.052	50	0		CDAARO
Cn1c(C[N@H+](C)C2CCCCCC2)cc(=O)n(C)c1=O	ZINC000040477884	174283266	/nfs/dbraw/zinc/28/32/66/174283266.db2.gz	HBRQNVCMBMDMNM-UHFFFAOYSA-N	1	0	279.384	1.239	50	0		CDAARO
CC(C)(C(=O)N1CCC[C@@]2(CC[NH2+]C2)C1)n1cccc1	ZINC000067758963	175789737	/nfs/dbraw/zinc/78/97/37/175789737.db2.gz	MUUKSDXZZKEDMF-INIZCTEOSA-N	1	0	275.396	1.825	50	0		CDAARO
Cc1cc2c(c(-c3ncc(F)cn3)c1)O[C@H](C[NH3+])C2	ZINC000067954836	175803854	/nfs/dbraw/zinc/80/38/54/175803854.db2.gz	UNXLOUUENRETMI-NSHDSACASA-N	1	0	259.284	1.853	50	0		CDAARO
CC(C)C[C@@H]([NH3+])C(=O)N(Cc1cnn(C)c1)C(C)C	ZINC000071405654	176155828	/nfs/dbraw/zinc/15/58/28/176155828.db2.gz	VSXWLEZUGKPOGU-CYBMUJFWSA-N	1	0	266.389	1.531	50	0		CDAARO
C[NH2+]CC(=O)N(Cc1ccccc1OC)C(C)C	ZINC000071405825	176155892	/nfs/dbraw/zinc/15/58/92/176155892.db2.gz	RHVXDLYZJJZEFZ-UHFFFAOYSA-N	1	0	250.342	1.652	50	0		CDAARO
CNC(=O)CC[N@H+](C)Cc1c[nH]c2cc(=O)ccc-2c1	ZINC000071638897	176238619	/nfs/dbraw/zinc/23/86/19/176238619.db2.gz	LSXXPTYCVKVJJY-UHFFFAOYSA-N	1	0	273.336	1.508	50	0		CDAARO
CCCn1nc([C@H]2CCC[NH2+]C2)n(-c2ccccc2)c1=O	ZINC000071748414	176258957	/nfs/dbraw/zinc/25/89/57/176258957.db2.gz	ZKJMBXPTUBJFSB-ZDUSSCGKSA-N	1	0	286.379	1.911	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(C(=O)c2cnn3cccnc23)CC1	ZINC000072127200	176320797	/nfs/dbraw/zinc/32/07/97/176320797.db2.gz	WITMQBPRSQMKRI-GFCCVEGCSA-N	1	0	287.367	1.286	50	0		CDAARO
OC[C@]1(O)CCC[N@H+](Cc2ccc(F)c(F)c2)CC1	ZINC000072132111	176321886	/nfs/dbraw/zinc/32/18/86/176321886.db2.gz	HQAYHBQYEFQQKI-AWEZNQCLSA-N	1	0	271.307	1.674	50	0		CDAARO
c1nc2c(c(N[C@H]3COC4(CCCC4)C3)n1)CC[NH2+]CC2	ZINC000072436724	176403056	/nfs/dbraw/zinc/40/30/56/176403056.db2.gz	XCBBROOCCRMEIE-GFCCVEGCSA-N	1	0	288.395	1.678	50	0		CDAARO
Cc1nonc1C(=O)N1CCCC[C@H]1CC[NH+](C)C	ZINC000072458447	176405754	/nfs/dbraw/zinc/40/57/54/176405754.db2.gz	YFYBYUANKLRTIL-NSHDSACASA-N	1	0	266.345	1.324	50	0		CDAARO
c1cn(CCc2cccnc2)c(-c2cc3n(n2)CC[NH2+]C3)n1	ZINC000072470221	176406680	/nfs/dbraw/zinc/40/66/80/176406680.db2.gz	MVYUNKAXPFBXOQ-UHFFFAOYSA-N	1	0	294.362	1.488	50	0		CDAARO
C[N@@H+]1CC[C@H]2CN(C(=O)NCCc3ccccc3)C[C@H]21	ZINC000077459992	177271683	/nfs/dbraw/zinc/27/16/83/177271683.db2.gz	TUDUMYDCQDTUKT-LSDHHAIUSA-N	1	0	273.380	1.575	50	0		CDAARO
Cc1cccc(C)c1OCC(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179120416	261414370	/nfs/dbraw/zinc/41/43/70/261414370.db2.gz	UKTWITWEXLCGFL-CYBMUJFWSA-N	1	0	262.353	1.503	50	0		CDAARO
COc1c(C)cnc(Cn2cc(C(C)(C)[NH3+])nn2)c1C	ZINC000070118593	424393153	/nfs/dbraw/zinc/39/31/53/424393153.db2.gz	HERBELMNKYRGAW-UHFFFAOYSA-N	1	0	275.356	1.541	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2ccncc2Cl)[C@H]1C[NH3+]	ZINC000091457053	274289800	/nfs/dbraw/zinc/28/98/00/274289800.db2.gz	RCTRLSJUAKDYIJ-SKDRFNHKSA-N	1	0	267.760	1.934	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1CN1CCN(c2ccc(O)cc2)CC1	ZINC000244716100	277062245	/nfs/dbraw/zinc/06/22/45/277062245.db2.gz	LIKVMRKHROAGKU-OAHLLOKOSA-N	1	0	275.396	1.608	50	0		CDAARO
C[NH+]1CCN([C@H]2CCN(Cc3ccc(Cl)o3)C2)CC1	ZINC000215452896	277111676	/nfs/dbraw/zinc/11/16/76/277111676.db2.gz	PZSRQJOFORNUMT-LBPRGKRZSA-N	1	0	283.803	1.755	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(C2=[NH+]CCN2)CC1	ZINC000091252481	277180329	/nfs/dbraw/zinc/18/03/29/277180329.db2.gz	CSTFXHJCZYJLRY-UHFFFAOYSA-N	1	0	253.346	1.635	50	0		CDAARO
COc1cc2nc(C)nc(N3CC[NH2+]CC3)c2cc1OC	ZINC000026467696	277857518	/nfs/dbraw/zinc/85/75/18/277857518.db2.gz	WNDCWPNNDOJLCC-UHFFFAOYSA-N	1	0	288.351	1.365	50	0		CDAARO
CC(C)c1nnc2n1CCN(C[C@H]1CCC[NH2+]C1)[C@@H]2C	ZINC000261765020	278108397	/nfs/dbraw/zinc/10/83/97/278108397.db2.gz	MQGFMBIJCJJLIO-OLZOCXBDSA-N	1	0	277.416	1.778	50	0		CDAARO
Cc1c[nH+]ccc1N1CCN(c2ncc(F)cn2)CC1	ZINC000359572356	279027616	/nfs/dbraw/zinc/02/76/16/279027616.db2.gz	AZXCSWXNUDIWEN-UHFFFAOYSA-N	1	0	273.315	1.646	50	0		CDAARO
Cc1nccn1[C@@H](C)C(=O)NCC[NH+]1CCCCCC1	ZINC000426571532	279174015	/nfs/dbraw/zinc/17/40/15/279174015.db2.gz	ARMJSHOPROFZIJ-ZDUSSCGKSA-N	1	0	278.400	1.745	50	0		CDAARO
Cn1ncc(N2CCC[C@@H]3C[N@H+](C)CC[C@H]32)c(Cl)c1=O	ZINC000108325006	290181944	/nfs/dbraw/zinc/18/19/44/290181944.db2.gz	GOSLKXUZXCPFKA-GHMZBOCLSA-N	1	0	296.802	1.354	50	0		CDAARO
COc1cc([C@H](C)[NH2+][C@H]2CCCN(C)C2=O)ccn1	ZINC000558149284	290381758	/nfs/dbraw/zinc/38/17/58/290381758.db2.gz	WDUHOCTWJYPJQA-JQWIXIFHSA-N	1	0	263.341	1.362	50	0		CDAARO
[NH3+]Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000004206183	295278934	/nfs/dbraw/zinc/27/89/34/295278934.db2.gz	BCDIURNDMMBMJT-UHFFFAOYSA-N	1	0	254.355	1.320	50	0		CDAARO
C[C@H](Cn1cncn1)[NH2+][C@@H](C)c1ccc2c(c1)OCCO2	ZINC000095421182	298932079	/nfs/dbraw/zinc/93/20/79/298932079.db2.gz	JHBWOEMLFHMZSK-NEPJUHHUSA-N	1	0	288.351	1.789	50	0		CDAARO
Cn1cnnc1C1CC[NH+](C[C@H]2CCCOC2)CC1	ZINC000252510274	328106025	/nfs/dbraw/zinc/10/60/25/328106025.db2.gz	ZFXUVALOFJFEEO-GFCCVEGCSA-N	1	0	264.373	1.421	50	0		CDAARO
O=C(COc1ccc(F)cc1F)N1C[C@@H]2CC[NH2+][C@@H]2C1	ZINC000534579876	328311208	/nfs/dbraw/zinc/31/12/08/328311208.db2.gz	REQDXUSQISKYMG-JOYOIKCWSA-N	1	0	282.290	1.164	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)c2c(O)cccc2O)CC1	ZINC000534587339	328316139	/nfs/dbraw/zinc/31/61/39/328316139.db2.gz	PKKSCPJLMIVMNX-UHFFFAOYSA-N	1	0	278.352	1.702	50	0		CDAARO
Cc1ccn2nc(C(=O)N3C[C@@H]4CC[NH2+][C@@H]4C3)cc2c1	ZINC000534654308	328338836	/nfs/dbraw/zinc/33/88/36/328338836.db2.gz	YUCBEXHJMIJLHJ-SMDDNHRTSA-N	1	0	270.336	1.077	50	0		CDAARO
C[NH2+]C[C@@H](C)CNS(=O)(=O)c1cc(C)c(C)s1	ZINC000195555241	323571597	/nfs/dbraw/zinc/57/15/97/323571597.db2.gz	JBSQKGXLLRLAIP-MRVPVSSYSA-N	1	0	276.427	1.499	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@@]2(C)CC[NH2+]C2)C[C@H](c2ccccc2)O1	ZINC000269249822	330068167	/nfs/dbraw/zinc/06/81/67/330068167.db2.gz	LYLCUMRMYSECSF-UNEWFSDZSA-N	1	0	288.391	1.975	50	0		CDAARO
Cc1nc2c([nH]1)C[N@H+](C[C@@H](O)c1ccccc1)CC2	ZINC000670440261	482985408	/nfs/dbraw/zinc/98/54/08/482985408.db2.gz	HBNSNZWHDQONAG-OAHLLOKOSA-N	1	0	257.337	1.810	50	0		CDAARO
CCCCn1ncnc1[C@@H](C)N1CC[NH+](C)CC1	ZINC000670452594	483023768	/nfs/dbraw/zinc/02/37/68/483023768.db2.gz	DJHYUMIGHKDYGH-GFCCVEGCSA-N	1	0	251.378	1.387	50	0		CDAARO
Cc1ncn(CC[NH2+][C@@H](C)CN(C)C(C)C)c1C	ZINC000670457318	483036080	/nfs/dbraw/zinc/03/60/80/483036080.db2.gz	ZGTHVUQOZGMSGU-LBPRGKRZSA-N	1	0	252.406	1.818	50	0		CDAARO
Cc1cc(N(C)C[C@@H]2CCOC2)nc(N2CCOCC2)[nH+]1	ZINC000670460425	483043352	/nfs/dbraw/zinc/04/33/52/483043352.db2.gz	WUMYQCSCYRVGIA-ZDUSSCGKSA-N	1	0	292.383	1.094	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CCc2nc(C)cc(=O)[nH]2)n1	ZINC000670462570	483050387	/nfs/dbraw/zinc/05/03/87/483050387.db2.gz	ZDQQVQGNDDLAMX-LBPRGKRZSA-N	1	0	289.383	1.525	50	0		CDAARO
Cn1nc(C(N)=O)c2c1CC[N@H+](C[C@H]1CC=CCC1)C2	ZINC000670468960	483061034	/nfs/dbraw/zinc/06/10/34/483061034.db2.gz	KRPMTSKVDUDMTO-NSHDSACASA-N	1	0	274.368	1.233	50	0		CDAARO
O=C(c1cc(-c2ccsc2)n[nH]1)N1CC[C@H]2C[NH2+]C[C@H]21	ZINC000077439501	483502514	/nfs/dbraw/zinc/50/25/14/483502514.db2.gz	QMFAPWQPCVJGIM-TVQRCGJNSA-N	1	0	288.376	1.572	50	0		CDAARO
C[C@H](NC(=O)N[C@@H]1CCCC[C@H]1O)C(C)(C)C[NH+](C)C	ZINC000185622647	525089773	/nfs/dbraw/zinc/08/97/73/525089773.db2.gz	BZASLPIMKDGYFN-YNEHKIRRSA-N	1	0	285.432	1.565	50	0		CDAARO
CC(C)COC(=O)N1CCN(CC[C@@H]2CCC[N@@H+]2C)CC1	ZINC000096489064	528073144	/nfs/dbraw/zinc/07/31/44/528073144.db2.gz	DTGQOERBFCTSLA-HNNXBMFYSA-N	1	0	297.443	1.881	50	0		CDAARO
CCC(=O)N1CCN(c2cc(-n3cccc3)nc(C)[nH+]2)CC1	ZINC000085472183	535308664	/nfs/dbraw/zinc/30/86/64/535308664.db2.gz	HKRYPSSXNVTFGA-UHFFFAOYSA-N	1	0	299.378	1.634	50	0		CDAARO
Cc1nc(NC(=O)N2CCN(C)C[C@@H]2C)sc1C	ZINC000089562633	545567336	/nfs/dbraw/zinc/56/73/36/545567336.db2.gz	ODGDAOQRFQGNLZ-QMMMGPOBSA-N	1	0	268.386	1.928	50	0		CDAARO
COCc1noc([C@@H](C)N2CCC([NH2+]C(C)C)CC2)n1	ZINC000097086114	567904183	/nfs/dbraw/zinc/90/41/83/567904183.db2.gz	OLJKGUKQHDRLAR-LLVKDONJSA-N	1	0	282.388	1.739	50	0		CDAARO
COc1cc2ncn([C@H]3CCC[NH2+]C3)c(=O)c2cc1OC	ZINC000757178337	577033615	/nfs/dbraw/zinc/03/36/15/577033615.db2.gz	TUECWXUHVURMTD-JTQLQIEISA-N	1	0	289.335	1.338	50	0		CDAARO
CCN(CCc1nc2c(cccc2C)[nH]1)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000952989388	615060472	/nfs/dbraw/zinc/06/04/72/615060472.db2.gz	CZFVQDXRJNYPNS-AWEZNQCLSA-N	1	0	298.390	1.790	50	0		CDAARO
Cc1nn(C)c(C)c1CN1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000888095907	617756813	/nfs/dbraw/zinc/75/68/13/617756813.db2.gz	KKEGSMGKEGBIFZ-UHFFFAOYSA-N	1	0	264.417	1.999	50	0		CDAARO
Cc1ncc(Cl)c(N2CC[C@@H](C[NH+](C)C)C2)n1	ZINC001772701988	1159437334	/nfs/dbraw/zinc/43/73/34/1159437334.db2.gz	CSWORCAUGYLADY-JTQLQIEISA-N	1	0	254.765	1.826	50	0		CDAARO
CNC(=O)c1cccnc1NC[C@@H](C)[NH+]1CCCC1	ZINC001704346955	1177697212	/nfs/dbraw/zinc/69/72/12/1177697212.db2.gz	DAAPQKVYMFCUHM-LLVKDONJSA-N	1	0	262.357	1.337	50	0		CDAARO
Cc1n[nH]c(C)c1CC[N@@H+](C)Cc1cc(=O)[nH]c(C)n1	ZINC001704350885	1177697629	/nfs/dbraw/zinc/69/76/29/1177697629.db2.gz	QQYUWLAZCQYJQE-UHFFFAOYSA-N	1	0	275.356	1.505	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OCc1nc(N(C)C)no1	ZINC000585124267	1164209385	/nfs/dbraw/zinc/20/93/85/1164209385.db2.gz	FAPNPJOUEZXXJA-JTQLQIEISA-N	1	0	284.360	1.190	50	0		CDAARO
COc1nccnc1N1CC[NH+](C2CCCC2)CC1	ZINC000095963755	721852587	/nfs/dbraw/zinc/85/25/87/721852587.db2.gz	GQVSTONYSUPPPW-UHFFFAOYSA-N	1	0	262.357	1.550	50	0		CDAARO
CON(C)C(=O)CC[NH+]1CCC(c2nccc(C)n2)CC1	ZINC000799165414	735314086	/nfs/dbraw/zinc/31/40/86/735314086.db2.gz	GIPMTTKVSNSAMQ-UHFFFAOYSA-N	1	0	292.383	1.374	50	0		CDAARO
C[C@@H]1CC[NH2+][C@@H](C)[C@@H]1NC(=O)Cc1ccc(O)cc1	ZINC000389081081	736311916	/nfs/dbraw/zinc/31/19/16/736311916.db2.gz	BAIPSSMXSHXLCA-JRPNMDOOSA-N	1	0	262.353	1.437	50	0		CDAARO
C[C@@H](O)C[N@@H+](Cc1ccc(F)c(F)c1)C[C@H](C)O	ZINC000000757412	736334580	/nfs/dbraw/zinc/33/45/80/736334580.db2.gz	VTCDSSQEVGFXPI-AOOOYVTPSA-N	1	0	259.296	1.528	50	0		CDAARO
CCn1nc(CNC[C@@]2(O)CCC[NH2+]C2)c2ccccc21	ZINC000072481476	733521524	/nfs/dbraw/zinc/52/15/24/733521524.db2.gz	ZIWDFHZIULCPEP-MRXNPFEDSA-N	1	0	288.395	1.260	50	0		CDAARO
O=C1C[C@@H]([NH2+]C2CCOCC2)CN1Cc1cccc(F)c1	ZINC000012073428	733769243	/nfs/dbraw/zinc/76/92/43/733769243.db2.gz	YOJMAYJKHIWDRP-OAHLLOKOSA-N	1	0	292.354	1.695	50	0		CDAARO
CC[N@@H+]1CCC[C@@](C)(c2nc(-c3cccnn3)no2)C1	ZINC000091657193	734816142	/nfs/dbraw/zinc/81/61/42/734816142.db2.gz	LANHSYVOIHBASO-CQSZACIVSA-N	1	0	273.340	1.900	50	0		CDAARO
Cc1nc(-c2cccc(NC(=O)[C@H]3C=CC[NH2+]3)c2)n[nH]1	ZINC000952973144	734972226	/nfs/dbraw/zinc/97/22/26/734972226.db2.gz	RGXMJRKXOYUGPT-GFCCVEGCSA-N	1	0	269.308	1.247	50	0		CDAARO
C[C@H]1CCC[C@@H]([NH+]2CCN(CCOCCO)CC2)C1	ZINC000019635959	735140655	/nfs/dbraw/zinc/14/06/55/735140655.db2.gz	HZSLFDRTPGGPNO-LSDHHAIUSA-N	1	0	270.417	1.192	50	0		CDAARO
Cc1nc[nH]c1CN1CCC([NH+]2CCSCC2)CC1	ZINC000244874406	735222396	/nfs/dbraw/zinc/22/23/96/735222396.db2.gz	XAUXQGFQCAKTLP-UHFFFAOYSA-N	1	0	280.441	1.731	50	0		CDAARO
C[NH+](C)CC[C@@H]1CN(C(=O)COc2ccccc2)CCO1	ZINC000011934234	735243761	/nfs/dbraw/zinc/24/37/61/735243761.db2.gz	BTBBPBYMGHFYCJ-OAHLLOKOSA-N	1	0	292.379	1.245	50	0		CDAARO
Cc1cc(C(=O)N2CC([N@H+]3CCCC[C@H]3C)C2)nc(C)n1	ZINC000952989541	735912903	/nfs/dbraw/zinc/91/29/03/735912903.db2.gz	QZDONZAMNOKSRZ-GFCCVEGCSA-N	1	0	288.395	1.792	50	0		CDAARO
COC1(c2noc(C34CC[NH+](CC3)C4)n2)CCCC1	ZINC000952883136	910450779	/nfs/dbraw/zinc/45/07/79/910450779.db2.gz	RFMBQUYKAKFDSG-UHFFFAOYSA-N	1	0	263.341	1.833	50	0		CDAARO
CN(CC1([NH+]2CCCCC2)CCCCC1)C(CO)CO	ZINC000952867130	910462850	/nfs/dbraw/zinc/46/28/50/910462850.db2.gz	JLMSZRXIGJSJIG-UHFFFAOYSA-N	1	0	284.444	1.460	50	0		CDAARO
Cc1cc(C(N)=O)c(N2CC[NH+](CC3CC3)CC2)nc1C	ZINC000826848723	925921971	/nfs/dbraw/zinc/92/19/71/925921971.db2.gz	XXLGPFDXUUTBMQ-UHFFFAOYSA-N	1	0	288.395	1.329	50	0		CDAARO
CN(C)c1cc(C[NH2+][C@H]2CCC(=O)NC23CCC3)ccn1	ZINC000585080541	930853906	/nfs/dbraw/zinc/85/39/06/930853906.db2.gz	MRBXHWWKHBMQKI-ZDUSSCGKSA-N	1	0	288.395	1.439	50	0		CDAARO
CCNC(=O)OC[C@@H]1CCCC[N@@H+]1Cc1c[nH]nc1C	ZINC000585084505	930876177	/nfs/dbraw/zinc/87/61/77/930876177.db2.gz	JINLMYDIWWUTQS-ZDUSSCGKSA-N	1	0	280.372	1.819	50	0		CDAARO
O=c1ccncn1CC1CC[NH+]([C@H]2CCCC[C@H]2O)CC1	ZINC000585636805	932834613	/nfs/dbraw/zinc/83/46/13/932834613.db2.gz	NIDHMZWSMMDAKM-LSDHHAIUSA-N	1	0	291.395	1.259	50	0		CDAARO
CO[C@H]1CN(C2CC[NH2+]CC2)C[C@H]1Cc1cc(C)no1	ZINC001529106897	968980442	/nfs/dbraw/zinc/98/04/42/968980442.db2.gz	SZZYBFDSSOEXEC-DOMZBBRYSA-N	1	0	279.384	1.224	50	0		CDAARO
COCC[NH+]1CCC(CN(C)Cc2nnc(C)s2)CC1	ZINC001529138589	968990171	/nfs/dbraw/zinc/99/01/71/968990171.db2.gz	FXKVYCASSMAPSC-UHFFFAOYSA-N	1	0	298.456	1.637	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3ccc(C)cn3)C[C@H]2O)[nH]n1	ZINC001529152306	968997123	/nfs/dbraw/zinc/99/71/23/968997123.db2.gz	SDYHZYKULQTIRO-CZUORRHYSA-N	1	0	286.379	1.457	50	0		CDAARO
O=C(c1ccccn1)[C@@H]1CCC[N@H+](CCn2cnnc2)C1	ZINC001529162113	968999161	/nfs/dbraw/zinc/99/91/61/968999161.db2.gz	WFWRMUZWEAEZFK-CYBMUJFWSA-N	1	0	285.351	1.268	50	0		CDAARO
CCCN1C[C@@H]([NH2+]Cc2ccc(CC)cn2)CC1=O	ZINC001529161506	969000115	/nfs/dbraw/zinc/00/01/15/969000115.db2.gz	KZMZAAUMYJWCPJ-AWEZNQCLSA-N	1	0	261.369	1.745	50	0		CDAARO
CC(C)C[N@@H+]1CCCN(CCc2nccn2C)CC1	ZINC001529186594	969006706	/nfs/dbraw/zinc/00/67/06/969006706.db2.gz	IPCVSXUEAWHNCQ-UHFFFAOYSA-N	1	0	264.417	1.626	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]Cc2nnc3ccccn32)n1	ZINC001506405821	975151978	/nfs/dbraw/zinc/15/19/78/975151978.db2.gz	ICVRNTSHMTZVND-GFCCVEGCSA-N	1	0	284.367	1.721	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](Nc2nc(C)ns2)C1	ZINC000096456187	230377375	/nfs/dbraw/zinc/37/73/75/230377375.db2.gz	MFAIDQNIBWDZFO-JTQLQIEISA-N	1	0	256.375	1.369	50	0		CDAARO
CCOC(=O)N1CC[C@@H]([NH2+]CCc2nncn2C(C)C)C1	ZINC000584903227	341986644	/nfs/dbraw/zinc/98/66/44/341986644.db2.gz	SCJXSTJCNXRVPA-GFCCVEGCSA-N	1	0	295.387	1.222	50	0		CDAARO
O=C(NCCC[N@H+]1CCC[C@H](O)C1)c1cc(O)ccc1F	ZINC000584902196	341986755	/nfs/dbraw/zinc/98/67/55/341986755.db2.gz	SFAYKJBJKVBHMD-LBPRGKRZSA-N	1	0	296.342	1.108	50	0		CDAARO
O=S(=O)(NCC[C@@H]1CC[NH2+]C1)c1cc(F)ccc1F	ZINC000110797217	230394056	/nfs/dbraw/zinc/39/40/56/230394056.db2.gz	GSOWMTIIIIBNON-VIFPVBQESA-N	1	0	290.335	1.243	50	0		CDAARO
Cc1cc([C@@H]2CCC[N@@H+](Cc3ccn(C)c(=O)c3)C2)[nH]n1	ZINC000084111332	539086108	/nfs/dbraw/zinc/08/61/08/539086108.db2.gz	OGQFUKJFUOGDIM-CQSZACIVSA-N	1	0	286.379	1.796	50	0		CDAARO
Cc1cc([C@H]2CCCN(C(=O)[C@H]3CCCC[N@H+]3C)C2)[nH]n1	ZINC000084110280	539086173	/nfs/dbraw/zinc/08/61/73/539086173.db2.gz	GWOYZULSCDQUQW-DZGCQCFKSA-N	1	0	290.411	1.908	50	0		CDAARO
Cn1ccnc1[C@H](NC(=O)C[N@H+](C)C1CC1)c1ccccc1	ZINC000095955441	185041532	/nfs/dbraw/zinc/04/15/32/185041532.db2.gz	IIFMFAKNZHFZQI-MRXNPFEDSA-N	1	0	298.390	1.720	50	0		CDAARO
COc1ccc([C@@H](C)[NH2+]C(CO)CO)c2ccccc12	ZINC000095968596	185048164	/nfs/dbraw/zinc/04/81/64/185048164.db2.gz	YEKKIJRCCJEMCI-LLVKDONJSA-N	1	0	275.348	1.852	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCNC(=O)c2cccc(O)c2)C[C@H](C)O1	ZINC000096003498	185061504	/nfs/dbraw/zinc/06/15/04/185061504.db2.gz	ORUFUIDSBGHBPF-BETUJISGSA-N	1	0	292.379	1.621	50	0		CDAARO
COc1cc(Br)ccc1C[NH2+]CCC(N)=O	ZINC000096005651	185062799	/nfs/dbraw/zinc/06/27/99/185062799.db2.gz	NIEPEPRWCGKTJR-UHFFFAOYSA-N	1	0	287.157	1.423	50	0		CDAARO
CCNC(=O)CCN(C)Cc1nc2cc(C)ccc2[nH]1	ZINC000240128338	361746124	/nfs/dbraw/zinc/74/61/24/361746124.db2.gz	IQAHDKGYHOILPZ-UHFFFAOYSA-N	1	0	274.368	1.829	50	0		CDAARO
O=C1CCCN1Cc1ccccc1C[NH2+][C@H]1CCOC1	ZINC000088679428	342089472	/nfs/dbraw/zinc/08/94/72/342089472.db2.gz	NGHWIECMDLLNQY-HNNXBMFYSA-N	1	0	274.364	1.688	50	0		CDAARO
COC(=O)N1CCC[C@@H]([NH2+]C2Cc3ccccc3C2)C1	ZINC000089401082	539087468	/nfs/dbraw/zinc/08/74/68/539087468.db2.gz	FUXSZZDRMOFFLO-CQSZACIVSA-N	1	0	274.364	1.974	50	0		CDAARO
CC(C)(C)[NH2+][C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1=O	ZINC000020271727	342088857	/nfs/dbraw/zinc/08/88/57/342088857.db2.gz	MPGQXJYIRKWKKA-SNVBAGLBSA-N	1	0	290.319	1.435	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1cc(-c2ccccn2)n[nH]1	ZINC000096118415	185102176	/nfs/dbraw/zinc/10/21/76/185102176.db2.gz	HAFIZKJYINHHGJ-GFCCVEGCSA-N	1	0	299.378	1.686	50	0		CDAARO
O=C(Cc1cc(F)ccc1F)NC[C@H]1CCCC[NH2+]1	ZINC000195542820	342626589	/nfs/dbraw/zinc/62/65/89/342626589.db2.gz	ZBXUZLHRXKKDSP-GFCCVEGCSA-N	1	0	268.307	1.766	50	0		CDAARO
Cc1c([C@H](C)[NH2+][C@@H]2C=C[C@H](CO)C2)cnc2ccnn21	ZINC000195558616	342628529	/nfs/dbraw/zinc/62/85/29/342628529.db2.gz	XCBZHXYYBIPJBT-WCFLWFBJSA-N	1	0	272.352	1.625	50	0		CDAARO
Cc1cc(NC(=O)CN2CC[C@@H]3CC[C@H](C2)[N@@H+]3C)no1	ZINC000244723648	361858103	/nfs/dbraw/zinc/85/81/03/361858103.db2.gz	MEZWNLNXMGRPGO-NWDGAFQWSA-N	1	0	278.356	1.090	50	0		CDAARO
C[N@H+](CCn1cc[nH]c1=O)C[C@@H]1Cc2ccccc2O1	ZINC000244742004	361861703	/nfs/dbraw/zinc/86/17/03/361861703.db2.gz	OAKAMPTYZPAQMP-ZDUSSCGKSA-N	1	0	273.336	1.112	50	0		CDAARO
CCc1nnc(CN2CC([N@@H+]3CCCC[C@@H]3C)C2)[nH]1	ZINC000244778771	361863809	/nfs/dbraw/zinc/86/38/09/361863809.db2.gz	PWJLCPWBPNBUEJ-NSHDSACASA-N	1	0	263.389	1.426	50	0		CDAARO
COc1ccnc(C(=O)NCC2CC[NH+](C(C)C)CC2)c1	ZINC000244874358	361867743	/nfs/dbraw/zinc/86/77/43/361867743.db2.gz	WZYRIAPHTJMVND-UHFFFAOYSA-N	1	0	291.395	1.940	50	0		CDAARO
Cc1cccc(CS(=O)(=O)N2CCC[C@@H]([C@@H](C)[NH3+])C2)c1	ZINC000269608074	190519887	/nfs/dbraw/zinc/51/98/87/190519887.db2.gz	DHMHMTQVPHPJDA-UKRRQHHQSA-N	1	0	296.436	1.884	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)c2cc(-c3cc(F)ccc3F)no2)C1	ZINC000097019418	185152954	/nfs/dbraw/zinc/15/29/54/185152954.db2.gz	VPMPNIQHAISIRU-SECBINFHSA-N	1	0	293.273	1.793	50	0		CDAARO
CC1(CNC(=O)Cc2c[nH]cn2)Cc2ccccc2C1	ZINC000585134422	342215496	/nfs/dbraw/zinc/21/54/96/342215496.db2.gz	RYXHKLUQJZRLLT-UHFFFAOYSA-N	1	0	269.348	1.874	50	0		CDAARO
O=C(NC[C@@H]1C[N@@H+]2CCC[C@H]2CO1)N1C[C@@H]2CCC[C@@H]2C1	ZINC000685939645	539045789	/nfs/dbraw/zinc/04/57/89/539045789.db2.gz	PBLKBKWJSOBAIQ-LJISPDSOSA-N	1	0	293.411	1.291	50	0		CDAARO
C[C@@H]1C[C@H](NCc2ccc3[nH]c(=O)[nH]c3c2)CC[N@@H+]1C	ZINC000585139880	342218526	/nfs/dbraw/zinc/21/85/26/342218526.db2.gz	GXSHNWUNOQWPRM-ZYHUDNBSSA-N	1	0	274.368	1.841	50	0		CDAARO
Cc1ccnc(C[NH2+][C@H]2CCC[C@H](S(C)(=O)=O)C2)c1	ZINC000392826401	539061329	/nfs/dbraw/zinc/06/13/29/539061329.db2.gz	LSOWCJBLNDBORA-JSGCOSHPSA-N	1	0	282.409	1.835	50	0		CDAARO
Cc1cc[nH+]c(NC[C@H]2CCN([C@H]3CCOC3=O)C2)c1	ZINC000225219007	539097094	/nfs/dbraw/zinc/09/70/94/539097094.db2.gz	ODBBIHYUFPAAHP-OLZOCXBDSA-N	1	0	275.352	1.439	50	0		CDAARO
CSC[C@H](C)C(=O)N[C@H]1C[C@@H]([NH+](C)C)C1(C)C	ZINC000600841143	342252552	/nfs/dbraw/zinc/25/25/52/342252552.db2.gz	AHQZSXZSJBIOTG-GARJFASQSA-N	1	0	258.431	1.830	50	0		CDAARO
CC[C@H](C(=O)N1CC[C@@H](Oc2ccccn2)C1)[NH+](C)C	ZINC000096477447	529600220	/nfs/dbraw/zinc/60/02/20/529600220.db2.gz	PIGIQYZJKMFLRA-CHWSQXEVSA-N	1	0	277.368	1.402	50	0		CDAARO
Cc1nn(-c2ccccc2)c(C)c1N1CC[NH2+]CC1	ZINC000061957886	282242013	/nfs/dbraw/zinc/24/20/13/282242013.db2.gz	ZCHVEEHZLQPVRX-UHFFFAOYSA-N	1	0	256.353	1.899	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)[C@@H]2COc3ccc(Cl)cc3C2)C1	ZINC000178516673	362245618	/nfs/dbraw/zinc/24/56/18/362245618.db2.gz	PAIOCXSARRSALD-PWSUYJOCSA-N	1	0	294.782	1.698	50	0		CDAARO
CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CC[C@H](NS(C)(=O)=O)C1	ZINC000191075534	362398716	/nfs/dbraw/zinc/39/87/16/362398716.db2.gz	LVHKJWZGIVLNCW-IHRRRGAJSA-N	1	0	286.441	1.602	50	0		CDAARO
CC1(CNC(=O)CCC(F)(F)F)CC[NH2+]CC1	ZINC000129020804	362480421	/nfs/dbraw/zinc/48/04/21/362480421.db2.gz	UAVTTWABQUDTEZ-UHFFFAOYSA-N	1	0	252.280	1.835	50	0		CDAARO
O=C(c1cnn(-c2ccccc2)c1)N1C[C@@H]2CCC[NH2+][C@@H]2C1	ZINC000097394159	185596930	/nfs/dbraw/zinc/59/69/30/185596930.db2.gz	VOVNXSCUIGWNPZ-XJKSGUPXSA-N	1	0	296.374	1.696	50	0		CDAARO
CCCc1noc(-c2cccn3c(C[NH3+])nnc23)n1	ZINC000582468965	346223707	/nfs/dbraw/zinc/22/37/07/346223707.db2.gz	RBNVSASIYBEHQP-UHFFFAOYSA-N	1	0	258.285	1.191	50	0		CDAARO
COc1ccc(OCC[N@H+](C)C[C@H](O)COC(C)C)cc1	ZINC000098076180	185683520	/nfs/dbraw/zinc/68/35/20/185683520.db2.gz	MTTLIUVSJKLZKY-AWEZNQCLSA-N	1	0	297.395	1.792	50	0		CDAARO
Cc1ccccc1C(=O)N1CCOC[C@@H]1C[NH+](C)C	ZINC000085469783	179075288	/nfs/dbraw/zinc/07/52/88/179075288.db2.gz	BPIYIDFELUOTAJ-ZDUSSCGKSA-N	1	0	262.353	1.398	50	0		CDAARO
CC(C)[NH2+]CCN1CCC[C@@H](Cc2nccn2C)C1	ZINC000193481594	362922465	/nfs/dbraw/zinc/92/24/65/362922465.db2.gz	OIGZBKKQNGCYEP-AWEZNQCLSA-N	1	0	264.417	1.673	50	0		CDAARO
O=C(NCc1cc(C2CC2)n[nH]1)[C@@H]1CC12CC[NH2+]CC2	ZINC000584884149	349342495	/nfs/dbraw/zinc/34/24/95/349342495.db2.gz	WSVGSDWSRNFBQN-LBPRGKRZSA-N	1	0	274.368	1.293	50	0		CDAARO
Cc1nonc1CNC1CC[NH+](Cc2ccco2)CC1	ZINC000584886742	349344656	/nfs/dbraw/zinc/34/46/56/349344656.db2.gz	CYRDAGKNPPPQPR-UHFFFAOYSA-N	1	0	276.340	1.725	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN(C(=O)c2ccncc2Cl)C1	ZINC000584896806	349358330	/nfs/dbraw/zinc/35/83/30/349358330.db2.gz	OXKQQOSKAMRELY-LLVKDONJSA-N	1	0	297.786	1.385	50	0		CDAARO
CN(C[C@@H]1CCCC[N@@H+]1C)C(=O)c1csc(N)n1	ZINC000584894129	349354019	/nfs/dbraw/zinc/35/40/19/349354019.db2.gz	MNIGQIHWIAOUPR-VIFPVBQESA-N	1	0	268.386	1.112	50	0		CDAARO
Cc1ncn(C)c1C(=O)N(C)CC[N@H+](C)C1CCCC1	ZINC000584900681	349362478	/nfs/dbraw/zinc/36/24/78/349362478.db2.gz	WQCDHMLWUNHPDX-UHFFFAOYSA-N	1	0	278.400	1.675	50	0		CDAARO
Cc1nc[nH]c1C[N@@H+]1CC[C@@](O)(C2CCOCC2)[C@H](C)C1	ZINC000091305868	180131420	/nfs/dbraw/zinc/13/14/20/180131420.db2.gz	OQXRQCUGUMTEBH-WBMJQRKESA-N	1	0	293.411	1.718	50	0		CDAARO
CCC[C@H]1CN(C(=O)Cc2ccccc2OC)C[C@@H]1[NH3+]	ZINC000091326017	180135183	/nfs/dbraw/zinc/13/51/83/180135183.db2.gz	LEGUVRXTYOLBQX-KBPBESRZSA-N	1	0	276.380	1.824	50	0		CDAARO
CCOc1ccccc1C(=O)N[C@H]1CCC[NH2+][C@@H]1C	ZINC000091496537	180171737	/nfs/dbraw/zinc/17/17/37/180171737.db2.gz	BTLWXOCQCOWUON-YPMHNXCESA-N	1	0	262.353	1.956	50	0		CDAARO
COc1ccc(S(=O)(=O)N[C@H]2CCC[NH2+][C@@H]2C)cc1	ZINC000091496954	180172450	/nfs/dbraw/zinc/17/24/50/180172450.db2.gz	ZDCITDQMJRNFNM-MFKMUULPSA-N	1	0	284.381	1.114	50	0		CDAARO
CC(C)c1cc(N(C)CCc2cnn(C)c2)nc(N)[nH+]1	ZINC000091426241	180151992	/nfs/dbraw/zinc/15/19/92/180151992.db2.gz	ULDJEHIQCDFEHA-UHFFFAOYSA-N	1	0	274.372	1.595	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)CCn2cc(Cl)cn2)C[C@@H]1C1CC1	ZINC000091586212	180199458	/nfs/dbraw/zinc/19/94/58/180199458.db2.gz	VMILYJCLGHSDIH-NEPJUHHUSA-N	1	0	282.775	1.122	50	0		CDAARO
CC(C)[N@@H+]1CCN(Cc2ccncc2)C[C@H]1CCO	ZINC000105625582	186065685	/nfs/dbraw/zinc/06/56/85/186065685.db2.gz	FJJIPBRCIWZZCZ-OAHLLOKOSA-N	1	0	263.385	1.359	50	0		CDAARO
CCN1CCC[C@](O)(C[N@@H+]2CCCC[C@H]2CCO)C1	ZINC000105966634	186095100	/nfs/dbraw/zinc/09/51/00/186095100.db2.gz	MTPYSZIMCYAYGJ-LSDHHAIUSA-N	1	0	270.417	1.070	50	0		CDAARO
CC[C@@H]1CN(Cc2cccnc2)CC[N@@H+]1C[C@H](C)O	ZINC000106906800	186150372	/nfs/dbraw/zinc/15/03/72/186150372.db2.gz	AXCGHIDREHNDPV-DZGCQCFKSA-N	1	0	263.385	1.359	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCN(S(=O)(=O)c2cccc(F)c2)C1	ZINC000109040347	186241354	/nfs/dbraw/zinc/24/13/54/186241354.db2.gz	HWSSQNNJGYUBKU-WDEREUQCSA-N	1	0	286.372	1.574	50	0		CDAARO
Cc1nc(CC[NH2+][C@H](C)Cn2cncn2)sc1C	ZINC000065421002	363214837	/nfs/dbraw/zinc/21/48/37/363214837.db2.gz	RVQAZHAZPAQURY-SECBINFHSA-N	1	0	265.386	1.572	50	0		CDAARO
O=c1[nH]c2ccccc2cc1C[NH2+][C@@H]1CCCCNC1=O	ZINC000036976481	363304466	/nfs/dbraw/zinc/30/44/66/363304466.db2.gz	BBAHFMLOTJSQJJ-CQSZACIVSA-N	1	0	285.347	1.286	50	0		CDAARO
CC[NH+](CC)CCn1c2ccccc2n(CCO)c1=N	ZINC000000305750	355903816	/nfs/dbraw/zinc/90/38/16/355903816.db2.gz	MZQWKMKJXAYBAS-UHFFFAOYSA-N	1	0	276.384	1.256	50	0		CDAARO
C[NH+](C)CCNS(=O)(=O)c1ccc(Cl)cc1	ZINC000000577390	355918397	/nfs/dbraw/zinc/91/83/97/355918397.db2.gz	ZEIRXYXCGPDADI-UHFFFAOYSA-N	1	0	262.762	1.180	50	0		CDAARO
[NH2+]=C1N[C@@H](C(=O)c2ccccc2)[C@H](c2ccccc2)N1	ZINC000000173758	355893902	/nfs/dbraw/zinc/89/39/02/355893902.db2.gz	HVZBMAKCDGCFLE-UONOGXRCSA-N	1	0	265.316	1.897	50	0		CDAARO
CC(C)(C)OC(=O)N[C@H]1CCN(C2CC[NH2+]CC2)C1	ZINC000002541472	355974604	/nfs/dbraw/zinc/97/46/04/355974604.db2.gz	FWXFHIGFBZXEOP-NSHDSACASA-N	1	0	269.389	1.337	50	0		CDAARO
COCC[NH2+]CCOCCOc1ccccc1F	ZINC000002981178	355990224	/nfs/dbraw/zinc/99/02/24/355990224.db2.gz	DLMOBXZANZIWPO-UHFFFAOYSA-N	1	0	257.305	1.457	50	0		CDAARO
OCC[NH2+]CCOCCOc1cc(Cl)ccc1Cl	ZINC000002980653	355990270	/nfs/dbraw/zinc/99/02/70/355990270.db2.gz	SNEAGYUCJXRHDV-UHFFFAOYSA-N	1	0	294.178	1.971	50	0		CDAARO
CCCCNC(=O)[C@@H]([NH3+])Cc1c[nH]c2ccccc12	ZINC000011754553	356278903	/nfs/dbraw/zinc/27/89/03/356278903.db2.gz	FAWMEMJYDOLBIO-ZDUSSCGKSA-N	1	0	259.353	1.954	50	0		CDAARO
Cc1c(-c2cc(C(F)(F)F)n(CCC[NH3+])n2)cnn1C	ZINC000012396003	356297194	/nfs/dbraw/zinc/29/71/94/356297194.db2.gz	WVGCBHMGZNCCDL-UHFFFAOYSA-N	1	0	287.289	1.960	50	0		CDAARO
CCOC(=O)N1CCN(Cc2ccc(C)o2)CC1	ZINC000016989221	356451174	/nfs/dbraw/zinc/45/11/74/356451174.db2.gz	XQEVSNBGNMBAJD-UHFFFAOYSA-N	1	0	252.314	1.862	50	0		CDAARO
COc1cc(CN2CCC[N@H+](C)CC2)cc(OC)c1OC	ZINC000019537406	356491620	/nfs/dbraw/zinc/49/16/20/356491620.db2.gz	VMSMOKBNXNTZEE-UHFFFAOYSA-N	1	0	294.395	1.850	50	0		CDAARO
O=C(c1cccnc1N1CC[NH2+]CC1)N1CCCCC1	ZINC000019015139	356474943	/nfs/dbraw/zinc/47/49/43/356474943.db2.gz	WIVGCIGQDNMDQO-UHFFFAOYSA-N	1	0	274.368	1.117	50	0		CDAARO
C[C@@H]1C[NH+](C2CCN(C(=O)c3ccco3)CC2)C[C@@H](C)O1	ZINC000019888795	356514077	/nfs/dbraw/zinc/51/40/77/356514077.db2.gz	ILWYUUFBSAZZBD-CHWSQXEVSA-N	1	0	292.379	1.993	50	0		CDAARO
C(C[NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCC2)CO[C@@H]1CCOC1	ZINC000194077371	358506081	/nfs/dbraw/zinc/50/60/81/358506081.db2.gz	RFMRMUZNNZFYAS-KBUPBQIOSA-N	1	0	281.396	1.729	50	0		CDAARO
O=S1(=O)CC[C@H]([NH2+]Cc2ccc(F)c(F)c2)C1	ZINC000019899734	363499252	/nfs/dbraw/zinc/49/92/52/363499252.db2.gz	QISOIVPFBKXBNC-VIFPVBQESA-N	1	0	261.293	1.242	50	0		CDAARO
Clc1cccc(C[NH2+]CCN2CCOCC2)c1	ZINC000023263503	356638438	/nfs/dbraw/zinc/63/84/38/356638438.db2.gz	ITICBCWCHCPMPV-UHFFFAOYSA-N	1	0	254.761	1.762	50	0		CDAARO
C[C@H]1C[NH+](CCCNc2cc(Cl)nc(N)n2)C[C@H](C)O1	ZINC000024056944	356651737	/nfs/dbraw/zinc/65/17/37/356651737.db2.gz	IIFXDPAFQWUMLV-UWVGGRQHSA-N	1	0	299.806	1.623	50	0		CDAARO
CNC(=O)[C@@H]1CCCCN1Cc1nc(C)cs1	ZINC000176348600	366321225	/nfs/dbraw/zinc/32/12/25/366321225.db2.gz	FPAIGYZKNYYARZ-JTQLQIEISA-N	1	0	253.371	1.552	50	0		CDAARO
CCOc1cc2c(cc1OCC)[C@H](C(CO)CO)[NH2+]CC2	ZINC000032099028	356774475	/nfs/dbraw/zinc/77/44/75/356774475.db2.gz	DLPCTIQNIDHILA-INIZCTEOSA-N	1	0	295.379	1.272	50	0		CDAARO
[NH3+]Cc1nc2ccccc2c(=O)n1-c1ccc(F)cc1	ZINC000041125603	357023764	/nfs/dbraw/zinc/02/37/64/357023764.db2.gz	NPIUMOLIURAEKQ-UHFFFAOYSA-N	1	0	269.279	1.984	50	0		CDAARO
O=C(OCC1CC[NH2+]CC1)c1cc(Cl)ccn1	ZINC000042768366	357079543	/nfs/dbraw/zinc/07/95/43/357079543.db2.gz	ZUIRIXBAOFVHBW-UHFFFAOYSA-N	1	0	254.717	1.891	50	0		CDAARO
C[C@H]1CC(C)(C)C[C@](CO)([NH2+]CCN2C(=O)CCC2=O)C1	ZINC000095432080	357513718	/nfs/dbraw/zinc/51/37/18/357513718.db2.gz	JVZHJPZAYTUROP-BLLLJJGKSA-N	1	0	296.411	1.302	50	0		CDAARO
C[C@H](CCc1ccccc1)[NH2+]CCN(C)S(C)(=O)=O	ZINC000065465337	357543698	/nfs/dbraw/zinc/54/36/98/357543698.db2.gz	BBSKLCWWAHUFOH-CYBMUJFWSA-N	1	0	284.425	1.489	50	0		CDAARO
CN(Cc1nccn1C)C(=O)c1cnnn1-c1ccccc1	ZINC000065490755	357544872	/nfs/dbraw/zinc/54/48/72/357544872.db2.gz	JCFGVGFOQUIESL-UHFFFAOYSA-N	1	0	296.334	1.273	50	0		CDAARO
C[NH+]1CCC(Cc2noc(CCN3CCCCO3)n2)CC1	ZINC000067772397	357626794	/nfs/dbraw/zinc/62/67/94/357626794.db2.gz	CAMGVDRMAZAPEL-UHFFFAOYSA-N	1	0	294.399	1.524	50	0		CDAARO
Cc1cc(C(=O)N2CC[NH2+][C@H](C)C2)nn1C(C)(C)C	ZINC000188371527	357643445	/nfs/dbraw/zinc/64/34/45/357643445.db2.gz	LEODBOUVYWHEHS-SNVBAGLBSA-N	1	0	264.373	1.380	50	0		CDAARO
Cc1ncc(C[NH+]2CCC3(CC(=O)N(C)C3)CC2)cn1	ZINC000072447378	357836246	/nfs/dbraw/zinc/83/62/46/357836246.db2.gz	AOJQZFDRTQONOJ-UHFFFAOYSA-N	1	0	274.368	1.229	50	0		CDAARO
OCc1ccc(C[NH+]2CCC(OC[C@@H]3CCOC3)CC2)o1	ZINC000097108594	357983842	/nfs/dbraw/zinc/98/38/42/357983842.db2.gz	JKXJKEPNBVSUHU-CYBMUJFWSA-N	1	0	295.379	1.789	50	0		CDAARO
c1nc2c(c(N[C@@H]3COC4(CCCC4)C3)n1)CC[NH2+]CC2	ZINC000072436725	357994135	/nfs/dbraw/zinc/99/41/35/357994135.db2.gz	XCBBROOCCRMEIE-LBPRGKRZSA-N	1	0	288.395	1.678	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCCC[NH3+])c2cccnc12	ZINC000097229270	358043789	/nfs/dbraw/zinc/04/37/89/358043789.db2.gz	CDSZOVWUJYJTJA-UHFFFAOYSA-N	1	0	279.365	1.170	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N1CC[C@H](C)C[C@@H](C)C1	ZINC000195554721	358557727	/nfs/dbraw/zinc/55/77/27/358557727.db2.gz	ZNIDWQFCRZJEFR-TUAOUCFPSA-N	1	0	258.431	1.961	50	0		CDAARO
CC(C)[C@H](CCO)[NH2+]CC(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000195563990	358565346	/nfs/dbraw/zinc/56/53/46/358565346.db2.gz	IXQGBRHOVLBGMG-MJBXVCDLSA-N	1	0	270.417	1.488	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)N(C)Cc2nccn2C)CC1	ZINC000095354637	358683479	/nfs/dbraw/zinc/68/34/79/358683479.db2.gz	RRMIVOPNKIRXSM-UHFFFAOYSA-N	1	0	278.400	1.499	50	0		CDAARO
CCc1[nH+]c(N)nc(N2CCC(c3ncon3)CC2)c1C	ZINC000095354873	358683761	/nfs/dbraw/zinc/68/37/61/358683761.db2.gz	MAHKFGXYNYPUJM-UHFFFAOYSA-N	1	0	288.355	1.697	50	0		CDAARO
CCn1ncnc1[C@@H](C)NC(=O)CCC[NH+]1CCCCC1	ZINC000095372900	358688791	/nfs/dbraw/zinc/68/87/91/358688791.db2.gz	GQTALRGCFBPWCH-CYBMUJFWSA-N	1	0	293.415	1.741	50	0		CDAARO
CCCCSc1nc(N)cc(NC[C@@]2(O)CC[NH2+]C2)n1	ZINC000095387431	358691489	/nfs/dbraw/zinc/69/14/89/358691489.db2.gz	HZSAPSOVKDRWKL-CYBMUJFWSA-N	1	0	297.428	1.087	50	0		CDAARO
CN(Cc1ccc2nonc2c1)C(=O)[C@H]1CCCC[N@@H+]1C	ZINC000097088020	358750493	/nfs/dbraw/zinc/75/04/93/358750493.db2.gz	OAJMBSXTMFSNFF-CQSZACIVSA-N	1	0	288.351	1.666	50	0		CDAARO
OC[C@@H]1C[NH2+]CCC12CCN(c1ncccc1Cl)CC2	ZINC000097499433	358780798	/nfs/dbraw/zinc/78/07/98/358780798.db2.gz	SIOOSWKVSWKJOO-LBPRGKRZSA-N	1	0	295.814	1.923	50	0		CDAARO
Cc1ccc(C[N@@H+]2CC[C@@](C)(O)[C@@H](O)C2)c2cccnc12	ZINC000097514234	358781283	/nfs/dbraw/zinc/78/12/83/358781283.db2.gz	PUTIOPZGSODYRH-DOTOQJQBSA-N	1	0	286.375	1.861	50	0		CDAARO
CCn1ncc(C(=O)N2CCN[C@@H](c3ccccc3)C2)c1C	ZINC000097568796	358785275	/nfs/dbraw/zinc/78/52/75/358785275.db2.gz	JJQUGZVMYDUCLX-MRXNPFEDSA-N	1	0	298.390	1.998	50	0		CDAARO
O=C([C@H]1CC[NH2+]C1)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000097619285	358788518	/nfs/dbraw/zinc/78/85/18/358788518.db2.gz	DEYZAGFLZIAJJL-PFWMLDTASA-N	1	0	299.418	1.454	50	0		CDAARO
CC(=O)c1cc(CN2CCN([C@H]3CC[NH2+]C3)CC2)cs1	ZINC000097772879	358797222	/nfs/dbraw/zinc/79/72/22/358797222.db2.gz	XFDKZXFELQQTOV-AWEZNQCLSA-N	1	0	293.436	1.430	50	0		CDAARO
CC(=O)c1cc(CN2CCN([C@@H]3CC[NH2+]C3)CC2)cs1	ZINC000097772878	358797990	/nfs/dbraw/zinc/79/79/90/358797990.db2.gz	XFDKZXFELQQTOV-CQSZACIVSA-N	1	0	293.436	1.430	50	0		CDAARO
C[N@H+](CCO)C[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000014238201	358964599	/nfs/dbraw/zinc/96/45/99/358964599.db2.gz	VCTDOUSPQVPEJQ-SECBINFHSA-N	1	0	294.178	1.657	50	0		CDAARO
Cc1ocnc1C(=O)N1CC([N@H+]2CCCC[C@@H]2C)C1	ZINC000216067495	358922043	/nfs/dbraw/zinc/92/20/43/358922043.db2.gz	ASNXDZXTHLWBOB-JTQLQIEISA-N	1	0	263.341	1.682	50	0		CDAARO
CCCOc1ccc(CCNC(=O)[C@@H]2C[NH2+]CCO2)cc1	ZINC000216426879	358944748	/nfs/dbraw/zinc/94/47/48/358944748.db2.gz	XUXHBKLXJWKPKL-HNNXBMFYSA-N	1	0	292.379	1.123	50	0		CDAARO
CCn1ccc(C(=O)NCC[NH+](C(C)C)C(C)C)cc1=O	ZINC000216492292	358947369	/nfs/dbraw/zinc/94/73/69/358947369.db2.gz	RWMGGQCEKXURFC-UHFFFAOYSA-N	1	0	293.411	1.717	50	0		CDAARO
CC(C)[NH2+]C[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000032107819	359186352	/nfs/dbraw/zinc/18/63/52/359186352.db2.gz	IMTBFKDWVMMLFN-SNVBAGLBSA-N	1	0	253.298	1.153	50	0		CDAARO
Cc1noc(C)c1CCC(=O)N1CCC[N@@H+](C)CC1	ZINC000032674246	359229361	/nfs/dbraw/zinc/22/93/61/359229361.db2.gz	QKKAVTCSNARFGY-UHFFFAOYSA-N	1	0	265.357	1.388	50	0		CDAARO
Cc1nnc(NC(=O)CN(C)Cc2ccccc2)s1	ZINC000025416876	359368110	/nfs/dbraw/zinc/36/81/10/359368110.db2.gz	XYALXNFXIIVWPJ-UHFFFAOYSA-N	1	0	276.365	1.917	50	0		CDAARO
Cn1cc(CCCNc2cc(C3CC([NH3+])C3)ncn2)cn1	ZINC000223449207	359427024	/nfs/dbraw/zinc/42/70/24/359427024.db2.gz	AMQGETYQQMDXCG-UHFFFAOYSA-N	1	0	286.383	1.460	50	0		CDAARO
CCc1nccn1CCC(=O)N1CC([NH+]2CCCCC2)C1	ZINC000222986915	359390684	/nfs/dbraw/zinc/39/06/84/359390684.db2.gz	SHIKHCCPYGHQSX-UHFFFAOYSA-N	1	0	290.411	1.532	50	0		CDAARO
COCC(=O)Nc1ccc(OC2CC[NH+](C)CC2)cc1	ZINC000224819118	359530832	/nfs/dbraw/zinc/53/08/32/359530832.db2.gz	BOUSFLSPWUQALZ-UHFFFAOYSA-N	1	0	278.352	1.745	50	0		CDAARO
CNC(=O)CN1CCC([NH2+]Cc2ccccc2Cl)CC1	ZINC000030905500	359633695	/nfs/dbraw/zinc/63/36/95/359633695.db2.gz	DPFITQSKMBCYHH-UHFFFAOYSA-N	1	0	295.814	1.640	50	0		CDAARO
Cc1ccc(F)cc1C[N@@H+]1CC[C@H](CO)[C@H](O)C1	ZINC000336522427	363688508	/nfs/dbraw/zinc/68/85/08/363688508.db2.gz	MLKONBJMIYKSGQ-BXUZGUMPSA-N	1	0	253.317	1.309	50	0		CDAARO
CC(C)n1ccc(C(=O)N2C[C@@H]3CC[N@H+](C)C[C@@H]3C2)n1	ZINC000408517992	359903692	/nfs/dbraw/zinc/90/36/92/359903692.db2.gz	RFODFWHPGQXFNY-QWHCGFSZSA-N	1	0	276.384	1.488	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OCCOC(=O)N(C)C	ZINC000408525652	359936036	/nfs/dbraw/zinc/93/60/36/359936036.db2.gz	OGWVQECJXXXUPH-NSHDSACASA-N	1	0	274.361	1.239	50	0		CDAARO
COc1c([C@H]2CCCN2[C@H]2CCOC2=O)c(C)nn1C	ZINC000257365310	359944059	/nfs/dbraw/zinc/94/40/59/359944059.db2.gz	IMTZCDWODAKUEZ-MNOVXSKESA-N	1	0	279.340	1.190	50	0		CDAARO
CCc1cnc(CN(C)[C@@H]2CCN([C@H]3CCOC3=O)C2)o1	ZINC000257366203	359947583	/nfs/dbraw/zinc/94/75/83/359947583.db2.gz	NBDBMOMEIWUZSF-YPMHNXCESA-N	1	0	293.367	1.059	50	0		CDAARO
CN(C(=O)c1ccccc1-n1cccn1)[C@@H]1CC[NH2+]C1	ZINC000521394618	359966645	/nfs/dbraw/zinc/96/66/45/359966645.db2.gz	NIRZPXFHOBZOCJ-GFCCVEGCSA-N	1	0	270.336	1.306	50	0		CDAARO
C[C@H]([NH2+]C[C@@H](O)CN1CCCC1=O)c1ccc(F)cc1F	ZINC000089515114	360095339	/nfs/dbraw/zinc/09/53/39/360095339.db2.gz	SGBIGUQYMHCUNR-CMPLNLGQSA-N	1	0	298.333	1.599	50	0		CDAARO
CSc1cccc(NC(=O)NC[C@]2(O)CCC[NH2+]C2)c1	ZINC000426434603	360530851	/nfs/dbraw/zinc/53/08/51/360530851.db2.gz	XONVJJCCMMICRK-AWEZNQCLSA-N	1	0	295.408	1.645	50	0		CDAARO
Cc1cc(=O)cc(C(=O)N(C)CC[N@H+](C)C2CCCC2)[nH]1	ZINC000426652070	360693181	/nfs/dbraw/zinc/69/31/81/360693181.db2.gz	SOLSNPZXKAOXOB-UHFFFAOYSA-N	1	0	291.395	1.630	50	0		CDAARO
Cc1cnn(CCCSc2nnc(CC[NH3+])n2C)c1	ZINC000426674354	360694222	/nfs/dbraw/zinc/69/42/22/360694222.db2.gz	UFRBMNIVSYHPNM-UHFFFAOYSA-N	1	0	280.401	1.004	50	0		CDAARO
C[NH2+]Cc1nnc(SCC[C@H]2CCOC2)n1C	ZINC000426412644	360666400	/nfs/dbraw/zinc/66/64/00/360666400.db2.gz	CWEUUICKBUIYRI-SECBINFHSA-N	1	0	256.375	1.053	50	0		CDAARO
CCn1nc(C)c(C(=O)N2CC[C@H](C[NH3+])C2)c1Cl	ZINC000178591884	189129301	/nfs/dbraw/zinc/12/93/01/189129301.db2.gz	KLBDQSLFJSBZGH-SECBINFHSA-N	1	0	270.764	1.286	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)c2ccc3nccn3c2)C1	ZINC000178598154	189130199	/nfs/dbraw/zinc/13/01/99/189130199.db2.gz	IWXKDMJKGUPSRZ-LBPRGKRZSA-N	1	0	258.325	1.158	50	0		CDAARO
Cc1c(C)n(C[C@@H](O)C[NH2+]CCO)c2ccc(F)cc12	ZINC000012421994	360710111	/nfs/dbraw/zinc/71/01/11/360710111.db2.gz	YZECOJDXJZVJMZ-ZDUSSCGKSA-N	1	0	280.343	1.340	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)CCOc2ccc(Cl)cc2)C1	ZINC000178527682	189124183	/nfs/dbraw/zinc/12/41/83/189124183.db2.gz	WDKRYLYIPIKEDH-NSHDSACASA-N	1	0	282.771	1.916	50	0		CDAARO
CCn1nc(C)c(C(=O)N2CC[C@@H](C[NH2+]C)C2)c1Cl	ZINC000179028879	189162993	/nfs/dbraw/zinc/16/29/93/189162993.db2.gz	PMAKUHNBDLQRMN-JTQLQIEISA-N	1	0	284.791	1.546	50	0		CDAARO
C[C@@H](CO)CSc1nnc(C[NH3+])n1-c1ccc(F)cc1	ZINC000426624969	360818281	/nfs/dbraw/zinc/81/82/81/360818281.db2.gz	ZETDFDMDVDCHGA-VIFPVBQESA-N	1	0	296.371	1.586	50	0		CDAARO
COCC[C@H](C)NC(=O)N1CC[C@@H](C[NH+](C)C)C1	ZINC000129815553	360884662	/nfs/dbraw/zinc/88/46/62/360884662.db2.gz	VGCJGTBMYWVQOJ-RYUDHWBXSA-N	1	0	257.378	1.005	50	0		CDAARO
O=C(C[C@H]1CC[NH2+]C1)NCCCc1nc2ccccc2[nH]1	ZINC000130346886	360944367	/nfs/dbraw/zinc/94/43/67/360944367.db2.gz	BLAHCLXIOALUFZ-GFCCVEGCSA-N	1	0	286.379	1.611	50	0		CDAARO
COCCCSc1nnc([C@H]2CCC[NH2+]C2)n1C	ZINC000426537493	360997874	/nfs/dbraw/zinc/99/78/74/360997874.db2.gz	MWUKSFCLPNBSBG-JTQLQIEISA-N	1	0	270.402	1.411	50	0		CDAARO
CCn1cc(C(=O)N2CCC([NH2+]C)CC2)c(C(C)C)n1	ZINC000299740221	200851073	/nfs/dbraw/zinc/85/10/73/200851073.db2.gz	XCXQNPFQOUFSHS-UHFFFAOYSA-N	1	0	278.400	1.850	50	0		CDAARO
C[C@H]([NH2+]C[C@H]1CN(C)CCN1C)c1ccccc1N(C)C	ZINC000093945022	299320066	/nfs/dbraw/zinc/32/00/66/299320066.db2.gz	YMQXQUKAMNASFG-GJZGRUSLSA-N	1	0	290.455	1.649	50	0		CDAARO
Fc1ccc(CN2CCN([C@@H]3CC[NH2+]C3)CC2)cc1Cl	ZINC000097773035	361081602	/nfs/dbraw/zinc/08/16/02/361081602.db2.gz	HBNGERYMWVNDKA-CYBMUJFWSA-N	1	0	297.805	1.959	50	0		CDAARO
CCOc1cc2c(cc1C[NH2+]C[C@@H](C)O)O[C@H](C)C2	ZINC000035111529	361258456	/nfs/dbraw/zinc/25/84/56/361258456.db2.gz	DAOZUFSMWUNKFJ-GHMZBOCLSA-N	1	0	265.353	1.879	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CC(=O)NC(=O)NC(C)(C)C	ZINC000007486438	364114728	/nfs/dbraw/zinc/11/47/28/364114728.db2.gz	AGDAIYKWLUXYBF-JTQLQIEISA-N	1	0	255.362	1.485	50	0		CDAARO
CCOC(=O)C[C@]1(C)OC[C@@H](C[NH+]2CCCCC2)O1	ZINC000003141339	364706920	/nfs/dbraw/zinc/70/69/20/364706920.db2.gz	UZULUDFGYFDQFW-TZMCWYRMSA-N	1	0	271.357	1.557	50	0		CDAARO
CCOc1ccccc1CCC(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179081058	364975886	/nfs/dbraw/zinc/97/58/86/364975886.db2.gz	VVDGUGNKUVUDRD-CQSZACIVSA-N	1	0	276.380	1.838	50	0		CDAARO
Cc1cc(CNC(=O)N2CC[N@@H+]3CCCC[C@H]3C2)no1	ZINC000089604900	366884256	/nfs/dbraw/zinc/88/42/56/366884256.db2.gz	AAXYUEMTMORIQG-ZDUSSCGKSA-N	1	0	278.356	1.363	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1CC(=O)NCCCc1ccccc1	ZINC000089939008	366972660	/nfs/dbraw/zinc/97/26/60/366972660.db2.gz	TYRASEVEQAUZQF-OAHLLOKOSA-N	1	0	289.423	1.371	50	0		CDAARO
CCNC(=O)CC[N@@H+]1CCC[C@H](Cc2nccn2C)C1	ZINC000090003604	367006703	/nfs/dbraw/zinc/00/67/03/367006703.db2.gz	ARTWZSGOQRNEIU-CYBMUJFWSA-N	1	0	278.400	1.201	50	0		CDAARO
CO[C@@H]1CC[C@@H]2OCC[N@H+](CCCCCO)[C@H]2C1	ZINC000252486079	367573763	/nfs/dbraw/zinc/57/37/63/367573763.db2.gz	DSRCOAFQYOTZAX-RDBSUJKOSA-N	1	0	257.374	1.417	50	0		CDAARO
C[N@H+](CCNC(=O)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C)C1CC1	ZINC000252517858	367742893	/nfs/dbraw/zinc/74/28/93/367742893.db2.gz	SWCPTBHNEWPFRO-YNEHKIRRSA-N	1	0	281.400	1.193	50	0		CDAARO
Cc1ccc([C@H](C)NC(=O)[C@@H]2CSCN2)cc1F	ZINC000094956636	367746859	/nfs/dbraw/zinc/74/68/59/367746859.db2.gz	JNTSLYWHEQXDMN-CABZTGNLSA-N	1	0	268.357	1.974	50	0		CDAARO
CC(C)[NH+]1CCC(N(C)C(=O)C[C@@H]2CCCC(=O)N2)CC1	ZINC000377157397	368081093	/nfs/dbraw/zinc/08/10/93/368081093.db2.gz	GELUWJJCSGTVBF-ZDUSSCGKSA-N	1	0	295.427	1.376	50	0		CDAARO
COc1cccc(C[C@@H]([NH3+])C(=O)Nc2ccc(C)nc2)c1	ZINC000638275030	369061353	/nfs/dbraw/zinc/06/13/53/369061353.db2.gz	UVZCNHGXIFVSIW-OAHLLOKOSA-N	1	0	285.347	1.907	50	0		CDAARO
Cc1cc(C(=O)NCC2CC[NH+]([C@@H]3CCOC3)CC2)no1	ZINC000575606838	370617192	/nfs/dbraw/zinc/61/71/92/370617192.db2.gz	MMQKUBGGPOVVCA-CYBMUJFWSA-N	1	0	293.367	1.214	50	0		CDAARO
O=C(C[N@H+]1CCC[C@H](O)CC1)NCC1CCCCC1	ZINC000331897752	204275302	/nfs/dbraw/zinc/27/53/02/204275302.db2.gz	DWTAJSQSIUPANM-AWEZNQCLSA-N	1	0	268.401	1.530	50	0		CDAARO
c1nnc(C2CC[NH+](CC[C@H]3CCOC3)CC2)[nH]1	ZINC000670443352	482988201	/nfs/dbraw/zinc/98/82/01/482988201.db2.gz	JWOQNDMECGPCPE-NSHDSACASA-N	1	0	250.346	1.411	50	0		CDAARO
Cc1n[nH]nc1C(=O)N(C)C[C@H]1CC[N@@H+](CC(C)C)C1	ZINC000299761309	372746761	/nfs/dbraw/zinc/74/67/61/372746761.db2.gz	VAGXSTLNXPCASA-GFCCVEGCSA-N	1	0	279.388	1.163	50	0		CDAARO
CN(CCCc1nccn1C)C(=O)c1ccc(C[NH3+])cc1	ZINC000299760070	372747002	/nfs/dbraw/zinc/74/70/02/372747002.db2.gz	UYQOZNNFDVFSKJ-UHFFFAOYSA-N	1	0	286.379	1.584	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1NC(=O)c1ccncc1Cl	ZINC000299768154	372750584	/nfs/dbraw/zinc/75/05/84/372750584.db2.gz	JRTWTJCSBYMKMQ-STQMWFEESA-N	1	0	297.786	1.572	50	0		CDAARO
O[C@H](c1ccncc1)c1ccc2c(c1)C[NH2+]CCO2	ZINC000299792867	372766261	/nfs/dbraw/zinc/76/62/61/372766261.db2.gz	GMBFDJPLINYQNX-OAHLLOKOSA-N	1	0	256.305	1.645	50	0		CDAARO
CC[N@@H+]1CC[C@@H]2[C@@H](C1)OCCN2C(=O)Cc1ccsc1	ZINC000253416430	373726603	/nfs/dbraw/zinc/72/66/03/373726603.db2.gz	VXQYEWILSPELCL-ZIAGYGMSSA-N	1	0	294.420	1.612	50	0		CDAARO
CSC[C@H](C)C(=O)N(C)[C@@H]1CC[N@H+](C)C[C@@H]1C	ZINC000107053154	373796845	/nfs/dbraw/zinc/79/68/45/373796845.db2.gz	AUAUCHWGPDGIHO-SDDRHHMPSA-N	1	0	258.431	1.784	50	0		CDAARO
C[NH+]1CCN(Cc2ccc(O)c3ncccc23)CC1	ZINC000019590067	374756806	/nfs/dbraw/zinc/75/68/06/374756806.db2.gz	IAALKBPGEDMXOE-UHFFFAOYSA-N	1	0	257.337	1.688	50	0		CDAARO
COc1cc(CN(C)CC[NH+](C)C)cc2c1OCO2	ZINC000019606964	374760432	/nfs/dbraw/zinc/76/04/32/374760432.db2.gz	GLWFWEZJMZHUQR-UHFFFAOYSA-N	1	0	266.341	1.417	50	0		CDAARO
CC[C@H](C)C[NH2+]CC1(S(C)(=O)=O)CCOCC1	ZINC000093076356	374730385	/nfs/dbraw/zinc/73/03/85/374730385.db2.gz	FSPCLBFVALMICQ-NSHDSACASA-N	1	0	263.403	1.216	50	0		CDAARO
CCC(CC)C[NH2+]CC1(S(C)(=O)=O)CCOCC1	ZINC000095434036	374933893	/nfs/dbraw/zinc/93/38/93/374933893.db2.gz	VVGKHFLYKHGDAK-UHFFFAOYSA-N	1	0	277.430	1.606	50	0		CDAARO
C[C@@H](C(=O)NC[C@H](O)c1ccncc1)[N@H+]1[C@H](C)CC[C@@H]1C	ZINC000095432657	374934179	/nfs/dbraw/zinc/93/41/79/374934179.db2.gz	LVSAXZWTPIXJDJ-XFMPKHEZSA-N	1	0	291.395	1.493	50	0		CDAARO
C[C@@H](c1ccc(S(N)(=O)=O)cc1)[N@H+](C)[C@H]1CCO[C@H]1C	ZINC000095457012	374953360	/nfs/dbraw/zinc/95/33/60/374953360.db2.gz	MNSWCOFXSXDSFR-MJVIPROJSA-N	1	0	298.408	1.504	50	0		CDAARO
COc1ccc(OCC[N@@H+]2CCC[C@@H]2CC(N)=O)cc1	ZINC000095466742	374961992	/nfs/dbraw/zinc/96/19/92/374961992.db2.gz	HAPYLJYZBRQQAG-GFCCVEGCSA-N	1	0	278.352	1.414	50	0		CDAARO
CCc1ccccc1NC(=O)C[NH2+][C@](C)(CO)C1CC1	ZINC000095469396	374963386	/nfs/dbraw/zinc/96/33/86/374963386.db2.gz	ZCKQREYCWNTSCL-MRXNPFEDSA-N	1	0	276.380	1.938	50	0		CDAARO
Cn1cc(CCC(=O)N[C@@H]2CCC[C@H]([NH+](C)C)C2)cn1	ZINC000095408061	374911043	/nfs/dbraw/zinc/91/10/43/374911043.db2.gz	RKRZSQPCVFPRGG-KGLIPLIRSA-N	1	0	278.400	1.342	50	0		CDAARO
O=C(CO)N[C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21	ZINC000108497720	412831662	/nfs/dbraw/zinc/83/16/62/412831662.db2.gz	OJRAQLLUEHDQHZ-HRCADAONSA-N	1	0	288.391	1.396	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+][C@@H](CO)c2cnn(C)c2)C1(C)C	ZINC000095988166	375047877	/nfs/dbraw/zinc/04/78/77/375047877.db2.gz	BOAASZMUNPXNTL-YNEHKIRRSA-N	1	0	267.373	1.247	50	0		CDAARO
Cc1ccc(NC(=O)N2CCC[N@H+](C)CC2)c(N(C)C)n1	ZINC000096000109	375050215	/nfs/dbraw/zinc/05/02/15/375050215.db2.gz	ZBCPSVKDVRAFBG-UHFFFAOYSA-N	1	0	291.399	1.625	50	0		CDAARO
NC(=O)[C@@H]([NH2+][C@@H]1CCCSC1)c1ccccc1	ZINC000097084456	375145341	/nfs/dbraw/zinc/14/53/41/375145341.db2.gz	LVMRZUFBZDGSGW-NEPJUHHUSA-N	1	0	250.367	1.698	50	0		CDAARO
C[C@H](CCc1ccc(O)cc1)[NH2+]CC(=O)N1CCOCC1	ZINC000097085168	375146962	/nfs/dbraw/zinc/14/69/62/375146962.db2.gz	OWYFOXSAVVXHKV-CYBMUJFWSA-N	1	0	292.379	1.162	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C[C@@H](O)CO[C@@H](C)c1ccccc1	ZINC000097160006	375151636	/nfs/dbraw/zinc/15/16/36/375151636.db2.gz	QGUQJSCGBZWWNI-XJKSGUPXSA-N	1	0	289.379	1.946	50	0		CDAARO
C[NH+](C)CCCNc1ncnnc1-c1ccccc1	ZINC000003767058	375793549	/nfs/dbraw/zinc/79/35/49/375793549.db2.gz	JVGDIAFZCKPPKK-UHFFFAOYSA-N	1	0	257.341	1.902	50	0		CDAARO
O=C([C@H]1CC12CC[NH2+]CC2)N1CCc2ccccc2C1	ZINC000070251968	284544342	/nfs/dbraw/zinc/54/43/42/284544342.db2.gz	PYJZIIIDYDGEIR-OAHLLOKOSA-N	1	0	270.376	1.961	50	0		CDAARO
C/C=C\C[C@@H](CO)[NH2+]C1CCN(c2nnc(C)s2)CC1	ZINC000606442160	375823156	/nfs/dbraw/zinc/82/31/56/375823156.db2.gz	ZYJNVOXOUARWRI-SCOBNMCVSA-N	1	0	296.440	1.732	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)/C=C\c2ccccn2)C1	ZINC000606441392	375823601	/nfs/dbraw/zinc/82/36/01/375823601.db2.gz	WQRRGHBOOQWTEW-MEJMFZKBSA-N	1	0	259.353	1.553	50	0		CDAARO
CNC(=O)[C@@H]1C[C@@H]([NH3+])CN1Cc1c(F)ccc(C)c1Cl	ZINC000067695222	377216436	/nfs/dbraw/zinc/21/64/36/377216436.db2.gz	IHAVSPHJZXGTMM-SKDRFNHKSA-N	1	0	299.777	1.435	50	0		CDAARO
Cc1nn(C)c(Cl)c1CN1CC[C@@]2(C1)CCC[NH2+]C2	ZINC000067742641	377235755	/nfs/dbraw/zinc/23/57/55/377235755.db2.gz	MKSLQIWQPSVLOB-AWEZNQCLSA-N	1	0	282.819	1.957	50	0		CDAARO
CO[C@H]1CCN(C(=O)C2CC[NH+](C(C)C)CC2)C1	ZINC000334803530	377427354	/nfs/dbraw/zinc/42/73/54/377427354.db2.gz	DYNBYPJXWBVHAY-ZDUSSCGKSA-N	1	0	254.374	1.354	50	0		CDAARO
COC(=O)[C@H](NCC[NH+]1CCCCC1)C(C)(C)C	ZINC000089621443	291766085	/nfs/dbraw/zinc/76/60/85/291766085.db2.gz	LERKRWAILAHPOF-LBPRGKRZSA-N	1	0	256.390	1.650	50	0		CDAARO
CCN1C(=O)C[C@H]([NH2+]C23CC4CC(CC(C4)C2)C3)C1=O	ZINC000019881458	285172737	/nfs/dbraw/zinc/17/27/37/285172737.db2.gz	JHZSBJBTIMMTEK-PCPABOIYSA-N	1	0	276.380	1.692	50	0		CDAARO
Cc1nn(C)c2nc(N3CC[N@@H+]4CCC[C@H]4C3)sc12	ZINC000244626640	256867756	/nfs/dbraw/zinc/86/77/56/256867756.db2.gz	FPONXCJKANDGKP-JTQLQIEISA-N	1	0	277.397	1.623	50	0		CDAARO
Cc1ccc(C(=O)N2CCC(OCCC[NH3+])CC2)c(C)n1	ZINC000094070882	184753586	/nfs/dbraw/zinc/75/35/86/184753586.db2.gz	RJFUAOJHFZIPAJ-UHFFFAOYSA-N	1	0	291.395	1.668	50	0		CDAARO
Cc1ccc(S(=O)(=O)[C@H](C[NH3+])c2cccnc2)cc1	ZINC000007951978	390179880	/nfs/dbraw/zinc/17/98/80/390179880.db2.gz	LIZZJJAHNUGKEJ-CQSZACIVSA-N	1	0	276.361	1.864	50	0		CDAARO
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]([NH3+])CC(C)C	ZINC000001605755	169723699	/nfs/dbraw/zinc/72/36/99/169723699.db2.gz	DJBPSNXKZLENEZ-ZIAGYGMSSA-N	1	0	292.379	1.260	50	0	biogenic	CDAARO
COC(=O)CC(C)(C)CC(=O)N1[C@H](C)C[NH+](C)C[C@H]1C	ZINC000096492982	390527640	/nfs/dbraw/zinc/52/76/40/390527640.db2.gz	AQKBDOJZJXOIAK-VXGBXAGGSA-N	1	0	284.400	1.517	50	0		CDAARO
Cc1cc(S(=O)(=O)NCC[NH2+]C2CC2)sc1Cl	ZINC000188454703	390958427	/nfs/dbraw/zinc/95/84/27/390958427.db2.gz	NJZSARKODOILAH-UHFFFAOYSA-N	1	0	294.829	1.740	50	0		CDAARO
O=C(c1cc(Cl)c[nH]1)N1CC[NH+](CC2CC2)CC1	ZINC000193625157	391912868	/nfs/dbraw/zinc/91/28/68/391912868.db2.gz	PBMYBGTYYVSUTC-UHFFFAOYSA-N	1	0	267.760	1.836	50	0		CDAARO
CC(C)=CC[NH+]1CCC(N2CCC[C@H]2C(N)=O)CC1	ZINC000096489100	393186839	/nfs/dbraw/zinc/18/68/39/393186839.db2.gz	FOHYRMPEJKLCIR-AWEZNQCLSA-N	1	0	265.401	1.367	50	0		CDAARO
COCC[N@H+](Cc1cnc(C)cn1)C(C)(C)CO	ZINC000084258393	483269225	/nfs/dbraw/zinc/26/92/25/483269225.db2.gz	KKTGGUZLHDSJMP-UHFFFAOYSA-N	1	0	253.346	1.004	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]1)N1CCN(c2ccccc2F)CC1	ZINC000005394990	134656778	/nfs/dbraw/zinc/65/67/78/134656778.db2.gz	FJCXOAFDEBQQDP-ZDUSSCGKSA-N	1	0	277.343	1.226	50	0		CDAARO
C[C@@H]1Oc2ccc(C(=O)C3CC[NH2+]CC3)cc2N(C)C1=O	ZINC000036244097	134815686	/nfs/dbraw/zinc/81/56/86/134815686.db2.gz	CNGLSGOXRQPNJH-JTQLQIEISA-N	1	0	288.347	1.613	50	0		CDAARO
COCC1(CNc2nccnc2C)CC[NH2+]CC1	ZINC000261561021	140348218	/nfs/dbraw/zinc/34/82/18/140348218.db2.gz	FQYMHZBXMFVSBO-UHFFFAOYSA-N	1	0	250.346	1.213	50	0		CDAARO
C[C@H](OC[C@@H]1CCCCO1)C(=O)N1CCC[C@@H](C)[C@H]1C[NH3+]	ZINC000247331809	397900939	/nfs/dbraw/zinc/90/09/39/397900939.db2.gz	VEETYBIGFIDZMU-CBBWQLFWSA-N	1	0	298.427	1.546	50	0		CDAARO
COCCN(C(=O)OC(C)(C)C)C1CC[NH2+]CC1	ZINC000058040510	292396193	/nfs/dbraw/zinc/39/61/93/292396193.db2.gz	JYHLMZKMISILOT-UHFFFAOYSA-N	1	0	258.362	1.622	50	0		CDAARO
C[C@@H](O)C(=O)NC[C@H](c1ccccc1)[NH+]1CCC(C)CC1	ZINC000095979914	287076123	/nfs/dbraw/zinc/07/61/23/287076123.db2.gz	SPSOQIWAMGXYOV-GDBMZVCRSA-N	1	0	290.407	1.957	50	0		CDAARO
CC[NH+](CC)CCCCCCn1c(C)cc(=O)n(C)c1=O	ZINC000002381332	169789452	/nfs/dbraw/zinc/78/94/52/169789452.db2.gz	YYYXGHHHQGNSIJ-UHFFFAOYSA-N	1	0	295.427	1.758	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@H]2CO)cc1OC	ZINC000005527328	170108448	/nfs/dbraw/zinc/10/84/48/170108448.db2.gz	HXXMHGSSGPFTCS-LBPRGKRZSA-N	1	0	251.326	1.661	50	0		CDAARO
C[NH+](C)[C@H](CNC(=S)NC1CC1)c1ccccc1	ZINC000006334600	170193295	/nfs/dbraw/zinc/19/32/95/170193295.db2.gz	SWJANHZPOPXMGK-CYBMUJFWSA-N	1	0	263.410	1.916	50	0		CDAARO
O=C(Nc1ccc2ccccc2c1)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000006536886	170211185	/nfs/dbraw/zinc/21/11/85/170211185.db2.gz	RPDYJTXWIGUABB-KBPBESRZSA-N	1	0	256.305	1.501	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CC(=O)NC(=O)NCc1cccs1	ZINC000008338752	170331958	/nfs/dbraw/zinc/33/19/58/170331958.db2.gz	QYIHEEUKIFFWIA-LLVKDONJSA-N	1	0	295.408	1.948	50	0		CDAARO
O[C@@H](COc1ccc2ccccc2c1)CN1CC[NH2+]CC1	ZINC000019668807	170835204	/nfs/dbraw/zinc/83/52/04/170835204.db2.gz	DQJKVORHJXYXNI-MRXNPFEDSA-N	1	0	286.375	1.485	50	0		CDAARO
C[NH+]1CCN(CCNC(=O)c2ccccc2Cl)CC1	ZINC000020726213	171270833	/nfs/dbraw/zinc/27/08/33/171270833.db2.gz	UVBUNEKNPBSNPN-UHFFFAOYSA-N	1	0	281.787	1.317	50	0		CDAARO
OCc1cn(C2CC[NH+](Cc3cccnc3)CC2)nn1	ZINC000020869379	171277378	/nfs/dbraw/zinc/27/73/78/171277378.db2.gz	RKULYZMJRHNFBZ-UHFFFAOYSA-N	1	0	273.340	1.003	50	0		CDAARO
C[N@@H+]1CCCN(Cn2nc3ccccn3c2=S)CC1	ZINC000022037219	171349972	/nfs/dbraw/zinc/34/99/72/171349972.db2.gz	PCAJGDKVSYHYQP-UHFFFAOYSA-N	1	0	277.397	1.460	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COC(C)(C)CC)CC1	ZINC000022802815	171399348	/nfs/dbraw/zinc/39/93/48/171399348.db2.gz	PCYIMOFJVYHDKU-ZDUSSCGKSA-N	1	0	258.406	1.190	50	0		CDAARO
CCn1nc(C[NH2+]C(C)(C)CO)c(-c2ccccc2)n1	ZINC000035287303	172105417	/nfs/dbraw/zinc/10/54/17/172105417.db2.gz	JKHGCWDMRXTNPE-UHFFFAOYSA-N	1	0	274.368	1.826	50	0		CDAARO
C[C@](CO)(c1ccc(Br)cc1)N1CC[NH2+]CC1	ZINC000038120674	174128335	/nfs/dbraw/zinc/12/83/35/174128335.db2.gz	WDUJJOYVCFRGBR-ZDUSSCGKSA-N	1	0	299.212	1.562	50	0		CDAARO
Cn1cc(CN2CC[N@H+](C3CCCC3)[C@H](CCO)C2)cn1	ZINC000039500120	174169564	/nfs/dbraw/zinc/16/95/64/174169564.db2.gz	MKPHOEUPXWCFMJ-MRXNPFEDSA-N	1	0	292.427	1.231	50	0		CDAARO
COC(=O)c1ccccc1COC[C@H]1CCC[NH2+]C1	ZINC000042782946	174878975	/nfs/dbraw/zinc/87/89/75/174878975.db2.gz	OBXYPPBYBUYBRP-LBPRGKRZSA-N	1	0	263.337	1.989	50	0		CDAARO
CN(C)c1cccc(C(=O)N2CCC(C[NH3+])CC2)c1	ZINC000044512961	175188855	/nfs/dbraw/zinc/18/88/55/175188855.db2.gz	HTJMCMNWRIHCNO-UHFFFAOYSA-N	1	0	261.369	1.564	50	0		CDAARO
Cc1ccc(NC(C)(C)C(=O)N2CC[C@@H](C[NH3+])C2)cc1	ZINC000071416066	176160445	/nfs/dbraw/zinc/16/04/45/176160445.db2.gz	ILOYQKLXGMBJBM-ZDUSSCGKSA-N	1	0	275.396	1.993	50	0		CDAARO
C[NH2+]CC(=O)NC[C@H]1CCN(c2ccccc2C)C1	ZINC000071662293	176242518	/nfs/dbraw/zinc/24/25/18/176242518.db2.gz	SPHKTAPPNGIYTA-CYBMUJFWSA-N	1	0	261.369	1.157	50	0		CDAARO
Cc1onc(-c2ccccc2)c1C(=O)N[C@H]1CC[C@H]1[NH3+]	ZINC000072126617	176320381	/nfs/dbraw/zinc/32/03/81/176320381.db2.gz	PGZNTWBDFVVQAX-NEPJUHHUSA-N	1	0	271.320	1.870	50	0		CDAARO
CCSC[C@H]([NH3+])C(=O)NCc1cnn2ccccc12	ZINC000072130618	176321288	/nfs/dbraw/zinc/32/12/88/176321288.db2.gz	YALWWTHNPRVPTR-NSHDSACASA-N	1	0	278.381	1.031	50	0		CDAARO
CCOc1ccccc1NC(=O)NC[C@@H]1C[NH2+]CCOC1	ZINC000072134681	176322214	/nfs/dbraw/zinc/32/22/14/176322214.db2.gz	NEZQPEBYTUQFEH-LBPRGKRZSA-N	1	0	293.367	1.443	50	0		CDAARO
CCc1ccc(C[N@@H+]2CCOC[C@H](CO)C2)nc1	ZINC000077524417	177278411	/nfs/dbraw/zinc/27/84/11/177278411.db2.gz	SHPMAPKJVHXVIR-ZDUSSCGKSA-N	1	0	250.342	1.085	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@]2(C1)[NH2+]CCc1nc[nH]c12	ZINC000258634853	265375810	/nfs/dbraw/zinc/37/58/10/265375810.db2.gz	SYPPZHWZYJYVER-CQSZACIVSA-N	1	0	278.356	1.392	50	0		CDAARO
CC(C)([NH3+])CNS(=O)(=O)c1ccc(C(F)(F)F)cc1	ZINC000129640879	275552077	/nfs/dbraw/zinc/55/20/77/275552077.db2.gz	BAYYELUAIJMIQJ-UHFFFAOYSA-N	1	0	296.314	1.721	50	0		CDAARO
CCC[N@@H+]1CCc2c(sc3[nH]c(=NN)nc(NN)c23)C1	ZINC000019707349	276014107	/nfs/dbraw/zinc/01/41/07/276014107.db2.gz	HIQCPWJAGLZZEA-UHFFFAOYSA-N	1	0	293.400	1.031	50	0		CDAARO
CCC[C@@H]1CN(C(=O)c2cccnn2)C[C@H]1[NH+](C)C	ZINC000082160511	276030812	/nfs/dbraw/zinc/03/08/12/276030812.db2.gz	SVPULASFZAYEJA-DGCLKSJQSA-N	1	0	262.357	1.279	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1Cn1c(=O)cnc2ccccc21	ZINC000095392180	276188148	/nfs/dbraw/zinc/18/81/48/276188148.db2.gz	ZUUYLUFBWAMYDI-LBPRGKRZSA-N	1	0	257.337	1.881	50	0		CDAARO
CCOC(=O)Cn1c2c(c(=[NH2+])c3c1CCCC3)CCC2	ZINC000002066203	276281665	/nfs/dbraw/zinc/28/16/65/276281665.db2.gz	MXPFQVVZAQMHRS-UHFFFAOYSA-N	1	0	274.364	1.898	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)[C@H]2Cc3ccccc3O2)CC1	ZINC000096956478	277049348	/nfs/dbraw/zinc/04/93/48/277049348.db2.gz	GMYLNPIHDQHGGY-CQSZACIVSA-N	1	0	260.337	1.154	50	0		CDAARO
CN1CCOc2ccc(NC(=O)[C@H]3CC[C@@H]([NH3+])C3)cc21	ZINC000246176265	277132927	/nfs/dbraw/zinc/13/29/27/277132927.db2.gz	BOVITEVHHRWNJX-WDEREUQCSA-N	1	0	275.352	1.581	50	0		CDAARO
C[N@@H+]1CC[C@@]23c4c5c(O)ccc4C[C@@H]1[C@@H]2CC[C@@H](O)[C@@H]3O5	ZINC000037634012	277161456	/nfs/dbraw/zinc/16/14/56/277161456.db2.gz	IJVCSMSMFSCRME-NOSXKOESSA-N	1	0	287.359	1.422	50	0	world	CDAARO
CC(C)(C)OC(=O)N1CCC2(CC1)[NH2+]CCc1nc[nH]c12	ZINC000096032946	277181874	/nfs/dbraw/zinc/18/18/74/277181874.db2.gz	DELFZIVILNAWRQ-UHFFFAOYSA-N	1	0	292.383	1.782	50	0		CDAARO
COC[C@@H](O)C[N@H+](C)[C@H]1CCCN(c2ccccc2)C1	ZINC000182396472	277249307	/nfs/dbraw/zinc/24/93/07/277249307.db2.gz	KQMMHDJSKBQZED-HOTGVXAUSA-N	1	0	278.396	1.595	50	0		CDAARO
C[NH2+]CC(=O)N[C@H]1CCCc2nc(-c3ccccc3)ncc21	ZINC000091304844	277264577	/nfs/dbraw/zinc/26/45/77/277264577.db2.gz	MSNADHPBLZLXTD-AWEZNQCLSA-N	1	0	296.374	1.857	50	0		CDAARO
COc1cccc2c(=O)n(C[C@H]3CCC[NH2+]3)cnc12	ZINC000032550917	277458682	/nfs/dbraw/zinc/45/86/82/277458682.db2.gz	VSLCXLHJQHRHQX-SNVBAGLBSA-N	1	0	259.309	1.157	50	0		CDAARO
C[C@H]1CC[N@H+](CC(=O)N[C@@H]2CCOC(C)(C)C2)C1	ZINC000408517998	278366977	/nfs/dbraw/zinc/36/69/77/278366977.db2.gz	RJLUFBWQISIMIP-NWDGAFQWSA-N	1	0	254.374	1.402	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@@]2(C[NH2+]CCO2)C1	ZINC000072194301	278393606	/nfs/dbraw/zinc/39/36/06/278393606.db2.gz	KSLJZAAAQPGVRM-CYBMUJFWSA-N	1	0	256.346	1.376	50	0		CDAARO
Cc1cnc(C)c(N2CC[NH+](C[C@@H]3CCOC3)CC2)n1	ZINC000184131803	279010854	/nfs/dbraw/zinc/01/08/54/279010854.db2.gz	NRXSYXHUYPRMRE-AWEZNQCLSA-N	1	0	276.384	1.252	50	0		CDAARO
CC(C)[NH2+][C@@H]1CCOC[C@H]1OCc1cscn1	ZINC000220129778	279627399	/nfs/dbraw/zinc/62/73/99/279627399.db2.gz	KPZWWPNWRPPUOQ-VXGBXAGGSA-N	1	0	256.371	1.815	50	0		CDAARO
Cn1cc(C(=O)N2CCC[C@@H]2C[NH+]2CCCC2)ccc1=O	ZINC000194678391	280047936	/nfs/dbraw/zinc/04/79/36/280047936.db2.gz	ZSOLFAGQIXDRQM-CQSZACIVSA-N	1	0	289.379	1.086	50	0		CDAARO
CC(C)[C@H](O)C[N@@H+]1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1	ZINC000366596191	280346895	/nfs/dbraw/zinc/34/68/95/280346895.db2.gz	JQFASDZYGMLPOI-VHDGCEQUSA-N	1	0	280.412	1.479	50	0		CDAARO
CCO[C@@H]1C[C@H](O)C12CC[NH+](C[C@@H](O)C(F)(F)F)CC2	ZINC000248542603	280363803	/nfs/dbraw/zinc/36/38/03/280363803.db2.gz	CCENWSOZKFLRMB-HBNTYKKESA-N	1	0	297.317	1.162	50	0		CDAARO
CC[C@@H]1CN(CC[NH3+])Cc2cc(OC)ccc2O1	ZINC000299761679	280413813	/nfs/dbraw/zinc/41/38/13/280413813.db2.gz	YZGVYMDQHNCGTA-GFCCVEGCSA-N	1	0	250.342	1.627	50	0		CDAARO
Cc1cc(N2CCC[C@@H]2C[NH+]2C[C@H](C)O[C@@H](C)C2)ncn1	ZINC000253370650	280553233	/nfs/dbraw/zinc/55/32/33/280553233.db2.gz	UGOIEYRKZQPEMU-SOUVJXGZSA-N	1	0	290.411	1.863	50	0		CDAARO
C[C@H](C(=O)N1C[C@H](C)C[C@@H](C)C1)[NH+]1CCC(O)CC1	ZINC000040460096	289315503	/nfs/dbraw/zinc/31/55/03/289315503.db2.gz	JERNGNIEVLLHNX-JHJVBQTASA-N	1	0	268.401	1.336	50	0		CDAARO
Cn1cncc1CN1CCCC[C@H]1C[NH+]1CCCC1	ZINC000215922444	294483202	/nfs/dbraw/zinc/48/32/02/294483202.db2.gz	CWWJRBCEGICUHS-AWEZNQCLSA-N	1	0	262.401	1.870	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC000269152576	295258236	/nfs/dbraw/zinc/25/82/36/295258236.db2.gz	CCFXRXNBDGFPNN-BPNCWPANSA-N	1	0	262.328	1.736	50	0		CDAARO
CC[N@H+](C)C1(CNc2nc(N)nc3nc[nH]c32)CCCC1	ZINC000534639417	328335152	/nfs/dbraw/zinc/33/51/52/328335152.db2.gz	KSGYLJNAHDKRQG-UHFFFAOYSA-N	1	0	289.387	1.393	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)Cc2ccncc2)CC1	ZINC000534651047	328337092	/nfs/dbraw/zinc/33/70/92/328337092.db2.gz	ZYFRYJSZVUFPBO-UHFFFAOYSA-N	1	0	261.369	1.615	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCNc2cccc(C(N)=O)n2)C1	ZINC000534654385	328338872	/nfs/dbraw/zinc/33/88/72/328338872.db2.gz	CANGQWYTZXWAFW-NSHDSACASA-N	1	0	262.357	1.324	50	0		CDAARO
C1CCN([C@H]2COC[C@@H]2[NH2+]C2CSCCSC2)C1	ZINC000534666888	328345526	/nfs/dbraw/zinc/34/55/26/328345526.db2.gz	KVWVNVKTEFGEKI-STQMWFEESA-N	1	0	288.482	1.288	50	0		CDAARO
CC[C@H]([NH2+]CC(=O)NC1CC1)c1c(C)nn(C)c1C	ZINC000097374421	323207802	/nfs/dbraw/zinc/20/78/02/323207802.db2.gz	OTUAMXZXJJDHSK-LBPRGKRZSA-N	1	0	264.373	1.356	50	0		CDAARO
Cc1c[nH]cc1C(=O)N1CCC[C@@H]([NH+]2CCOCC2)CC1	ZINC000584226323	327068676	/nfs/dbraw/zinc/06/86/76/327068676.db2.gz	QAVYIJOJHBDJCR-CQSZACIVSA-N	1	0	291.395	1.650	50	0		CDAARO
COc1ccc(CCNc2nnc(C(C)(C)[NH3+])o2)cc1	ZINC001772709868	1159444036	/nfs/dbraw/zinc/44/40/36/1159444036.db2.gz	NRDFIPMYHQGKLR-UHFFFAOYSA-N	1	0	276.340	1.927	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+][C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000090919033	482519193	/nfs/dbraw/zinc/51/91/93/482519193.db2.gz	ZPCLXIWDZKCOCF-CWRNSKLLSA-N	1	0	288.391	1.945	50	0		CDAARO
CC(=O)NC(C)(C)C[C@H](C)[N@@H+]1CCc2n[nH]c(C)c2C1	ZINC000670440139	482985439	/nfs/dbraw/zinc/98/54/39/482985439.db2.gz	PZKOBXRVOAPQDP-JTQLQIEISA-N	1	0	278.400	1.770	50	0		CDAARO
COc1ncccc1C[N@@H+]1CC[C@H](C(C)(C)O)C1	ZINC000670440199	482985733	/nfs/dbraw/zinc/98/57/33/482985733.db2.gz	DNNSDBFFPDQDPA-LBPRGKRZSA-N	1	0	250.342	1.683	50	0		CDAARO
Cc1n[nH]c(C)c1CCC[N@@H+](C)CC(=O)NC1CC1	ZINC000670443004	482990286	/nfs/dbraw/zinc/99/02/86/482990286.db2.gz	DLDXMHBFHBCXME-UHFFFAOYSA-N	1	0	264.373	1.170	50	0		CDAARO
CC(C)[N@@H+]1CCO[C@@H](CC(=O)NCCC2(O)CCCC2)C1	ZINC000670447701	483001757	/nfs/dbraw/zinc/00/17/57/483001757.db2.gz	JUNLXKCSGOQRCA-AWEZNQCLSA-N	1	0	298.427	1.297	50	0		CDAARO
CNC(=O)C[C@H]1CC[N@H+](Cc2cc(CC(C)C)n[nH]2)C1	ZINC000670449785	483010048	/nfs/dbraw/zinc/01/00/48/483010048.db2.gz	KMFFRWYSGHOZIW-GFCCVEGCSA-N	1	0	278.400	1.566	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(C(=O)C2CCCCCC2)C[C@H]1O	ZINC000670451825	483015319	/nfs/dbraw/zinc/01/53/19/483015319.db2.gz	QHDMVJUQLNEPHE-LSDHHAIUSA-N	1	0	282.428	1.728	50	0		CDAARO
COCCCC1CC[NH+](CC(=O)N2CCCC2)CC1	ZINC000670457181	483037326	/nfs/dbraw/zinc/03/73/26/483037326.db2.gz	LBYYUONMFOOVBT-UHFFFAOYSA-N	1	0	268.401	1.747	50	0		CDAARO
COc1nc(N2CC[C@H](C[NH+](C)C)C2)ncc1F	ZINC000670460136	483042715	/nfs/dbraw/zinc/04/27/15/483042715.db2.gz	NQNFATNIUAWIRN-SECBINFHSA-N	1	0	254.309	1.012	50	0		CDAARO
Cc1cc(N(C)C[C@H]2CCOC2)nc(N2CCOCC2)[nH+]1	ZINC000670460424	483043472	/nfs/dbraw/zinc/04/34/72/483043472.db2.gz	WUMYQCSCYRVGIA-CYBMUJFWSA-N	1	0	292.383	1.094	50	0		CDAARO
CC[N@@H+]1CC[C@@H](NC(=O)CCC(=O)N2CCCCCC2)C1	ZINC000670467816	483060330	/nfs/dbraw/zinc/06/03/30/483060330.db2.gz	GTOWJZISZIVWCC-CQSZACIVSA-N	1	0	295.427	1.380	50	0		CDAARO
CCCCc1ncc(C[N@H+](C)C[C@H]2CC(=O)N(C)C2)[nH]1	ZINC000670469387	483063430	/nfs/dbraw/zinc/06/34/30/483063430.db2.gz	NMRNSDLIFYJQPP-GFCCVEGCSA-N	1	0	278.400	1.662	50	0		CDAARO
C[N@H+](CC[C@@H]1CCCCO1)CC(=O)N1CCCC1	ZINC000680370702	483598753	/nfs/dbraw/zinc/59/87/53/483598753.db2.gz	KALJQLVAHMZTPC-ZDUSSCGKSA-N	1	0	254.374	1.500	50	0		CDAARO
O=C(CCc1nc2cc(F)ccc2[nH]1)N[C@@H]1CCC[NH2+]C1	ZINC000097819489	534494309	/nfs/dbraw/zinc/49/43/09/534494309.db2.gz	KWZIMXSDFSDPMN-LLVKDONJSA-N	1	0	290.342	1.503	50	0		CDAARO
CC[C@H](Oc1ccc(OC)cc1)C(=O)NCC[NH+](C)C	ZINC000013670676	522874857	/nfs/dbraw/zinc/87/48/57/522874857.db2.gz	SZRAEUNZTJAZGV-AWEZNQCLSA-N	1	0	280.368	1.530	50	0		CDAARO
C[C@H]1CNC(=O)CC[N@@H+]1Cc1ccc(-n2ccnc2)cc1	ZINC000067982850	524690804	/nfs/dbraw/zinc/69/08/04/524690804.db2.gz	YKHMIWPLEWYBHE-ZDUSSCGKSA-N	1	0	284.363	1.583	50	0		CDAARO
c1cc(C[NH2+]CCCn2cnc3ccccc32)n[nH]1	ZINC000036900172	526426222	/nfs/dbraw/zinc/42/62/22/526426222.db2.gz	XYELBZQQVSXVFB-UHFFFAOYSA-N	1	0	255.325	1.939	50	0		CDAARO
CC[NH+](CC)[C@H]1CCN(C(=O)N[C@@H](C)CSC)C1	ZINC000096440480	528285271	/nfs/dbraw/zinc/28/52/71/528285271.db2.gz	JAVJKSZHPJTCGK-RYUDHWBXSA-N	1	0	273.446	1.864	50	0		CDAARO
C[NH2+][C@@H]1CCCN(Cc2cccc3c2OCCO3)C1	ZINC000261758982	536362758	/nfs/dbraw/zinc/36/27/58/536362758.db2.gz	MSRPQFZBJLAHKL-CYBMUJFWSA-N	1	0	262.353	1.642	50	0		CDAARO
Cn1cc(C[NH2+]Cc2ccnc(-n3cccn3)c2)cn1	ZINC000097159085	538438064	/nfs/dbraw/zinc/43/80/64/538438064.db2.gz	VQOKDWDXLGCLTG-UHFFFAOYSA-N	1	0	268.324	1.291	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]Cc1ccc(-n2cccn2)nc1	ZINC000097159286	567905090	/nfs/dbraw/zinc/90/50/90/567905090.db2.gz	WYUPWWBBHUQWKO-UHFFFAOYSA-N	1	0	268.324	1.589	50	0		CDAARO
COc1ccc2[nH]c(CNC(=O)[C@H]3CC[C@@H]([NH3+])C3)nc2c1	ZINC000072434729	567905094	/nfs/dbraw/zinc/90/50/94/567905094.db2.gz	QDLCAXKMHCUAKA-VHSXEESVSA-N	1	0	288.351	1.315	50	0		CDAARO
C[C@@H]1C[NH2+][C@H]([C@@H]2CC[C@@H](C(F)(F)F)NC2)[C@H](N)C1	ZINC000757209121	577035786	/nfs/dbraw/zinc/03/57/86/577035786.db2.gz	FYDKCBZQGYYGEM-UNQZSWDGSA-N	1	0	265.323	1.242	50	0		CDAARO
C[C@@H]1C[NH2+][C@H]([C@@H]2CC[C@@H](C(F)(F)F)NC2)[C@@H](N)C1	ZINC000757209112	577035831	/nfs/dbraw/zinc/03/58/31/577035831.db2.gz	FYDKCBZQGYYGEM-HPENLJRUSA-N	1	0	265.323	1.242	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@H]([NH3+])C2CCC2)C1	ZINC000958527912	613973215	/nfs/dbraw/zinc/97/32/15/613973215.db2.gz	IGZIYFQHBFBKLT-SNVBAGLBSA-N	1	0	256.346	1.096	50	0		CDAARO
C[NH2+]Cc1cn([C@@H]2CCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000888095817	617757038	/nfs/dbraw/zinc/75/70/38/617757038.db2.gz	HGGWOKCCVCIVGC-LLVKDONJSA-N	1	0	281.360	1.179	50	0		CDAARO
COc1ccc(/C=C/C[N@H+]2C[C@@H]3[C@H](C2)C3(CO)CO)cc1	ZINC001772711678	1159445874	/nfs/dbraw/zinc/44/58/74/1159445874.db2.gz	IYNBKEPAJDWOQV-HNQCBELMSA-N	1	0	289.375	1.241	50	0		CDAARO
O[C@@H](Cn1cc(C[C@H]2CC[NH2+]C2)nn1)c1ccccc1	ZINC000585135454	1164218280	/nfs/dbraw/zinc/21/82/80/1164218280.db2.gz	KSSICCQUBFAYRH-DOMZBBRYSA-N	1	0	272.352	1.164	50	0		CDAARO
CO[C@@H]1CCC[C@@]12CCCN(C(=O)C(C)(C)[NH3+])C2	ZINC001704329978	1177691522	/nfs/dbraw/zinc/69/15/22/1177691522.db2.gz	DXWZWAFEWIZEKT-RISCZKNCSA-N	1	0	254.374	1.531	50	0		CDAARO
Cc1cnc(N2[C@@H]3CC[C@H]2C[N@H+](C)CC3)nc1N(C)C	ZINC001704335593	1177693570	/nfs/dbraw/zinc/69/35/70/1177693570.db2.gz	CQMSXPZRJSCFPU-OLZOCXBDSA-N	1	0	275.400	1.524	50	0		CDAARO
CCc1ccc(C[N@H+](C)CCCn2cnnn2)nc1	ZINC001704348327	1177697394	/nfs/dbraw/zinc/69/73/94/1177697394.db2.gz	KKWNZJXAVRNGJI-UHFFFAOYSA-N	1	0	260.345	1.153	50	0		CDAARO
Cc1cnc2c(C(=O)N3CCC[C@]4(CC[NH2+]C4)C3)cnn2c1	ZINC000067805563	737057670	/nfs/dbraw/zinc/05/76/70/737057670.db2.gz	BZJWIKVBOBUPAU-MRXNPFEDSA-N	1	0	299.378	1.253	50	0		CDAARO
COc1ncc(C[NH2+][C@@H]2CCCN(C(=O)C(C)C)C2)cn1	ZINC000952985390	737455255	/nfs/dbraw/zinc/45/52/55/737455255.db2.gz	ACGALAWKEJOXJI-CYBMUJFWSA-N	1	0	292.383	1.222	50	0		CDAARO
C[C@@H](C(N)=O)[NH+]1CCC(CNC(=O)c2ccccc2)CC1	ZINC000952976949	739072534	/nfs/dbraw/zinc/07/25/34/739072534.db2.gz	NQNOJWOTKCIKKI-LBPRGKRZSA-N	1	0	289.379	1.002	50	0		CDAARO
C[C@@](O)(CN1CC[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1	ZINC000252689427	738910910	/nfs/dbraw/zinc/91/09/10/738910910.db2.gz	RDTJMZQABUUBAB-OWCLPIDISA-N	1	0	260.381	1.720	50	0		CDAARO
C[N@@H+]1CCC[C@H]1CCn1ccc2[nH]c(=O)c(C#N)cc2c1=O	ZINC000067513844	737614734	/nfs/dbraw/zinc/61/47/34/737614734.db2.gz	SHJODVAMZKLDJY-LBPRGKRZSA-N	1	0	298.346	1.046	50	0		CDAARO
O[C@@H]1C[N@H+](CCCC2CCCC2)CC[C@H]1N1CCOCC1	ZINC000012756322	737861025	/nfs/dbraw/zinc/86/10/25/737861025.db2.gz	DCPOTQBDHPYRKU-IAGOWNOFSA-N	1	0	296.455	1.724	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1CCNCc1cnccc1Cl	ZINC000952860196	910413668	/nfs/dbraw/zinc/41/36/68/910413668.db2.gz	HNQBQTLAUKRGNF-CYBMUJFWSA-N	1	0	283.803	1.671	50	0		CDAARO
CNC(=O)C[C@@H]1CC[N@H+](Cc2cc(C(C)C)no2)C1	ZINC000823821037	925731910	/nfs/dbraw/zinc/73/19/10/925731910.db2.gz	PDTLKHFGCHNMHP-NSHDSACASA-N	1	0	265.357	1.756	50	0		CDAARO
COc1ccc2c(c1)CC[C@@H]([N@@H+]1CCCNC(=O)C1)C2	ZINC000824751217	925835143	/nfs/dbraw/zinc/83/51/43/925835143.db2.gz	UFAVSRDIUOEFTE-CQSZACIVSA-N	1	0	274.364	1.374	50	0		CDAARO
CC1(C)CC(CC(=O)N2CCOCC2)CC(C)(C)[NH2+]1	ZINC000827968278	926007723	/nfs/dbraw/zinc/00/77/23/926007723.db2.gz	MIBSYZVPDSMCCZ-UHFFFAOYSA-N	1	0	268.401	1.792	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)c1ccc(O)c(F)c1	ZINC000828152430	926056819	/nfs/dbraw/zinc/05/68/19/926056819.db2.gz	BOHTYKKNQZNQNK-UHFFFAOYSA-N	1	0	289.310	1.499	50	0		CDAARO
O=C(NCCCCO)[C@H]1CC[N@H+](Cc2ccc(F)cc2)C1	ZINC000585091085	930927929	/nfs/dbraw/zinc/92/79/29/930927929.db2.gz	VQMOEXTVDCRTDG-AWEZNQCLSA-N	1	0	294.370	1.536	50	0		CDAARO
Cc1cc(C[N@@H+]2CCC[C@@]23CCNC3=O)ccc1F	ZINC000585116549	930967385	/nfs/dbraw/zinc/96/73/85/930967385.db2.gz	AMRIZZZEGALSCH-HNNXBMFYSA-N	1	0	262.328	1.989	50	0		CDAARO
C[C@@H](C[NH+](C)C)[C@@H]1CCCCN1C(=O)c1ccn(C)n1	ZINC000585128029	931012877	/nfs/dbraw/zinc/01/28/77/931012877.db2.gz	PZQKUTBBNDUKPR-JSGCOSHPSA-N	1	0	278.400	1.613	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N1CCC[C@@H]1C[NH3+]	ZINC000193296409	932872481	/nfs/dbraw/zinc/87/24/81/932872481.db2.gz	LVVOEOYVDFUULO-GFCCVEGCSA-N	1	0	268.382	1.361	50	0		CDAARO
COC1(OC)CC[C@H]1[NH2+][C@@H]1CCN(c2ncccc2F)C1	ZINC000864097256	934606646	/nfs/dbraw/zinc/60/66/46/934606646.db2.gz	RAMMOLPSMPDHBX-DGCLKSJQSA-N	1	0	295.358	1.541	50	0		CDAARO
CC[N@@H+]1CCC[C@](C)(c2nc(-c3cccnn3)no2)C1	ZINC000091657194	934871843	/nfs/dbraw/zinc/87/18/43/934871843.db2.gz	LANHSYVOIHBASO-AWEZNQCLSA-N	1	0	273.340	1.900	50	0		CDAARO
C/C=C(\C)C(=O)N[C@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000015064325	935533504	/nfs/dbraw/zinc/53/35/04/935533504.db2.gz	DPGQARWKGYRQOU-HIICFIELSA-N	1	0	279.428	1.627	50	0		CDAARO
CC(C)C[N@@H+]1CCN(CCCn2cccc2)C[C@@H]1CCO	ZINC001529180618	969006304	/nfs/dbraw/zinc/00/63/04/969006304.db2.gz	FQEPCWKHPPUSPQ-KRWDZBQOSA-N	1	0	293.455	1.903	50	0		CDAARO
O[C@@H]1C[N@H+](Cc2ccoc2)C[C@H]1Cc1ccccn1	ZINC001529180218	969007307	/nfs/dbraw/zinc/00/73/07/969007307.db2.gz	DMZDSCAXBSUIQY-UKRRQHHQSA-N	1	0	258.321	1.710	50	0		CDAARO
O=C([C@@H]1C=CC[NH2+]1)N1CCOc2ccc(Cl)cc2C1	ZINC001506400568	975149447	/nfs/dbraw/zinc/14/94/47/975149447.db2.gz	KMAWLNFRIBHVRI-LBPRGKRZSA-N	1	0	278.739	1.589	50	0		CDAARO
CCS(=O)(=O)N1CC[C@@H](C)[N@H+](Cc2ccccc2)CC1	ZINC000098014185	230390999	/nfs/dbraw/zinc/39/09/99/230390999.db2.gz	IOCLUNDYWLGUSC-CQSZACIVSA-N	1	0	296.436	1.933	50	0		CDAARO
C[C@H]1C[C@@H](NC(=O)CCC(=O)OC(C)(C)C)C[N@@H+]1C1CC1	ZINC000192395512	342467832	/nfs/dbraw/zinc/46/78/32/342467832.db2.gz	AYDFKXVWFGFBHU-NWDGAFQWSA-N	1	0	296.411	1.850	50	0		CDAARO
C[C@H]1C[C@@H]([NH3+])CCN1C(=O)Cc1noc2ccccc21	ZINC000129266510	230394544	/nfs/dbraw/zinc/39/45/44/230394544.db2.gz	JZUDIZMCCZSVLD-QWRGUYRKSA-N	1	0	273.336	1.709	50	0		CDAARO
CCOC(=O)[C@@H]1[C@H](C(=O)OCC)C(C)(C)[C@H]1[NH+]1CCCC1	ZINC000004489512	341995688	/nfs/dbraw/zinc/99/56/88/341995688.db2.gz	RJAIFMNTFDYYIO-UPJWGTAASA-N	1	0	297.395	1.849	50	0		CDAARO
CCOC(=O)C1CC2CC(C(=O)OCC)CC(C1)[NH2+]2	ZINC000095630161	185016906	/nfs/dbraw/zinc/01/69/06/185016906.db2.gz	CYOAMOAKXMVYBL-UHFFFAOYSA-N	1	0	269.341	1.259	50	0		CDAARO
CC[C@H](O)C[N@@H+]1CCC[C@H](c2n[nH]cc2C(=O)N(C)C)C1	ZINC000252504815	398217884	/nfs/dbraw/zinc/21/78/84/398217884.db2.gz	VMEFENNTVPEKJB-RYUDHWBXSA-N	1	0	294.399	1.062	50	0		CDAARO
Cc1cccc(CS(=O)(=O)NC2(C[NH3+])CCCC2)c1	ZINC000095972630	185049447	/nfs/dbraw/zinc/04/94/47/185049447.db2.gz	UABKGROCXZKIPO-UHFFFAOYSA-N	1	0	282.409	1.686	50	0		CDAARO
C[C@@H](Cn1ncc2ccccc2c1=O)[NH2+][C@H]1CCOC1	ZINC000095983744	185053784	/nfs/dbraw/zinc/05/37/84/185053784.db2.gz	CDLTVFMCRBLJSI-AAEUAGOBSA-N	1	0	273.336	1.164	50	0		CDAARO
C[C@H]1C[NH+](CCCNc2cnccc2C(N)=O)C[C@H](C)O1	ZINC000096006362	185063054	/nfs/dbraw/zinc/06/30/54/185063054.db2.gz	ONZODLAPJLLZAU-RYUDHWBXSA-N	1	0	292.383	1.092	50	0		CDAARO
Cn1nccc1C[NH2+]C[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000096010200	185064412	/nfs/dbraw/zinc/06/44/12/185064412.db2.gz	FTYKBXRESNNZAX-LBPRGKRZSA-N	1	0	294.399	1.767	50	0		CDAARO
COCc1noc([C@H](C)[NH2+][C@H]2CCCC[C@@H]2CO)n1	ZINC000124990367	187164361	/nfs/dbraw/zinc/16/43/61/187164361.db2.gz	RGSSMHKFNNLJBB-AXFHLTTASA-N	1	0	269.345	1.418	50	0		CDAARO
CC(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2CO)cc1	ZINC000004948372	342089119	/nfs/dbraw/zinc/08/91/19/342089119.db2.gz	AJAAWXFYHFPWRQ-HNNXBMFYSA-N	1	0	262.353	1.992	50	0		CDAARO
CCNC(=O)N1CC[NH+](C2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000089977450	539087707	/nfs/dbraw/zinc/08/77/07/539087707.db2.gz	MHYLTMMDNDQXHG-VXGBXAGGSA-N	1	0	269.389	1.290	50	0		CDAARO
O=C(C[NH+]1CCCCCCC1)NCCc1cnccn1	ZINC000243915027	361830689	/nfs/dbraw/zinc/83/06/89/361830689.db2.gz	BLWDMPZEEJLVTO-UHFFFAOYSA-N	1	0	276.384	1.401	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](NC(=O)c2cc(C)n(C)c2C)C1	ZINC000244701187	361856901	/nfs/dbraw/zinc/85/69/01/361856901.db2.gz	KBSNCQIWFKRLME-CYBMUJFWSA-N	1	0	263.385	1.856	50	0		CDAARO
C[N@H+](CCC(=O)NCc1ccccc1F)CC1(C)COC1	ZINC000244742260	361862090	/nfs/dbraw/zinc/86/20/90/361862090.db2.gz	OENCRJOARAIBNM-UHFFFAOYSA-N	1	0	294.370	1.800	50	0		CDAARO
CCN1CCC[C@H]1C[NH2+][C@H](C)C(=O)NC1CCCC1	ZINC000022029937	342175321	/nfs/dbraw/zinc/17/53/21/342175321.db2.gz	ZWGSMRCMUMXBCS-OCCSQVGLSA-N	1	0	267.417	1.508	50	0		CDAARO
O=C(NCCC[NH2+][C@H]1CCCNC(=O)C1)c1cccs1	ZINC000585134821	342215581	/nfs/dbraw/zinc/21/55/81/342215581.db2.gz	KTWCFVLQDHHNHM-NSHDSACASA-N	1	0	295.408	1.126	50	0		CDAARO
C[N@@H+]1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccco3)[C@H]2C1	ZINC000685939754	539045596	/nfs/dbraw/zinc/04/55/96/539045596.db2.gz	HXZSYWQLVLBTLQ-SYQHCUMBSA-N	1	0	274.364	1.936	50	0		CDAARO
COC1(OC)CCOC[C@H]1[NH2+]CCc1ccncc1C	ZINC000685943208	539046017	/nfs/dbraw/zinc/04/60/17/539046017.db2.gz	GBFWSHGBCPXDCW-CQSZACIVSA-N	1	0	280.368	1.300	50	0		CDAARO
c1csc(-c2n[nH]cc2C[NH2+]C[C@H]2COCCO2)c1	ZINC000037998247	362101152	/nfs/dbraw/zinc/10/11/52/362101152.db2.gz	ZZWZSPXVBLRBHA-NSHDSACASA-N	1	0	279.365	1.643	50	0		CDAARO
NC(=O)[C@@H]1CCC[N@H+](Cc2ccc3c(c2)OCCO3)C1	ZINC000084459122	362264856	/nfs/dbraw/zinc/26/48/56/362264856.db2.gz	XFWSGVNCONYHED-GFCCVEGCSA-N	1	0	276.336	1.155	50	0		CDAARO
CN(C[C@@H]1CCCO1)C(=O)c1ccc(C[NH+](C)C)cc1	ZINC000083851184	362255553	/nfs/dbraw/zinc/25/55/53/362255553.db2.gz	XEWFZTBKKVRNMX-HNNXBMFYSA-N	1	0	276.380	1.999	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1C(=O)/C=C/c1ccc2c(c1)CCO2	ZINC000089937733	362323358	/nfs/dbraw/zinc/32/33/58/362323358.db2.gz	DOFORYIRJBVTPP-BPJJOFIESA-N	1	0	286.375	1.797	50	0		CDAARO
O=C(N[C@@H]1CCCC[C@H]1CO)[C@H]1CC12CC[NH2+]CC2	ZINC000300729574	344178238	/nfs/dbraw/zinc/17/82/38/344178238.db2.gz	KZFLCDFUBJTKOW-YNEHKIRRSA-N	1	0	266.385	1.043	50	0		CDAARO
C/C=C/CC(=O)N[C@H]([C@H]1C[C@H](O)C1)C1CC[NH2+]CC1	ZINC000252538927	362392391	/nfs/dbraw/zinc/39/23/91/362392391.db2.gz	NJJZJBUMDUBCHY-QKUGQPBVSA-N	1	0	266.385	1.208	50	0		CDAARO
CCC(C)(C)C[NH2+]C1CCN(CC(=O)OC)CC1	ZINC000192026350	362610119	/nfs/dbraw/zinc/61/01/19/362610119.db2.gz	DNXAYVKFZVRWCB-UHFFFAOYSA-N	1	0	256.390	1.650	50	0		CDAARO
CCCCC[N@@H+]1CC[C@@]2(C1)NC(=O)N(C(C)C)C2=O	ZINC000089953438	347629677	/nfs/dbraw/zinc/62/96/77/347629677.db2.gz	MHTBTXXHEQPMJB-AWEZNQCLSA-N	1	0	267.373	1.581	50	0		CDAARO
Cc1cc(CC(=O)N2CC[NH+](CC3CCC3)CC2)on1	ZINC000584887310	349345534	/nfs/dbraw/zinc/34/55/34/349345534.db2.gz	NVYKKOPUDKUVSF-UHFFFAOYSA-N	1	0	277.368	1.470	50	0		CDAARO
CCCS(=O)(=O)NC[C@H](C)[NH2+]Cc1cnc(C)cc1C	ZINC000584888225	349346657	/nfs/dbraw/zinc/34/66/57/349346657.db2.gz	SOAXEZATQTYCFD-ZDUSSCGKSA-N	1	0	299.440	1.506	50	0		CDAARO
O=C(Cn1cccc1)N1CCC(C[NH+]2CCOCC2)CC1	ZINC000584888862	349347193	/nfs/dbraw/zinc/34/71/93/349347193.db2.gz	WZWHDOAIEQJPPH-UHFFFAOYSA-N	1	0	291.395	1.059	50	0		CDAARO
[NH3+]Cc1cccc(C(=O)N[C@@H]2CCc3c[nH]nc3C2)c1	ZINC000584888538	349347272	/nfs/dbraw/zinc/34/72/72/349347272.db2.gz	XSDYABUCVHVGST-CYBMUJFWSA-N	1	0	270.336	1.156	50	0		CDAARO
O[C@H]1C[N@@H+](C2Cc3ccccc3C2)C[C@@H]1N1CCCCC1	ZINC000584897839	349358741	/nfs/dbraw/zinc/35/87/41/349358741.db2.gz	NNELFJICFWNEMP-ROUUACIJSA-N	1	0	286.419	1.685	50	0		CDAARO
CSCC(=O)N1CC[NH+](CC2CCCC2)CC1	ZINC000584900476	349362340	/nfs/dbraw/zinc/36/23/40/349362340.db2.gz	HUDDIGKYDRBUDD-UHFFFAOYSA-N	1	0	256.415	1.684	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCNc2ccncn2)C[C@H](C)O1	ZINC000091636531	180211445	/nfs/dbraw/zinc/21/14/45/180211445.db2.gz	ZSULTZWFURWMBX-TXEJJXNPSA-N	1	0	250.346	1.388	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2cc(C)nc(C)c2)C[C@@H]1[NH3+]	ZINC000091756402	180246580	/nfs/dbraw/zinc/24/65/80/180246580.db2.gz	HLTZCAWSGVWIPS-JSGCOSHPSA-N	1	0	261.369	1.898	50	0		CDAARO
Cc1n[nH]c(C)c1CN1CC2(CC[NH2+]CC2)CCC1=O	ZINC000091997199	180302993	/nfs/dbraw/zinc/30/29/93/180302993.db2.gz	LKUBSCCQGJLONN-UHFFFAOYSA-N	1	0	276.384	1.519	50	0		CDAARO
Cc1nc(CCN(C)C(=O)CC[C@H]2CCC[N@H+](C)C2)no1	ZINC000092045745	180310617	/nfs/dbraw/zinc/31/06/17/180310617.db2.gz	PTDBGVZTQXFKHQ-CYBMUJFWSA-N	1	0	294.399	1.501	50	0		CDAARO
CS[C@@H]1CC[C@H]([N@H+](C)CCC(=O)N2CCOCC2)C1	ZINC000107064369	186157763	/nfs/dbraw/zinc/15/77/63/186157763.db2.gz	SPHUPVKMEXUCGK-QWHCGFSZSA-N	1	0	286.441	1.451	50	0		CDAARO
OC[C@H]1C[C@@H]2CC[N@@H+]1C[C@@H]2c1cn(Cc2ccccc2)nn1	ZINC000070633574	351248683	/nfs/dbraw/zinc/24/86/83/351248683.db2.gz	IYEFDCIUQZOKFX-XHSDSOJGSA-N	1	0	298.390	1.497	50	0	biogenic,in-vitro	CDAARO
CN1CC[N@H+](C)Cc2ccc(NC(=O)[C@@H]3CCCO3)cc21	ZINC000095986350	351465575	/nfs/dbraw/zinc/46/55/75/351465575.db2.gz	DYNBUWDRUFWCHR-HNNXBMFYSA-N	1	0	289.379	1.686	50	0		CDAARO
C[C@@H]1C[C@H](CNC(=O)NC[C@H]2CCCC[N@H+](C)C2)[C@@H](C)O1	ZINC000624207761	351481294	/nfs/dbraw/zinc/48/12/94/351481294.db2.gz	PXGYLTIJZICRKH-KBUPBQIOSA-N	1	0	297.443	1.831	50	0		CDAARO
[NH3+]C[C@H]1CCCN1C(=O)Cc1cccc(Cl)c1	ZINC000122332158	187026874	/nfs/dbraw/zinc/02/68/74/187026874.db2.gz	VEEJZMGUTOTBQC-GFCCVEGCSA-N	1	0	252.745	1.832	50	0		CDAARO
O=S(=O)(c1cc(F)ccc1Cl)N1CCC[NH2+]CC1	ZINC000123875972	187112918	/nfs/dbraw/zinc/11/29/18/187112918.db2.gz	KYWINVBUQOSCRE-UHFFFAOYSA-N	1	0	292.763	1.463	50	0		CDAARO
CCc1ccc([C@H](C)NC(=O)[C@H]2C[C@H](O)C[NH2+]2)cc1	ZINC000037016600	363313343	/nfs/dbraw/zinc/31/33/43/363313343.db2.gz	GKISWOWMXQUIKE-LEWSCRJBSA-N	1	0	262.353	1.149	50	0		CDAARO
COCCC[NH2+]CCOCCOc1cccc(OC)c1	ZINC000002981111	355989967	/nfs/dbraw/zinc/98/99/67/355989967.db2.gz	XBEQXAQUJFMOIT-UHFFFAOYSA-N	1	0	283.368	1.717	50	0		CDAARO
COCC[NH2+]CCOCCOc1ccccc1OC	ZINC000002981067	355990213	/nfs/dbraw/zinc/99/02/13/355990213.db2.gz	LGYVKYUVHBXPGG-UHFFFAOYSA-N	1	0	269.341	1.327	50	0		CDAARO
CCOc1ccc(NC(=O)C[NH2+]C)cc1OCC	ZINC000003336015	355999819	/nfs/dbraw/zinc/99/98/19/355999819.db2.gz	BYEPBHRSIJSTCE-UHFFFAOYSA-N	1	0	252.314	1.642	50	0		CDAARO
CCCS(=O)(=O)c1ccccc1N1CC[NH2+]CC1	ZINC000035062056	356003355	/nfs/dbraw/zinc/00/33/55/356003355.db2.gz	FNXWWLAMYSBLBO-UHFFFAOYSA-N	1	0	268.382	1.280	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@H](C[NH2+]Cc2csnn2)C1	ZINC000097373161	356093652	/nfs/dbraw/zinc/09/36/52/356093652.db2.gz	XOBLGUSZCPMHFI-JTQLQIEISA-N	1	0	298.412	1.885	50	0		CDAARO
COc1ccc2ccccc2c1C[NH2+]CCOCCO	ZINC000010435731	356258200	/nfs/dbraw/zinc/25/82/00/356258200.db2.gz	ITVOEIKLIRIIJT-UHFFFAOYSA-N	1	0	275.348	1.947	50	0		CDAARO
COc1cc(N2CCC[C@H](CC[NH3+])C2)nc(OC)n1	ZINC000032560958	356264469	/nfs/dbraw/zinc/26/44/69/356264469.db2.gz	AUWFVXNLQUDNEB-SNVBAGLBSA-N	1	0	266.345	1.059	50	0		CDAARO
O=C1C[C@@H]([NH2+]CC2CC2)CN1CCc1ccc(F)cc1	ZINC000011816799	356279775	/nfs/dbraw/zinc/27/97/75/356279775.db2.gz	UOEFWZZVTXYLSA-OAHLLOKOSA-N	1	0	276.355	1.969	50	0		CDAARO
Cc1cc(=O)[nH]c(Nc2ccc(N3CC[NH+](C)CC3)cc2)n1	ZINC000011903414	356284188	/nfs/dbraw/zinc/28/41/88/356284188.db2.gz	HHZWPDLKBUJDRK-UHFFFAOYSA-N	1	0	299.378	1.574	50	0		CDAARO
COc1cccc(OC[C@@H](O)C[NH2+]C2CCSCC2)c1	ZINC000032576320	356286993	/nfs/dbraw/zinc/28/69/93/356286993.db2.gz	FJOCIBSNHFCDJX-ZDUSSCGKSA-N	1	0	297.420	1.920	50	0		CDAARO
COc1ccccc1C(=O)O[C@H](C)CN1CC[NH+](C)CC1	ZINC000019456185	356485790	/nfs/dbraw/zinc/48/57/90/356485790.db2.gz	SMDGVVGPMXNGMT-CYBMUJFWSA-N	1	0	292.379	1.488	50	0		CDAARO
CCN1CCC([N@@H+]2CCC[C@H](C(=O)NC3CC3)C2)CC1	ZINC000019225409	356477979	/nfs/dbraw/zinc/47/79/79/356477979.db2.gz	ZCFWWTKTZWQHDT-ZDUSSCGKSA-N	1	0	279.428	1.461	50	0		CDAARO
COc1ccccc1C[NH2+]CCN1CCOCC1	ZINC000019570855	356492530	/nfs/dbraw/zinc/49/25/30/356492530.db2.gz	WGVIWMAMZMWHQZ-UHFFFAOYSA-N	1	0	250.342	1.117	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COc2cc(C)cc(C)c2)CC1	ZINC000019790739	356504098	/nfs/dbraw/zinc/50/40/98/356504098.db2.gz	GBSKQYUVKRBSIL-INIZCTEOSA-N	1	0	292.423	1.681	50	0		CDAARO
CCc1cccc(OCCOCCNCC[NH3+])c1	ZINC000020118666	356526141	/nfs/dbraw/zinc/52/61/41/356526141.db2.gz	BCTIEGXUBGRZOM-UHFFFAOYSA-N	1	0	252.358	1.193	50	0		CDAARO
O=C(CCN1CC[NH2+]CC1)N1CCCc2ccccc21	ZINC000020270091	356534292	/nfs/dbraw/zinc/53/42/92/356534292.db2.gz	NRLGITWXSKUZMF-UHFFFAOYSA-N	1	0	273.380	1.261	50	0		CDAARO
CCc1cc2c(ncnc2N2CC[NH+](CCO)CC2)s1	ZINC000020319961	356536753	/nfs/dbraw/zinc/53/67/53/356536753.db2.gz	BDXMTGMCYVHLJF-UHFFFAOYSA-N	1	0	292.408	1.368	50	0		CDAARO
COc1ccc(OC/C=C/CN2CC[NH+](C)CC2)cc1	ZINC000023114626	356628580	/nfs/dbraw/zinc/62/85/80/356628580.db2.gz	PKPWSLABDHLAAY-ONEGZZNKSA-N	1	0	276.380	1.878	50	0		CDAARO
CNC(=O)NC(=O)[C@@H](C)[N@H+](C)CCCOc1ccccc1	ZINC000029852597	356744061	/nfs/dbraw/zinc/74/40/61/356744061.db2.gz	XSWABDJEIFZWLQ-GFCCVEGCSA-N	1	0	293.367	1.231	50	0		CDAARO
CCc1nc(-c2ccc(N3CC[NH2+]CC3)cc2)no1	ZINC000032918118	356790206	/nfs/dbraw/zinc/79/02/06/356790206.db2.gz	KWYLVIIAIIBLEB-UHFFFAOYSA-N	1	0	258.325	1.709	50	0		CDAARO
C[N@@H+]1Cc2ccccc2C[C@H]1CNc1ncnc2nc[nH]c21	ZINC000032519383	356781946	/nfs/dbraw/zinc/78/19/46/356781946.db2.gz	GBEXVQBTQQUTKD-ZDUSSCGKSA-N	1	0	294.362	1.822	50	0		CDAARO
C[C@@H]1Oc2ccc(C(=O)C3CC[NH2+]CC3)cc2NC1=O	ZINC000036244099	356867286	/nfs/dbraw/zinc/86/72/86/356867286.db2.gz	JIPZQLXFNYZWRY-VIFPVBQESA-N	1	0	274.320	1.588	50	0		CDAARO
CCSC[C@H](C)[NH2+]C1CCN(S(C)(=O)=O)CC1	ZINC000067770212	356869513	/nfs/dbraw/zinc/86/95/13/356869513.db2.gz	QQZVKYCKQVEGTC-JTQLQIEISA-N	1	0	280.459	1.142	50	0		CDAARO
Cc1ccc(-c2noc(CN3CCC[NH2+]CC3)n2)cc1	ZINC000036964322	356892542	/nfs/dbraw/zinc/89/25/42/356892542.db2.gz	SPFNBVMQUZXECH-UHFFFAOYSA-N	1	0	272.352	1.840	50	0		CDAARO
O=C(NCCSc1ccccc1)[C@@H]1CCC[NH2+]C1	ZINC000037904343	356942510	/nfs/dbraw/zinc/94/25/10/356942510.db2.gz	FKBHOIUFYANGQK-GFCCVEGCSA-N	1	0	264.394	1.895	50	0		CDAARO
CN(CCCC(=O)N1CCC([NH3+])CC1)C(=O)OC(C)(C)C	ZINC000058040905	357375891	/nfs/dbraw/zinc/37/58/91/357375891.db2.gz	IPGKUTMFNCVJLB-UHFFFAOYSA-N	1	0	299.415	1.583	50	0		CDAARO
C[C@H](Oc1cccnc1)C(=O)N1CCC[C@H](C)[C@@H]1C[NH3+]	ZINC000247314680	357431732	/nfs/dbraw/zinc/43/17/32/357431732.db2.gz	RPDRENXZEZLVCM-OBJOEFQTSA-N	1	0	277.368	1.435	50	0		CDAARO
CN(CCCNC(=O)C[C@@H]1CC[NH2+]C1)c1ccccc1	ZINC000089717529	357508504	/nfs/dbraw/zinc/50/85/04/357508504.db2.gz	RSFSGLFJTBZVNS-AWEZNQCLSA-N	1	0	275.396	1.629	50	0		CDAARO
C[C@@H]1C[C@@H](OC[C@@H](O)C[NH+]2CCN(C)CC2)CC(C)(C)C1	ZINC000022937536	357445587	/nfs/dbraw/zinc/44/55/87/357445587.db2.gz	YVAWMZJIRZQCSS-OWCLPIDISA-N	1	0	298.471	1.826	50	0		CDAARO
CCC[N@H+](CCN1C[C@H]2CC[C@@H](C1)O2)CC1CC1	ZINC000095462334	283260692	/nfs/dbraw/zinc/26/06/92/283260692.db2.gz	LKYUNDDBIXFVRW-GASCZTMLSA-N	1	0	252.402	1.972	50	0		CDAARO
CNC(=O)C[C@@H](C)[N@H+](C)Cc1nc2c(s1)CCCC2	ZINC000065380258	357533515	/nfs/dbraw/zinc/53/35/15/357533515.db2.gz	LYSWTOIKNDWKQH-SNVBAGLBSA-N	1	0	281.425	1.978	50	0		CDAARO
Cc1cc(C)n(-c2cccc(C[N@@H+](C)C(CO)CO)c2)n1	ZINC000065394423	357535373	/nfs/dbraw/zinc/53/53/73/357535373.db2.gz	NNDFNFTWDWVLIG-UHFFFAOYSA-N	1	0	289.379	1.274	50	0		CDAARO
C[C@H]1Cc2cc(C[NH2+]CC(=O)Nc3cnccn3)ccc2O1	ZINC000065424123	357540539	/nfs/dbraw/zinc/54/05/39/357540539.db2.gz	LJWIBWGRVLNEGS-NSHDSACASA-N	1	0	298.346	1.528	50	0		CDAARO
O=C(c1onc2ccccc21)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000065419409	357540632	/nfs/dbraw/zinc/54/06/32/357540632.db2.gz	OCPCZHJKIFNCGV-MNOVXSKESA-N	1	0	271.320	1.794	50	0		CDAARO
COc1ccccc1/C=C/CN1C[C@H]([NH+](C)C)C[C@H]1CO	ZINC000065535357	357548028	/nfs/dbraw/zinc/54/80/28/357548028.db2.gz	DCRORHJRTKRDPJ-DODUIYEKSA-N	1	0	290.407	1.705	50	0		CDAARO
CC(=O)Nc1ccsc1C(=O)NC[C@H]1CCC[N@@H+](C)C1	ZINC000067694633	357619128	/nfs/dbraw/zinc/61/91/28/357619128.db2.gz	WSBXWTNVQLPWQY-LLVKDONJSA-N	1	0	295.408	1.778	50	0		CDAARO
Cc1nc2cc(C(=O)N3[C@@H]4CC[C@H]3C[NH2+]CC4)ccc2[nH]1	ZINC000067947972	357639941	/nfs/dbraw/zinc/63/99/41/357639941.db2.gz	LJLCTSCVMSUVFG-OLZOCXBDSA-N	1	0	284.363	1.838	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](NC(=O)c2cccc3c2NCCC3)C1	ZINC000067934915	357638770	/nfs/dbraw/zinc/63/87/70/357638770.db2.gz	BNYRXPWPTFLQKZ-VXGBXAGGSA-N	1	0	259.353	1.654	50	0		CDAARO
C[C@@H]1CN(C(=O)COc2ccccc2F)CC[NH2+]1	ZINC000188452822	357686568	/nfs/dbraw/zinc/68/65/68/357686568.db2.gz	GXRYYCQWCXZKOV-SNVBAGLBSA-N	1	0	252.289	1.025	50	0		CDAARO
Cc1nn(CCO)cc1CN1CCCC[C@@H]1CC[NH+](C)C	ZINC000072430388	357834789	/nfs/dbraw/zinc/83/47/89/357834789.db2.gz	CXZSYBOGZVZBSP-MRXNPFEDSA-N	1	0	294.443	1.490	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+][C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000097081559	357945086	/nfs/dbraw/zinc/94/50/86/357945086.db2.gz	DSJQXTFZCMWRTL-WDEREUQCSA-N	1	0	254.374	1.400	50	0		CDAARO
NC(=O)[C@@H]1CCCN1C1CC[NH+](CC2CCC2)CC1	ZINC000095981752	283320960	/nfs/dbraw/zinc/32/09/60/283320960.db2.gz	HVDZGBRRFCXTJC-AWEZNQCLSA-N	1	0	265.401	1.201	50	0		CDAARO
CCCc1cc(C(=O)N2CCC[C@@](O)(C[NH+](C)C)C2)no1	ZINC000082166664	358150662	/nfs/dbraw/zinc/15/06/62/358150662.db2.gz	RSYNKFVPDIVHHP-OAHLLOKOSA-N	1	0	295.383	1.156	50	0		CDAARO
COc1cccc(C[NH2+][C@@H]2CN3CCC2CC3)c1OC	ZINC000019947881	358226916	/nfs/dbraw/zinc/22/69/16/358226916.db2.gz	YHYGIQDGXVYBQX-CQSZACIVSA-N	1	0	276.380	1.888	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)Cc3ccc(F)cc3)C[C@H]12	ZINC000248651950	363608795	/nfs/dbraw/zinc/60/87/95/363608795.db2.gz	VDEYYPIKJPANTB-KWCYVHTRSA-N	1	0	262.328	1.564	50	0		CDAARO
CC(C)[C@H]([NH3+])C(=O)N1CCc2cccc(F)c2C1	ZINC000195555007	358557488	/nfs/dbraw/zinc/55/74/88/358557488.db2.gz	YNLOCYIJFHIDCM-ZDUSSCGKSA-N	1	0	250.317	1.694	50	0		CDAARO
CC(C)(C)c1ccc2c(c1)CCN2C(=O)[C@@H]1C[NH2+]CCO1	ZINC000195543384	358559872	/nfs/dbraw/zinc/55/98/72/358559872.db2.gz	BXGLPNPSEBHLPO-HNNXBMFYSA-N	1	0	288.391	1.862	50	0		CDAARO
CC(C)c1cc(N2CC[C@@H](N3CC[NH+](C)CC3)C2)ncn1	ZINC000095386161	358691069	/nfs/dbraw/zinc/69/10/69/358691069.db2.gz	HLJPGPUDOPEHCO-CQSZACIVSA-N	1	0	289.427	1.426	50	0		CDAARO
COc1c(C)cc(NC(=O)NCC[NH+](C)C)cc1C	ZINC000096153545	358710206	/nfs/dbraw/zinc/71/02/06/358710206.db2.gz	BFMLFFBGQZVWMV-UHFFFAOYSA-N	1	0	265.357	1.995	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](OC(=O)[C@H](CO)c1ccccc1)C2	ZINC000100009280	358817107	/nfs/dbraw/zinc/81/71/07/358817107.db2.gz	RKUNBYITZUJHSG-FXUDXRNXSA-N	1	0	289.375	1.931	50	0	endogenous,fda	CDAARO
CC[N@@H+]1CCCC[C@@H]1C(=O)NCCNc1cccnc1	ZINC000097492402	358780734	/nfs/dbraw/zinc/78/07/34/358780734.db2.gz	BBJZMQNHQITNTF-CQSZACIVSA-N	1	0	276.384	1.484	50	0		CDAARO
Cc1nc(C(=O)N2C[C@H]3C[NH2+]C[C@H]3C2)c(C)s1	ZINC000097527220	358782703	/nfs/dbraw/zinc/78/27/03/358782703.db2.gz	MBMYITRMYUSWHH-AOOOYVTPSA-N	1	0	251.355	1.051	50	0		CDAARO
CC(=O)c1cc(C(=O)N2C[C@H]3C[NH2+]C[C@H]3C2)cs1	ZINC000097604149	358787360	/nfs/dbraw/zinc/78/73/60/358787360.db2.gz	MSVFVZNELXMBGP-PHIMTYICSA-N	1	0	264.350	1.242	50	0		CDAARO
CN(C(=O)c1cc(C(F)(F)F)n[nH]1)[C@@H]1CC[N@H+](C)C1	ZINC000097681801	358793009	/nfs/dbraw/zinc/79/30/09/358793009.db2.gz	BVSWNMPLUPHBMA-SSDOTTSWSA-N	1	0	276.262	1.205	50	0		CDAARO
CN(C(=O)c1cc(C(F)(F)F)n[nH]1)[C@H]1CC[N@H+](C)C1	ZINC000097681800	358793048	/nfs/dbraw/zinc/79/30/48/358793048.db2.gz	BVSWNMPLUPHBMA-ZETCQYMHSA-N	1	0	276.262	1.205	50	0		CDAARO
Cc1ccccc1C[C@@H](C)[NH2+]CC(=O)N1CCOCC1	ZINC000095988829	359724073	/nfs/dbraw/zinc/72/40/73/359724073.db2.gz	DNMCBMSXPWWKEA-CQSZACIVSA-N	1	0	276.380	1.374	50	0		CDAARO
CC(C)[C@H]([NH2+]CC(=O)NC1CC1)[C@@H](O)c1ccccc1	ZINC000408516360	359899183	/nfs/dbraw/zinc/89/91/83/359899183.db2.gz	NCTBCRZQRYTQCU-HOTGVXAUSA-N	1	0	276.380	1.613	50	0		CDAARO
CN(CC[N@H+](C)C1CC1)C(=O)Cc1ccncc1Cl	ZINC000408517974	359903700	/nfs/dbraw/zinc/90/37/00/359903700.db2.gz	QPVMUVUGEAHJDJ-UHFFFAOYSA-N	1	0	281.787	1.830	50	0		CDAARO
OCC[C@@H]1CSCC[N@@H+]1CCO[C@@H]1CCCCO1	ZINC000408514851	359904815	/nfs/dbraw/zinc/90/48/15/359904815.db2.gz	MWMBXNBOYZLUKN-CHWSQXEVSA-N	1	0	275.414	1.329	50	0		CDAARO
CN(C(=O)c1ccccc1-n1cccn1)[C@H]1CC[NH2+]C1	ZINC000521394619	359966802	/nfs/dbraw/zinc/96/68/02/359966802.db2.gz	NIRZPXFHOBZOCJ-LBPRGKRZSA-N	1	0	270.336	1.306	50	0		CDAARO
C[C@H](CCc1ccccc1)[NH2+]CCS(=O)(=O)N(C)C	ZINC000065406385	360094762	/nfs/dbraw/zinc/09/47/62/360094762.db2.gz	WONVNSYNKCSCCJ-CYBMUJFWSA-N	1	0	284.425	1.489	50	0		CDAARO
Cc1c[nH+]c(C)n1C1CCN(C(=O)c2ccnn2C)CC1	ZINC000409420913	360224341	/nfs/dbraw/zinc/22/43/41/360224341.db2.gz	CIECNXSYUXJMIV-UHFFFAOYSA-N	1	0	287.367	1.711	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1[C@@H]1CCN(C(=O)c2nccn2C)C1	ZINC000409421065	360230264	/nfs/dbraw/zinc/23/02/64/360230264.db2.gz	CBRMQKCLQQQLDG-CYBMUJFWSA-N	1	0	299.378	1.890	50	0		CDAARO
C[N@@H+]1CCC[C@H]1C(=O)N1CCCC[C@H]1Cn1cccn1	ZINC000248165666	360427990	/nfs/dbraw/zinc/42/79/90/360427990.db2.gz	ZOZQWRVBAGWUQO-KBPBESRZSA-N	1	0	276.384	1.358	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(C[C@@H](O)c2cccc(F)c2)C[C@H]1C	ZINC000248318303	360495044	/nfs/dbraw/zinc/49/50/44/360495044.db2.gz	OIERGGADFLJKQW-DVOMOZLQSA-N	1	0	296.386	1.246	50	0		CDAARO
[NH3+]CCCC(=O)N[C@H](c1ccccc1)[C@H]1CCCO1	ZINC000178085952	189089860	/nfs/dbraw/zinc/08/98/60/189089860.db2.gz	CHKCZTKGIWQVIF-UKRRQHHQSA-N	1	0	262.353	1.762	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)COc2ccc(F)cc2)C1	ZINC000178512617	189122795	/nfs/dbraw/zinc/12/27/95/189122795.db2.gz	ADDAMXFNAGCAGQ-SNVBAGLBSA-N	1	0	252.289	1.012	50	0		CDAARO
CN(Cc1cnccn1)C(=O)NC[C@@H]1CCCC[N@@H+]1C	ZINC000426428434	360669980	/nfs/dbraw/zinc/66/99/80/360669980.db2.gz	XBCMQVDFZKPGOO-ZDUSSCGKSA-N	1	0	277.372	1.102	50	0		CDAARO
[NH3+]CCOc1cccc(C(=O)NCC[C@@H]2CCOC2)c1	ZINC000426485668	360675469	/nfs/dbraw/zinc/67/54/69/360675469.db2.gz	HVLRAANBGWAFAU-GFCCVEGCSA-N	1	0	278.352	1.181	50	0		CDAARO
Cn1cncc1-c1ccc(C(=O)NCC[NH+]2CCCC2)cc1	ZINC000426493981	360676067	/nfs/dbraw/zinc/67/60/67/360676067.db2.gz	ICSOSWVVLWTJMX-UHFFFAOYSA-N	1	0	298.390	1.913	50	0		CDAARO
CCCc1nc(C)c(C(=O)N2CC[C@H](C[NH3+])C2)s1	ZINC000178551445	189126341	/nfs/dbraw/zinc/12/63/41/189126341.db2.gz	NPMJJOUFPQRSFD-SNVBAGLBSA-N	1	0	267.398	1.825	50	0		CDAARO
Cc1ccc(OCC(=O)NC[C@@H](C)[NH+]2CCCC2)cc1	ZINC000036077102	360833398	/nfs/dbraw/zinc/83/33/98/360833398.db2.gz	DHPARMNRSZMGLR-CQSZACIVSA-N	1	0	276.380	1.974	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)CSC(F)(F)F)C1	ZINC000178973405	283601980	/nfs/dbraw/zinc/60/19/80/283601980.db2.gz	RZZNBFGBSBIALA-SSDOTTSWSA-N	1	0	256.293	1.307	50	0		CDAARO
C[C@H](C(=O)NCc1cc2ccc(F)cc2[nH]c1=O)[NH+](C)C	ZINC000426529170	360979598	/nfs/dbraw/zinc/97/95/98/360979598.db2.gz	AOHWJFSCZQYAMJ-SECBINFHSA-N	1	0	291.326	1.646	50	0		CDAARO
C[C@@](O)(C[N@@H+]1CCC[C@H]1Cn1cncn1)c1ccccc1	ZINC000248320895	361329721	/nfs/dbraw/zinc/32/97/21/361329721.db2.gz	SXWOUWINBAGOIO-JKSUJKDBSA-N	1	0	286.379	1.650	50	0		CDAARO
Cc1cc(NC(=O)[C@H](C)N(C)Cc2cccnc2)no1	ZINC000183595250	189363619	/nfs/dbraw/zinc/36/36/19/189363619.db2.gz	XQYDKGYKNWEPHN-NSHDSACASA-N	1	0	274.324	1.837	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1ccc(C(N)=O)cn1	ZINC000267530916	363840876	/nfs/dbraw/zinc/84/08/76/363840876.db2.gz	QFGDZVQEARFPCF-GFCCVEGCSA-N	1	0	262.357	1.467	50	0		CDAARO
COc1ccnc(NC[C@@H]2CC[N@H+](CC(C)C)C2)n1	ZINC000268226441	364010446	/nfs/dbraw/zinc/01/04/46/364010446.db2.gz	KYOHLSROEDFEJU-LBPRGKRZSA-N	1	0	264.373	1.875	50	0		CDAARO
CN1C[C@H](C[NH+]2CCC(C(F)(F)F)CC2)CC1=O	ZINC000618254031	364031688	/nfs/dbraw/zinc/03/16/88/364031688.db2.gz	ATBJIHSNZHRGMS-SECBINFHSA-N	1	0	264.291	1.739	50	0		CDAARO
C[C@H]1CN(C(=O)c2ccc3ncccc3c2)CC[NH2+]1	ZINC000088059256	364051100	/nfs/dbraw/zinc/05/11/00/364051100.db2.gz	BPBZMDIXXLJMRQ-NSHDSACASA-N	1	0	255.321	1.669	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1cc(N)ccc1OC	ZINC000000347680	364176607	/nfs/dbraw/zinc/17/66/07/364176607.db2.gz	FKLZXOIYBRAZIN-LBPRGKRZSA-N	1	0	277.368	1.492	50	0		CDAARO
COc1cc(C[NH2+]C(C)C)cc(Cl)c1OCC(N)=O	ZINC000002884290	364656471	/nfs/dbraw/zinc/65/64/71/364656471.db2.gz	BZUTWRJSJLONGA-UHFFFAOYSA-N	1	0	286.759	1.711	50	0		CDAARO
CO[C@@H]1C[NH2+][C@@H](C(=O)NCCOc2ccc(Cl)cc2)C1	ZINC000191878377	189607368	/nfs/dbraw/zinc/60/73/68/189607368.db2.gz	CAGVXJFYEYLBLW-QWHCGFSZSA-N	1	0	298.770	1.212	50	0		CDAARO
C[N@H+](CC(=O)NC1(CO)CCSCC1)CC(C)(C)C	ZINC000585121985	364856530	/nfs/dbraw/zinc/85/65/30/364856530.db2.gz	IUJSODLANDOMGE-UHFFFAOYSA-N	1	0	288.457	1.339	50	0		CDAARO
COc1c(C)cnc(C[NH2+]C2(C(N)=O)CCCCC2)c1C	ZINC000088545586	365439900	/nfs/dbraw/zinc/43/99/00/365439900.db2.gz	UCVXZHQMUBCHOK-UHFFFAOYSA-N	1	0	291.395	1.985	50	0		CDAARO
NS(=O)(=O)[C@H]1CC[N@H+](CCCC2CCCC2)C1	ZINC000089818060	366939717	/nfs/dbraw/zinc/93/97/17/366939717.db2.gz	IXGZJXQBBDZBIP-LBPRGKRZSA-N	1	0	260.403	1.320	50	0		CDAARO
CCC1(CC)[C@H](OC)C[C@@H]1[N@H+](C)CCn1cncn1	ZINC000089948131	366975748	/nfs/dbraw/zinc/97/57/48/366975748.db2.gz	DBHLLYUGMWDOSZ-QWHCGFSZSA-N	1	0	266.389	1.804	50	0		CDAARO
CC1(C)C[C@@H]([NH2+][C@@H]2CC(=O)N(C3CC3)C2)C(C)(C)O1	ZINC000090181386	367024417	/nfs/dbraw/zinc/02/44/17/367024417.db2.gz	KASGNWRGEGBPHC-ZYHUDNBSSA-N	1	0	266.385	1.685	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)OCc2ccccc2)C[C@H]1F	ZINC000079035464	367348981	/nfs/dbraw/zinc/34/89/81/367348981.db2.gz	SYVUWEZGXXHYPH-NEPJUHHUSA-N	1	0	252.289	1.694	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCN(C(=O)CCC(F)(F)F)C1	ZINC000088834109	367327725	/nfs/dbraw/zinc/32/77/25/367327725.db2.gz	IBRFSTQMDUUHIB-BDAKNGLRSA-N	1	0	252.280	1.915	50	0		CDAARO
CC[C@@H]1CN(S(C)(=O)=O)CC[C@H]1[NH2+]Cc1ccco1	ZINC000252517163	367740594	/nfs/dbraw/zinc/74/05/94/367740594.db2.gz	BDUXNQPJVJORBJ-DGCLKSJQSA-N	1	0	286.397	1.429	50	0		CDAARO
O=C(NCc1cc[nH]n1)N1CCCC[C@@H]([NH+]2CCCC2)C1	ZINC000095953308	284003914	/nfs/dbraw/zinc/00/39/14/284003914.db2.gz	UILJVYNHQLWKLI-CQSZACIVSA-N	1	0	291.399	1.570	50	0		CDAARO
C[C@H]1C[N@H+](C)CC[C@H]1N(C)CC(=O)Nc1ccccc1	ZINC000252585490	368161155	/nfs/dbraw/zinc/16/11/55/368161155.db2.gz	IYOLJEVPJAZLTI-DZGCQCFKSA-N	1	0	275.396	1.897	50	0		CDAARO
COC(=O)C(C)(C)CC[N@@H+]1CCO[C@@H]([C@H]2CCCO2)C1	ZINC000252584462	368162259	/nfs/dbraw/zinc/16/22/59/368162259.db2.gz	AOOUKTDESNNFHA-CHWSQXEVSA-N	1	0	285.384	1.456	50	0		CDAARO
Cc1nnc(NC(=O)N2CC[N@@H+](C(C)C)[C@H](C)C2)s1	ZINC000055370232	369973270	/nfs/dbraw/zinc/97/32/70/369973270.db2.gz	QOCOAEHEEXZBDP-SECBINFHSA-N	1	0	283.401	1.793	50	0		CDAARO
O=C(NCC1CC[NH+]([C@H]2CCOC2)CC1)c1cccs1	ZINC000575608086	370624377	/nfs/dbraw/zinc/62/43/77/370624377.db2.gz	QLHXIDUHAUECQL-ZDUSSCGKSA-N	1	0	294.420	1.979	50	0		CDAARO
Cc1cc(C(=O)N2CC[NH2+]C[C@H]2C)c(F)cc1F	ZINC000125042460	376205401	/nfs/dbraw/zinc/20/54/01/376205401.db2.gz	DLHOBHGLVUOTKH-SECBINFHSA-N	1	0	254.280	1.707	50	0		CDAARO
CN(C[C@H]1CCCC[N@@H+]1C)c1ncccc1C(N)=O	ZINC000670444941	482994549	/nfs/dbraw/zinc/99/45/49/482994549.db2.gz	PZEFQPIDMLAIDN-LLVKDONJSA-N	1	0	262.357	1.101	50	0		CDAARO
CC(C)NC(=O)[C@@H]1C[C@@H]([NH3+])CN1Cc1ccc(Cl)cc1	ZINC000299769720	372750288	/nfs/dbraw/zinc/75/02/88/372750288.db2.gz	PNARCPFGTPZJKP-KGLIPLIRSA-N	1	0	295.814	1.766	50	0		CDAARO
O=C(NCC[NH+]1CCC(CO)CC1)c1ccc(Cl)cn1	ZINC000299795686	372769296	/nfs/dbraw/zinc/76/92/96/372769296.db2.gz	OWDOLBZYMBYCND-UHFFFAOYSA-N	1	0	297.786	1.169	50	0		CDAARO
c1ccc(C2CCN([C@H]3C[NH2+]CCOC3)CC2)cc1	ZINC000299804107	372773144	/nfs/dbraw/zinc/77/31/44/372773144.db2.gz	ZTSJOCXYRZHPSP-INIZCTEOSA-N	1	0	260.381	1.854	50	0		CDAARO
COc1cncc(/C=C\CC[N@H+](C)CCCO)c1	ZINC000582000224	373489557	/nfs/dbraw/zinc/48/95/57/373489557.db2.gz	DIYJVJFJNXANMW-UTCJRWHESA-N	1	0	250.342	1.808	50	0		CDAARO
O=C(Cc1ccc(F)cc1F)NCC[C@@H]1CC[NH2+]C1	ZINC000095067641	373706242	/nfs/dbraw/zinc/70/62/42/373706242.db2.gz	ABPLOLFILRRXME-JTQLQIEISA-N	1	0	268.307	1.623	50	0		CDAARO
O=C(N[C@@H]1CN(Cc2ccc[nH]2)C[C@H]1CO)c1ccccc1	ZINC000253412886	373720839	/nfs/dbraw/zinc/72/08/39/373720839.db2.gz	SJTYEPBFEVRKRB-GOEBONIOSA-N	1	0	299.374	1.237	50	0		CDAARO
Cn1cc(C[N@@H+]2CCCC[C@H]2CN2CCOCC2)cn1	ZINC000111301803	374489982	/nfs/dbraw/zinc/48/99/82/374489982.db2.gz	WXIDHDUXOOOSRF-HNNXBMFYSA-N	1	0	278.400	1.107	50	0		CDAARO
CN1CCC([NH2+]C[C@H](O)c2cccc(F)c2)CC1	ZINC000037887392	374818266	/nfs/dbraw/zinc/81/82/66/374818266.db2.gz	PTSKDJMDPNHXBI-AWEZNQCLSA-N	1	0	252.333	1.543	50	0		CDAARO
CC(C)c1ccnc(N2CCO[C@@H](CC[NH3+])C2)n1	ZINC000095353246	374888189	/nfs/dbraw/zinc/88/81/89/374888189.db2.gz	JGCCNVNFZHWMCI-NSHDSACASA-N	1	0	250.346	1.154	50	0		CDAARO
C[C@@H](CCc1cccc(F)c1)[NH2+]C[C@@H]1CN(C)CCN1C	ZINC000095422303	374924285	/nfs/dbraw/zinc/92/42/85/374924285.db2.gz	WOMKCFSAAIHWEW-WMLDXEAASA-N	1	0	293.430	1.982	50	0		CDAARO
c1ccc(C[NH2+][C@H]2CCN(c3ccccn3)C2)nc1	ZINC000095435725	374936148	/nfs/dbraw/zinc/93/61/48/374936148.db2.gz	VMLWSEVGSAGDJT-AWEZNQCLSA-N	1	0	254.337	1.845	50	0		CDAARO
CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1[NH2+]Cc1cc[nH]c1	ZINC000095435718	374936257	/nfs/dbraw/zinc/93/62/57/374936257.db2.gz	FYOKMSWZZSEFHM-OLZOCXBDSA-N	1	0	295.383	1.739	50	0		CDAARO
CC(C)[C@H]1C[C@H](C[NH2+]C2(CCO)CCOCC2)CCO1	ZINC000095466062	374962147	/nfs/dbraw/zinc/96/21/47/374962147.db2.gz	BSEYEURYJSZODZ-HUUCEWRRSA-N	1	0	285.428	1.959	50	0		CDAARO
CC(C)[C@@H]1C[C@H](C[NH2+]C2(CCO)CCOCC2)CCO1	ZINC000095466061	374962212	/nfs/dbraw/zinc/96/22/12/374962212.db2.gz	BSEYEURYJSZODZ-CABCVRRESA-N	1	0	285.428	1.959	50	0		CDAARO
CNc1snc(C)c1C(=O)N1C[C@H](C)[C@H]([NH+](C)C)C1	ZINC000095402449	374906292	/nfs/dbraw/zinc/90/62/92/374906292.db2.gz	BTXDYVUGBQUACI-WCBMZHEXSA-N	1	0	282.413	1.515	50	0		CDAARO
C[N@H+](CCn1cncn1)C1CCN(c2ccccn2)CC1	ZINC000095964230	375042310	/nfs/dbraw/zinc/04/23/10/375042310.db2.gz	QRCFTANGJBHQED-UHFFFAOYSA-N	1	0	286.383	1.274	50	0		CDAARO
Cc1ccc(O)c(C[N@@H+]2CCCC3(C2)OCCO3)n1	ZINC000097058861	375142584	/nfs/dbraw/zinc/14/25/84/375142584.db2.gz	FGQCEWSCXWKWHY-UHFFFAOYSA-N	1	0	264.325	1.435	50	0		CDAARO
C[C@@H]1CN(C(=O)COc2cccc(F)c2)CC[NH2+]1	ZINC000299738579	375199436	/nfs/dbraw/zinc/19/94/36/375199436.db2.gz	CJJBHZGHUBCKJY-SNVBAGLBSA-N	1	0	252.289	1.025	50	0		CDAARO
CN(C(=O)CCc1nncn1-c1ccccc1)[C@H]1CC[NH2+]C1	ZINC000299739488	375200147	/nfs/dbraw/zinc/20/01/47/375200147.db2.gz	PAIQFCGQYZHTNA-AWEZNQCLSA-N	1	0	299.378	1.020	50	0		CDAARO
O=C(NC[C@H](O)c1ccccc1Cl)[C@H]1CC[NH2+]C1	ZINC000299740132	375202356	/nfs/dbraw/zinc/20/23/56/375202356.db2.gz	WDSJZOBWBABXAG-CABZTGNLSA-N	1	0	268.744	1.099	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CC[NH2+]C[C@H]2C)cc1F	ZINC000606441886	375823615	/nfs/dbraw/zinc/82/36/15/375823615.db2.gz	RHWUQWYODQKAFK-VLWUPBBWSA-N	1	0	278.327	1.668	50	0		CDAARO
CNC(=O)c1ccc(C[N@H+](C)[C@@H]2CCCC[C@H]2O)o1	ZINC000239539256	376016935	/nfs/dbraw/zinc/01/69/35/376016935.db2.gz	AVYSPKCBHCKFIZ-VXGBXAGGSA-N	1	0	266.341	1.375	50	0		CDAARO
CC[C@@H]1CN(S(C)(=O)=O)CC[C@H]1[NH2+]CC1CC1	ZINC000240626757	376017795	/nfs/dbraw/zinc/01/77/95/376017795.db2.gz	HJAPPOWOESWXFX-VXGBXAGGSA-N	1	0	260.403	1.046	50	0		CDAARO
CCc1nnc(NC(=O)N2C[C@@H]3CCC[N@@H+]3C[C@@H]2C)s1	ZINC000089296345	377814733	/nfs/dbraw/zinc/81/47/33/377814733.db2.gz	VLOMGYUAMHSGNV-UWVGGRQHSA-N	1	0	295.412	1.801	50	0		CDAARO
Cc1cc(=O)oc2cc(NC(=O)[C@@H]3CCC[NH2+]3)ccc12	ZINC000000403569	169631633	/nfs/dbraw/zinc/63/16/33/169631633.db2.gz	HSLXTZWJAHQHHF-LBPRGKRZSA-N	1	0	272.304	1.792	50	0		CDAARO
CC[NH+](CC)CCCOC(=O)c1ccc(O)cc1O	ZINC000002288894	260009016	/nfs/dbraw/zinc/00/90/16/260009016.db2.gz	SBWJUOJQEAWDQZ-UHFFFAOYSA-N	1	0	267.325	1.987	50	0	biogenic	CDAARO
CCNC(=O)N[C@H]1CC[N@H+](Cc2cnc(C)s2)C[C@@H]1C	ZINC000096420280	256761908	/nfs/dbraw/zinc/76/19/08/256761908.db2.gz	LACLLWAMJGFKJS-GWCFXTLKSA-N	1	0	296.440	1.981	50	0		CDAARO
Cc1ccc(C[NH2+]CCCN2CCOCC2)s1	ZINC000095098707	184944474	/nfs/dbraw/zinc/94/44/74/184944474.db2.gz	GQKOEXXOGKCWAU-UHFFFAOYSA-N	1	0	254.399	1.868	50	0		CDAARO
CCc1ccc(OC[C@@H](O)CN2CC[NH+](C)CC2)cc1	ZINC000019338629	390226160	/nfs/dbraw/zinc/22/61/60/390226160.db2.gz	YYTLATYPGKVEQP-HNNXBMFYSA-N	1	0	278.396	1.236	50	0		CDAARO
Cc1nc(C(=O)OC[C@@H]2C[N@H+](CC(C)C)CCO2)cs1	ZINC000096420385	390514036	/nfs/dbraw/zinc/51/40/36/390514036.db2.gz	WUMVTGJXNGAISP-LBPRGKRZSA-N	1	0	298.408	1.965	50	0		CDAARO
C[C@@H](C(=O)NCCNc1ccccn1)[NH+]1CCCCCC1	ZINC000096435986	390518814	/nfs/dbraw/zinc/51/88/14/390518814.db2.gz	YCOLHNGTWLTKAI-AWEZNQCLSA-N	1	0	290.411	1.874	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1CC[C@H](N(C)C(=O)OC(C)(C)C)C1	ZINC000096455390	390522173	/nfs/dbraw/zinc/52/21/73/390522173.db2.gz	NINIPMHHPVAVGG-NWDGAFQWSA-N	1	0	272.389	1.699	50	0		CDAARO
CSCC[C@@H](CO)Nc1nc(N(C)C)[nH+]c(C)c1C	ZINC000065383261	390552181	/nfs/dbraw/zinc/55/21/81/390552181.db2.gz	RYBKFELLCGWFLW-NSHDSACASA-N	1	0	284.429	1.685	50	0		CDAARO
CC[C@@H]1c2ccsc2CC[N@H+]1CCC(=O)NC(N)=O	ZINC000011473569	390902851	/nfs/dbraw/zinc/90/28/51/390902851.db2.gz	MNUVNRYOBJVSLH-SNVBAGLBSA-N	1	0	281.381	1.642	50	0		CDAARO
CN1CCN(CC(=O)NC23CC4CC(CC(C4)C2)C3)CC1	ZINC000020472400	391032790	/nfs/dbraw/zinc/03/27/90/391032790.db2.gz	OZFUQIZWPPCTPS-UHFFFAOYSA-N	1	0	291.439	1.319	50	0		CDAARO
Cc1cc2c(c(-c3ncccc3C(N)=O)c1)O[C@H](C[NH3+])C2	ZINC000067688499	391963160	/nfs/dbraw/zinc/96/31/60/391963160.db2.gz	XSOIRTZRTPLJKA-NSHDSACASA-N	1	0	283.331	1.418	50	0		CDAARO
C[N@@H+]1CCN(c2cc[nH+]c3ccccc32)C[C@@H]1C(=O)[O-]	ZINC000067921327	391964780	/nfs/dbraw/zinc/96/47/80/391964780.db2.gz	AFBPNTNJXPILOP-CQSZACIVSA-N	1	0	271.320	1.440	50	0		CDAARO
CO[C@@H](C[NH3+])CC(=O)N(CC1CC1)c1ccccc1	ZINC000262811059	131263723	/nfs/dbraw/zinc/26/37/23/131263723.db2.gz	ULRSKKDTSAPFIK-CQSZACIVSA-N	1	0	262.353	1.793	50	0		CDAARO
COC[C@@H](C)[NH2+]Cc1ccccc1CN1CCCC1=O	ZINC000065419646	392881993	/nfs/dbraw/zinc/88/19/93/392881993.db2.gz	KNYUJFXRRMXMSN-CYBMUJFWSA-N	1	0	276.380	1.934	50	0		CDAARO
CC[C@H]1CN(c2nccc(-c3cnn(C)c3)n2)CC[N@@H+]1C	ZINC000082039335	135004596	/nfs/dbraw/zinc/00/45/96/135004596.db2.gz	UOUBWACEMQUPLL-ZDUSSCGKSA-N	1	0	286.383	1.408	50	0		CDAARO
COc1ccccc1/C=C\C[NH2+][C@H]1CCc2ncnn2C1	ZINC000104060972	397930055	/nfs/dbraw/zinc/93/00/55/397930055.db2.gz	NWUXIXQAYDIMRC-SDQPKGBYSA-N	1	0	284.363	1.905	50	0		CDAARO
COc1ccccc1CC(=O)N1CCCC[C@@H]2C[NH2+]C[C@@H]21	ZINC000077010805	397984622	/nfs/dbraw/zinc/98/46/22/397984622.db2.gz	VANASYYVGCDCDD-CABCVRRESA-N	1	0	288.391	1.838	50	0		CDAARO
CC[C@@H](C(=O)N1CCN(C)C[C@H]1C)c1c(C)noc1C	ZINC000335889407	151084755	/nfs/dbraw/zinc/08/47/55/151084755.db2.gz	AZPYMOVGMUPCKE-ZWNOBZJWSA-N	1	0	279.384	1.948	50	0		CDAARO
COC(=O)[C@]12C[N@H+](C[C@H]3CCC=CO3)C[C@H]1COCC2	ZINC000373485427	160205171	/nfs/dbraw/zinc/20/51/71/160205171.db2.gz	NSIQDNNPLNRRRF-GZBFAFLISA-N	1	0	281.352	1.191	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]Cc2ccco2)CC1	ZINC000003683595	169907892	/nfs/dbraw/zinc/90/78/92/169907892.db2.gz	KTPPDEKJHYWJST-UHFFFAOYSA-N	1	0	252.314	1.990	50	0		CDAARO
CCC(=O)Nc1ccc(C(=O)NCCC[NH+](C)C)cc1	ZINC000004783444	170016246	/nfs/dbraw/zinc/01/62/46/170016246.db2.gz	DMERKZNYUQIKCZ-UHFFFAOYSA-N	1	0	277.368	1.717	50	0		CDAARO
C[NH+](C)CCNC(=O)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000005251072	170079545	/nfs/dbraw/zinc/07/95/45/170079545.db2.gz	TUIZFKAYUKWOLR-UHFFFAOYSA-N	1	0	287.722	1.095	50	0		CDAARO
CCc1ccc(S(=O)(=O)NCCC[NH+](C)C)cc1	ZINC000005262292	170080956	/nfs/dbraw/zinc/08/09/56/170080956.db2.gz	ONCGEPXKBMRRIQ-UHFFFAOYSA-N	1	0	270.398	1.479	50	0		CDAARO
O=C(NCC[NH2+]Cc1cccnc1)c1ccccc1	ZINC000007093571	170267329	/nfs/dbraw/zinc/26/73/29/170267329.db2.gz	LOCCZYMCFLUTQL-UHFFFAOYSA-N	1	0	255.321	1.601	50	0		CDAARO
CCNC(=O)NC(=O)C[N@@H+]1CCC[C@H]2CCCC[C@@H]21	ZINC000007587549	170292035	/nfs/dbraw/zinc/29/20/35/170292035.db2.gz	HNJQZQMDECKFBC-NEPJUHHUSA-N	1	0	267.373	1.487	50	0		CDAARO
Cc1cc(C)c2c(CN3CC[NH2+]CC3)cc(=O)oc2c1	ZINC000020348986	171154477	/nfs/dbraw/zinc/15/44/77/171154477.db2.gz	ZAXXFVQBKNEIKZ-UHFFFAOYSA-N	1	0	272.348	1.815	50	0	biogenic	CDAARO
O=c1[nH]c2ccccc2cc1C[NH2+]CCCn1ccnc1	ZINC000020506073	171228362	/nfs/dbraw/zinc/22/83/62/171228362.db2.gz	AJYPHJVPANXMBY-UHFFFAOYSA-N	1	0	282.347	1.905	50	0		CDAARO
CCCn1cc(CN2CC[N@H+](C)[C@@H](CCO)C2)c(C)n1	ZINC000020539261	171241533	/nfs/dbraw/zinc/24/15/33/171241533.db2.gz	LTHBMKLZKVYEIC-HNNXBMFYSA-N	1	0	280.416	1.100	50	0		CDAARO
COc1cc(C(C)=O)ccc1OCCCN1CCOCC1	ZINC000020653294	171268766	/nfs/dbraw/zinc/26/87/66/171268766.db2.gz	KSYDRLYCMHOLOO-UHFFFAOYSA-N	1	0	293.363	1.999	50	0		CDAARO
c1ccc2c(c1)CC[C@@H]([NH2+]CCCN1CCOCC1)C2	ZINC000023283147	171419144	/nfs/dbraw/zinc/41/91/44/171419144.db2.gz	PJSGTWUZEKFVHJ-QGZVFWFLSA-N	1	0	274.408	1.856	50	0		CDAARO
C[NH2+]C1CCN(S(=O)(=O)c2ccc(F)cc2C)CC1	ZINC000037536763	173255912	/nfs/dbraw/zinc/25/59/12/173255912.db2.gz	UEHMBJPLRWQYOU-UHFFFAOYSA-N	1	0	286.372	1.507	50	0		CDAARO
CC[NH+](CC)CCCNC(=O)C(=O)Nc1cccc(O)c1	ZINC000040287118	174220142	/nfs/dbraw/zinc/22/01/42/174220142.db2.gz	HHECGKYRLKYURK-UHFFFAOYSA-N	1	0	293.367	1.179	50	0		CDAARO
CC(C)NC(=O)[C@@H]1C[C@@H]([NH3+])CN1Cc1cc(C(C)C)no1	ZINC000067458442	175775616	/nfs/dbraw/zinc/77/56/16/175775616.db2.gz	MQHWXMGYJWLBFP-RISCZKNCSA-N	1	0	294.399	1.224	50	0		CDAARO
CCCc1cnc(C)nc1N1CCOC[C@H](C[NH+](C)C)C1	ZINC000072130962	176321684	/nfs/dbraw/zinc/32/16/84/176321684.db2.gz	HKSWFXCUKJZBDJ-CQSZACIVSA-N	1	0	292.427	1.752	50	0		CDAARO
CCc1ccc(C[N@@H+]2CCC[C@@](O)(CO)CC2)nc1	ZINC000072145013	176324678	/nfs/dbraw/zinc/32/46/78/176324678.db2.gz	NPICSJXQTKYIRV-HNNXBMFYSA-N	1	0	264.369	1.353	50	0		CDAARO
FC(F)(F)c1cccnc1NC[C@H]1C[NH2+]CCOC1	ZINC000072148746	176325452	/nfs/dbraw/zinc/32/54/52/176325452.db2.gz	NDBDTWNHFWNFQD-SECBINFHSA-N	1	0	275.274	1.748	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCN(C(=O)c2cccc3cc[nH]c32)C1	ZINC000072156146	176328543	/nfs/dbraw/zinc/32/85/43/176328543.db2.gz	GEVBADFUNHERHU-INIZCTEOSA-N	1	0	287.363	1.307	50	0		CDAARO
O=C(NCc1ccc(Cl)cc1)NC[C@@H]1C[NH2+]CCOC1	ZINC000072158291	176329327	/nfs/dbraw/zinc/32/93/27/176329327.db2.gz	QDUUTFXUGXWAEM-LBPRGKRZSA-N	1	0	297.786	1.375	50	0		CDAARO
Oc1cccc(CN2CCC[C@](O)(C[NH+]3CCCC3)C2)c1	ZINC000077459752	177271344	/nfs/dbraw/zinc/27/13/44/177271344.db2.gz	IJVJQJVUGFCLQT-KRWDZBQOSA-N	1	0	290.407	1.815	50	0		CDAARO
c1ccc2nc(N3CC[N@@H+]4CCC[C@H]4C3)cnc2c1	ZINC000106827561	275071987	/nfs/dbraw/zinc/07/19/87/275071987.db2.gz	QGKZYSFHCJGDSU-LBPRGKRZSA-N	1	0	254.337	1.914	50	0		CDAARO
CC[N@@H+]1CCCN(c2ccc(-n3ccc(C)n3)nn2)CC1	ZINC000096453673	276165102	/nfs/dbraw/zinc/16/51/02/276165102.db2.gz	RJLVLWTUSPECCQ-UHFFFAOYSA-N	1	0	286.383	1.503	50	0		CDAARO
CCCS(=O)(=O)N1C[C@H]([NH3+])[C@@H](c2ccc(OC)cc2)C1	ZINC000091694112	276268196	/nfs/dbraw/zinc/26/81/96/276268196.db2.gz	XBKBKAKGJKHPDP-KGLIPLIRSA-N	1	0	298.408	1.162	50	0		CDAARO
COC(=O)N1CCC[C@H]([NH2+][C@@H]2CCN(C3CC3)C2)C1	ZINC000089401065	277071914	/nfs/dbraw/zinc/07/19/14/277071914.db2.gz	DWHZMQTVBGTBTC-NWDGAFQWSA-N	1	0	267.373	1.044	50	0		CDAARO
COC(=O)[C@@]12CCC[C@H]1C[N@H+](Cc1cncs1)C2	ZINC000096009048	277114809	/nfs/dbraw/zinc/11/48/09/277114809.db2.gz	ZJPINNYIJHGJJC-GXFFZTMASA-N	1	0	266.366	1.918	50	0		CDAARO
COc1cc2c(cc1OC)CN(C1CC[NH2+]CC1)CC2	ZINC000002559689	277393768	/nfs/dbraw/zinc/39/37/68/277393768.db2.gz	GAGMAKLCMYOEKJ-UHFFFAOYSA-N	1	0	276.380	1.814	50	0		CDAARO
C[C@@H](CO)NC(=O)NC[C@@H](c1ccc(Cl)cc1)[NH+](C)C	ZINC000084640287	278290191	/nfs/dbraw/zinc/29/01/91/278290191.db2.gz	ODAPDMHQAFDRFU-GWCFXTLKSA-N	1	0	299.802	1.623	50	0		CDAARO
C[C@@H]1C[C@H](OC[C@H](O)C[NH+]2CCN(C)CC2)CC(C)(C)C1	ZINC000022588890	279001422	/nfs/dbraw/zinc/00/14/22/279001422.db2.gz	YVAWMZJIRZQCSS-OAGGEKHMSA-N	1	0	298.471	1.826	50	0		CDAARO
C[C@H](C(=O)N1CCCn2cncc2C1)[N@@H+]1CCC[C@H](C)C1	ZINC000107014598	279197728	/nfs/dbraw/zinc/19/77/28/279197728.db2.gz	WRVXAEMEHRWOKH-UONOGXRCSA-N	1	0	290.411	1.736	50	0		CDAARO
Cc1c(C(=O)NC[C@@H](c2ccsc2)[NH+](C)C)cnn1C	ZINC000025814966	280214993	/nfs/dbraw/zinc/21/49/93/280214993.db2.gz	NCUYDVMRQGZFBI-ZDUSSCGKSA-N	1	0	292.408	1.823	50	0		CDAARO
c1ccc(COC2CC[NH+](C[C@@H]3COCCO3)CC2)nc1	ZINC000244723645	280479651	/nfs/dbraw/zinc/47/96/51/280479651.db2.gz	MEYQQQPFPQEDIR-MRXNPFEDSA-N	1	0	292.379	1.478	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)/C=C\c2ccc(C(N)=O)cc2)C1	ZINC000255276907	289362940	/nfs/dbraw/zinc/36/29/40/289362940.db2.gz	XAIMRXQGVTWCNW-DEBLGDTFSA-N	1	0	287.363	1.009	50	0		CDAARO
C[C@H](C[NH+]1CCCCC1)NC(=O)c1nc(C2CC2)nn1C	ZINC000562831067	293209030	/nfs/dbraw/zinc/20/90/30/293209030.db2.gz	BUQPJSSNCBDWLU-LLVKDONJSA-N	1	0	291.399	1.297	50	0		CDAARO
Cc1nc(NC(=O)N2CCC[C@H]2C[NH+]2CCCC2)nn1C	ZINC000048353771	293316987	/nfs/dbraw/zinc/31/69/87/293316987.db2.gz	CKHOYRVJFPEMKI-LBPRGKRZSA-N	1	0	292.387	1.216	50	0		CDAARO
[NH3+]C[C@@H](NS(=O)(=O)c1cccc2ccccc21)C1CC1	ZINC000123942108	295244000	/nfs/dbraw/zinc/24/40/00/295244000.db2.gz	QAZAULDHMSFMRN-CQSZACIVSA-N	1	0	290.388	1.855	50	0		CDAARO
[NH3+]C[C@H](c1ccncc1)N1CCC(O)(C(F)(F)F)CC1	ZINC000035287511	295264542	/nfs/dbraw/zinc/26/45/42/295264542.db2.gz	GQQYAXJIHFVCJV-LLVKDONJSA-N	1	0	289.301	1.471	50	0		CDAARO
Cc1cc(C(F)(F)F)cc(N2CCO[C@H](C[NH3+])C2)n1	ZINC000534577307	328310486	/nfs/dbraw/zinc/31/04/86/328310486.db2.gz	NSFWXMKQNNWKEL-SNVBAGLBSA-N	1	0	275.274	1.573	50	0		CDAARO
O=C([C@H]1C=CC[NH2+]1)N1CCC(Oc2ccccc2F)CC1	ZINC000534579706	328311225	/nfs/dbraw/zinc/31/12/25/328311225.db2.gz	RCBGKNIMVMTHMD-CQSZACIVSA-N	1	0	290.338	1.724	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCC(=O)NCC2(CO)CCCC2)C1	ZINC000534585456	328315080	/nfs/dbraw/zinc/31/50/80/328315080.db2.gz	ZDJBGOGFNSHKJQ-AWEZNQCLSA-N	1	0	282.428	1.777	50	0		CDAARO
CCn1ccnc1CN(C)C(=O)NCC(C)(C)[N@H+](C)CC	ZINC000534633481	328332526	/nfs/dbraw/zinc/33/25/26/328332526.db2.gz	PNIBRXUOVMTASN-UHFFFAOYSA-N	1	0	295.431	1.775	50	0		CDAARO
C[C@H](CN1CCCCCC1)[NH2+]CCn1cncn1	ZINC000534653113	328338272	/nfs/dbraw/zinc/33/82/72/328338272.db2.gz	DANZYGWVTUPUCY-CYBMUJFWSA-N	1	0	251.378	1.132	50	0		CDAARO
COCCC(=O)NC[C@@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534664754	328344752	/nfs/dbraw/zinc/34/47/52/328344752.db2.gz	LDYNAZJVZKUHCT-LBPRGKRZSA-N	1	0	254.374	1.404	50	0		CDAARO
O=C(N[C@H]1COC[C@@H]1[NH+]1CCCC1)c1ccc(F)c(F)c1	ZINC000534666142	328345279	/nfs/dbraw/zinc/34/52/79/328345279.db2.gz	VQTZUFZBTDGZSE-KBPBESRZSA-N	1	0	296.317	1.558	50	0		CDAARO
CCOC(=O)N1CC[C@@H]([NH2+]CCc2nc(C)cs2)C1	ZINC000534675229	328347858	/nfs/dbraw/zinc/34/78/58/328347858.db2.gz	LNAREHCMJARUTG-LLVKDONJSA-N	1	0	283.397	1.814	50	0		CDAARO
O=C(Cc1ccsc1)N[C@H]1COC[C@@H]1[NH+]1CCCCC1	ZINC000534672978	328348616	/nfs/dbraw/zinc/34/86/16/328348616.db2.gz	KVRXHQYDGSQZMC-KBPBESRZSA-N	1	0	294.420	1.660	50	0		CDAARO
COCC1(CNC(=O)C2CC[NH2+]CC2)CCCC1	ZINC000534661826	328349477	/nfs/dbraw/zinc/34/94/77/328349477.db2.gz	OKGYZTZFUNXHFZ-UHFFFAOYSA-N	1	0	254.374	1.309	50	0		CDAARO
CN(C)[C@H](C[NH2+][C@@H]1CC(C)(C)OC1(C)C)c1cnn(C)c1	ZINC000096477917	329526862	/nfs/dbraw/zinc/52/68/62/329526862.db2.gz	VCBNADBPQYUKLA-ZIAGYGMSSA-N	1	0	294.443	1.959	50	0		CDAARO
CS(=O)(=O)Nc1ccc([C@@H]2CCC[NH2+]C2)cc1	ZINC000258618178	1159736684	/nfs/dbraw/zinc/73/66/84/1159736684.db2.gz	LPOWYZXFMZFXKT-LLVKDONJSA-N	1	0	254.355	1.525	50	0		CDAARO
[NH3+]Cc1cccnc1N1CCN(c2ccccc2)CC1	ZINC000019274734	482253394	/nfs/dbraw/zinc/25/33/94/482253394.db2.gz	HZZWWKQZBWURDV-UHFFFAOYSA-N	1	0	268.364	1.867	50	0		CDAARO
CCOC(C[N@@H+]1CC[C@@H]2OCCC[C@@H]2C1)OCC	ZINC000097161671	482459198	/nfs/dbraw/zinc/45/91/98/482459198.db2.gz	IZBKIDGVBJQLPA-OLZOCXBDSA-N	1	0	257.374	1.886	50	0		CDAARO
c1[nH]nc2c1CC[C@@H]([NH2+]C1CSCCSC1)C2	ZINC000670465139	483055281	/nfs/dbraw/zinc/05/52/81/483055281.db2.gz	LRTIFSDAGRXQEG-SNVBAGLBSA-N	1	0	269.439	1.705	50	0		CDAARO
COc1cccc2ncn([C@H]3CC[C@@H]([NH3+])CC3)c(=O)c21	ZINC000670473726	483083231	/nfs/dbraw/zinc/08/32/31/483083231.db2.gz	BGGDAEKFQHDZMK-PHIMTYICSA-N	1	0	273.336	1.848	50	0		CDAARO
CC(C)(CO)CCCNC(=O)N1CC[C@@H]([NH+]2CCCC2)C1	ZINC000096452822	527190900	/nfs/dbraw/zinc/19/09/00/527190900.db2.gz	PXJWBGMSTRRPAS-CQSZACIVSA-N	1	0	297.443	1.665	50	0		CDAARO
CC(C)n1ccc(C(=O)N2CCCC[C@H]2[C@@H](C)[NH3+])n1	ZINC000269188271	535082994	/nfs/dbraw/zinc/08/29/94/535082994.db2.gz	NYVYOWMQKYUZQK-YPMHNXCESA-N	1	0	264.373	1.806	50	0		CDAARO
C[N@@H+]1CCO[C@@H]2CCN(c3ccncc3Cl)C[C@H]21	ZINC000285130088	567904847	/nfs/dbraw/zinc/90/48/47/567904847.db2.gz	SANOBTUFOWEENW-CHWSQXEVSA-N	1	0	267.760	1.644	50	0		CDAARO
CC(C)[NH2+]C1CCN(C[C@@H](O)C(F)(F)F)CC1	ZINC000097141818	567905034	/nfs/dbraw/zinc/90/50/34/567905034.db2.gz	WHWBPOBTWPQBDS-SNVBAGLBSA-N	1	0	254.296	1.372	50	0		CDAARO
CCOc1ccc(C[NH2+]CCN2CCCC[C@@H]2CO)cn1	ZINC000952972997	615511198	/nfs/dbraw/zinc/51/11/98/615511198.db2.gz	QZRPGKCIGRCCSU-OAHLLOKOSA-N	1	0	293.411	1.417	50	0		CDAARO
CCn1ccc(C[NH2+][C@H]2CCCN(C(=O)C(C)C)C2)n1	ZINC000952966312	616031985	/nfs/dbraw/zinc/03/19/85/616031985.db2.gz	IAFSEGSXDLTAHB-AWEZNQCLSA-N	1	0	278.400	1.640	50	0		CDAARO
C[C@H]([NH3+])CONC(=O)c1ccc(Br)s1	ZINC000888094364	617754338	/nfs/dbraw/zinc/75/43/38/617754338.db2.gz	LZQUVFQQZKCSPK-YFKPBYRVSA-N	1	0	279.159	1.519	50	0		CDAARO
C[NH2+]CC(=O)Nc1ccc(OC[C@@H]2CCCCO2)cc1	ZINC000952968314	616937385	/nfs/dbraw/zinc/93/73/85/616937385.db2.gz	KVDNDIIRKHJZFX-AWEZNQCLSA-N	1	0	278.352	1.792	50	0		CDAARO
CNc1nc(N[C@@H]2COC[C@H]2Cc2ccncc2)cc(C)[nH+]1	ZINC001704302080	1177680248	/nfs/dbraw/zinc/68/02/48/1177680248.db2.gz	AXTNVYIRLZCWJF-ZIAGYGMSSA-N	1	0	299.378	1.891	50	0		CDAARO
COc1nc(N2CCC[N@@H+]3CCC[C@H]3C2)ncc1F	ZINC001704304165	1177681651	/nfs/dbraw/zinc/68/16/51/1177681651.db2.gz	AXYTYKRKDBWKNR-JTQLQIEISA-N	1	0	266.320	1.299	50	0		CDAARO
Cc1nc[nH]c1CN(CC[NH+](C)C)Cc1ccoc1	ZINC001704333149	1177691288	/nfs/dbraw/zinc/69/12/88/1177691288.db2.gz	WSQMMNRBIODHHN-UHFFFAOYSA-N	1	0	262.357	1.875	50	0		CDAARO
CO[C@@H]1CCC[C@]12CCC[N@H+](CC(=O)NC1CC1)C2	ZINC001704337051	1177693531	/nfs/dbraw/zinc/69/35/31/1177693531.db2.gz	RQZSLTNHWNKYBS-UKRRQHHQSA-N	1	0	266.385	1.546	50	0		CDAARO
O=C([C@@H]1CCC[N@H+](Cc2ccco2)C1)N1CCCOCC1	ZINC000019781778	740257828	/nfs/dbraw/zinc/25/78/28/740257828.db2.gz	NMKZKQHOLGJYCO-CQSZACIVSA-N	1	0	292.379	1.741	50	0		CDAARO
Cc1nc2c(cnn2C)c(N[C@H]2Cc3ccccc3[C@@H]2[NH3+])n1	ZINC000095355821	740357183	/nfs/dbraw/zinc/35/71/83/740357183.db2.gz	LIWFYFHPGZEVKD-KBPBESRZSA-N	1	0	294.362	1.708	50	0		CDAARO
CC(=O)NCCc1nc(C(C)C)nn1-c1cc[nH+]cc1C	ZINC000065455860	740831282	/nfs/dbraw/zinc/83/12/82/740831282.db2.gz	JKKSFCHJJZZTEE-UHFFFAOYSA-N	1	0	287.367	1.773	50	0		CDAARO
COCCN1CC[N@H+](Cc2ccccc2C)CCC1=O	ZINC000014887824	740850822	/nfs/dbraw/zinc/85/08/22/740850822.db2.gz	IHVUHLJGIMRFEU-UHFFFAOYSA-N	1	0	276.380	1.676	50	0		CDAARO
N#Cc1ccc(C(F)(F)F)cc1N1CC[NH2+]CC1	ZINC000165431540	741865927	/nfs/dbraw/zinc/86/59/27/741865927.db2.gz	CLBMTFGCAJDIQT-UHFFFAOYSA-N	1	0	255.243	1.987	50	0		CDAARO
c1cnc(N2CC[NH+](CCCc3cccnc3)CC2)nc1	ZINC000019112671	741874483	/nfs/dbraw/zinc/87/44/83/741874483.db2.gz	UZTLCHRJXYXTQH-UHFFFAOYSA-N	1	0	283.379	1.626	50	0		CDAARO
Cc1nn(C)cc1NC(=O)[C@H](Cc1ccccc1)N(C)C	ZINC000172770292	739545154	/nfs/dbraw/zinc/54/51/54/739545154.db2.gz	ICXVRLGRRNXTJN-HNNXBMFYSA-N	1	0	286.379	1.840	50	0		CDAARO
CCOc1ccc(C[NH2+][C@@H](C)C(N)=O)cc1Cl	ZINC000032547826	740149250	/nfs/dbraw/zinc/14/92/50/740149250.db2.gz	HWLUNMJIUJAZMF-QMMMGPOBSA-N	1	0	256.733	1.702	50	0		CDAARO
C[C@@H]1[C@@H]2CCC[N@@H+]2CCN1CC(C)(C)CN1CCOCC1	ZINC000032565177	742384047	/nfs/dbraw/zinc/38/40/47/742384047.db2.gz	QATOXTAWNQLKAG-CVEARBPZSA-N	1	0	295.471	1.513	50	0		CDAARO
COc1ccc(Cc2nc3c(c(=O)[nH]2)CC[NH2+]CC3)cc1	ZINC000065429902	742796898	/nfs/dbraw/zinc/79/68/98/742796898.db2.gz	MFMJRDJXXOTRSU-UHFFFAOYSA-N	1	0	285.347	1.058	50	0		CDAARO
CN1C[C@@H]2C[C@@H](c3cccc(O)c3)[N@@H+]3CCC[C@@]23C1=O	ZINC000011661185	742831832	/nfs/dbraw/zinc/83/18/32/742831832.db2.gz	POJRGCZPLWOWKA-NOLJZWGESA-N	1	0	272.348	1.760	50	0		CDAARO
C(C[C@@H]1CCC[NH2+]C1)c1noc(C2CCOCC2)n1	ZINC000675024448	899883436	/nfs/dbraw/zinc/88/34/36/899883436.db2.gz	HBYOFBBYCJBINR-NSHDSACASA-N	1	0	265.357	1.896	50	0		CDAARO
Fc1cnc(C[C@@H]2CC[C@H](C[NH+]3CCSCC3)O2)nc1	ZINC000952854541	910408961	/nfs/dbraw/zinc/40/89/61/910408961.db2.gz	KPXJZZISFHAMTQ-QWHCGFSZSA-N	1	0	297.399	1.755	50	0		CDAARO
CN(C)C(=O)[C@H]1CC[N@H+](C[C@@H]2COC3(CCCCC3)O2)C1	ZINC000952883223	910452143	/nfs/dbraw/zinc/45/21/43/910452143.db2.gz	YAGHHSLSIIVZSL-UONOGXRCSA-N	1	0	296.411	1.472	50	0		CDAARO
CC[C@@H](C)C[NH+]1CCC(O)(c2ncnn2C)CC1	ZINC000952883470	910454545	/nfs/dbraw/zinc/45/45/45/910454545.db2.gz	XRWSDCAKJPGKRY-LLVKDONJSA-N	1	0	252.362	1.145	50	0		CDAARO
C/C=C/C[N@@H+]1CCC[C@@H](CNC(=O)c2cc(C)n(C)n2)C1	ZINC000952960032	910467451	/nfs/dbraw/zinc/46/74/51/910467451.db2.gz	XDLACMYRCQYPRI-NNTXTVRGSA-N	1	0	290.411	1.746	50	0		CDAARO
Cc1cccnc1C[C@@H](C)N(C)c1cc(CC[NH3+])ncn1	ZINC000067678363	936619347	/nfs/dbraw/zinc/61/93/47/936619347.db2.gz	WEHJGWDDEUSUFD-CYBMUJFWSA-N	1	0	285.395	1.749	50	0		CDAARO
CC(C)[C@H](CNS(=O)(=O)CC1CCCC1)[NH+](C)C	ZINC000820694798	925545113	/nfs/dbraw/zinc/54/51/13/925545113.db2.gz	RRUGQEBQKZHHSD-ZDUSSCGKSA-N	1	0	276.446	1.682	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](NC(=O)c2cc(O)ccc2N)C1	ZINC000822922788	925656359	/nfs/dbraw/zinc/65/63/59/925656359.db2.gz	WOKFICBAZRLNMT-NSHDSACASA-N	1	0	277.368	1.579	50	0		CDAARO
CNc1nc(NC[C@@H]2CCC[N@H+](C)C2)ncc1F	ZINC000824090564	925799852	/nfs/dbraw/zinc/79/98/52/925799852.db2.gz	YJUSBXSETHPLDN-VIFPVBQESA-N	1	0	253.325	1.411	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@@H]2CCCCC[N@@H+]2C)C[C@H](C)O1	ZINC000825031265	925848970	/nfs/dbraw/zinc/84/89/70/925848970.db2.gz	IAURJXFOCIGWRU-XQQFMLRXSA-N	1	0	254.374	1.497	50	0		CDAARO
O=C(NC1CC1)[C@@]1(CCO)CC[N@H+](Cc2ccccc2)C1	ZINC000581811651	927202982	/nfs/dbraw/zinc/20/29/82/927202982.db2.gz	YKOOOMWKWXLZCA-QGZVFWFLSA-N	1	0	288.391	1.540	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+](CC[S@@](C)=O)C1	ZINC000585079726	930852202	/nfs/dbraw/zinc/85/22/02/930852202.db2.gz	GJCCCJQGRZZWAK-XEKQOVJPSA-N	1	0	288.457	1.382	50	0		CDAARO
Cc1nc(=NC[C@@H]2CCC[N@H+](Cc3ccco3)C2)n(C)[nH]1	ZINC001529124991	968988815	/nfs/dbraw/zinc/98/88/15/968988815.db2.gz	CUNSICRVHVRAOM-ZDUSSCGKSA-N	1	0	289.383	1.463	50	0		CDAARO
O[C@@H]1C[N@H+](CCCCOCc2ccccc2)C[C@H]1F	ZINC001506398113	975148052	/nfs/dbraw/zinc/14/80/52/975148052.db2.gz	LRYCWCHGKYUREL-HUUCEWRRSA-N	1	0	267.344	1.998	50	0		CDAARO
CCSCC[N@@H+]1CCC[C@@](CO)(CN(C)C)C1	ZINC001506400254	975149398	/nfs/dbraw/zinc/14/93/98/975149398.db2.gz	BGCDYONHSBOFML-CYBMUJFWSA-N	1	0	260.447	1.376	50	0		CDAARO
CC1=C(C(=O)NCCC[N@@H+](C)C2CCCC2)OCCO1	ZINC001506421141	975158008	/nfs/dbraw/zinc/15/80/08/975158008.db2.gz	XXDPQHWZZLKQGI-UHFFFAOYSA-N	1	0	282.384	1.645	50	0		CDAARO
Cn1ccnc1CC[N@@H+]1CCCN(Cc2ccccn2)CC1	ZINC001506429631	975161691	/nfs/dbraw/zinc/16/16/91/975161691.db2.gz	YEMMIDITZBHZEA-UHFFFAOYSA-N	1	0	299.422	1.566	50	0		CDAARO
O=C(NCCC[N@H+]1CCC[C@H]1CO)C1CCCC1	ZINC000096461790	230377988	/nfs/dbraw/zinc/37/79/88/230377988.db2.gz	YJTJXSONTLXKCD-ZDUSSCGKSA-N	1	0	254.374	1.140	50	0		CDAARO
[NH3+][C@@H]1CCCCN(C(=O)c2ncc(F)cc2F)C1	ZINC000082127908	177923482	/nfs/dbraw/zinc/92/34/82/177923482.db2.gz	ONRJMGMJCCWMMV-SECBINFHSA-N	1	0	255.268	1.313	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)NCc1cccnc1)C1CCOCC1	ZINC000096492021	230382888	/nfs/dbraw/zinc/38/28/88/230382888.db2.gz	PCLSYFRPPCIFCC-GFCCVEGCSA-N	1	0	277.368	1.103	50	0		CDAARO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@H]([NH+]2CCCC2)CC1	ZINC000107500391	398148804	/nfs/dbraw/zinc/14/88/04/398148804.db2.gz	MMBKPZLIMAEUCO-YNEHKIRRSA-N	1	0	281.356	1.129	50	0		CDAARO
O=c1cc(C[N@H+](Cc2ccccc2)C2CC2)[nH]c(=O)[nH]1	ZINC000095947992	185038233	/nfs/dbraw/zinc/03/82/33/185038233.db2.gz	UGZSQQYPGDCIGU-UHFFFAOYSA-N	1	0	271.320	1.228	50	0		CDAARO
CSc1ccc([C@@H](C)[NH2+]C(CO)CO)cc1F	ZINC000095968598	185047420	/nfs/dbraw/zinc/04/74/20/185047420.db2.gz	YFXUMANEWRQYDC-MRVPVSSYSA-N	1	0	259.346	1.551	50	0		CDAARO
CC(C)c1cccc(S(=O)(=O)N2CCC[C@@H]2C[NH3+])c1	ZINC000095972652	185049455	/nfs/dbraw/zinc/04/94/55/185049455.db2.gz	SOQCXHFZWMXDTO-CYBMUJFWSA-N	1	0	282.409	1.922	50	0		CDAARO
CC1CC[NH+](C[C@H](O)Cn2cc(-n3cccc3)cn2)CC1	ZINC000095974787	185049852	/nfs/dbraw/zinc/04/98/52/185049852.db2.gz	ISGNNYMQKONTOA-INIZCTEOSA-N	1	0	288.395	1.767	50	0		CDAARO
COc1ccc(NC(=O)N2CC[NH+]3CCC2CC3)cn1	ZINC000241657675	361753264	/nfs/dbraw/zinc/75/32/64/361753264.db2.gz	PYHOHCKCFPQMNQ-UHFFFAOYSA-N	1	0	276.340	1.402	50	0		CDAARO
CCn1ccc(CN2CC([N@@H+]3CCCC[C@@H]3C)C2)n1	ZINC000244652079	361854816	/nfs/dbraw/zinc/85/48/16/361854816.db2.gz	GZKAUEOOJPYJLU-ZDUSSCGKSA-N	1	0	262.401	1.962	50	0		CDAARO
Cc1ccc2[nH]c(CN3CCN([C@@H]4CC[NH2+]C4)CC3)nc2c1	ZINC000244691025	361857440	/nfs/dbraw/zinc/85/74/40/361857440.db2.gz	JBGYDEZQHZPJKU-CQSZACIVSA-N	1	0	299.422	1.351	50	0		CDAARO
C[N@H+](CCn1cc[nH]c1=O)C[C@H]1Cc2ccccc2O1	ZINC000244742003	361862105	/nfs/dbraw/zinc/86/21/05/361862105.db2.gz	OAKAMPTYZPAQMP-CYBMUJFWSA-N	1	0	273.336	1.112	50	0		CDAARO
CCC1=NO[C@@H](C[NH+]2CCC(c3nncn3C)CC2)C1	ZINC000244840352	361866403	/nfs/dbraw/zinc/86/64/03/361866403.db2.gz	ULIWMYYMKFDXGL-CYBMUJFWSA-N	1	0	277.372	1.549	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+]C[C@](C)(O)c2cnn(C)c2)C1(C)C	ZINC000097034561	185157842	/nfs/dbraw/zinc/15/78/42/185157842.db2.gz	MCMNZPYQDCRKAK-GUTXKFCHSA-N	1	0	281.400	1.421	50	0		CDAARO
COc1ccc(S(=O)(=O)NCC2=CC[NH2+]CC2)cc1C	ZINC000189294591	539058144	/nfs/dbraw/zinc/05/81/44/539058144.db2.gz	YCTDZZWUBHLQIL-UHFFFAOYSA-N	1	0	296.392	1.202	50	0		CDAARO
Cn1c(C[N@@H+]2CC[C@H](C(N)=O)C2)cc2ccccc21	ZINC000585141291	342219039	/nfs/dbraw/zinc/21/90/39/342219039.db2.gz	SXVAWTPORTWCIU-LBPRGKRZSA-N	1	0	257.337	1.486	50	0		CDAARO
C[C@@H]1C[N@H+](C)C[C@@H]1NS(=O)(=O)/C=C\c1ccccc1	ZINC000098056027	342226676	/nfs/dbraw/zinc/22/66/76/342226676.db2.gz	OOFOEAJQOARGRV-WXRQEABKSA-N	1	0	280.393	1.527	50	0		CDAARO
CCNC(=O)N1CC[NH+]([C@@H]2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000338892010	539067175	/nfs/dbraw/zinc/06/71/75/539067175.db2.gz	MHYLTMMDNDQXHG-CLLJXQQHSA-N	1	0	269.389	1.290	50	0		CDAARO
C[C@@H]1Cc2ccccc2N1C(=O)CSC1=[NH+]CCN1	ZINC000012752667	539100095	/nfs/dbraw/zinc/10/00/95/539100095.db2.gz	IPRLYFWYSJJJQS-SNVBAGLBSA-N	1	0	275.377	1.657	50	0		CDAARO
O=C(NCc1nccs1)C12CCC[NH+](CCC1)C2	ZINC000585121014	362040305	/nfs/dbraw/zinc/04/03/05/362040305.db2.gz	BWSGXSHWOIVGRN-UHFFFAOYSA-N	1	0	265.382	1.635	50	0		CDAARO
CCCCNC(=O)[C@@H](C)N1CC[N@H+](C)[C@H](C(C)(C)C)C1	ZINC000585116449	362045355	/nfs/dbraw/zinc/04/53/55/362045355.db2.gz	WMWCWEWXKATMGF-KGLIPLIRSA-N	1	0	283.460	1.953	50	0		CDAARO
CSC[C@H](C)C(=O)N1CCC([NH+]2CCOCC2)CC1	ZINC000585123962	362054879	/nfs/dbraw/zinc/05/48/79/362054879.db2.gz	TXVAHTSVFPFAAM-LBPRGKRZSA-N	1	0	286.441	1.309	50	0		CDAARO
C[C@H]1CC[N@H+](C[C@H](O)COC(C)(C)C)CCS1	ZINC000192172385	362612404	/nfs/dbraw/zinc/61/24/04/362612404.db2.gz	FIQNDXGUDAJWIW-RYUDHWBXSA-N	1	0	261.431	1.990	50	0		CDAARO
NC(=O)[C@H]1CCC[N@@H+]1CCSCc1ccccc1	ZINC000192618766	362665903	/nfs/dbraw/zinc/66/59/03/362665903.db2.gz	IROMJZHYWBRQPD-CYBMUJFWSA-N	1	0	264.394	1.870	50	0		CDAARO
C[C@@H](NC(=O)N1CCC[C@H](O)C1)C(C)(C)C[NH+](C)C	ZINC000085423138	179059161	/nfs/dbraw/zinc/05/91/61/179059161.db2.gz	PKVLMGRRLYCPJV-NEPJUHHUSA-N	1	0	271.405	1.129	50	0		CDAARO
CSCCC(=O)N1CCN(c2cc[nH+]cc2C)CC1	ZINC000219295400	136583372	/nfs/dbraw/zinc/58/33/72/136583372.db2.gz	GDYMHXOXGLIVHM-UHFFFAOYSA-N	1	0	279.409	1.792	50	0		CDAARO
CC[C@H]1CN(C(=O)c2csc(COC)n2)C[C@@H]1[NH+](C)C	ZINC000089948582	347628082	/nfs/dbraw/zinc/62/80/82/347628082.db2.gz	WSNWDXHCKACLLQ-JQWIXIFHSA-N	1	0	297.424	1.702	50	0		CDAARO
CCCSCC(=O)NC[C@H]1CC[N@H+](CCC)C1	ZINC000053405373	348747973	/nfs/dbraw/zinc/74/79/73/348747973.db2.gz	LLCHIAQLQBERCA-GFCCVEGCSA-N	1	0	258.431	1.978	50	0		CDAARO
CC(C)SCC[N@@H+]1CCCn2nc([C@H](O)CO)cc2C1	ZINC000230563231	348756454	/nfs/dbraw/zinc/75/64/54/348756454.db2.gz	VSLHWLIWOTZRCJ-CQSZACIVSA-N	1	0	299.440	1.256	50	0		CDAARO
COC(C)(C)CCNC(=O)[C@H]1CC12CC[NH2+]CC2	ZINC000584884868	349343311	/nfs/dbraw/zinc/34/33/11/349343311.db2.gz	CLTNOFQJZGXXTG-LLVKDONJSA-N	1	0	254.374	1.307	50	0		CDAARO
CCO[C@H]1C[N@H+](CC)C[C@@H]1n1cnc2ccncc2c1=O	ZINC000584888773	349347135	/nfs/dbraw/zinc/34/71/35/349347135.db2.gz	YVQRULXUJVBMNG-KBPBESRZSA-N	1	0	288.351	1.073	50	0		CDAARO
O=C(NCCC[N@H+]1CCCC[C@H]1CO)c1ccoc1	ZINC000584892387	349352209	/nfs/dbraw/zinc/35/22/09/349352209.db2.gz	XBODIXDHPXSFDN-ZDUSSCGKSA-N	1	0	266.341	1.246	50	0		CDAARO
Cc1cc(=O)cc(C(=O)NC[C@H](C(C)C)[NH+]2CCCC2)o1	ZINC000584894863	349355271	/nfs/dbraw/zinc/35/52/71/349355271.db2.gz	VWQIDAOJSVBFDQ-CQSZACIVSA-N	1	0	292.379	1.798	50	0		CDAARO
[NH3+][C@H]1CCC[C@@H](C(=O)N2CCC3(COC(=O)O3)CC2)C1	ZINC000584897346	349359345	/nfs/dbraw/zinc/35/93/45/349359345.db2.gz	HMXXNTDIDZAHEV-MNOVXSKESA-N	1	0	282.340	1.032	50	0		CDAARO
C/C(=C\c1ccccc1)C[N@@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000271208970	191000932	/nfs/dbraw/zinc/00/09/32/191000932.db2.gz	TYCRJTBVENCTQV-NRMKIYEFSA-N	1	0	294.420	1.713	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@H]1NS(=O)(=O)c1ccc(F)c(F)c1	ZINC000091496878	180172499	/nfs/dbraw/zinc/17/24/99/180172499.db2.gz	XNKUWXHTCCQXHL-PRHODGIISA-N	1	0	290.335	1.384	50	0		CDAARO
CNC(=O)C[N@@H+]1CCC[C@@](CO)(CC=C(C)C)C1	ZINC000091548461	180188299	/nfs/dbraw/zinc/18/82/99/180188299.db2.gz	UBKALUMZBDTHQG-CQSZACIVSA-N	1	0	254.374	1.163	50	0		CDAARO
CCn1nc(C(C)C)cc1C(=O)N1C[C@@H]2CCC[NH2+][C@@H]2C1	ZINC000091907574	180284403	/nfs/dbraw/zinc/28/44/03/180284403.db2.gz	BEJJMBHIXPDVFW-GXTWGEPZSA-N	1	0	290.411	1.850	50	0		CDAARO
C[N@@H+]1CCC[C@H](NC(=O)[C@H](c2ccccc2)n2cccn2)C1	ZINC000106579741	186127672	/nfs/dbraw/zinc/12/76/72/186127672.db2.gz	CQEWIVOUUALSQY-HOTGVXAUSA-N	1	0	298.390	1.683	50	0		CDAARO
C[NH+](C)C[C@H]1CCN(C(=O)c2n[nH]c3c2CCCC3)C1	ZINC000095959277	351457936	/nfs/dbraw/zinc/45/79/36/351457936.db2.gz	LPITWHQDKZZQME-LLVKDONJSA-N	1	0	276.384	1.312	50	0		CDAARO
CCC[C@@H]1NC(=[NH2+])NC(=N)N1c1cccc(Cl)c1	ZINC000096026640	351475650	/nfs/dbraw/zinc/47/56/50/351475650.db2.gz	JZSCQRCFXATNGX-SNVBAGLBSA-N	1	0	265.748	1.916	50	0		CDAARO
CC(C)COCCNC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@H]21	ZINC000096499717	351569598	/nfs/dbraw/zinc/56/95/98/351569598.db2.gz	VQLPYPQRMKTEMR-LSDHHAIUSA-N	1	0	297.443	1.785	50	0		CDAARO
Cc1cc(C(=O)NCC2CC[NH2+]CC2)nn1-c1ccccc1	ZINC000120541083	186907042	/nfs/dbraw/zinc/90/70/42/186907042.db2.gz	CAUKAGREDYBAAE-UHFFFAOYSA-N	1	0	298.390	1.910	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CN(C(=O)c2ccccc2Cl)CCO1	ZINC000122884872	187057397	/nfs/dbraw/zinc/05/73/97/187057397.db2.gz	XUAAUNTWTLFWLS-BXKDBHETSA-N	1	0	268.744	1.528	50	0		CDAARO
C[C@@H]1C[C@H]1c1ccc(C[NH2+]CC2(CO)COC2)o1	ZINC000123032014	187066744	/nfs/dbraw/zinc/06/67/44/187066744.db2.gz	PEIJVGOYSIYVOW-ZYHUDNBSSA-N	1	0	251.326	1.502	50	0		CDAARO
C[C@@H](CCc1nnc(C2CC2)[nH]1)[NH+]1CCN(C)CC1	ZINC000065433540	363264832	/nfs/dbraw/zinc/26/48/32/363264832.db2.gz	CIFJWSBHRCDBPX-NSHDSACASA-N	1	0	263.389	1.251	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C[C@@H]1COc2ccccc2O1	ZINC000036864717	363281890	/nfs/dbraw/zinc/28/18/90/363281890.db2.gz	RQUUKTVSUDOJHA-GFCCVEGCSA-N	1	0	273.336	1.956	50	0		CDAARO
CC[NH+](CC)CCNC(=O)Cn1c(C)nc2ccccc21	ZINC000002180671	355962015	/nfs/dbraw/zinc/96/20/15/355962015.db2.gz	VMXUYNLNOJCHFU-UHFFFAOYSA-N	1	0	288.395	1.803	50	0		CDAARO
CC(C)C[NH+]1CCC(N[C@@H](C)c2nncn2C)CC1	ZINC000067757386	356007958	/nfs/dbraw/zinc/00/79/58/356007958.db2.gz	BAVPTOFGTQLWEJ-LBPRGKRZSA-N	1	0	265.405	1.586	50	0		CDAARO
Brc1ccc2ncnc(N3CC[NH2+]CC3)c2c1	ZINC000004226385	356022644	/nfs/dbraw/zinc/02/26/44/356022644.db2.gz	YKLUQABTYJZQOJ-UHFFFAOYSA-N	1	0	293.168	1.802	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC([NH3+])CC2)cc1	ZINC000004299052	356026002	/nfs/dbraw/zinc/02/60/02/356026002.db2.gz	DSHYCTJDCZLVLE-UHFFFAOYSA-N	1	0	254.355	1.107	50	0		CDAARO
Cc1cc(NC(=O)[C@H](C)[NH2+][C@H](C)[C@@H]2CCCO2)on1	ZINC000097374273	356094773	/nfs/dbraw/zinc/09/47/73/356094773.db2.gz	IWXGZJSLNAVWTI-VWYCJHECSA-N	1	0	267.329	1.467	50	0		CDAARO
CN(CCOc1ccccc1F)C(=O)[C@]1(F)CC[NH2+]C1	ZINC000299738635	356263552	/nfs/dbraw/zinc/26/35/52/356263552.db2.gz	DJLWVEUCSJJBMK-AWEZNQCLSA-N	1	0	284.306	1.365	50	0		CDAARO
CCn1cc(C(=O)N(C)[C@H]2CC[NH2+]C2)c(C(C)C)n1	ZINC000299738741	356263731	/nfs/dbraw/zinc/26/37/31/356263731.db2.gz	FTBNOEQMAHFJND-NSHDSACASA-N	1	0	264.373	1.460	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNc1nc(Cl)nc2nc[nH]c21	ZINC000013653828	356351737	/nfs/dbraw/zinc/35/17/37/356351737.db2.gz	REOZDSCREGBQIL-QMMMGPOBSA-N	1	0	280.763	1.903	50	0		CDAARO
COC(=O)c1ccc(CN2CCCC[C@H]2C(N)=O)cc1	ZINC000032751436	356358875	/nfs/dbraw/zinc/35/88/75/356358875.db2.gz	QKJJTWMCXYPJMR-ZDUSSCGKSA-N	1	0	276.336	1.313	50	0		CDAARO
C[NH+](C)CCNC(=O)CCC(=O)Nc1ccc(Cl)cc1	ZINC000004575011	356423618	/nfs/dbraw/zinc/42/36/18/356423618.db2.gz	QQIPXVMAYXEMMO-UHFFFAOYSA-N	1	0	297.786	1.737	50	0		CDAARO
Nc1cccnc1N1CC[NH+](Cc2ccccc2)CC1	ZINC000019389953	356483717	/nfs/dbraw/zinc/48/37/17/356483717.db2.gz	KOQUBJBSRNMBSY-UHFFFAOYSA-N	1	0	268.364	1.986	50	0		CDAARO
CC[NH+]1CCN(CCC(=O)Nc2ccc(C)cc2)CC1	ZINC000019528180	356490129	/nfs/dbraw/zinc/49/01/29/356490129.db2.gz	YWBDETADHUIETM-UHFFFAOYSA-N	1	0	275.396	1.961	50	0		CDAARO
Cc1cc(Br)ccc1OCCNCC[NH3+]	ZINC000020118487	356526114	/nfs/dbraw/zinc/52/61/14/356526114.db2.gz	RBDBBGRXGCIGIN-UHFFFAOYSA-N	1	0	273.174	1.685	50	0		CDAARO
Cc1cccc(OCCOCCN2CC[NH2+]CC2)c1C	ZINC000020117990	356526171	/nfs/dbraw/zinc/52/61/71/356526171.db2.gz	FQPKOCRIMOMWBE-UHFFFAOYSA-N	1	0	278.396	1.604	50	0		CDAARO
Fc1ccc(OCCOCCN2CC[NH2+]CC2)cc1	ZINC000020117996	356526331	/nfs/dbraw/zinc/52/63/31/356526331.db2.gz	FQWLPDMNRUFHJS-UHFFFAOYSA-N	1	0	268.332	1.126	50	0		CDAARO
O=S1(=O)CC[C@@H]([NH2+]Cc2ccc(F)c(F)c2)C1	ZINC000019899731	363499474	/nfs/dbraw/zinc/49/94/74/363499474.db2.gz	QISOIVPFBKXBNC-SECBINFHSA-N	1	0	261.293	1.242	50	0		CDAARO
CC(C)C(=O)NCC1(C(F)(F)F)CC[NH2+]CC1	ZINC000725264771	538455769	/nfs/dbraw/zinc/45/57/69/538455769.db2.gz	UVYWNGQTECTCTE-UHFFFAOYSA-N	1	0	252.280	1.691	50	0		CDAARO
C[C@@H](CN1CCOCC1)[NH2+][C@@H](CO)c1ccccc1	ZINC000097238526	295930217	/nfs/dbraw/zinc/93/02/17/295930217.db2.gz	AIIHAGBTUAGAFG-ZFWWWQNUSA-N	1	0	264.369	1.030	50	0		CDAARO
CN(CCO)C1=CC(=[N+]2CCOCC2)CC(C)(C)C1	ZINC000025326646	356672772	/nfs/dbraw/zinc/67/27/72/356672772.db2.gz	ASKDTRBHRFJUED-UHFFFAOYSA-N	1	0	267.393	1.098	50	0		CDAARO
CNC(=O)C1CC[NH+](C[C@H](O)c2ccc(F)cc2)CC1	ZINC000025353956	356672886	/nfs/dbraw/zinc/67/28/86/356672886.db2.gz	ZXVVLAJHPBYMOF-AWEZNQCLSA-N	1	0	280.343	1.317	50	0		CDAARO
C[NH2+]CC1CCN(C(=O)c2cncnc2C(C)C)CC1	ZINC000269145292	356808926	/nfs/dbraw/zinc/80/89/26/356808926.db2.gz	CNIMHBGBYDIXGG-UHFFFAOYSA-N	1	0	276.384	1.672	50	0		CDAARO
c1cnc(N2CC[NH+]([C@H]3CCSC3)CC2)nc1	ZINC000023282618	356816652	/nfs/dbraw/zinc/81/66/52/356816652.db2.gz	SSZODLMWUJPRBQ-NSHDSACASA-N	1	0	250.371	1.104	50	0		CDAARO
CNc1nc(N2CCCCC2)nc(N2CCCCC2)n1	ZINC000095411800	357274819	/nfs/dbraw/zinc/27/48/19/357274819.db2.gz	IBLVAXCSVPJUHG-UHFFFAOYSA-N	1	0	276.388	1.894	50	0		CDAARO
COCCN(Cc1ccccn1)C(=O)C[C@@H]1CC[NH2+]C1	ZINC000089745425	357502707	/nfs/dbraw/zinc/50/27/07/357502707.db2.gz	HBGRJCKTXPEVHE-ZDUSSCGKSA-N	1	0	277.368	1.056	50	0		CDAARO
Cc1cc(N(C)CC2(CO)CCC2)nc(N(C)C)[nH+]1	ZINC000065398115	357536776	/nfs/dbraw/zinc/53/67/76/357536776.db2.gz	QVKXJCPYQVQETF-UHFFFAOYSA-N	1	0	264.373	1.450	50	0		CDAARO
CC[C@@H](O)CNc1nc(CC[NH3+])nc2ccccc21	ZINC000065403319	357537905	/nfs/dbraw/zinc/53/79/05/357537905.db2.gz	BTSVWDRXISMOBW-SNVBAGLBSA-N	1	0	260.341	1.314	50	0		CDAARO
COc1cc(NC[C@H](c2ccccn2)[NH+](C)C)ncn1	ZINC000065409638	357539144	/nfs/dbraw/zinc/53/91/44/357539144.db2.gz	BGMKAXXYYVBQKI-GFCCVEGCSA-N	1	0	273.340	1.595	50	0		CDAARO
COc1ccccc1CCNC(=O)C[NH2+]C1CC=CC1	ZINC000065527828	357546995	/nfs/dbraw/zinc/54/69/95/357546995.db2.gz	AHGKPDWNKIRPGI-UHFFFAOYSA-N	1	0	274.364	1.662	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]Cc2[nH]nc3c2CCC3)n1	ZINC000067743081	357624100	/nfs/dbraw/zinc/62/41/00/357624100.db2.gz	YVCQDDOWOYOPJL-NSHDSACASA-N	1	0	273.384	1.890	50	0		CDAARO
CC(C)CC[C@@]1(C2CC[NH2+]CC2)NC(=O)NC1=O	ZINC000067784470	357626340	/nfs/dbraw/zinc/62/63/40/357626340.db2.gz	HGPNSJBULQTQDQ-ZDUSSCGKSA-N	1	0	253.346	1.000	50	0		CDAARO
CCc1nccn1CC(=O)N1CCC[C@@]2(CC[NH2+]C2)C1	ZINC000067784799	357627814	/nfs/dbraw/zinc/62/78/14/357627814.db2.gz	VWCSGZFORBMPIH-HNNXBMFYSA-N	1	0	276.384	1.048	50	0		CDAARO
Cc1ccc(NC(=O)C(=O)NCC2CC[NH+](C)CC2)cc1	ZINC000022998979	357581896	/nfs/dbraw/zinc/58/18/96/357581896.db2.gz	WCSNPWZLBYOJNW-UHFFFAOYSA-N	1	0	289.379	1.392	50	0		CDAARO
Nc1ncc(C(=O)N[C@@H]2CC[C@@H]([NH3+])C2)c(-c2ccccc2)n1	ZINC000067817485	357629287	/nfs/dbraw/zinc/62/92/87/357629287.db2.gz	HEHBQSQRZNHTJA-VXGBXAGGSA-N	1	0	297.362	1.335	50	0		CDAARO
CC[C@H]1CN(Cc2ncnn2CC)CC[C@@]1(C)O	ZINC000067697113	357619020	/nfs/dbraw/zinc/61/90/20/357619020.db2.gz	OVAIDFQNOWVXOL-WCQYABFASA-N	1	0	252.362	1.281	50	0		CDAARO
C[N@@H+](Cc1c[nH]nc1-c1ccc(F)cc1)C[C@@H](O)CO	ZINC000067847357	357631438	/nfs/dbraw/zinc/63/14/38/357631438.db2.gz	MQOQIOOUKCWGGQ-CYBMUJFWSA-N	1	0	279.315	1.001	50	0		CDAARO
C[C@H](Cc1ccc(F)cc1)[NH+]1CCN(C=O)CC1	ZINC000071928230	357796668	/nfs/dbraw/zinc/79/66/68/357796668.db2.gz	YAKXGSARPXQQFE-GFCCVEGCSA-N	1	0	250.317	1.531	50	0		CDAARO
CN(CCCc1cnn(C)c1)C(=O)[C@H]([NH3+])c1ccccc1	ZINC000071775959	357780934	/nfs/dbraw/zinc/78/09/34/357780934.db2.gz	VTGGCTBEIKLEMY-OAHLLOKOSA-N	1	0	286.379	1.511	50	0		CDAARO
Cc1nc(CN2CCC([N@@H+]3CCC[C@@H](O)C3)CC2)co1	ZINC000072475201	357838149	/nfs/dbraw/zinc/83/81/49/357838149.db2.gz	AJHBBYWHTMUWAV-OAHLLOKOSA-N	1	0	279.384	1.404	50	0		CDAARO
C[C@@H]1CC[C@@H]([NH2+]CCCNS(C)(=O)=O)[C@H](C)C1	ZINC000097108701	357984369	/nfs/dbraw/zinc/98/43/69/357984369.db2.gz	YMHCUQARWBXYBC-IJLUTSLNSA-N	1	0	262.419	1.340	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)N1CCC(C)CC1)c1cnn(C)c1	ZINC000097112183	357987583	/nfs/dbraw/zinc/98/75/83/357987583.db2.gz	DLGZAUVGEFTLPI-GFCCVEGCSA-N	1	0	264.373	1.329	50	0		CDAARO
Cc1cccnc1N1CCN(C[C@H]2CC[NH2+]C2)CC1	ZINC000077424973	358018565	/nfs/dbraw/zinc/01/85/65/358018565.db2.gz	IOVFIGUIYYLEES-AWEZNQCLSA-N	1	0	260.385	1.122	50	0		CDAARO
CC(C)[N@@H+]1CCO[C@H](Cn2cc(Br)cn2)C1	ZINC000080747776	358105017	/nfs/dbraw/zinc/10/50/17/358105017.db2.gz	FXCVWEOHVAKVCG-NSHDSACASA-N	1	0	288.189	1.755	50	0		CDAARO
Cc1cc(N2CCO[C@@H](c3nccs3)C2)nc(N)[nH+]1	ZINC000097203831	358191184	/nfs/dbraw/zinc/19/11/84/358191184.db2.gz	FZCZPSUTONCHKD-SECBINFHSA-N	1	0	277.353	1.402	50	0		CDAARO
C[C@H](Cc1ccccc1)C[N@@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000195569302	358566532	/nfs/dbraw/zinc/56/65/32/358566532.db2.gz	UZYGOQULALXDEG-UKRRQHHQSA-N	1	0	296.436	1.489	50	0		CDAARO
COc1ccc(-c2cc(C(=O)N3CC[C@H]([NH3+])C3)[nH]n2)cc1	ZINC000091793334	358527932	/nfs/dbraw/zinc/52/79/32/358527932.db2.gz	BYRFLIXZKYRISU-NSHDSACASA-N	1	0	286.335	1.259	50	0		CDAARO
[NH3+][C@H]1CN(c2ncc(F)c(N3CCCC3)n2)C[C@@H]1C1CC1	ZINC000091876540	358531735	/nfs/dbraw/zinc/53/17/35/358531735.db2.gz	CVDUYQQDAZEKFO-YPMHNXCESA-N	1	0	291.374	1.389	50	0		CDAARO
O=C(C[NH2+]CCO)Nc1ccc(OC(F)(F)F)cc1	ZINC000095082627	358676497	/nfs/dbraw/zinc/67/64/97/358676497.db2.gz	JXQYHZVJFFQVIQ-UHFFFAOYSA-N	1	0	278.230	1.106	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CCC(=O)NCCCn1cccn1	ZINC000095363687	358685389	/nfs/dbraw/zinc/68/53/89/358685389.db2.gz	SDDKHGXDOGMLFL-CQSZACIVSA-N	1	0	278.400	1.654	50	0		CDAARO
Cc1cc(C)c2c(ncnc2N[C@@H]2C[C@@H](CO)[N@H+](C)C2)n1	ZINC000095362498	358685629	/nfs/dbraw/zinc/68/56/29/358685629.db2.gz	UWAHUHBLVODDKU-NEPJUHHUSA-N	1	0	287.367	1.119	50	0		CDAARO
CCC[NH+]1CCC(CC(=O)N[C@H](C)c2nncn2C)CC1	ZINC000095364584	358686993	/nfs/dbraw/zinc/68/69/93/358686993.db2.gz	XWOCKFFFYQQGGH-GFCCVEGCSA-N	1	0	293.415	1.504	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1Cn1ncc2ccccc2c1=O	ZINC000095378791	358689765	/nfs/dbraw/zinc/68/97/65/358689765.db2.gz	JHIWODQGDGOHCN-CYBMUJFWSA-N	1	0	257.337	1.881	50	0		CDAARO
O=C(N1CC[NH2+]C[C@H](O)C1)C1(c2ccccc2)CCCC1	ZINC000097117615	358751860	/nfs/dbraw/zinc/75/18/60/358751860.db2.gz	KVOVKLYYKZLXCO-HNNXBMFYSA-N	1	0	288.391	1.291	50	0		CDAARO
Cc1ocnc1C(=O)N(CC[NH+](C)C)C[C@H]1CCCO1	ZINC000097259259	358762287	/nfs/dbraw/zinc/76/22/87/358762287.db2.gz	ZFELKHCRNUTSAS-GFCCVEGCSA-N	1	0	281.356	1.166	50	0		CDAARO
CCc1noc(C)c1C(=O)N[C@H]1Cc2ccccc2[C@@H]1[NH3+]	ZINC000097522795	358782156	/nfs/dbraw/zinc/78/21/56/358782156.db2.gz	YYZAAOJMIUTQNO-ZFWWWQNUSA-N	1	0	285.347	1.900	50	0		CDAARO
O=C(CCCc1cn[nH]c1)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000097654215	358790177	/nfs/dbraw/zinc/79/01/77/358790177.db2.gz	RVZCRELAFNCFED-OLZOCXBDSA-N	1	0	262.357	1.085	50	0		CDAARO
Cc1ccc(-c2n[nH]cc2CN2CC[NH2+]C[C@H](O)C2)cc1	ZINC000097744677	358795774	/nfs/dbraw/zinc/79/57/74/358795774.db2.gz	GQPCRQHBUISWGN-HNNXBMFYSA-N	1	0	286.379	1.151	50	0		CDAARO
Cc1cccc(N2CCN(C(=O)[C@H](C)OC(C)C)CC2)n1	ZINC000097823622	358801452	/nfs/dbraw/zinc/80/14/52/358801452.db2.gz	DESOBEXYVRBEJM-AWEZNQCLSA-N	1	0	291.395	1.852	50	0		CDAARO
O=C(NC[C@@H]1C[C@H](F)C[NH2+]1)c1ccc(Cl)cc1O	ZINC000215034983	358870769	/nfs/dbraw/zinc/87/07/69/358870769.db2.gz	XNFNDNPGDTWFGO-IUCAKERBSA-N	1	0	272.707	1.475	50	0		CDAARO
C[N@H+](Cc1cccc(OCC(N)=O)c1)[C@@H]1CCCC[C@@H]1O	ZINC000216258988	358933270	/nfs/dbraw/zinc/93/32/70/358933270.db2.gz	DFXMLALYBQXXPU-CABCVRRESA-N	1	0	292.379	1.286	50	0		CDAARO
c1cnc(N2CCC[N@@H+](C[C@@H]3CCOC3)CC2)nc1	ZINC000216441449	358945779	/nfs/dbraw/zinc/94/57/79/358945779.db2.gz	GQYSYGXKPVNETO-ZDUSSCGKSA-N	1	0	262.357	1.025	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCNC(=O)c2ccc(F)c(O)c2)C1	ZINC000219314109	359088045	/nfs/dbraw/zinc/08/80/45/359088045.db2.gz	RQILGPGXGWIJJD-NSHDSACASA-N	1	0	280.343	1.993	50	0		CDAARO
O=C(O[C@@H]1C[NH+]2CCC1CC2)[C@H]1COc2ccccc2O1	ZINC000000108987	359097524	/nfs/dbraw/zinc/09/75/24/359097524.db2.gz	MUWXMGFHWUUUDA-HUUCEWRRSA-N	1	0	289.331	1.464	50	0		CDAARO
C[C@@H]1CCC[C@@H](C)N1C(=O)C[N@H+](C)CC(C)(C)O	ZINC000087408555	359126634	/nfs/dbraw/zinc/12/66/34/359126634.db2.gz	FSPUGWSBXBHRPT-VXGBXAGGSA-N	1	0	256.390	1.479	50	0		CDAARO
C[NH+]1CCC(CC(=O)N2CCC3(CC[C@H]3O)CC2)CC1	ZINC000257180644	359216135	/nfs/dbraw/zinc/21/61/35/359216135.db2.gz	DSJCJELYCZGCIM-CQSZACIVSA-N	1	0	280.412	1.482	50	0		CDAARO
CN(Cc1ccoc1)Cc1nnc([C@H]2C[C@H]([NH3+])C2)n1C	ZINC000222560864	359354948	/nfs/dbraw/zinc/35/49/48/359354948.db2.gz	DASQGWOUTSJIGL-TXEJJXNPSA-N	1	0	275.356	1.245	50	0		CDAARO
CC(=O)N1CC([N@H+](Cc2ccccc2)C2CCOCC2)C1	ZINC000257184085	359501298	/nfs/dbraw/zinc/50/12/98/359501298.db2.gz	TVOJQCSAMMDRIA-UHFFFAOYSA-N	1	0	288.391	1.898	50	0		CDAARO
COc1cccc(C[NH2+]C2CCN(S(C)(=O)=O)CC2)c1	ZINC000030656126	359617125	/nfs/dbraw/zinc/61/71/25/359617125.db2.gz	OBIDYMNWFYRAEL-UHFFFAOYSA-N	1	0	298.408	1.209	50	0		CDAARO
CC(C)CCO[C@H](C)C(=O)N1CC[C@H]([NH3+])C[C@H]1C	ZINC000408519136	359911366	/nfs/dbraw/zinc/91/13/66/359911366.db2.gz	DZCLLMKZDUWGIZ-UPJWGTAASA-N	1	0	256.390	1.776	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@@H]1CCN(C(=O)c2cccn2C)C1	ZINC000409421097	360230401	/nfs/dbraw/zinc/23/04/01/360230401.db2.gz	HNVABLRPGPYGHN-CYBMUJFWSA-N	1	0	272.352	1.926	50	0		CDAARO
CNc1snc(C)c1C(=O)NC[C@H](C)Cn1ccnc1	ZINC000176402827	360278206	/nfs/dbraw/zinc/27/82/06/360278206.db2.gz	SOEYIKMVIJOMLT-VIFPVBQESA-N	1	0	293.396	1.756	50	0		CDAARO
O=C(NCC(F)(F)F)N[C@@H]1CC[N@@H+]2CCC[C@H]2C1	ZINC000095950729	360323407	/nfs/dbraw/zinc/32/34/07/360323407.db2.gz	BRKOMTFIDAWSSG-BDAKNGLRSA-N	1	0	265.279	1.475	50	0		CDAARO
CN(C(=O)c1ccc(-c2ncccn2)cc1)[C@H]1CC[N@H+](C)C1	ZINC000426544528	360682216	/nfs/dbraw/zinc/68/22/16/360682216.db2.gz	WEVXXTUTYDGIPL-HNNXBMFYSA-N	1	0	296.374	1.920	50	0		CDAARO
COc1ccc(Cl)cc1CC(=O)N1CC[C@H](C[NH3+])C1	ZINC000178514065	189122676	/nfs/dbraw/zinc/12/26/76/189122676.db2.gz	CIARSUCSXIWIIF-SNVBAGLBSA-N	1	0	282.771	1.698	50	0		CDAARO
C[NH+]1CCC(C)(C(=O)N2CCC[C@@H](c3nnc[nH]3)C2)CC1	ZINC000426397337	360663422	/nfs/dbraw/zinc/66/34/22/360663422.db2.gz	DDVVDCXHGJYWFS-GFCCVEGCSA-N	1	0	291.399	1.243	50	0		CDAARO
CCOCCNC(=O)c1ccc(-c2c[nH+]ccc2N)cc1	ZINC000426396396	360663991	/nfs/dbraw/zinc/66/39/91/360663991.db2.gz	JOFSQAKHFPDIEQ-UHFFFAOYSA-N	1	0	285.347	1.927	50	0		CDAARO
CC(C)c1nccc(C(=O)N(C)CC[NH+]2CCCC2)n1	ZINC000426485508	360674989	/nfs/dbraw/zinc/67/49/89/360674989.db2.gz	ATRLASXYVLYKDJ-UHFFFAOYSA-N	1	0	276.384	1.768	50	0		CDAARO
COc1cc(F)c(C(=O)N2CC[C@@H](C[NH3+])C2)cc1OC	ZINC000178522725	189124037	/nfs/dbraw/zinc/12/40/37/189124037.db2.gz	WXLVUMWNQLILFB-VIFPVBQESA-N	1	0	282.315	1.264	50	0		CDAARO
Cc1n[nH]c(C)c1CCN(C)C(=O)C(C)(C)[NH+]1CCCC1	ZINC000426521549	360985055	/nfs/dbraw/zinc/98/50/55/360985055.db2.gz	XLCQTANBNUUEJC-UHFFFAOYSA-N	1	0	292.427	1.902	50	0		CDAARO
Cc1cccc(-n2cc(CNC(=O)C[C@@H]3CC[NH2+]C3)cn2)c1	ZINC000299781004	200871083	/nfs/dbraw/zinc/87/10/83/200871083.db2.gz	QNNZVMHVMDOCCC-AWEZNQCLSA-N	1	0	298.390	1.797	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@@H]([NH3+])C(C)C)CCN1CC(F)F	ZINC000182909303	189339274	/nfs/dbraw/zinc/33/92/74/189339274.db2.gz	ULFHNPKEQAPIGZ-PWSUYJOCSA-N	1	0	277.359	1.158	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC[C@@H]([NH3+])C2)cc1F	ZINC000036297071	361462333	/nfs/dbraw/zinc/46/23/33/361462333.db2.gz	PWUUGGLIWKAHQQ-SNVBAGLBSA-N	1	0	272.345	1.246	50	0		CDAARO
Cc1ccc(S[C@@H](C)C(=O)N2CC[NH2+]CC2)cc1	ZINC000019686579	364079467	/nfs/dbraw/zinc/07/94/67/364079467.db2.gz	ATBKWVLGADCDFE-LBPRGKRZSA-N	1	0	264.394	1.907	50	0		CDAARO
O=C(c1cncc(F)c1)N1CC[C@H]([NH+]2CCCCC2)C1	ZINC000268272685	364022478	/nfs/dbraw/zinc/02/24/78/364022478.db2.gz	ODRBEYKTFPCUMV-AWEZNQCLSA-N	1	0	277.343	1.921	50	0		CDAARO
OCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000031599495	364992858	/nfs/dbraw/zinc/99/28/58/364992858.db2.gz	FTMNSXDJPJHNSF-UHFFFAOYSA-N	1	0	274.286	1.820	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@@H](C(=O)N2CCC3(CC2)OCCO3)C1	ZINC000089840151	366944693	/nfs/dbraw/zinc/94/46/93/366944693.db2.gz	IICFRMULQBGEEM-CQSZACIVSA-N	1	0	296.411	1.330	50	0		CDAARO
COCCn1cc(NC(=O)[C@@H](C(C)C)[NH+](C)C)ccc1=O	ZINC000089791111	366936797	/nfs/dbraw/zinc/93/67/97/366936797.db2.gz	DDSGOKCAADCMAN-CQSZACIVSA-N	1	0	295.383	1.019	50	0		CDAARO
CC(C)([NH2+]C[C@@H]1CCS(=O)(=O)C1)c1ccccc1	ZINC000280098971	367258707	/nfs/dbraw/zinc/25/87/07/367258707.db2.gz	SVDWYKGQDTZZDX-LBPRGKRZSA-N	1	0	267.394	1.946	50	0		CDAARO
COc1ccc(C(=O)N[C@@H]2CC[NH2+]C[C@@H]2C)c(OC)c1	ZINC000094344998	367402397	/nfs/dbraw/zinc/40/23/97/367402397.db2.gz	VUOLDKORNKBSSV-GXFFZTMASA-N	1	0	278.352	1.432	50	0		CDAARO
Cc1ccc(C(=O)N[C@H]2CC[NH2+]C[C@H]2C)cc1F	ZINC000094345422	367471709	/nfs/dbraw/zinc/47/17/09/367471709.db2.gz	MCUGJJNOCHPIBJ-MFKMUULPSA-N	1	0	250.317	1.862	50	0		CDAARO
CN1CCN(C(=O)C[C@@H]([NH3+])c2ccccc2)C(C)(C)C1=O	ZINC000094866060	367458482	/nfs/dbraw/zinc/45/84/82/367458482.db2.gz	OEGAWZPNWJMBRT-CYBMUJFWSA-N	1	0	289.379	1.156	50	0		CDAARO
CN(CC[N@H+](C)[C@@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000252497935	367645712	/nfs/dbraw/zinc/64/57/12/367645712.db2.gz	QRQJTDNPYVUGOJ-LLVKDONJSA-N	1	0	258.362	1.574	50	0		CDAARO
COc1ccc(OC)c([C@H](O)CN2CC[N@H+](C)C[C@H]2C)c1	ZINC000252511433	367673697	/nfs/dbraw/zinc/67/36/97/367673697.db2.gz	GSJMUGFGZXJONF-IUODEOHRSA-N	1	0	294.395	1.373	50	0		CDAARO
C[C@@H]([NH2+]CC(C)(C)C(N)=O)c1ccc(S(C)(=O)=O)cc1	ZINC000195558779	296116353	/nfs/dbraw/zinc/11/63/53/296116353.db2.gz	PMUUVJMARYXNTD-SNVBAGLBSA-N	1	0	298.408	1.252	50	0		CDAARO
Cc1nn(CCCNC(=O)[C@@H]2CCC[NH2+]CC2)c(C)c1C	ZINC000299757214	372745434	/nfs/dbraw/zinc/74/54/34/372745434.db2.gz	JKJOMMUXIFUKKM-OAHLLOKOSA-N	1	0	292.427	1.704	50	0		CDAARO
CCc1n[nH]cc1C(=O)NC[C@H]1CC[N@@H+](C2CCCC2)C1	ZINC000299758399	372746880	/nfs/dbraw/zinc/74/68/80/372746880.db2.gz	MRZCMWYLPWLTAS-GFCCVEGCSA-N	1	0	290.411	1.966	50	0		CDAARO
Nc1nc(C(=O)NC[C@H]2CC[N@@H+](C3CCCC3)C2)cs1	ZINC000299767467	372748460	/nfs/dbraw/zinc/74/84/60/372748460.db2.gz	HMQHORFTAIBJAO-SNVBAGLBSA-N	1	0	294.424	1.720	50	0		CDAARO
Cc1ccc2nc(CNC(=O)C[C@@H]3CC[NH2+]C3)cn2c1	ZINC000299787901	372762078	/nfs/dbraw/zinc/76/20/78/372762078.db2.gz	SXJUQPCSQFVOFG-LBPRGKRZSA-N	1	0	272.352	1.259	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)N(C)C[C@@H]1CC[N@@H+](C(C)C)C1	ZINC000299794986	372766964	/nfs/dbraw/zinc/76/69/64/372766964.db2.gz	KLAWRGKWNSRGJR-AWEZNQCLSA-N	1	0	292.427	1.758	50	0		CDAARO
O=C(Cc1ccc(F)cc1F)NCC1CC[NH2+]CC1	ZINC000095066494	373706189	/nfs/dbraw/zinc/70/61/89/373706189.db2.gz	WOOCJHOVUPSRSV-UHFFFAOYSA-N	1	0	268.307	1.623	50	0		CDAARO
Cc1cccc(C(=O)N2CCO[C@H]3CC[N@@H+](C)C[C@@H]32)c1O	ZINC000253425294	373732895	/nfs/dbraw/zinc/73/28/95/373732895.db2.gz	CHQWMCINHAMFCM-KBPBESRZSA-N	1	0	290.363	1.246	50	0		CDAARO
C[C@@H](NC(=O)NCCc1ccccn1)C1=CC[N@H+](C)CC1	ZINC000253424920	373733109	/nfs/dbraw/zinc/73/31/09/373733109.db2.gz	UXTZWBMHLDTKAS-CYBMUJFWSA-N	1	0	288.395	1.574	50	0		CDAARO
COC(=O)[C@@H]1CCN(Cc2cc(F)ncc2F)C[C@@H]1C	ZINC000253430602	373736287	/nfs/dbraw/zinc/73/62/87/373736287.db2.gz	NDIVOQVCHZJAGM-GXSJLCMTSA-N	1	0	284.306	1.991	50	0		CDAARO
Cc1n[nH]cc1C[N@H+](C)CCn1cc(Cl)cn1	ZINC000639971505	373910364	/nfs/dbraw/zinc/91/03/64/373910364.db2.gz	RGATZRSOJIZKKB-UHFFFAOYSA-N	1	0	253.737	1.700	50	0		CDAARO
Cn1cncc1CNC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000112716397	374228093	/nfs/dbraw/zinc/22/80/93/374228093.db2.gz	JFCFDCXQHWFSTN-UHFFFAOYSA-N	1	0	250.390	1.819	50	0		CDAARO
CC[NH+](CC)CC(=O)N1CCO[C@H](Cc2ccccc2)C1	ZINC000012465406	374505902	/nfs/dbraw/zinc/50/59/02/374505902.db2.gz	RSSWVYDTQXTSML-MRXNPFEDSA-N	1	0	290.407	1.798	50	0		CDAARO
COC(=O)CCC[N@@H+]1CCCC[C@@H]1c1cn[nH]c1	ZINC000117341880	374535205	/nfs/dbraw/zinc/53/52/05/374535205.db2.gz	LWQLCVAXIXPOGZ-GFCCVEGCSA-N	1	0	251.330	1.890	50	0		CDAARO
C[C@H]([C@H](C)O)[NH+]1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000108323651	412824955	/nfs/dbraw/zinc/82/49/55/412824955.db2.gz	STCDWRMUHCPXON-IJEWVQPXSA-N	1	0	278.396	1.107	50	0		CDAARO
Cc1ccc2c(c1)[nH]c1c2ncn(CC[NH+](C)C)c1=O	ZINC000002450885	374592575	/nfs/dbraw/zinc/59/25/75/374592575.db2.gz	BMLGWLLBFJOUBC-UHFFFAOYSA-N	1	0	270.336	1.748	50	0		CDAARO
COc1cc(CNC[C@@H]2CCC[N@H+](C)C2)cc2c1OCO2	ZINC000108428678	412829087	/nfs/dbraw/zinc/82/90/87/412829087.db2.gz	XRNRBXVSVMCXSL-LBPRGKRZSA-N	1	0	292.379	1.855	50	0		CDAARO
Cc1cc(Cl)ccc1C(=O)NC[C@]1(O)CC[NH2+]C1	ZINC000252502618	189979014	/nfs/dbraw/zinc/97/90/14/189979014.db2.gz	URQHLJWPEOUVRL-ZDUSSCGKSA-N	1	0	268.744	1.103	50	0		CDAARO
Cc1cnc(NCC2(C[NH+]3CCN(C)CC3)CC2)nc1	ZINC000095365657	374889862	/nfs/dbraw/zinc/88/98/62/374889862.db2.gz	OIBKWPYXXQDHML-UHFFFAOYSA-N	1	0	275.400	1.225	50	0		CDAARO
Cn1ncc(N[C@@H]2CC[N@@H+](C3CCCC3)C2)c(Cl)c1=O	ZINC000095389613	374897054	/nfs/dbraw/zinc/89/70/54/374897054.db2.gz	WBNHNEVTXRMWOX-SNVBAGLBSA-N	1	0	296.802	1.863	50	0		CDAARO
CCCC[N@H+](C)CCNC(=O)N1CCO[C@@H](C)[C@@H]1C	ZINC000095422004	374924093	/nfs/dbraw/zinc/92/40/93/374924093.db2.gz	PDAJBIUDMKJSQW-STQMWFEESA-N	1	0	271.405	1.537	50	0		CDAARO
Cn1cccc1C[NH2+][C@]1(CO)CCc2ccccc21	ZINC000095429769	374930946	/nfs/dbraw/zinc/93/09/46/374930946.db2.gz	FPGSMUIJMNAOQH-INIZCTEOSA-N	1	0	256.349	1.949	50	0		CDAARO
CN1CC[C@H]([NH2+]Cc2ccc(OC(F)F)c(F)c2)C1=O	ZINC000095437387	374937652	/nfs/dbraw/zinc/93/76/52/374937652.db2.gz	HDSUQCQRJKPFSC-JTQLQIEISA-N	1	0	288.269	1.747	50	0		CDAARO
CC[C@@H](NC(=O)NC1CC[NH+](CC)CC1)[C@H]1CCCO1	ZINC000095440303	374942909	/nfs/dbraw/zinc/94/29/09/374942909.db2.gz	WXKPYXGLTFHHGC-ZIAGYGMSSA-N	1	0	283.416	1.728	50	0		CDAARO
CC(C)(O)C(C)(C)[NH2+]CC(=O)NCc1cccs1	ZINC000095459769	374957456	/nfs/dbraw/zinc/95/74/56/374957456.db2.gz	JCFZBQXJGURGRE-UHFFFAOYSA-N	1	0	270.398	1.503	50	0		CDAARO
C[NH+](C)C1CN(C(=O)Nc2cccc(-c3nnco3)c2)C1	ZINC000095462315	374959573	/nfs/dbraw/zinc/95/95/73/374959573.db2.gz	WRWUCNMTPPZBGN-UHFFFAOYSA-N	1	0	287.323	1.514	50	0		CDAARO
NC(=O)[C@H]1C[C@H](O)C[N@@H+]1CCCc1cccc2ccccc21	ZINC000095399126	374904652	/nfs/dbraw/zinc/90/46/52/374904652.db2.gz	GCVWIEJGEDUPJV-DOTOQJQBSA-N	1	0	298.386	1.693	50	0		CDAARO
Cc1ccccc1-c1ncnc(N2CC[NH+](C)CC2)c1N	ZINC000096282108	375073193	/nfs/dbraw/zinc/07/31/93/375073193.db2.gz	UWVKSKCDMYIHKM-UHFFFAOYSA-N	1	0	283.379	1.786	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C\C(=O)N1CCCC[C@H]1C[NH3+]	ZINC000493342448	375445876	/nfs/dbraw/zinc/44/58/76/375445876.db2.gz	ZLHDBLDEDVKLOI-ZADCQDASSA-N	1	0	296.802	1.735	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)/C=C\c2csc(C)n2)C1	ZINC000606441687	375823447	/nfs/dbraw/zinc/82/34/47/375823447.db2.gz	NXIBKLITLBFQFJ-GZTOBOFZSA-N	1	0	265.382	1.675	50	0		CDAARO
O=C(COc1cccnc1)N1CCC[C@@]2(CC[NH2+]C2)C1	ZINC000067472679	377098624	/nfs/dbraw/zinc/09/86/24/377098624.db2.gz	GMAWASUWUWARMV-HNNXBMFYSA-N	1	0	275.352	1.063	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@H](CCNC(=O)c2ccc[nH]2)C1	ZINC000067804574	377239975	/nfs/dbraw/zinc/23/99/75/377239975.db2.gz	JPZWZLJLTBKUHH-CYBMUJFWSA-N	1	0	279.384	1.491	50	0		CDAARO
CNC(=O)c1nc(-c2ccc([C@H](C)[NH+]3CCCC3)cc2)n[nH]1	ZINC000426405140	256861942	/nfs/dbraw/zinc/86/19/42/256861942.db2.gz	MODHALUUMDCWPA-NSHDSACASA-N	1	0	299.378	1.988	50	0		CDAARO
N=C(NC(N)=[NH2+])Nc1nc(-c2ccccc2)cs1	ZINC000000089397	390134063	/nfs/dbraw/zinc/13/40/63/390134063.db2.gz	QJCCJCDEYRVCQG-UHFFFAOYSA-N	1	0	260.326	1.640	50	0		CDAARO
[NH3+]C[C@@H](O)COCCC12CC3CC(CC(C3)C1)C2	ZINC000002271239	390141450	/nfs/dbraw/zinc/14/14/50/390141450.db2.gz	BTXJWBXVRNLYAC-WRHSUISWSA-N	1	0	253.386	1.929	50	0		CDAARO
O=C(Nc1ccc(F)cc1)c1n[nH]c2c1C[NH2+]CC2	ZINC000042784050	390430209	/nfs/dbraw/zinc/43/02/09/390430209.db2.gz	SQASIAADEYJOBK-UHFFFAOYSA-N	1	0	260.272	1.447	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]CCNC(=O)c1cccs1	ZINC000097159615	390800961	/nfs/dbraw/zinc/80/09/61/390800961.db2.gz	DRPKXYINJVCUFH-UHFFFAOYSA-N	1	0	278.381	1.608	50	0		CDAARO
CCOCCC(=O)N1CCCN(c2cc[nH+]cc2C)CC1	ZINC000082109390	390837776	/nfs/dbraw/zinc/83/77/76/390837776.db2.gz	IEZRKKRIGZKWEV-UHFFFAOYSA-N	1	0	291.395	1.855	50	0		CDAARO
COCCC[N@@H+]1CC[C@@H](CNc2nnc(C)o2)C1	ZINC000095383002	390910898	/nfs/dbraw/zinc/91/08/98/390910898.db2.gz	UUBZJEDYDRUHTO-NSHDSACASA-N	1	0	254.334	1.148	50	0		CDAARO
CC[N@@H+]1CC[C@@H](Nc2nc(C)nc3oc(C)nc32)C1	ZINC000063869542	391193260	/nfs/dbraw/zinc/19/32/60/391193260.db2.gz	JGHNMVDCYWDQCW-SNVBAGLBSA-N	1	0	261.329	1.741	50	0		CDAARO
CCCN1C[C@H](C[NH2+][C@@H]2CCCSC2)CC1=O	ZINC000421356228	391849542	/nfs/dbraw/zinc/84/95/42/391849542.db2.gz	WQZCLGSWYHXIIP-NWDGAFQWSA-N	1	0	256.415	1.730	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCNC(=O)c2ccc(C(N)=O)cc2)C1	ZINC000458195116	391849684	/nfs/dbraw/zinc/84/96/84/391849684.db2.gz	QPBMHEJERPXTOM-GFCCVEGCSA-N	1	0	289.379	1.247	50	0		CDAARO
COc1ccc(CCC(=O)N2CC[C@@H]([NH3+])C2)cc1F	ZINC000257661034	131145884	/nfs/dbraw/zinc/14/58/84/131145884.db2.gz	DGSKKSJGTMUJCT-LLVKDONJSA-N	1	0	266.316	1.327	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)c2ccn(-c3ccc(F)cc3)n2)C1	ZINC000095971460	393156436	/nfs/dbraw/zinc/15/64/36/393156436.db2.gz	SMDHXSNNPDNSSA-LLVKDONJSA-N	1	0	274.299	1.185	50	0		CDAARO
[NH3+]C1(CC(=O)N2CCN(c3ccc(O)cc3)CC2)CCC1	ZINC000094294333	135086104	/nfs/dbraw/zinc/08/61/04/135086104.db2.gz	GCGBHKYXGYPCSH-UHFFFAOYSA-N	1	0	289.379	1.312	50	0		CDAARO
COCc1nc(C)cc(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)n1	ZINC000240555620	140262871	/nfs/dbraw/zinc/26/28/71/140262871.db2.gz	GWQJRYQPRPJXTE-OLZOCXBDSA-N	1	0	276.384	1.970	50	0		CDAARO
Cc1ccc(CCN(C[C@H]2CCCO2)C(=O)[C@@H](C)[NH3+])cc1	ZINC000119054380	292094686	/nfs/dbraw/zinc/09/46/86/292094686.db2.gz	FTGWQSHTLZIORJ-GDBMZVCRSA-N	1	0	290.407	1.892	50	0		CDAARO
COC[C@H](O)C[N@H+](C)Cc1ccc(F)c(Cl)c1	ZINC000092255906	147004976	/nfs/dbraw/zinc/00/49/76/147004976.db2.gz	WACFWRNEUIHVGR-SNVBAGLBSA-N	1	0	261.724	1.918	50	0		CDAARO
CC[C@H](C(=O)N1CCN(C)C[C@H]1C)c1c(C)noc1C	ZINC000335889406	151084690	/nfs/dbraw/zinc/08/46/90/151084690.db2.gz	AZPYMOVGMUPCKE-MFKMUULPSA-N	1	0	279.384	1.948	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]CCCNS(C)(=O)=O)[C@H](C)C1	ZINC000097108699	296732962	/nfs/dbraw/zinc/73/29/62/296732962.db2.gz	YMHCUQARWBXYBC-UTUOFQBUSA-N	1	0	262.419	1.340	50	0		CDAARO
[NH3+]CC(=O)N1CCC[C@H]1C(=O)Nc1ccc2ccccc2c1	ZINC000004899437	170037792	/nfs/dbraw/zinc/03/77/92/170037792.db2.gz	WKQUUNDBFODDFP-HNNXBMFYSA-N	1	0	297.358	1.728	50	0	in-vitro	CDAARO
COCC[NH2+]Cc1ccc(OCC(=O)NC(C)(C)C)cc1	ZINC000006701236	170229353	/nfs/dbraw/zinc/22/93/53/170229353.db2.gz	QOFLIDKNSJAFJA-UHFFFAOYSA-N	1	0	294.395	1.716	50	0		CDAARO
[NH3+]C[C@H](c1cccnc1)S(=O)(=O)c1ccccc1	ZINC000008031083	170315048	/nfs/dbraw/zinc/31/50/48/170315048.db2.gz	PPXANUXCMGIIFL-CYBMUJFWSA-N	1	0	262.334	1.555	50	0		CDAARO
C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCCCC1	ZINC000008118999	170319498	/nfs/dbraw/zinc/31/94/98/170319498.db2.gz	QZJJQHDMXCRBDS-JTQLQIEISA-N	1	0	288.351	1.669	50	0		CDAARO
Cc1cc(C(=O)NC2CC[NH+](C(C)C)CC2)no1	ZINC000016605331	170704784	/nfs/dbraw/zinc/70/47/84/170704784.db2.gz	ZOFXUJHALPFJLX-UHFFFAOYSA-N	1	0	251.330	1.586	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)CO[C@@H]2CCC[C@@H]2C)CC1	ZINC000020707533	171269763	/nfs/dbraw/zinc/26/97/63/171269763.db2.gz	HOQJEEHSQKXMCX-SOUVJXGZSA-N	1	0	270.417	1.190	50	0		CDAARO
CC[NH+]1CCN(C[C@H]2COc3ccccc3O2)CC1	ZINC000020791702	171272690	/nfs/dbraw/zinc/27/26/90/171272690.db2.gz	YSMURWKPMWDUGL-ZDUSSCGKSA-N	1	0	262.353	1.464	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CN2C[C@@H](C)O[C@@H](C)C2)C1	ZINC000020865499	171276769	/nfs/dbraw/zinc/27/67/69/171276769.db2.gz	JAJCIDJDPMTPMG-HZSPNIEDSA-N	1	0	256.390	1.064	50	0		CDAARO
COc1ccc(NC(=O)NCCC[NH+](C)C)cc1	ZINC000023232946	171416629	/nfs/dbraw/zinc/41/66/29/171416629.db2.gz	YTWLLQOHLUVHBP-UHFFFAOYSA-N	1	0	251.330	1.768	50	0		CDAARO
O=C(COc1cccnc1)N1CCC[C@]2(CC[NH2+]C2)C1	ZINC000067472678	175775354	/nfs/dbraw/zinc/77/53/54/175775354.db2.gz	GMAWASUWUWARMV-OAHLLOKOSA-N	1	0	275.352	1.063	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN(Cc2cc(C(C)(C)C)n[nH]2)C1	ZINC000072144599	176324076	/nfs/dbraw/zinc/32/40/76/176324076.db2.gz	BXGDHFFOESMHPS-ZDUSSCGKSA-N	1	0	294.443	1.717	50	0		CDAARO
O=C(NCCn1cccn1)c1ccc([C@@H]2CC[NH2+]C2)cc1	ZINC000072152528	176327474	/nfs/dbraw/zinc/32/74/74/176327474.db2.gz	XERIJDLRKVSXLZ-OAHLLOKOSA-N	1	0	284.363	1.390	50	0		CDAARO
O=C(NCCn1cccn1)c1ccc([C@H]2CC[NH2+]C2)cc1	ZINC000072152529	176327543	/nfs/dbraw/zinc/32/75/43/176327543.db2.gz	XERIJDLRKVSXLZ-HNNXBMFYSA-N	1	0	284.363	1.390	50	0		CDAARO
COCCN(Cc1ccc(C)s1)C[C@]1(O)CC[NH2+]C1	ZINC000077407620	177263760	/nfs/dbraw/zinc/26/37/60/177263760.db2.gz	GPNVOLGOMSEJJI-AWEZNQCLSA-N	1	0	284.425	1.229	50	0		CDAARO
O=C(CCc1cc(Cl)no1)N1CC[C@H]2C[NH2+]C[C@H]21	ZINC000077452733	177270396	/nfs/dbraw/zinc/27/03/96/177270396.db2.gz	XJQWSEFIYAQBQH-WCBMZHEXSA-N	1	0	269.732	1.081	50	0		CDAARO
Cn1c(CN2CCCC2)nnc1C1CC[NH+](C)CC1	ZINC000077471521	177272551	/nfs/dbraw/zinc/27/25/51/177272551.db2.gz	LHHYZFCUFGLQLC-UHFFFAOYSA-N	1	0	263.389	1.220	50	0		CDAARO
CCOc1ccccc1CCC(=O)N1CCC[C@@H]([NH3+])C1	ZINC000191337631	264493260	/nfs/dbraw/zinc/49/32/60/264493260.db2.gz	FFDZLMUBTWZDGZ-CQSZACIVSA-N	1	0	276.380	1.968	50	0		CDAARO
CC[NH+](CC)C[C@H](C)NC(=O)Nc1cc(C)on1	ZINC000063975420	276108027	/nfs/dbraw/zinc/10/80/27/276108027.db2.gz	MCTCTAIKLRWZSN-VIFPVBQESA-N	1	0	254.334	1.835	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	ZINC000122616923	277278084	/nfs/dbraw/zinc/27/80/84/277278084.db2.gz	QSTPJHDAIZMCGQ-NSHDSACASA-N	1	0	262.309	1.239	50	0		CDAARO
CNc1ncc(CN(C)c2cc([C@H]3C[C@@H]([NH3+])C3)ncn2)cn1	ZINC000252549841	277305728	/nfs/dbraw/zinc/30/57/28/277305728.db2.gz	RVKVYLRICVYELS-TXEJJXNPSA-N	1	0	299.382	1.149	50	0		CDAARO
C[C@@H]([NH2+]CCNS(=O)(=O)c1ccccc1)[C@@H]1CCCO1	ZINC000097108749	278347746	/nfs/dbraw/zinc/34/77/46/278347746.db2.gz	LYQBXOXWASLSHF-OCCSQVGLSA-N	1	0	298.408	1.122	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@H]2[NH2+]CCS[C@@H]2C1	ZINC000086003087	278408533	/nfs/dbraw/zinc/40/85/33/278408533.db2.gz	NHMOWLFHCDJJHH-VHSXEESVSA-N	1	0	258.387	1.701	50	0		CDAARO
O=C1CC[C@@H]2C[N@H+](C[C@H]3CCOC3)CC[C@@H]2N1C1CC1	ZINC000343555451	280258284	/nfs/dbraw/zinc/25/82/84/280258284.db2.gz	XLWKOTKFGILDGQ-NFAWXSAZSA-N	1	0	278.396	1.498	50	0		CDAARO
O[C@]1(C[NH2+][C@@H]2CCCOc3cc(F)ccc32)CCOC1	ZINC000182168556	280449531	/nfs/dbraw/zinc/44/95/31/280449531.db2.gz	MFLLOSXBYGQQFV-HIFRSBDPSA-N	1	0	281.327	1.780	50	0		CDAARO
Cc1ccccc1N1CCC[N@H+](C[C@@H]2COCCO2)CC1	ZINC000244874923	281346843	/nfs/dbraw/zinc/34/68/43/281346843.db2.gz	XJRKSJXYNLFGPW-MRXNPFEDSA-N	1	0	290.407	1.923	50	0		CDAARO
CCC(=O)N1CC[C@@H]([NH2+][C@@H]2CC(C)(C)OC2(C)C)C1	ZINC000095969368	289063461	/nfs/dbraw/zinc/06/34/61/289063461.db2.gz	JYZPMUUASFCKPX-VXGBXAGGSA-N	1	0	268.401	1.933	50	0		CDAARO
[NH3+]CC1(NS(=O)(=O)c2cc(F)cc(F)c2)CCCC1	ZINC000095394519	295223560	/nfs/dbraw/zinc/22/35/60/295223560.db2.gz	XVTDGUCCYDTWNQ-UHFFFAOYSA-N	1	0	290.335	1.515	50	0		CDAARO
CC(C)[C@H]([NH3+])C(=O)Nc1cnn(Cc2ccncc2)c1	ZINC000178749805	315959588	/nfs/dbraw/zinc/95/95/88/315959588.db2.gz	LXGADKACFLVZRM-ZDUSSCGKSA-N	1	0	273.340	1.248	50	0		CDAARO
CC1CCC(C[N@@H+]2C[C@@H]3OCCN(C)[C@H]3C2)CC1	ZINC000336329198	316015390	/nfs/dbraw/zinc/01/53/90/316015390.db2.gz	JRBOKPHKHFWPRU-WUCCLRPBSA-N	1	0	252.402	1.828	50	0		CDAARO
C[C@@H](C(=O)NCCn1cncn1)[N@H+](C)C1CCCCC1	ZINC000534586234	328315546	/nfs/dbraw/zinc/31/55/46/328315546.db2.gz	QNJMALZFNCPFMX-LBPRGKRZSA-N	1	0	279.388	1.047	50	0		CDAARO
CC[N@@H+]1CCC[C@H](Nc2cc(-n3cccn3)ncn2)C1	ZINC000534646468	328329354	/nfs/dbraw/zinc/32/93/54/328329354.db2.gz	DKXFMDZUNRAEDX-LBPRGKRZSA-N	1	0	272.356	1.559	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)N[C@@H]1COC2(C1)CCCCC2	ZINC000534640853	328335897	/nfs/dbraw/zinc/33/58/97/328335897.db2.gz	BMCXMMHJJHLTKR-AWEZNQCLSA-N	1	0	280.412	1.984	50	0		CDAARO
CCCc1cnc(C)nc1N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000534641485	328336255	/nfs/dbraw/zinc/33/62/55/328336255.db2.gz	ZJZXGVRVOHJZND-NMWPEEMBSA-N	1	0	272.396	1.924	50	0		CDAARO
CN(Cc1nccn1Cc1ccccc1)C(=O)[C@H]1C=CC[NH2+]1	ZINC000534652972	328338297	/nfs/dbraw/zinc/33/82/97/328338297.db2.gz	CLDXLTYUSQAGQW-OAHLLOKOSA-N	1	0	296.374	1.418	50	0		CDAARO
Cc1cc(S(=O)(=O)N(C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)c(C)o1	ZINC000097234966	323207735	/nfs/dbraw/zinc/20/77/35/323207735.db2.gz	IHDMLKVJRVZXNE-FUNVUKJBSA-N	1	0	298.408	1.800	50	0		CDAARO
CCOC(=O)[C@@H]1C[N@H+](C)C[C@H]1C(=O)c1ccccc1	ZINC000248322579	334298194	/nfs/dbraw/zinc/29/81/94/334298194.db2.gz	WQKWIFSBDCEQNX-CHWSQXEVSA-N	1	0	261.321	1.610	50	0		CDAARO
Cc1ccc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)s1	ZINC000091893853	482590553	/nfs/dbraw/zinc/59/05/53/482590553.db2.gz	QMVAMTAXUQODNR-MNOVXSKESA-N	1	0	250.367	1.866	50	0		CDAARO
COc1nc(NCCC[N@@H+]2CCC[C@H](CO)C2)ncc1F	ZINC000670445935	482994985	/nfs/dbraw/zinc/99/49/85/482994985.db2.gz	BRBYUAXEZLHCDW-NSHDSACASA-N	1	0	298.362	1.131	50	0		CDAARO
CN(C[C@@H]1CC[N@H+](C)C1(C)C)c1ncccc1C(N)=O	ZINC000670459241	483040879	/nfs/dbraw/zinc/04/08/79/483040879.db2.gz	KTVXTVSANMOVIG-NSHDSACASA-N	1	0	276.384	1.347	50	0		CDAARO
C[C@H](CN1CCOC1=O)[NH2+]Cc1cccc2c[nH]nc21	ZINC000084051442	483236206	/nfs/dbraw/zinc/23/62/06/483236206.db2.gz	UUMCHIFRYAWMNP-SNVBAGLBSA-N	1	0	274.324	1.493	50	0		CDAARO
Cc1cnc(CN(C)[C@@H]2CC[N@H+](CC3CCOCC3)C2)o1	ZINC000084258823	483269517	/nfs/dbraw/zinc/26/95/17/483269517.db2.gz	ZEFWZNOYMPYXDE-OAHLLOKOSA-N	1	0	293.411	1.916	50	0		CDAARO
C[NH+](C)CCN1CCCN(c2ncccc2F)CC1	ZINC000084485946	483282484	/nfs/dbraw/zinc/28/24/84/483282484.db2.gz	NOPFNJRTGKDUJQ-UHFFFAOYSA-N	1	0	266.364	1.294	50	0		CDAARO
CC[C@@H](O)[C@H]1CCCC[N@@H+]1CCS(=O)(=O)C(C)C	ZINC000084727068	483318717	/nfs/dbraw/zinc/31/87/17/483318717.db2.gz	OUPGIODOULTFSY-CHWSQXEVSA-N	1	0	277.430	1.435	50	0		CDAARO
CC(C)[NH+]1CCN(C(=O)Cc2cccc(N)c2)CC1	ZINC000052922632	519679510	/nfs/dbraw/zinc/67/95/10/519679510.db2.gz	PXTPQAOWKMDLPQ-UHFFFAOYSA-N	1	0	261.369	1.364	50	0		CDAARO
CC[C@@H](O)C[NH+]1CCC(NC(=O)C2CCC2)CC1	ZINC000096441404	529226375	/nfs/dbraw/zinc/22/63/75/529226375.db2.gz	RFMFMIUUWMUWRQ-CYBMUJFWSA-N	1	0	254.374	1.138	50	0		CDAARO
COc1cc(C(=O)NCc2ccnc(NC3CC3)c2)on1	ZINC000097095556	567903989	/nfs/dbraw/zinc/90/39/89/567903989.db2.gz	BEALEXXXDCZLGX-UHFFFAOYSA-N	1	0	288.307	1.583	50	0		CDAARO
NC[C@@H]1C[C@H]([C@H]2CC[C@H](C(F)(F)F)NC2)CC[NH2+]1	ZINC000757207444	577035792	/nfs/dbraw/zinc/03/57/92/577035792.db2.gz	BEYZMBORRMATFB-VPOLOUISSA-N	1	0	265.323	1.244	50	0		CDAARO
CC[C@H]1CN(CC[NH2+][C@H]2CCCn3ccnc32)CCO1	ZINC000888094084	617752772	/nfs/dbraw/zinc/75/27/72/617752772.db2.gz	GRBKHCWQYOAUPX-KBPBESRZSA-N	1	0	278.400	1.418	50	0		CDAARO
CC1(C)[C@H]([NH2+]CCS(=O)(=O)C2CC2)[C@@H]2CCC[C@@H]21	ZINC000850474809	632057458	/nfs/dbraw/zinc/05/74/58/632057458.db2.gz	QNMZRANDCYPSRH-FRRDWIJNSA-N	1	0	271.426	1.978	50	0		CDAARO
Cc1cc(C)cc(NC(=O)N2C[C@H]3C[NH2+]C[C@@]3(CO)C2)c1	ZINC001772709228	1159444518	/nfs/dbraw/zinc/44/45/18/1159444518.db2.gz	IXBQSBIRTZGNKX-CJNGLKHVSA-N	1	0	289.379	1.349	50	0		CDAARO
Cc1nc[nH]c1CN(CC[NH+](C)C)C(=O)[C@H]1CC=CCC1	ZINC001704312298	1177684181	/nfs/dbraw/zinc/68/41/81/1177684181.db2.gz	OYFNXQMOIAZFJQ-AWEZNQCLSA-N	1	0	290.411	1.965	50	0		CDAARO
Cc1ncc(Cl)c(N2CCN(CCC[NH+](C)C)CC2)n1	ZINC001704313023	1177685636	/nfs/dbraw/zinc/68/56/36/1177685636.db2.gz	FAXRQNXYLAQIMB-UHFFFAOYSA-N	1	0	297.834	1.512	50	0		CDAARO
Cc1ccc(C(=O)N(CC[NH+](C)C)Cc2c[nH]cn2)s1	ZINC001704325547	1177688892	/nfs/dbraw/zinc/68/88/92/1177688892.db2.gz	PJQZXRQSNGXJCH-UHFFFAOYSA-N	1	0	292.408	1.984	50	0		CDAARO
Nc1ncccc1C[N@H+]1C[C@@H](Cc2ccccn2)[C@H](O)C1	ZINC001704354151	1177698789	/nfs/dbraw/zinc/69/87/89/1177698789.db2.gz	UMRGRDNQSQLRQT-UKRRQHHQSA-N	1	0	284.363	1.094	50	0		CDAARO
C[C@H](C[C@@H]1CCC(=O)N1)[NH2+]C[C@H]1CCOC(C)(C)C1	ZINC000926557016	742851302	/nfs/dbraw/zinc/85/13/02/742851302.db2.gz	FKBHZDYYWXTCIJ-AGIUHOORSA-N	1	0	268.401	1.838	50	0		CDAARO
Cc1nc2ccccc2cc1C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178569286	743351909	/nfs/dbraw/zinc/35/19/09/743351909.db2.gz	XYYJGRRYHLRKSE-GFCCVEGCSA-N	1	0	269.348	1.964	50	0		CDAARO
Cc1ncc(C[NH2+][C@@H]2CC(=O)N(CC3CCCCC3)C2)[nH]1	ZINC000012314234	745898321	/nfs/dbraw/zinc/89/83/21/745898321.db2.gz	CWXHZRGECGWSSG-CQSZACIVSA-N	1	0	290.411	1.989	50	0		CDAARO
O=C(NC[C@H]1CCCN(c2cc[nH+]cc2)C1)c1cnccn1	ZINC000952976433	746245447	/nfs/dbraw/zinc/24/54/47/746245447.db2.gz	RPBHXQDXODRBJF-CYBMUJFWSA-N	1	0	297.362	1.518	50	0		CDAARO
CCN(C(=O)c1n[nH]c2c1C[NH2+]CC2)c1nc(C)cs1	ZINC000188604829	746856559	/nfs/dbraw/zinc/85/65/59/746856559.db2.gz	FXALWNOGMNYCIL-UHFFFAOYSA-N	1	0	291.380	1.487	50	0		CDAARO
C[C@H]1[C@@H]2CCC[N@@H+]2CCN1CC(C)(C)CN1CCOCC1	ZINC000032565179	746881555	/nfs/dbraw/zinc/88/15/55/746881555.db2.gz	QATOXTAWNQLKAG-HOTGVXAUSA-N	1	0	295.471	1.513	50	0		CDAARO
Cc1nc(CN2CCC[C@](O)(C[NH+](C)C)CC2)cs1	ZINC000072128068	747015569	/nfs/dbraw/zinc/01/55/69/747015569.db2.gz	CNSAJHZRHXMHPQ-CQSZACIVSA-N	1	0	283.441	1.730	50	0		CDAARO
CCn1cc(CN2CC[N@H+](C(C)C)[C@H](CCO)C2)cn1	ZINC000022909940	747051053	/nfs/dbraw/zinc/05/10/53/747051053.db2.gz	YERCPNLFYDEVSO-OAHLLOKOSA-N	1	0	280.416	1.180	50	0		CDAARO
CC(C)(C)C[C@H]([NH3+])C1(O)C[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000958528582	747335333	/nfs/dbraw/zinc/33/53/33/747335333.db2.gz	VOFYEEUVVAWTAM-NUVITONLSA-N	1	0	275.414	1.221	50	0		CDAARO
COCC[C@@]1(CO)CCC[N@H+](CC2CCOCC2)C1	ZINC000091951913	747674050	/nfs/dbraw/zinc/67/40/50/747674050.db2.gz	KYAGLHBTYHAIKG-HNNXBMFYSA-N	1	0	271.401	1.524	50	0		CDAARO
CC[N@@H+](Cc1cnc(N)nc1)CC1CCOCC1	ZINC000065433987	748349706	/nfs/dbraw/zinc/34/97/06/748349706.db2.gz	SXUQMEYYDQLFDN-UHFFFAOYSA-N	1	0	250.346	1.307	50	0		CDAARO
[NH3+]CCNS(=O)(=O)/C=C\c1ccccc1Cl	ZINC000713847065	748424037	/nfs/dbraw/zinc/42/40/37/748424037.db2.gz	PFBRFDBVQZUJFW-YVMONPNESA-N	1	0	260.746	1.189	50	0		CDAARO
Cc1cccc(C[NH2+]C[C@@]2(O)CCCN(C)C2=O)c1	ZINC000012090642	748843111	/nfs/dbraw/zinc/84/31/11/748843111.db2.gz	ICNZUCNJFXRAFN-HNNXBMFYSA-N	1	0	262.353	1.068	50	0		CDAARO
O=C1CC[C@@]2(CC[N@H+](Cc3ccc4c(c3)OCCO4)C2)N1	ZINC000675018042	899870281	/nfs/dbraw/zinc/87/02/81/899870281.db2.gz	SGVIAYYUQACEEV-INIZCTEOSA-N	1	0	288.347	1.312	50	0		CDAARO
[NH3+]CCN(Cc1ccccc1)C[C@H](O)CC1(O)CCC1	ZINC000952877584	910435441	/nfs/dbraw/zinc/43/54/41/910435441.db2.gz	SGSCXBQKOCPOQK-OAHLLOKOSA-N	1	0	278.396	1.113	50	0		CDAARO
C[C@@H](CCn1cccn1)[NH2+]C1CC(O)(C(F)(F)F)C1	ZINC000952883073	910452882	/nfs/dbraw/zinc/45/28/82/910452882.db2.gz	MJKJLZNCDYGIGF-WHXUTIOJSA-N	1	0	277.290	1.707	50	0		CDAARO
C[NH+](C)C1(CNc2cc3nncn3c(N)n2)CCCCC1	ZINC000952863875	910457341	/nfs/dbraw/zinc/45/73/41/910457341.db2.gz	XCWWCPJZEJMLOQ-UHFFFAOYSA-N	1	0	289.387	1.383	50	0		CDAARO
C[C@H]1CN(C[C@@H](O)Cn2cccn2)CC[N@@H+]1C1CCCC1	ZINC000952884276	910458784	/nfs/dbraw/zinc/45/87/84/910458784.db2.gz	WVZKDIBFAUUOIR-GOEBONIOSA-N	1	0	292.427	1.193	50	0		CDAARO
CC[C@@H](C)NC(=O)NCCNc1cc[nH+]cc1C	ZINC000822635464	925644069	/nfs/dbraw/zinc/64/40/69/925644069.db2.gz	NMLIXYLNULKAKB-LLVKDONJSA-N	1	0	250.346	1.322	50	0		CDAARO
Cc1nc(N)sc1CC(=O)N1CC[N@@H+](C(C)C)[C@H](C)C1	ZINC000827945759	926000141	/nfs/dbraw/zinc/00/01/41/926000141.db2.gz	JXTGDAACJSGWSM-SNVBAGLBSA-N	1	0	296.440	1.517	50	0		CDAARO
COCCC1([NH+](C)C)CCN(C(=O)C(C)C)CC1	ZINC000581804648	927204175	/nfs/dbraw/zinc/20/41/75/927204175.db2.gz	HFAHAGDYHHEBLH-UHFFFAOYSA-N	1	0	256.390	1.602	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)N[C@H]1C[C@H]([NH+](C)C)C12CCC2	ZINC000585131306	931023899	/nfs/dbraw/zinc/02/38/99/931023899.db2.gz	RKBMJQCZPVQNFW-KBPBESRZSA-N	1	0	290.411	1.558	50	0		CDAARO
OCC[N@@H+](Cc1cccs1)C[C@@H]1CCCOC1	ZINC001207469012	940202926	/nfs/dbraw/zinc/20/29/26/940202926.db2.gz	TXOGHGCOIGIQDQ-LBPRGKRZSA-N	1	0	255.383	1.969	50	0		CDAARO
O=C1CCC2(CC[NH+](Cc3ccn4nccc4c3)CC2)N1	ZINC001237543885	944831213	/nfs/dbraw/zinc/83/12/13/944831213.db2.gz	BIWSRIWIIOEIDV-UHFFFAOYSA-N	1	0	284.363	1.579	50	0		CDAARO
C[NH+](C)CCc1nnc(NC(=O)Cc2cccs2)s1	ZINC001529089568	968979762	/nfs/dbraw/zinc/97/97/62/968979762.db2.gz	BDWGDAGMEYVDEW-UHFFFAOYSA-N	1	0	296.421	1.885	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CCN(C)c1nc(C(N)=O)cs1	ZINC001529159243	968996801	/nfs/dbraw/zinc/99/68/01/968996801.db2.gz	QTSKOSLSDUDGAK-SNVBAGLBSA-N	1	0	282.413	1.553	50	0		CDAARO
Cc1n[nH]c(C)c1CCC[N@@H+](C)Cc1cc(=O)[nH]c(=O)[nH]1	ZINC001529196457	969011253	/nfs/dbraw/zinc/01/12/53/969011253.db2.gz	AGPUPHKVTLXNEP-UHFFFAOYSA-N	1	0	291.355	1.292	50	0		CDAARO
OC1(C[NH+]2CCCC2)CCN(c2ccccn2)CC1	ZINC001506397972	975148211	/nfs/dbraw/zinc/14/82/11/975148211.db2.gz	QUUSRCSZHKIEKW-UHFFFAOYSA-N	1	0	261.369	1.509	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](CN(C)Cc2cnc(C)cn2)C1	ZINC001506400242	975148802	/nfs/dbraw/zinc/14/88/02/975148802.db2.gz	BEMINPXVVWCXQO-HNNXBMFYSA-N	1	0	292.427	1.575	50	0		CDAARO
CN(C)c1nc(NC[C@@H]2CCCC[N@@H+]2C)ncc1F	ZINC001506403571	975150484	/nfs/dbraw/zinc/15/04/84/975150484.db2.gz	SURKZKKJSWYVFL-JTQLQIEISA-N	1	0	267.352	1.578	50	0		CDAARO
O=C(C[NH2+][C@@H]1CCN(c2ccccc2)C1)N1CCCC1	ZINC001506412408	975154116	/nfs/dbraw/zinc/15/41/16/975154116.db2.gz	CHFSUONZDAKPIB-CQSZACIVSA-N	1	0	273.380	1.477	50	0		CDAARO
OC[C@]1(O)CCC[N@@H+](C2CSCCSC2)CC1	ZINC001506428100	975160965	/nfs/dbraw/zinc/16/09/65/975160965.db2.gz	LZOWAQZTIWAOTK-LBPRGKRZSA-N	1	0	277.455	1.044	50	0		CDAARO
Oc1cccc([C@@H](O)C[NH2+]C2CSCCSC2)c1	ZINC001506429671	975161790	/nfs/dbraw/zinc/16/17/90/975161790.db2.gz	SSBWQGCJYCHSPQ-ZDUSSCGKSA-N	1	0	285.434	1.864	50	0		CDAARO
Cn1cncc1CN1CCC(CO)(C[NH+]2CCCC2)CC1	ZINC000219877203	230396944	/nfs/dbraw/zinc/39/69/44/230396944.db2.gz	MUVBXFVQJBVPNQ-UHFFFAOYSA-N	1	0	292.427	1.090	50	0		CDAARO
COc1ccnc(N2C[C@H]3CC[C@H](C[N@H+]3CC3CC3)C2)n1	ZINC000095527053	185003556	/nfs/dbraw/zinc/00/35/56/185003556.db2.gz	PBPODWLJIWBRBA-ZIAGYGMSSA-N	1	0	288.395	1.796	50	0		CDAARO
Cc1nccn1CC[NH2+]C1CSCCSC1	ZINC000584904063	341994071	/nfs/dbraw/zinc/99/40/71/341994071.db2.gz	LNTLKNRODCVTRO-UHFFFAOYSA-N	1	0	257.428	1.630	50	0		CDAARO
Cc1nc(C[NH2+][C@@H]2CCCC[C@H]2C(N)=O)cs1	ZINC000097375141	342002828	/nfs/dbraw/zinc/00/28/28/342002828.db2.gz	PKEUZMLNHMVIFL-GHMZBOCLSA-N	1	0	253.371	1.585	50	0		CDAARO
C[C@H](NC(=O)C[NH2+][C@@H](C)[C@@H]1CCOC1)c1ccccc1	ZINC000095941382	185036279	/nfs/dbraw/zinc/03/62/79/185036279.db2.gz	LNRFGXWFHTXHJL-KCQAQPDRSA-N	1	0	276.380	1.878	50	0		CDAARO
CCCc1noc2ncc(C(=O)N[C@@H]3CC[N@H+](C)C3)cc12	ZINC000095955374	185041631	/nfs/dbraw/zinc/04/16/31/185041631.db2.gz	HMWVSYOTWXFAOJ-LLVKDONJSA-N	1	0	288.351	1.609	50	0		CDAARO
CCCCN(C)S(=O)(=O)NC[C@H]1CCC[N@H+](CC)C1	ZINC000095958221	185043804	/nfs/dbraw/zinc/04/38/04/185043804.db2.gz	ZXNIOTTXAKKHFG-CYBMUJFWSA-N	1	0	291.461	1.285	50	0		CDAARO
C[C@@H](C[C@H](O)c1cccs1)[NH2+]Cc1cnnn1C	ZINC000095978226	185052189	/nfs/dbraw/zinc/05/21/89/185052189.db2.gz	GJPLLFMZTWDSRY-ONGXEEELSA-N	1	0	266.370	1.478	50	0		CDAARO
C[C@H](Cn1ncc2ccccc2c1=O)[NH2+][C@@H]1CCOC1	ZINC000095983743	185053837	/nfs/dbraw/zinc/05/38/37/185053837.db2.gz	CDLTVFMCRBLJSI-DGCLKSJQSA-N	1	0	273.336	1.164	50	0		CDAARO
O[C@H]1CCC[C@H]1C[NH2+]C1CCN(c2nccs2)CC1	ZINC000095990357	185057773	/nfs/dbraw/zinc/05/77/73/185057773.db2.gz	AXMRKGQFHUAROT-AAEUAGOBSA-N	1	0	281.425	1.863	50	0		CDAARO
COc1ccc([C@@H](C)[C@H](C)[NH2+]CC(=O)N(C)C)cc1	ZINC000095992479	185059380	/nfs/dbraw/zinc/05/93/80/185059380.db2.gz	RBAYOGULEQENAE-RYUDHWBXSA-N	1	0	264.369	1.865	50	0		CDAARO
CN1C(=O)N[C@@](C)([C@@H]2CCC[N@H+](CC3CCC3)C2)C1=O	ZINC000089914238	539087667	/nfs/dbraw/zinc/08/76/67/539087667.db2.gz	HBFDGHIIUWZJHV-DOMZBBRYSA-N	1	0	279.384	1.439	50	0		CDAARO
CC(C)C[C@@H](NC(=O)C[C@H]1C[NH2+]CCO1)C(C)(C)C	ZINC000195543582	342626629	/nfs/dbraw/zinc/62/66/29/342626629.db2.gz	FCIJEPBWVFZCPZ-QWHCGFSZSA-N	1	0	270.417	1.942	50	0		CDAARO
CCN(CCn1cccn1)CC[N@@H+]1C[C@H]2CC[C@@H]1C2	ZINC000244734633	361859676	/nfs/dbraw/zinc/85/96/76/361859676.db2.gz	NJGARIIICZQUNI-LSDHHAIUSA-N	1	0	262.401	1.689	50	0		CDAARO
COCCC1CC[NH+](CC[C@@H]2CCS(=O)(=O)C2)CC1	ZINC000625630740	342192436	/nfs/dbraw/zinc/19/24/36/342192436.db2.gz	LQFIMJUMJMULFU-CQSZACIVSA-N	1	0	289.441	1.560	50	0		CDAARO
C[N@H+](CCN1CCOC1=O)[C@H]1Cc2ccccc2[C@@H]1O	ZINC000097034131	185157537	/nfs/dbraw/zinc/15/75/37/185157537.db2.gz	PFKVXLHPNBMHBA-KBPBESRZSA-N	1	0	276.336	1.029	50	0		CDAARO
NC(=O)[C@@H]1CC[N@H+](C[C@@H]2C[C@@H]2c2ccc(F)cc2)C1	ZINC000585140650	342218667	/nfs/dbraw/zinc/21/86/67/342218667.db2.gz	HXAPIPIDIYPYEL-MBNYWOFBSA-N	1	0	262.328	1.736	50	0		CDAARO
[NH3+][C@H]1CCN(CC(=O)Nc2cccc(Br)c2)C1	ZINC000050242669	539160262	/nfs/dbraw/zinc/16/02/62/539160262.db2.gz	QIAXMUPXVIJSPP-JTQLQIEISA-N	1	0	298.184	1.421	50	0		CDAARO
CC(C)NC(=O)N1CCN([C@@H](C)c2cccnc2)CC1	ZINC000079090642	362139063	/nfs/dbraw/zinc/13/90/63/362139063.db2.gz	VGCDCBFOKQLGPA-ZDUSSCGKSA-N	1	0	276.384	1.878	50	0		CDAARO
C[C@@H]1CN(C)CC[N@@H+]1CCc1ccc2c(c1)CCO2	ZINC000095404865	342431588	/nfs/dbraw/zinc/43/15/88/342431588.db2.gz	AAGZJTPYPSUACJ-CYBMUJFWSA-N	1	0	260.381	1.800	50	0		CDAARO
Fc1cc(CC[NH2+]C[C@H]2CCOC2)c2c(c1)COCO2	ZINC000095966292	282959393	/nfs/dbraw/zinc/95/93/93/282959393.db2.gz	KDWSLNHXMXQWLG-LLVKDONJSA-N	1	0	281.327	1.861	50	0		CDAARO
O=C(N[C@H]1CCC[NH2+]C1)c1cccc(F)c1Cl	ZINC000127184893	187288249	/nfs/dbraw/zinc/28/82/49/187288249.db2.gz	GWURZGDJLMWEOQ-QMMMGPOBSA-N	1	0	256.708	1.961	50	0		CDAARO
C[N@H+](CCC(N)=O)Cc1cc(=O)c2cccc(Cl)c2[nH]1	ZINC000253537427	362436523	/nfs/dbraw/zinc/43/65/23/362436523.db2.gz	XZMCHYDQALRAEF-UHFFFAOYSA-N	1	0	293.754	1.901	50	0		CDAARO
O[C@H](C[NH2+]C1CCOCC1)COc1ccc(F)cc1	ZINC000037893008	362438419	/nfs/dbraw/zinc/43/84/19/362438419.db2.gz	JNUBMWIEFBPAOR-CYBMUJFWSA-N	1	0	269.316	1.334	50	0		CDAARO
CN1C(=O)N(c2ccccc2)C2(CC[NH2+]CC2)C1=O	ZINC000000016722	344995394	/nfs/dbraw/zinc/99/53/94/344995394.db2.gz	LAJFUJQONZNLBD-UHFFFAOYSA-N	1	0	259.309	1.207	50	0		CDAARO
CCOC(C[N@@H+]1CC[C@H]2OCCC[C@H]2C1)OCC	ZINC000248613202	362606285	/nfs/dbraw/zinc/60/62/85/362606285.db2.gz	IZBKIDGVBJQLPA-QWHCGFSZSA-N	1	0	257.374	1.886	50	0		CDAARO
O[C@H](C[NH+]1CCN(Cc2cc(F)ccc2F)CC1)C1CC1	ZINC000085436872	179062813	/nfs/dbraw/zinc/06/28/13/179062813.db2.gz	KBEDCUGIUZQAMD-MRXNPFEDSA-N	1	0	296.361	1.853	50	0		CDAARO
Cn1c(N)c(C2=[NH+]CCC2)c(=O)n1-c1ccccc1	ZINC000008132296	282575605	/nfs/dbraw/zinc/57/56/05/282575605.db2.gz	SUTONGXPINCZLU-UHFFFAOYSA-N	1	0	256.309	1.341	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@@H](C)c1cc(C)sc1C	ZINC000097373721	323207969	/nfs/dbraw/zinc/20/79/69/323207969.db2.gz	UVAZJSVYMXCSRW-JTQLQIEISA-N	1	0	290.454	1.955	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1Cn1cnc2ncccc2c1=O	ZINC000584885233	349343257	/nfs/dbraw/zinc/34/32/57/349343257.db2.gz	HIRROSNIINLSTP-LLVKDONJSA-N	1	0	258.325	1.276	50	0		CDAARO
Cc1c[nH+]ccc1N1CCN(C(=O)C[C@@H]2CCOC2)CC1	ZINC000584886536	349344556	/nfs/dbraw/zinc/34/45/56/349344556.db2.gz	VRFCYZMNLJFQEU-AWEZNQCLSA-N	1	0	289.379	1.465	50	0		CDAARO
CCC(CC)[C@@H](CNC(=O)c1ccc(=O)[nH]n1)[NH+](C)C	ZINC000089943128	179888993	/nfs/dbraw/zinc/88/89/93/179888993.db2.gz	ZKBPWAGQELTZRE-GFCCVEGCSA-N	1	0	280.372	1.278	50	0		CDAARO
Cc1ccc(O)cc1C(=O)NCC[N@@H+]1CCC[C@@H](CO)C1	ZINC000584894299	349354067	/nfs/dbraw/zinc/35/40/67/349354067.db2.gz	KDWKBROPCVXBQJ-CYBMUJFWSA-N	1	0	292.379	1.135	50	0		CDAARO
C[C@@H](NC1CC[NH+](Cc2ccco2)CC1)c1nncn1C	ZINC000584894631	349354221	/nfs/dbraw/zinc/35/42/21/349354221.db2.gz	HWHDSQXNXMJEAY-GFCCVEGCSA-N	1	0	289.383	1.723	50	0		CDAARO
O=C1CC[C@H]([NH2+]Cc2ccccc2-n2ccnc2)CCN1	ZINC000584895292	349355993	/nfs/dbraw/zinc/35/59/93/349355993.db2.gz	LNDWFAKCFGTPEE-AWEZNQCLSA-N	1	0	284.363	1.631	50	0		CDAARO
CN(CCn1ccnc1)C(=O)c1cccc2c1CCC2=O	ZINC000584898284	349360085	/nfs/dbraw/zinc/36/00/85/349360085.db2.gz	BBBZIULEMAJGQO-UHFFFAOYSA-N	1	0	283.331	1.784	50	0		CDAARO
CCNc1ncc(C[N@@H+]2CCC[C@](CC)(CO)C2)cn1	ZINC000091412202	180149153	/nfs/dbraw/zinc/14/91/53/180149153.db2.gz	KALOIUUUJUMZKS-HNNXBMFYSA-N	1	0	278.400	1.893	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2c[nH]c(=O)c3ccccc23)C[C@@H]1[NH3+]	ZINC000091586801	180200816	/nfs/dbraw/zinc/20/08/16/180200816.db2.gz	KRRDUKRCQXNGQI-NHYWBVRUSA-N	1	0	299.374	1.728	50	0		CDAARO
CC(C)Cc1cc(C(=O)NCC[NH+]2CCCC2)n(C)n1	ZINC000091657171	180218134	/nfs/dbraw/zinc/21/81/34/180218134.db2.gz	CYGYNVURHQTWOW-UHFFFAOYSA-N	1	0	278.400	1.444	50	0		CDAARO
CC[C@H]1C[N@H+](CC2CCCC2)CCN1C[C@H](C)O	ZINC000106906859	186150347	/nfs/dbraw/zinc/15/03/47/186150347.db2.gz	ZBHDKEDOHYEUTA-ZFWWWQNUSA-N	1	0	254.418	1.954	50	0		CDAARO
CC[C@H]1CN(Cc2nnc(C3CC3)o2)CC[N@@H+]1C[C@H](C)O	ZINC000106929221	186152986	/nfs/dbraw/zinc/15/29/86/186152986.db2.gz	XKVJJDMXIJLJPA-AAEUAGOBSA-N	1	0	294.399	1.224	50	0		CDAARO
Cc1nn(C)c2ncc(C[NH2+][C@H]3CCCC[C@@H]3O)cc12	ZINC000107912616	186197924	/nfs/dbraw/zinc/19/79/24/186197924.db2.gz	IWDSUVXBPOJQLW-KBPBESRZSA-N	1	0	274.368	1.670	50	0		CDAARO
CS[C@@H]1CCC[C@H]1[N@H+](C)CC(=O)N(C)C1CC1	ZINC000110642599	186308952	/nfs/dbraw/zinc/30/89/52/186308952.db2.gz	KCPWTQJIEKOVMT-VXGBXAGGSA-N	1	0	256.415	1.823	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CC[C@H]([NH3+])C2)c2cccnc12	ZINC000123596475	187099780	/nfs/dbraw/zinc/09/97/80/187099780.db2.gz	ZLORKWULCKEAHU-NSHDSACASA-N	1	0	291.376	1.265	50	0		CDAARO
CC(C)[C@@H]([NH3+])C(=O)Nc1c[nH]cc(Br)c1=O	ZINC000423756817	535207811	/nfs/dbraw/zinc/20/78/11/535207811.db2.gz	BTKQJEOAPUXUPZ-MRVPVSSYSA-N	1	0	288.145	1.059	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)c2ccc(Cl)cn2)CC1	ZINC000265436592	363316047	/nfs/dbraw/zinc/31/60/47/363316047.db2.gz	INTMAIDISNQFCK-UHFFFAOYSA-N	1	0	297.786	1.576	50	0		CDAARO
COCC[N@@H+]1CC[C@H](NC(=O)N(C)Cc2cscn2)C1	ZINC000265502438	363331907	/nfs/dbraw/zinc/33/19/07/363331907.db2.gz	DIKGDYNCNQQDHX-NSHDSACASA-N	1	0	298.412	1.005	50	0		CDAARO
COc1ccc(OC)c(C[NH2+]C[C@H]2CCCO2)c1	ZINC000000784592	355921248	/nfs/dbraw/zinc/92/12/48/355921248.db2.gz	VBIAHDCHALWQCZ-CYBMUJFWSA-N	1	0	251.326	1.972	50	0		CDAARO
CCOC(=O)C(CCC[NH+](CC)CC)C(=O)OCC	ZINC000002166423	355962718	/nfs/dbraw/zinc/96/27/18/355962718.db2.gz	BLYNLPYSPJSYHY-UHFFFAOYSA-N	1	0	273.373	1.851	50	0		CDAARO
CCOc1ccc(C[NH2+]CCCN2CCOCC2)cc1	ZINC000002380315	355968653	/nfs/dbraw/zinc/96/86/53/355968653.db2.gz	RKOCZCYQGXYZGD-UHFFFAOYSA-N	1	0	278.396	1.897	50	0		CDAARO
COC[C@H](C)[NH2+]Cc1ccc(OC)c(OC)c1OC	ZINC000004685554	356040710	/nfs/dbraw/zinc/04/07/10/356040710.db2.gz	CTAIAXZIQQOWFD-JTQLQIEISA-N	1	0	269.341	1.837	50	0		CDAARO
CC[NH2+]C[C@@]1(O)CCCN(Cc2ccc(F)cc2)C1=O	ZINC000012712180	356319865	/nfs/dbraw/zinc/31/98/65/356319865.db2.gz	YPOBBJUJZRGHEW-HNNXBMFYSA-N	1	0	280.343	1.289	50	0		CDAARO
COc1cccc(C(=O)NC2CC[NH+](C)CC2)c1OC	ZINC000016602523	356443009	/nfs/dbraw/zinc/44/30/09/356443009.db2.gz	RQSQHGNKOSWUGK-UHFFFAOYSA-N	1	0	278.352	1.528	50	0		CDAARO
COc1cc(NC(=O)[C@H]2CCC[NH2+]2)cc(OC)c1OC	ZINC000019410291	356485032	/nfs/dbraw/zinc/48/50/32/356485032.db2.gz	CJPPFQXRAPTEIX-SNVBAGLBSA-N	1	0	280.324	1.403	50	0		CDAARO
C[NH+]1CCN(CCC(=O)Nc2ccc(F)c(F)c2)CC1	ZINC000019590018	356492341	/nfs/dbraw/zinc/49/23/41/356492341.db2.gz	NKAMJPWSNXPQKP-UHFFFAOYSA-N	1	0	283.322	1.541	50	0		CDAARO
CCOc1ccc(OCCOCCNCC[NH3+])cc1	ZINC000020118734	356525675	/nfs/dbraw/zinc/52/56/75/356525675.db2.gz	NKTJMGQRJCLSSO-UHFFFAOYSA-N	1	0	268.357	1.029	50	0		CDAARO
C1=C[C@@H](N2CC[NH+](C[C@@H]3CCOC3)CC2)CCC1	ZINC000084137113	356526029	/nfs/dbraw/zinc/52/60/29/356526029.db2.gz	HKJWBGPMOFRXDG-LSDHHAIUSA-N	1	0	250.386	1.749	50	0		CDAARO
COCCNC(=O)C1CC[NH+](Cc2ccc(F)cc2)CC1	ZINC000020100460	356526274	/nfs/dbraw/zinc/52/62/74/356526274.db2.gz	BWQNPLKRZNPZLL-UHFFFAOYSA-N	1	0	294.370	1.800	50	0		CDAARO
CCCS(=O)(=O)NCC1(C(F)(F)F)CC[NH2+]CC1	ZINC000725264720	538455668	/nfs/dbraw/zinc/45/56/68/538455668.db2.gz	MZLGHSRIXFSMCH-UHFFFAOYSA-N	1	0	288.335	1.248	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N[C@@H]2C[N@@H+](C)C[C@@H]2C)c1	ZINC000078899129	538476878	/nfs/dbraw/zinc/47/68/78/538476878.db2.gz	COKIHFULKDPGPD-CMPLNLGQSA-N	1	0	286.372	1.363	50	0		CDAARO
CCNC(=O)C1CC[NH+](Cc2cc(C)no2)CC1	ZINC000028971504	356729018	/nfs/dbraw/zinc/72/90/18/356729018.db2.gz	CLHSTEXQGOTOHW-UHFFFAOYSA-N	1	0	251.330	1.331	50	0		CDAARO
O=S(=O)(c1ccc(Cl)cc1)N1CC[C@H]2C[NH2+]C[C@H]21	ZINC000036265633	356868471	/nfs/dbraw/zinc/86/84/71/356868471.db2.gz	BIZCFAPIHJSXJJ-JOYOIKCWSA-N	1	0	286.784	1.322	50	0		CDAARO
CC(=O)N1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000095408759	357211749	/nfs/dbraw/zinc/21/17/49/357211749.db2.gz	OQFQHMCFCTWVLX-BETUJISGSA-N	1	0	268.401	1.744	50	0		CDAARO
CCC[N@@H+](Cc1ccc(SC)cc1)C[C@H](O)CO	ZINC000055384850	357332845	/nfs/dbraw/zinc/33/28/45/357332845.db2.gz	ICDXLKRNFFDNOP-ZDUSSCGKSA-N	1	0	269.410	1.974	50	0		CDAARO
CC1CCN(C(=O)CC[NH2+][C@@H]2CCSC2)CC1	ZINC000065370794	357532487	/nfs/dbraw/zinc/53/24/87/357532487.db2.gz	FQGGDCKNSCZRTR-GFCCVEGCSA-N	1	0	256.415	1.730	50	0		CDAARO
C=Cc1cccc(C[N@H+]2CCC[C@@H](CNC(=O)CO)C2)c1	ZINC000067723515	357621627	/nfs/dbraw/zinc/62/16/27/357621627.db2.gz	KDQLKIQQZFHKEZ-INIZCTEOSA-N	1	0	288.391	1.650	50	0		CDAARO
COC[C@@H]([NH2+]C1CSCCSC1)c1ccnn1C	ZINC000067473080	357610072	/nfs/dbraw/zinc/61/00/72/357610072.db2.gz	JXEMVLATJZYOKG-LLVKDONJSA-N	1	0	287.454	1.546	50	0		CDAARO
CCCCOCC(=O)N1CCC[C@]2(CC[NH2+]C2)C1	ZINC000067514255	357611732	/nfs/dbraw/zinc/61/17/32/357611732.db2.gz	QUBHRCGOXXCDKR-CQSZACIVSA-N	1	0	254.374	1.405	50	0		CDAARO
CCn1c(=O)n(CCSC(C)C)nc1[C@@H]1CCC[NH2+]C1	ZINC000067675473	357617373	/nfs/dbraw/zinc/61/73/73/357617373.db2.gz	REFMVUBGWLUCRL-GFCCVEGCSA-N	1	0	298.456	1.673	50	0		CDAARO
Cc1[nH]c2c(c1C(=O)N[C@@H]1CC[C@@H]([NH3+])C1)C(=O)CCC2	ZINC000067966762	357640841	/nfs/dbraw/zinc/64/08/41/357640841.db2.gz	DKOXKHDEQQUUIM-NXEZZACHSA-N	1	0	275.352	1.452	50	0		CDAARO
COCC(=O)NC[C@H]1CCC[N@H+](Cc2cccc(O)c2)C1	ZINC000067869180	357634195	/nfs/dbraw/zinc/63/41/95/357634195.db2.gz	PGZRSXCKGBEHNU-CQSZACIVSA-N	1	0	292.379	1.367	50	0		CDAARO
NC(=O)CN1C[C@H]2CC[C@@H]1C[N@H+](Cc1ccccc1)C2	ZINC000092037119	283289188	/nfs/dbraw/zinc/28/91/88/283289188.db2.gz	XANNLYBQYBQWFI-LSDHHAIUSA-N	1	0	273.380	1.068	50	0		CDAARO
Cc1nc(CCCNC(=O)[C@H]2CC[C@@H]([NH3+])C2)sc1C	ZINC000072440607	357835974	/nfs/dbraw/zinc/83/59/74/357835974.db2.gz	FYRBXWWDJQLVLM-NWDGAFQWSA-N	1	0	281.425	1.936	50	0		CDAARO
CC(=O)N1CCC(C[NH2+]Cc2ccc(C)cn2)CC1	ZINC000097015920	357915383	/nfs/dbraw/zinc/91/53/83/357915383.db2.gz	ZZOWLYAPQJDTDB-UHFFFAOYSA-N	1	0	261.369	1.738	50	0		CDAARO
Cn1cc(N2CC[C@H]([N@H+](C)CCc3ccncc3)C2=O)cn1	ZINC000097051173	357935100	/nfs/dbraw/zinc/93/51/00/357935100.db2.gz	CVGDDCUHQJTTEN-HNNXBMFYSA-N	1	0	299.378	1.095	50	0		CDAARO
CCn1cc(CN2CC[N@H+](CC(C)(C)O)[C@H](C)C2)cn1	ZINC000188899514	358036916	/nfs/dbraw/zinc/03/69/16/358036916.db2.gz	RRZYBIZYBDPBRD-CYBMUJFWSA-N	1	0	280.416	1.180	50	0		CDAARO
CC(=O)N1CCC(C[NH2+][C@H](C)CCn2cccn2)CC1	ZINC000097234815	358050531	/nfs/dbraw/zinc/05/05/31/358050531.db2.gz	LZBJMIWEPJAEMP-CYBMUJFWSA-N	1	0	278.400	1.510	50	0		CDAARO
Cc1ncsc1CCC(=O)NCC[NH+]1CCCC1	ZINC000082148252	358149625	/nfs/dbraw/zinc/14/96/25/358149625.db2.gz	VUTRFUZINZIYPH-UHFFFAOYSA-N	1	0	267.398	1.596	50	0		CDAARO
CCn1cc(C2CCN(c3cc(C)[nH+]c(N)n3)CC2)cn1	ZINC000097202388	358188730	/nfs/dbraw/zinc/18/87/30/358188730.db2.gz	XPOJJPPVAOTOJN-UHFFFAOYSA-N	1	0	286.383	1.968	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccccc2C[NH+](C)C)C[C@]1(C)O	ZINC000091818979	358528734	/nfs/dbraw/zinc/52/87/34/358528734.db2.gz	PGZHOBIELDVHDA-WBMJQRKESA-N	1	0	276.380	1.591	50	0		CDAARO
CC(C)c1nccn1[C@@H](C)C(=O)NCC[NH+]1CCCC1	ZINC000095358489	358684630	/nfs/dbraw/zinc/68/46/30/358684630.db2.gz	GWHYWIGZRJAZIC-ZDUSSCGKSA-N	1	0	278.400	1.780	50	0		CDAARO
CC(C)(C)OC(=O)[C@H](c1ccccc1)N1CC[C@@H]([NH3+])C1=O	ZINC000096300615	358732406	/nfs/dbraw/zinc/73/24/06/358732406.db2.gz	XDUUTRYCHAVIAF-OLZOCXBDSA-N	1	0	290.363	1.629	50	0		CDAARO
Cc1cc(C)n(C)c(=O)c1C(=O)NCc1ccc(C[NH3+])cc1	ZINC000097532781	358782349	/nfs/dbraw/zinc/78/23/49/358782349.db2.gz	JFYRBJAJURRQGU-UHFFFAOYSA-N	1	0	299.374	1.391	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1C(=O)N1CCC(c2ncc[nH]2)CC1	ZINC000097675482	358792720	/nfs/dbraw/zinc/79/27/20/358792720.db2.gz	CKUGCDUQQNCSNU-ZDUSSCGKSA-N	1	0	276.384	1.600	50	0		CDAARO
COC[C@@H]1CCC[N@H+](Cc2ccc(OC)nc2)C1	ZINC000215965674	358912662	/nfs/dbraw/zinc/91/26/62/358912662.db2.gz	RUWVSHSXRSIVJX-CYBMUJFWSA-N	1	0	250.342	1.949	50	0		CDAARO
Cc1ccccc1-n1cc(CN2CC[C@H]([NH3+])C2)cn1	ZINC000216088617	358923427	/nfs/dbraw/zinc/92/34/27/358923427.db2.gz	JBVLHEHZDVQRRI-AWEZNQCLSA-N	1	0	256.353	1.714	50	0		CDAARO
CCN(C[C@H]1C[N@H+](CC2CCC2)CCO1)c1cccnn1	ZINC000084774595	358997251	/nfs/dbraw/zinc/99/72/51/358997251.db2.gz	UHNLDWGOXXTYNE-OAHLLOKOSA-N	1	0	290.411	1.804	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(C(=O)COc2cccnc2)CC1	ZINC000221430718	359248260	/nfs/dbraw/zinc/24/82/60/359248260.db2.gz	LHYCSNLMLFUPJR-CYBMUJFWSA-N	1	0	277.368	1.403	50	0		CDAARO
Cc1cccnc1CCNC(=O)CC[N@@H+]1C[C@@H]2CC[C@H]1C2	ZINC000221180615	359214031	/nfs/dbraw/zinc/21/40/31/359214031.db2.gz	QQZHNBMGKRFXNB-CABCVRRESA-N	1	0	287.407	1.923	50	0		CDAARO
CCC[N@@H+]1CC[C@@H](NC(=O)c2ccnc(CC)c2)C1	ZINC000221222750	359218115	/nfs/dbraw/zinc/21/81/15/359218115.db2.gz	GHPAMXLCCMUZIC-CQSZACIVSA-N	1	0	261.369	1.858	50	0		CDAARO
CC[C@H]1CCCC[N@@H+]1CC(=O)NCc1nccn1C	ZINC000221246524	359222322	/nfs/dbraw/zinc/22/23/22/359222322.db2.gz	IPAYFAWOLGZSSI-LBPRGKRZSA-N	1	0	264.373	1.301	50	0		CDAARO
CCCn1ncc(C[N@@H+]2C[C@H](O)[C@@H](OCC)C2)c1C	ZINC000223530433	359432129	/nfs/dbraw/zinc/43/21/29/359432129.db2.gz	DHUPGVMACKYZFN-KBPBESRZSA-N	1	0	267.373	1.183	50	0		CDAARO
Nc1nc(NCCOc2ccccc2)cc(C2CC([NH3+])C2)n1	ZINC000223139965	359403134	/nfs/dbraw/zinc/40/31/34/359403134.db2.gz	VNYQVJQWZFPXLO-UHFFFAOYSA-N	1	0	299.378	1.754	50	0		CDAARO
[NH3+]C1CC(c2cc(NCc3cccnc3)ncn2)C1	ZINC000223775040	359455038	/nfs/dbraw/zinc/45/50/38/359455038.db2.gz	NGNJHOHDIOMBOM-UHFFFAOYSA-N	1	0	255.325	1.688	50	0		CDAARO
Cc1cccc(CCSc2nnc(CC[NH3+])n2C)n1	ZINC000426510131	360677468	/nfs/dbraw/zinc/67/74/68/360677468.db2.gz	MQXWKBQKRRTTQE-UHFFFAOYSA-N	1	0	277.397	1.355	50	0		CDAARO
Cc1nnc(CNC(=O)C[C@@H]2CCCC[N@H+]2C)s1	ZINC000426593545	360686713	/nfs/dbraw/zinc/68/67/13/360686713.db2.gz	CPFTUQWHFKPAOS-JTQLQIEISA-N	1	0	268.386	1.337	50	0		CDAARO
CC(C)c1nccc(C(=O)NCc2nccn2C)n1	ZINC000426613621	360690268	/nfs/dbraw/zinc/69/02/68/360690268.db2.gz	KWOAXNXBULILIH-UHFFFAOYSA-N	1	0	259.313	1.264	50	0		CDAARO
[NH3+]CCOc1ccc(F)cc1C(=O)NC1CCC1	ZINC000426661153	360693268	/nfs/dbraw/zinc/69/32/68/360693268.db2.gz	BHVAXIXDMNZUBY-UHFFFAOYSA-N	1	0	252.289	1.446	50	0		CDAARO
C[NH+](C)Cc1cccc(C(=O)NCCc2cc[nH]n2)c1	ZINC000426388353	360662192	/nfs/dbraw/zinc/66/21/92/360662192.db2.gz	CRMQYBRMBLLZOW-UHFFFAOYSA-N	1	0	272.352	1.444	50	0		CDAARO
CC(C)[C@@H]1C=CCN1C(=O)Cc1ccc(OCC[NH3+])cc1	ZINC000426394620	360663811	/nfs/dbraw/zinc/66/38/11/360663811.db2.gz	PFBLTVKLAVEKPE-INIZCTEOSA-N	1	0	288.391	1.990	50	0		CDAARO
O=C(Cn1ccnn1)NCC[C@@H]1CCC[N@@H+]2CCCC[C@H]12	ZINC000426674201	360694426	/nfs/dbraw/zinc/69/44/26/360694426.db2.gz	KZDFSYMQXBOFNH-UONOGXRCSA-N	1	0	291.399	1.049	50	0		CDAARO
CCCCc1nc(CN2CCO[C@H](CC[NH3+])C2)c[nH]1	ZINC000426715922	360698396	/nfs/dbraw/zinc/69/83/96/360698396.db2.gz	MJLWCOBAEOKGOB-CYBMUJFWSA-N	1	0	266.389	1.302	50	0		CDAARO
CCCOCCSc1nnc([C@H]2CCC[NH2+]C2)n1C	ZINC000426734016	360700146	/nfs/dbraw/zinc/70/01/46/360700146.db2.gz	MUBANQKSZOHSGQ-NSHDSACASA-N	1	0	284.429	1.801	50	0		CDAARO
CCc1ccccc1OCC(=O)N1CC[C@H](C[NH2+]C)C1	ZINC000178969968	189158286	/nfs/dbraw/zinc/15/82/86/189158286.db2.gz	QINLMEJGIIQFGF-CYBMUJFWSA-N	1	0	276.380	1.696	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)Cc2ccc(OC)c(F)c2)C1	ZINC000178963752	189157884	/nfs/dbraw/zinc/15/78/84/189157884.db2.gz	SLQKUJAPLACOFD-GFCCVEGCSA-N	1	0	280.343	1.445	50	0		CDAARO
COc1csc(C(=O)N2CCC[C@]3(CC[NH2+]C3)C2)c1	ZINC000367401450	361378415	/nfs/dbraw/zinc/37/84/15/361378415.db2.gz	LEVPDQMMYMGZSD-CQSZACIVSA-N	1	0	280.393	1.972	50	0		CDAARO
CCCNC(=O)NC(=O)C[N@H+](C)[C@@H]1CCc2ccccc21	ZINC000012821107	361416501	/nfs/dbraw/zinc/41/65/01/361416501.db2.gz	JNUDRGLLGAQGRP-CQSZACIVSA-N	1	0	289.379	1.842	50	0		CDAARO
Cn1ccnc1-c1ccc(C(=O)NCC[NH+]2CCCC2)cc1	ZINC000426719980	361609632	/nfs/dbraw/zinc/60/96/32/361609632.db2.gz	PVKUAQVNTIPNHW-UHFFFAOYSA-N	1	0	298.390	1.913	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)COc2ccc(F)cc2F)C1	ZINC000191366621	189592868	/nfs/dbraw/zinc/59/28/68/189592868.db2.gz	MCBSOICJZBTWET-SNVBAGLBSA-N	1	0	270.279	1.293	50	0		CDAARO
COCCN(Cc1ccccc1F)C(=O)C[C@@H]1CC[NH2+]C1	ZINC000215589896	189695043	/nfs/dbraw/zinc/69/50/43/189695043.db2.gz	VUKYTUXPYANFNH-ZDUSSCGKSA-N	1	0	294.370	1.800	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CC[C@@H](C[NH3+])C2)cc1F	ZINC000606442013	366880867	/nfs/dbraw/zinc/88/08/67/366880867.db2.gz	ZWOOPBKGYICNGW-FHMRSRPSSA-N	1	0	278.327	1.655	50	0		CDAARO
Cc1cc(CNC(=O)N[C@@H](C)C(C)(C)C[NH+](C)C)n(C)n1	ZINC000252499122	367648067	/nfs/dbraw/zinc/64/80/67/367648067.db2.gz	RVTATHZFHXAWRH-LBPRGKRZSA-N	1	0	295.431	1.504	50	0		CDAARO
CCc1ccc(CNC(=O)CN2CC[N@H+](C)C[C@H]2C)s1	ZINC000252511231	367675673	/nfs/dbraw/zinc/67/56/73/367675673.db2.gz	FHEKSOXSDITZDC-GFCCVEGCSA-N	1	0	295.452	1.563	50	0		CDAARO
Cc1ccc([C@@H](C)NC(=O)[C@@H]2CSCN2)cc1F	ZINC000094956635	367748058	/nfs/dbraw/zinc/74/80/58/367748058.db2.gz	JNTSLYWHEQXDMN-SKDRFNHKSA-N	1	0	268.357	1.974	50	0		CDAARO
Cc1nc(CNc2cc(C[NH+](C)C)ncn2)c(C)o1	ZINC000063835310	368903852	/nfs/dbraw/zinc/90/38/52/368903852.db2.gz	SMRAACJMMGBTQX-UHFFFAOYSA-N	1	0	261.329	1.755	50	0		CDAARO
CSCCC(=O)N1CCC[C@@H](C[NH+]2CCN(C)CC2)C1	ZINC000368978986	369656289	/nfs/dbraw/zinc/65/62/89/369656289.db2.gz	HNAHOLKKWUDPPT-AWEZNQCLSA-N	1	0	299.484	1.226	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+]1C[C@H]1CCCC[C@H]1C	ZINC000097108450	284179330	/nfs/dbraw/zinc/17/93/30/284179330.db2.gz	LHCNCBJSZGOJCB-NDBYEHHHSA-N	1	0	255.358	1.421	50	0		CDAARO
CS[C@@H]1C[N@H+](CCc2ccncc2C)C[C@H]1N(C)C	ZINC000573840013	371678486	/nfs/dbraw/zinc/67/84/86/371678486.db2.gz	KKXQVLSEONDSJO-HUUCEWRRSA-N	1	0	279.453	1.910	50	0		CDAARO
C[C@H](CC(=O)N1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)C1CC1	ZINC000252673353	371683606	/nfs/dbraw/zinc/68/36/06/371683606.db2.gz	RBQKEXFETBDUKI-BPLDGKMQSA-N	1	0	280.412	1.480	50	0		CDAARO
O=C(Cc1cnn(-c2ccccc2)c1)NC[C@@H]1CCC[NH2+]1	ZINC000178719018	372203601	/nfs/dbraw/zinc/20/36/01/372203601.db2.gz	DXJWKIAQQVGYOB-AWEZNQCLSA-N	1	0	284.363	1.283	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)[C@@H](C)COC	ZINC000253371216	373678911	/nfs/dbraw/zinc/67/89/11/373678911.db2.gz	AMZBBAMALDXUDK-BFHYXJOUSA-N	1	0	268.401	1.744	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)[C@H](C)COC	ZINC000253371218	373680063	/nfs/dbraw/zinc/68/00/63/373680063.db2.gz	AMZBBAMALDXUDK-MGPQQGTHSA-N	1	0	268.401	1.744	50	0		CDAARO
Cc1nc(C)c(C(=O)NCC[C@@H]2CCC[N@H+]2C)o1	ZINC000215426610	374669094	/nfs/dbraw/zinc/66/90/94/374669094.db2.gz	IAVPSGRUCJEEOD-NSHDSACASA-N	1	0	251.330	1.506	50	0		CDAARO
[NH3+]CCCOC1CCN(C(=O)c2ccc(F)c(F)c2)CC1	ZINC000094070947	374812191	/nfs/dbraw/zinc/81/21/91/374812191.db2.gz	DLYBFZICOLZVIP-UHFFFAOYSA-N	1	0	298.333	1.935	50	0		CDAARO
CCc1cc(=O)[nH]c(C[N@H+](C)C2CCC(OC)CC2)n1	ZINC000095412422	374915666	/nfs/dbraw/zinc/91/56/66/374915666.db2.gz	GSVWURGQBXQDQH-UHFFFAOYSA-N	1	0	279.384	1.722	50	0		CDAARO
COc1ccc([C@H](C)[C@H](C)[NH2+]CCS(C)(=O)=O)cc1	ZINC000095421223	374923681	/nfs/dbraw/zinc/92/36/81/374923681.db2.gz	NJTVEEXVJZRKER-NEPJUHHUSA-N	1	0	285.409	1.821	50	0		CDAARO
Cc1cccc(C)c1C[N@@H+](C)CC(C)(CO)CO	ZINC000095443002	374944892	/nfs/dbraw/zinc/94/48/92/374944892.db2.gz	IAVVJIYRIOAEHM-UHFFFAOYSA-N	1	0	251.370	1.726	50	0		CDAARO
CC[NH+]1CCN(c2nccc(-n3nc(C)cc3C)n2)CC1	ZINC000096101966	375057196	/nfs/dbraw/zinc/05/71/96/375057196.db2.gz	KNFHZKZVBZWCKE-UHFFFAOYSA-N	1	0	286.383	1.421	50	0		CDAARO
CC[NH+](CC)CCN1CCC(C2OCCO2)CC1	ZINC000097050819	375140721	/nfs/dbraw/zinc/14/07/21/375140721.db2.gz	JKGXJNKMCKHOBA-UHFFFAOYSA-N	1	0	256.390	1.413	50	0		CDAARO
COC(=O)c1cc(CN2CC[N@H+](C)C[C@H]2C(C)C)c[nH]1	ZINC000097058992	375142418	/nfs/dbraw/zinc/14/24/18/375142418.db2.gz	OFASQFOAYAGNDD-AWEZNQCLSA-N	1	0	279.384	1.573	50	0		CDAARO
Cc1ccc(CC(=O)N2CCC[C@H]([C@@H](C)[NH3+])C2)cn1	ZINC000299738821	375199586	/nfs/dbraw/zinc/19/95/86/375199586.db2.gz	GWEGYSOPVGKASS-OCCSQVGLSA-N	1	0	261.369	1.518	50	0		CDAARO
Cc1cc(C(=O)CSc2nc(N)cc(N)[nH+]2)c(C)n1C	ZINC000002628848	375276668	/nfs/dbraw/zinc/27/66/68/375276668.db2.gz	IJZSQRQOZTYOBU-UHFFFAOYSA-N	1	0	291.380	1.571	50	0		CDAARO
CC(=O)NCC[NH2+]C[C@H](O)COc1ccccc1C(C)C	ZINC000003441430	375700176	/nfs/dbraw/zinc/70/01/76/375700176.db2.gz	CFMFMJXYYKQHIS-AWEZNQCLSA-N	1	0	294.395	1.275	50	0		CDAARO
CNC(=O)c1cccc(Oc2ncnc3c2C[N@H+](C)CC3)c1	ZINC000065475454	376134648	/nfs/dbraw/zinc/13/46/48/376134648.db2.gz	KXBGWVFCPONQQF-UHFFFAOYSA-N	1	0	298.346	1.616	50	0		CDAARO
Nc1cc[nH+]cc1C(=O)N1CCc2sccc2C1	ZINC000126952784	377047947	/nfs/dbraw/zinc/04/79/47/377047947.db2.gz	DEMVCBBOVZRLCU-UHFFFAOYSA-N	1	0	259.334	1.924	50	0		CDAARO
CC(C)c1nnc(N2CCOC3(CC[NH+](C)CC3)C2)s1	ZINC000645385236	377257765	/nfs/dbraw/zinc/25/77/65/377257765.db2.gz	SHGUPLHDGFBBBH-UHFFFAOYSA-N	1	0	296.440	1.963	50	0		CDAARO
COc1cccc(C(=O)N2CCC[C@]3(CC[NH2+]C3)C2)c1O	ZINC000067851417	377260459	/nfs/dbraw/zinc/26/04/59/377260459.db2.gz	YOINWFPTSNWJQS-MRXNPFEDSA-N	1	0	290.363	1.617	50	0		CDAARO
CN1CC[N@H+](C)C[C@@H]1CNC(=O)N1CCCC(C)(C)CC1	ZINC000078952912	377905604	/nfs/dbraw/zinc/90/56/04/377905604.db2.gz	BNHLHRFRJRZKMB-AWEZNQCLSA-N	1	0	296.459	1.454	50	0		CDAARO
COc1ccc(/C=C\C(=O)NOC[C@H](C)[NH3+])cc1OC	ZINC000493133995	253379239	/nfs/dbraw/zinc/37/92/39/253379239.db2.gz	UMTLKQVFCRAMIA-BXKUYDPTSA-N	1	0	280.324	1.112	50	0		CDAARO
C[C@@H]1CCCN(S(=O)(=O)N2CCCCCC2)[C@H]1C[NH3+]	ZINC000252097217	296393836	/nfs/dbraw/zinc/39/38/36/296393836.db2.gz	FREMGPMCPWVKSK-OLZOCXBDSA-N	1	0	289.445	1.166	50	0		CDAARO
O=C(C[NH2+]CCCO)NC12CC3CC(CC(C3)C1)C2	ZINC000002496790	390142658	/nfs/dbraw/zinc/14/26/58/390142658.db2.gz	GKCDMFHUVAQPQU-UHFFFAOYSA-N	1	0	266.385	1.043	50	0		CDAARO
CC(C)[N@H+](CCOC[C@@H]1CCCO1)Cc1cnn(C)c1	ZINC000096421075	390514302	/nfs/dbraw/zinc/51/43/02/390514302.db2.gz	SPVCSTGHUUQVOA-HNNXBMFYSA-N	1	0	281.400	1.826	50	0		CDAARO
CCCc1nc(C)cc(NCC[NH+]2CCC(O)CC2)n1	ZINC000065381700	390549896	/nfs/dbraw/zinc/54/98/96/390549896.db2.gz	LHFFQWXAKKWWKH-UHFFFAOYSA-N	1	0	278.400	1.606	50	0		CDAARO
C[C@H]1c2ccsc2CC[N@H+]1CCC(=O)NC(N)=O	ZINC000011474139	390902441	/nfs/dbraw/zinc/90/24/41/390902441.db2.gz	FPXFWIYLTLFSNX-QMMMGPOBSA-N	1	0	267.354	1.252	50	0		CDAARO
Cc1ccc(C(=O)N2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)s1	ZINC000248652914	391161590	/nfs/dbraw/zinc/16/15/90/391161590.db2.gz	VKWPZQKIWRYBCF-GARJFASQSA-N	1	0	250.367	1.866	50	0		CDAARO
[NH3+][C@@H]1CC[C@H]2CN(C(=O)CCc3cccs3)C[C@H]12	ZINC000252587585	131136411	/nfs/dbraw/zinc/13/64/11/131136411.db2.gz	ZIGZRERIIHCQSD-WCFLWFBJSA-N	1	0	264.394	1.876	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]1)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000261753415	131167298	/nfs/dbraw/zinc/16/72/98/131167298.db2.gz	QJIYAIKCOWJNRW-JYJNAYRXSA-N	1	0	288.391	1.853	50	0		CDAARO
C[NH2+][C@@H](C)CNC(=O)c1cc(F)cc2nccnc21	ZINC000261831701	131171841	/nfs/dbraw/zinc/17/18/41/131171841.db2.gz	VLIUIQJKDCGVEU-QMMMGPOBSA-N	1	0	262.288	1.107	50	0		CDAARO
c1ccc([C@@H]2CN(c3ncnc4c3CC[NH2+]C4)CCO2)cc1	ZINC000067921885	285488650	/nfs/dbraw/zinc/48/86/50/285488650.db2.gz	NTUAFVWJSAGSPK-INIZCTEOSA-N	1	0	296.374	1.700	50	0		CDAARO
COCc1nc2n(n1)CCC[C@H]2N[C@H]1CC[N@@H+](C2CC2)C1	ZINC000095423841	393147492	/nfs/dbraw/zinc/14/74/92/393147492.db2.gz	IQFPQVSJNAGNIU-WCQYABFASA-N	1	0	291.399	1.086	50	0		CDAARO
C(=C\c1ccccc1)\C[NH2+][C@@H]1CCc2ncnn2C1	ZINC000104060939	397930284	/nfs/dbraw/zinc/93/02/84/397930284.db2.gz	ZLJRSBDHTLDCES-HJHHMULASA-N	1	0	254.337	1.896	50	0		CDAARO
Cc1n[nH]cc1C1CC[NH+]([C@H]2CCN(C(C)C)C2=O)CC1	ZINC000375337793	160370480	/nfs/dbraw/zinc/37/04/80/160370480.db2.gz	UUFZYJXFSGJNQU-HNNXBMFYSA-N	1	0	290.411	1.907	50	0		CDAARO
CCOc1ccccc1C[NH2+]CCCN1CCOCC1	ZINC000002511860	169797243	/nfs/dbraw/zinc/79/72/43/169797243.db2.gz	VCUVSKMNEDSISJ-UHFFFAOYSA-N	1	0	278.396	1.897	50	0		CDAARO
COCC[NH2+]CC[C@@H]1CCC(=O)N1CCc1cccs1	ZINC000012037870	170468086	/nfs/dbraw/zinc/46/80/86/170468086.db2.gz	AICMEHLJNZZTJL-ZDUSSCGKSA-N	1	0	296.436	1.908	50	0		CDAARO
Cc1nc(CN2CC[N@@H+](CC(C)C)[C@@H](CCO)C2)c[nH]1	ZINC000020540201	171241445	/nfs/dbraw/zinc/24/14/45/171241445.db2.gz	VRALWMWOZJZRCS-HNNXBMFYSA-N	1	0	280.416	1.243	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N1CCC[C@H]([NH3+])C1	ZINC000037116484	172967410	/nfs/dbraw/zinc/96/74/10/172967410.db2.gz	VVOJNXBPQSEJHS-NSHDSACASA-N	1	0	272.345	1.246	50	0		CDAARO
CCCN(C(=O)c1c(C)nn(C)c1C)[C@H]1CC[NH2+]C1	ZINC000037540012	173261441	/nfs/dbraw/zinc/26/14/41/173261441.db2.gz	MGVKEQBXZQWHON-LBPRGKRZSA-N	1	0	264.373	1.251	50	0		CDAARO
Cc1cc(CN2CCC([N@@H+]3CC[C@@H](O)C3)CC2)on1	ZINC000662151770	414539027	/nfs/dbraw/zinc/53/90/27/414539027.db2.gz	KZCFMCNVPFRKCZ-CYBMUJFWSA-N	1	0	265.357	1.014	50	0		CDAARO
NC(=O)COc1cccc(-c2cccc3c2CC[NH2+]C3)c1	ZINC000071764413	176261680	/nfs/dbraw/zinc/26/16/80/176261680.db2.gz	JJMNHENKPUUVTM-UHFFFAOYSA-N	1	0	282.343	1.863	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)c1cnn2c1CCCC2	ZINC000072143630	176324349	/nfs/dbraw/zinc/32/43/49/176324349.db2.gz	OFBXYHXEBPJBDD-UHFFFAOYSA-N	1	0	299.378	1.765	50	0		CDAARO
CSCc1nc(CNC[C@@]2(O)CCC[NH2+]C2)cs1	ZINC000072428449	176402193	/nfs/dbraw/zinc/40/21/93/176402193.db2.gz	KEJKDUUDNHQKLQ-GFCCVEGCSA-N	1	0	287.454	1.210	50	0		CDAARO
Oc1cccc(CN2CCC[C@@](O)(C[NH+]3CCCC3)C2)c1	ZINC000077459753	177271158	/nfs/dbraw/zinc/27/11/58/177271158.db2.gz	IJVJQJVUGFCLQT-QGZVFWFLSA-N	1	0	290.407	1.815	50	0		CDAARO
O=C(CCCOCc1ccccc1)N1CC[C@H]2C[NH2+]C[C@H]21	ZINC000077564031	177281117	/nfs/dbraw/zinc/28/11/17/177281117.db2.gz	NFYNZDATWDURSO-JKSUJKDBSA-N	1	0	288.391	1.804	50	0		CDAARO
C[C@@H]1CN(C)c2ccccc2N(C(=O)[C@@]2(F)CC[NH2+]C2)C1	ZINC000252671451	296969945	/nfs/dbraw/zinc/96/99/45/296969945.db2.gz	VUQJPRZUQYDKFM-MLGOLLRUSA-N	1	0	291.370	1.807	50	0		CDAARO
CCOC(=O)CN1c2ccccc2N2CCC[NH+]=C12	ZINC000004663420	260015907	/nfs/dbraw/zinc/01/59/07/260015907.db2.gz	HOPMCIZHPAOZNL-UHFFFAOYSA-N	1	0	259.309	1.636	50	0		CDAARO
NC(=O)[C@@H](c1ccccc1)N1C[C@@H](c2ccccc2)[C@H]([NH3+])C1	ZINC000261743539	270311785	/nfs/dbraw/zinc/31/17/85/270311785.db2.gz	MUBHZVWEYAZQJY-GVDBMIGSSA-N	1	0	295.386	1.640	50	0		CDAARO
C[NH+]1CCC2(CC1)N=C(c1ccccc1)C(=S)N2	ZINC000006817147	273872440	/nfs/dbraw/zinc/87/24/40/273872440.db2.gz	YOTXRAMOGZFEOJ-UHFFFAOYSA-N	1	0	259.378	1.828	50	0		CDAARO
CO[C@H]1CN(c2ncnc3c(C)csc32)CC[C@H]1[NH3+]	ZINC000071661623	274081524	/nfs/dbraw/zinc/08/15/24/274081524.db2.gz	WDOITWVXTCTXPE-ZJUUUORDSA-N	1	0	278.381	1.552	50	0		CDAARO
O[C@@H](C[NH+]1CCN(Cc2cc(F)ccc2F)CC1)C1CC1	ZINC000085436871	275051591	/nfs/dbraw/zinc/05/15/91/275051591.db2.gz	KBEDCUGIUZQAMD-INIZCTEOSA-N	1	0	296.361	1.853	50	0		CDAARO
CC[NH+](CC)[C@H](CNc1ncncn1)c1ccco1	ZINC000223195873	276340845	/nfs/dbraw/zinc/34/08/45/276340845.db2.gz	QJUOWBTXSSZHFK-LLVKDONJSA-N	1	0	261.329	1.960	50	0		CDAARO
CN(C[C@@H]1CCCCO1)C(=O)[C@@H]1CCCCC[C@@H]1[NH3+]	ZINC000094752826	276849672	/nfs/dbraw/zinc/84/96/72/276849672.db2.gz	BEENGRHAQNSIEJ-MJBXVCDLSA-N	1	0	268.401	1.922	50	0		CDAARO
CN1CCN(C(=O)[C@@H]2CCC[NH2+]2)c2ccc(F)cc21	ZINC000072535235	277093561	/nfs/dbraw/zinc/09/35/61/277093561.db2.gz	MCZKFLWDFLIGHA-NSHDSACASA-N	1	0	263.316	1.361	50	0		CDAARO
CC(C)(C)OC(=O)N[C@H]1CC[N@@H+](C2CCOCC2)C1	ZINC000067800918	277204310	/nfs/dbraw/zinc/20/43/10/277204310.db2.gz	ZCXDCILJOPQCNH-NSHDSACASA-N	1	0	270.373	1.764	50	0		CDAARO
CC(C)C[N@@H+]1CCC[C@H]1CNC(=O)NCC(F)F	ZINC000089840186	277398204	/nfs/dbraw/zinc/39/82/04/277398204.db2.gz	IBLSGPBNMLTYEK-JTQLQIEISA-N	1	0	263.332	1.671	50	0		CDAARO
C[C@@H]1CN(C(=O)C[C@@H]2OCCc3ccccc32)C[C@@H](C)[NH2+]1	ZINC000246890963	278647343	/nfs/dbraw/zinc/64/73/43/278647343.db2.gz	IYWQTAPYDNFYJV-IOASZLSFSA-N	1	0	288.391	1.899	50	0		CDAARO
CCOC(=O)N(C)C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1	ZINC000095976555	279569035	/nfs/dbraw/zinc/56/90/35/279569035.db2.gz	UQUUYHUOTSPQLV-KBPBESRZSA-N	1	0	284.400	1.843	50	0		CDAARO
Cc1ccc(NC(=O)c2n[nH]c3c2C[NH2+]CC3)cc1	ZINC000042784031	280908605	/nfs/dbraw/zinc/90/86/05/280908605.db2.gz	AOPVZOKJXZVCQS-UHFFFAOYSA-N	1	0	256.309	1.616	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)/C=C\c2ccc3c(c2)OCCO3)C1	ZINC000255431482	289371835	/nfs/dbraw/zinc/37/18/35/289371835.db2.gz	OHOGREPVMOYWDX-RYWCDNDXSA-N	1	0	288.347	1.421	50	0		CDAARO
COc1cc([C@@H](C)[NH2+][C@@H]2CCCN(C)C2=O)ccn1	ZINC000558149286	290381515	/nfs/dbraw/zinc/38/15/15/290381515.db2.gz	WDUHOCTWJYPJQA-ZYHUDNBSSA-N	1	0	263.341	1.362	50	0		CDAARO
COc1ccc(/C=C\C(=O)NCC[NH+](C)C)cc1OC	ZINC000006343602	295059189	/nfs/dbraw/zinc/05/91/89/295059189.db2.gz	KHOHOXHCAKOINY-VURMDHGXSA-N	1	0	278.352	1.395	50	0		CDAARO
[NH3+]CC[C@H]1CCCCN1S(=O)(=O)c1cccs1	ZINC000020182137	303389792	/nfs/dbraw/zinc/38/97/92/303389792.db2.gz	CTDKNRUFDGPBSC-SNVBAGLBSA-N	1	0	274.411	1.640	50	0		CDAARO
CC(C)[C@@H](CNC(=O)c1ccc(O)c(F)c1)[NH+](C)C	ZINC000534577365	328310381	/nfs/dbraw/zinc/31/03/81/328310381.db2.gz	FWNHPSRNZCLUKT-GFCCVEGCSA-N	1	0	268.332	1.847	50	0		CDAARO
c1ccc(-c2nnc(N3C[C@@H]4[NH2+]CCO[C@H]4C3)s2)cc1	ZINC000534577265	328310439	/nfs/dbraw/zinc/31/04/39/328310439.db2.gz	BICZGCICUUXSEJ-RYUDHWBXSA-N	1	0	288.376	1.382	50	0		CDAARO
CC[C@H](NC(=O)C[N@H+](C)C(C)C)c1ncnn1CC	ZINC000534646505	328329739	/nfs/dbraw/zinc/32/97/39/328329739.db2.gz	QURMQEVZMKJFBN-NSHDSACASA-N	1	0	267.377	1.206	50	0		CDAARO
O=C(N[C@H]1COC[C@@H]1[NH+]1CCCCC1)C1CCCCC1	ZINC000534644768	328330394	/nfs/dbraw/zinc/33/03/94/328330394.db2.gz	UFPUIRVRIJTYHG-GJZGRUSLSA-N	1	0	280.412	1.936	50	0		CDAARO
O=C([O-])C[NH+]1CCC([NH2+][C@@H]2CCCSC2)CC1	ZINC000534652178	328337586	/nfs/dbraw/zinc/33/75/86/328337586.db2.gz	SBCOAWHZPGUMEX-LLVKDONJSA-N	1	0	258.387	1.021	50	0		CDAARO
CC(C)[C@H](CNc1cccc(C(N)=O)n1)[NH+](C)C	ZINC000534660319	328342478	/nfs/dbraw/zinc/34/24/78/328342478.db2.gz	LKHKDGCYKPFVJN-NSHDSACASA-N	1	0	250.346	1.179	50	0		CDAARO
CN(CC[C@@H]1CCCCO1)C(=O)C1CC[NH2+]CC1	ZINC000534670124	328346977	/nfs/dbraw/zinc/34/69/77/328346977.db2.gz	NZIYOWHOVWPZBT-ZDUSSCGKSA-N	1	0	254.374	1.404	50	0		CDAARO
COc1nc(NCC[C@@H]2CCC[N@H+](C)C2)ncc1F	ZINC000534673155	328348783	/nfs/dbraw/zinc/34/87/83/328348783.db2.gz	NDDPKARAEZXSAG-JTQLQIEISA-N	1	0	268.336	1.190	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@H](C)[C@@H]2CCOC2)cc1	ZINC000095988356	328524554	/nfs/dbraw/zinc/52/45/54/328524554.db2.gz	NMWJCNOCOSBYLI-BXUZGUMPSA-N	1	0	263.337	1.988	50	0		CDAARO
COc1nc(NC[C@@H](c2ccco2)[NH+](C)C)ncc1F	ZINC001772701422	1159437500	/nfs/dbraw/zinc/43/75/00/1159437500.db2.gz	MFXCIZFXMVFMIL-JTQLQIEISA-N	1	0	280.303	1.932	50	0		CDAARO
Cc1ncc(Cl)c(NCC[N@@H+]2CCC[C@H](CO)C2)n1	ZINC001772702183	1159437537	/nfs/dbraw/zinc/43/75/37/1159437537.db2.gz	AGJRQYLEFNFOTD-NSHDSACASA-N	1	0	284.791	1.555	50	0		CDAARO
CC(=O)NC(C)(C)C[C@@H](C)[N@@H+]1CCc2n[nH]c(C)c2C1	ZINC000670440140	482985762	/nfs/dbraw/zinc/98/57/62/482985762.db2.gz	PZKOBXRVOAPQDP-SNVBAGLBSA-N	1	0	278.400	1.770	50	0		CDAARO
CC(C)(O)[C@H]1CC[N@H+](Cc2ccc(OCCO)cc2)C1	ZINC000670444630	482991344	/nfs/dbraw/zinc/99/13/44/482991344.db2.gz	JLNFGVHLIUGRTR-AWEZNQCLSA-N	1	0	279.380	1.651	50	0		CDAARO
CCOc1ccc(C[N@@H+]2CCC[C@@H](c3nnc[nH]3)C2)cn1	ZINC000670448437	483004678	/nfs/dbraw/zinc/00/46/78/483004678.db2.gz	DPNWROSIRRFAIG-CYBMUJFWSA-N	1	0	287.367	1.978	50	0		CDAARO
Cc1cc2n(n1)CCN(C[C@H]1Cc3c(nc(C)nc3C)O1)C2	ZINC000670450061	483011821	/nfs/dbraw/zinc/01/18/21/483011821.db2.gz	DCHZKAQAXBMAGL-CQSZACIVSA-N	1	0	299.378	1.418	50	0		CDAARO
Nc1ncc(C[N@@H+]2CCC[C@@H](CN3CCCC3=O)C2)s1	ZINC000670460130	483042250	/nfs/dbraw/zinc/04/22/50/483042250.db2.gz	JWBWWFDITGSAHP-LLVKDONJSA-N	1	0	294.424	1.560	50	0		CDAARO
CCC1CC[NH+](CCNc2ccc(C(N)=O)cn2)CC1	ZINC000670462296	483047280	/nfs/dbraw/zinc/04/72/80/483047280.db2.gz	YIUAVPVJQCDAOM-UHFFFAOYSA-N	1	0	276.384	1.714	50	0		CDAARO
CCN(C(=O)C[N@H+](C)C1CCC(CO)CC1)C1CC1	ZINC000084761080	483325077	/nfs/dbraw/zinc/32/50/77/483325077.db2.gz	IJFIKHWTMLAEOW-UHFFFAOYSA-N	1	0	268.401	1.480	50	0		CDAARO
CNC(=O)C1CC[NH+]([C@H](C)C(=O)N2CCCCCC2)CC1	ZINC000053847093	483517310	/nfs/dbraw/zinc/51/73/10/483517310.db2.gz	WUDVTAKJTXKJCK-CYBMUJFWSA-N	1	0	295.427	1.236	50	0		CDAARO
C[N@H+](CCCn1cnnn1)CCOc1ccccc1	ZINC001704350475	1161395310	/nfs/dbraw/zinc/39/53/10/1161395310.db2.gz	ACESBYJTQMIBIW-UHFFFAOYSA-N	1	0	261.329	1.074	50	0		CDAARO
Cc1ccc(O)c(C[NH2+][C@H]2CCO[C@@H]2c2ccnn2C)n1	ZINC000284403931	534198297	/nfs/dbraw/zinc/19/82/97/534198297.db2.gz	CKPNLGZBHRLSCJ-NHYWBVRUSA-N	1	0	288.351	1.449	50	0		CDAARO
CC(=O)Nc1c[nH]nc1[C@H]1CCCN(CC(C)(C)[NH3+])C1	ZINC000261745934	534680318	/nfs/dbraw/zinc/68/03/18/534680318.db2.gz	BWJSHFZPKPNDAR-NSHDSACASA-N	1	0	279.388	1.285	50	0		CDAARO
CC(C)CCN1C(=O)C[C@H]([N@@H+]2CC[C@]3(CCOC3)C2)C1=O	ZINC000096461903	527721491	/nfs/dbraw/zinc/72/14/91/527721491.db2.gz	LWTYVPAICCMJPD-BBRMVZONSA-N	1	0	294.395	1.272	50	0		CDAARO
CC(C)[NH2+][C@@H]1CCN(Cc2cscn2)C[C@H]1O	ZINC000426374417	527759769	/nfs/dbraw/zinc/75/97/69/527759769.db2.gz	SKXRLOMTDJVECG-VXGBXAGGSA-N	1	0	255.387	1.076	50	0		CDAARO
COc1cc(F)ccc1C[N@H+](C)[C@H](C)CC(N)=O	ZINC000952982804	617197659	/nfs/dbraw/zinc/19/76/59/617197659.db2.gz	MPIJKGQMYVLYGH-SECBINFHSA-N	1	0	254.305	1.530	50	0		CDAARO
C[C@@]1([NH3+])CCCC[C@H]1C(=O)NCCCc1cc(=O)[nH][nH]1	ZINC000888096796	617759488	/nfs/dbraw/zinc/75/94/88/617759488.db2.gz	QWIRLWFPQLTZKE-SMDDNHRTSA-N	1	0	280.372	1.072	50	0		CDAARO
CC[C@@]1(O)CCC[C@@H]2C[N@H+](Cc3cnc(N)nc3)C[C@@H]21	ZINC001704298658	1177679089	/nfs/dbraw/zinc/67/90/89/1177679089.db2.gz	KNJZZBWQNUPNFO-VNHYZAJKSA-N	1	0	276.384	1.432	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3cccnc3C)C[C@@H]2O)[nH]n1	ZINC001704337600	1177692363	/nfs/dbraw/zinc/69/23/63/1177692363.db2.gz	BBXWDXCJZRELEC-ZBFHGGJFSA-N	1	0	286.379	1.457	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNCc2ccc(Cl)o2)C1	ZINC000065982233	750056200	/nfs/dbraw/zinc/05/62/00/750056200.db2.gz	DPOYDWRAZUDUFK-NSHDSACASA-N	1	0	272.776	1.991	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](n2cnc3ncccc3c2=O)C1	ZINC000032587025	750131222	/nfs/dbraw/zinc/13/12/22/750131222.db2.gz	BWLVXZGBRFQZRA-LBPRGKRZSA-N	1	0	272.352	1.838	50	0		CDAARO
O=C1C[C@H]([NH2+]Cc2cnc[nH]2)CN1C1Cc2ccccc2C1	ZINC000012196537	750844755	/nfs/dbraw/zinc/84/47/55/750844755.db2.gz	WQYXTPJCDNZXCL-AWEZNQCLSA-N	1	0	296.374	1.268	50	0		CDAARO
C[C@@H](COC[C@@H](O)C[NH+]1CCN(C)CC1)c1ccccc1	ZINC000020638933	750917559	/nfs/dbraw/zinc/91/75/59/750917559.db2.gz	NOFWBZNOYUENPG-RDJZCZTQSA-N	1	0	292.423	1.415	50	0		CDAARO
C[N@@H+]1CCCC2(CCN(C(=O)c3cc(N)n[nH]3)CC2)CC1	ZINC000071315177	752730294	/nfs/dbraw/zinc/73/02/94/752730294.db2.gz	YXQYEDDMASDAIE-UHFFFAOYSA-N	1	0	291.399	1.330	50	0		CDAARO
O=C(c1ccco1)N1CCC[C@H]([NH2+]Cc2ncc[nH]2)C1	ZINC000952981522	753064347	/nfs/dbraw/zinc/06/43/47/753064347.db2.gz	ZRTKWVJZCLFFTN-NSHDSACASA-N	1	0	274.324	1.397	50	0		CDAARO
COCC(=O)N1CCC2(CC1)CCC(O)(C[NH+](C)C)CC2	ZINC000581790627	899631620	/nfs/dbraw/zinc/63/16/20/899631620.db2.gz	BAEJVCLSJGQNSH-UHFFFAOYSA-N	1	0	298.427	1.108	50	0		CDAARO
C[C@@H](CCN(C)CCc1nccn1C)[NH+]1CCCC1	ZINC001506395092	908870924	/nfs/dbraw/zinc/87/09/24/908870924.db2.gz	CATUQCDJPWAORV-AWEZNQCLSA-N	1	0	264.417	1.769	50	0		CDAARO
C[C@@H](O)C(C)(C)[NH2+]CC(=O)Nc1ccc(F)cc1F	ZINC000952878196	910434183	/nfs/dbraw/zinc/43/41/83/910434183.db2.gz	ZRLAMRQVOVAQLY-MRVPVSSYSA-N	1	0	272.295	1.652	50	0		CDAARO
Cc1n[nH]cc1CN(C)C(=O)CC[C@@H](C)[NH+]1CCOCC1	ZINC000952982752	910545393	/nfs/dbraw/zinc/54/53/93/910545393.db2.gz	MNODBRGROFIAPB-GFCCVEGCSA-N	1	0	294.399	1.177	50	0		CDAARO
N#Cc1nccc(N[C@@H]2[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)n1	ZINC000398386610	936710925	/nfs/dbraw/zinc/71/09/25/936710925.db2.gz	XOBZSXAQCMIKFN-HALDLXJZSA-N	1	0	291.358	1.891	50	0		CDAARO
C[C@H](CN1CCN(C)CC1)[NH+]1CCC(c2cc[nH]n2)CC1	ZINC000821746004	925594629	/nfs/dbraw/zinc/59/46/29/925594629.db2.gz	GBVFYVYSWHFHSF-CQSZACIVSA-N	1	0	291.443	1.225	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNC(=O)c1noc(C)c1CO	ZINC000823113161	925671095	/nfs/dbraw/zinc/67/10/95/925671095.db2.gz	DJELJIDJJUBELW-LLVKDONJSA-N	1	0	281.356	1.080	50	0		CDAARO
C[N@H+](CCc1ncc[nH]1)C[C@@H]1COc2ccccc2O1	ZINC000823690350	925721624	/nfs/dbraw/zinc/72/16/24/925721624.db2.gz	WHXQHLNCGHIYSM-GFCCVEGCSA-N	1	0	273.336	1.724	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCC(=O)NCCc2ncc[nH]2)C1	ZINC000823770641	925726577	/nfs/dbraw/zinc/72/65/77/925726577.db2.gz	STOUEYVCTWWCCD-GFCCVEGCSA-N	1	0	264.373	1.190	50	0		CDAARO
Cc1n[nH]c(CN2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1Cl	ZINC000823806706	925730349	/nfs/dbraw/zinc/73/03/49/925730349.db2.gz	HVINCSKQNJNSFP-AOOOYVTPSA-N	1	0	254.765	1.365	50	0		CDAARO
COCc1nc(-c2ccc(O[C@H]3CC[NH2+]C3)cc2)no1	ZINC000670061795	937153013	/nfs/dbraw/zinc/15/30/13/937153013.db2.gz	LQTZCAWCTJXDFE-LBPRGKRZSA-N	1	0	275.308	1.624	50	0		CDAARO
NC(=O)[C@]1(c2ccccc2)CC[N@H+](Cc2cscn2)C1	ZINC000585087177	930898571	/nfs/dbraw/zinc/89/85/71/930898571.db2.gz	MIGKEINSDSQHBQ-OAHLLOKOSA-N	1	0	287.388	1.772	50	0		CDAARO
CC[N@@H+]1CCCN(C(=O)c2ccc(C(N)=O)cc2)[C@H](C)C1	ZINC000585088107	930905285	/nfs/dbraw/zinc/90/52/85/930905285.db2.gz	KEYHIRWXFAIRDQ-GFCCVEGCSA-N	1	0	289.379	1.342	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CNc2cc(N)nc(SC)n2)C1	ZINC001529158729	968997495	/nfs/dbraw/zinc/99/74/95/968997495.db2.gz	JSYHBCXRQBLDRR-SNVBAGLBSA-N	1	0	297.428	1.161	50	0		CDAARO
COCC[N@@H+]1C[C@@H](Cc2cc(C)no2)[C@@H](OC)C1	ZINC001529161244	968999335	/nfs/dbraw/zinc/99/93/35/968999335.db2.gz	FBAXJYGIFGONOQ-YPMHNXCESA-N	1	0	254.330	1.119	50	0		CDAARO
Cc1cc(C(=O)N(C)C[C@H]2CCCC[N@@H+]2C)c(=O)[nH]c1C	ZINC001506400518	975148820	/nfs/dbraw/zinc/14/88/20/975148820.db2.gz	WFXCHLNUGNHSHR-CYBMUJFWSA-N	1	0	291.395	1.960	50	0		CDAARO
Cc1nc(CN(C)CC[C@@H]2CCCC[N@@H+]2C)no1	ZINC000096441538	230372996	/nfs/dbraw/zinc/37/29/96/230372996.db2.gz	ZOOHQYZKQKQUPO-LBPRGKRZSA-N	1	0	252.362	1.684	50	0		CDAARO
NC(=O)c1ccc(C[NH2+][C@@H]2CCCSC2)cc1	ZINC000096452770	230376164	/nfs/dbraw/zinc/37/61/64/230376164.db2.gz	XOYMHKYWVCREQB-GFCCVEGCSA-N	1	0	250.367	1.771	50	0		CDAARO
CCOC(=O)N1CC[C@H]([NH2+]CCc2nncn2C(C)C)C1	ZINC000584903228	341986676	/nfs/dbraw/zinc/98/66/76/341986676.db2.gz	SCJXSTJCNXRVPA-LBPRGKRZSA-N	1	0	295.387	1.222	50	0		CDAARO
COc1nc(NC[C@H]2CC[N@@H+](C3CCCC3)C2)ncc1F	ZINC000584902291	341986783	/nfs/dbraw/zinc/98/67/83/341986783.db2.gz	MDSDRDBUTCQXCF-LLVKDONJSA-N	1	0	294.374	1.723	50	0		CDAARO
CCOCCC(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1CC	ZINC000106662107	349446271	/nfs/dbraw/zinc/44/62/71/349446271.db2.gz	OJKLIMXULXNFIL-ZIAGYGMSSA-N	1	0	268.401	1.888	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)NCC[C@@H]1CC[NH2+]C1	ZINC000110797222	230394074	/nfs/dbraw/zinc/39/40/74/230394074.db2.gz	NVWAEUWVCGHUEM-NSHDSACASA-N	1	0	286.372	1.412	50	0		CDAARO
Nc1nc(NCC(F)(F)F)cc(C2CC(O)C2)[nH+]1	ZINC000222745670	230398315	/nfs/dbraw/zinc/39/83/15/230398315.db2.gz	PUIFEDLQHMSRJV-UHFFFAOYSA-N	1	0	262.235	1.271	50	0		CDAARO
CCC[C@@H]1CN(C(=O)c2ncccc2O)C[C@H]1[NH+](C)C	ZINC000095531572	185005102	/nfs/dbraw/zinc/00/51/02/185005102.db2.gz	IUCPQHCYDWWHJW-VXGBXAGGSA-N	1	0	277.368	1.590	50	0		CDAARO
CCc1noc(CC[NH2+]C2CSCCSC2)n1	ZINC000584890996	341999239	/nfs/dbraw/zinc/99/92/39/341999239.db2.gz	ARXVUQRAXNSACL-UHFFFAOYSA-N	1	0	273.427	1.613	50	0		CDAARO
c1ccc(C[NH2+]C[C@@H]2COC3(CCOCC3)O2)nc1	ZINC000095991139	185058817	/nfs/dbraw/zinc/05/88/17/185058817.db2.gz	FHHJTHUCRZAPMT-CYBMUJFWSA-N	1	0	264.325	1.093	50	0		CDAARO
Cc1ccc(NC(=O)C[N@H+]2CC[C@H]([C@@H](C)O)C2)cc1C	ZINC000095993820	185059499	/nfs/dbraw/zinc/05/94/99/185059499.db2.gz	GEPLEIFDXSMMMT-KGLIPLIRSA-N	1	0	276.380	1.945	50	0		CDAARO
COCCOc1ccc(C[NH2+][C@@H](C)[C@H](C)COC)cn1	ZINC000095995517	185060745	/nfs/dbraw/zinc/06/07/45/185060745.db2.gz	GISCFEXRJDXMER-OLZOCXBDSA-N	1	0	282.384	1.867	50	0		CDAARO
C[C@H]1C[N@H+](C)CC[C@@H]1N(C)C(=O)Nc1cccn(C)c1=O	ZINC000089937325	539087645	/nfs/dbraw/zinc/08/76/45/539087645.db2.gz	ATXFIQXNONHXKE-AAEUAGOBSA-N	1	0	292.383	1.189	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)[C@H](C)c1c(F)cccc1F	ZINC000195554088	342625766	/nfs/dbraw/zinc/62/57/66/342625766.db2.gz	CXGNCIGNRVUNIA-ZHAHWJHGSA-N	1	0	284.306	1.171	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)c1ccc2nc(C)ccc2c1	ZINC000195554117	342625905	/nfs/dbraw/zinc/62/59/05/342625905.db2.gz	LQANVXXQCUTHFK-CABCVRRESA-N	1	0	285.347	1.260	50	0		CDAARO
Cn1cc([C@@](C)(O)C[NH2+][C@@H]2CCCSC2)cn1	ZINC000195558528	342628450	/nfs/dbraw/zinc/62/84/50/342628450.db2.gz	DQKWDRUYAFXQLI-NEPJUHHUSA-N	1	0	255.387	1.113	50	0		CDAARO
C[C@H](CC(=O)N1CCCCCC1)[NH2+][C@@H]1C=C[C@H](CO)C1	ZINC000195558601	342628508	/nfs/dbraw/zinc/62/85/08/342628508.db2.gz	UPFWPKIWYBPIMU-QLFBSQMISA-N	1	0	280.412	1.694	50	0		CDAARO
O=C(c1ccoc1)N1CCC[N@H+](CCc2cn[nH]c2)CC1	ZINC000243893753	361829257	/nfs/dbraw/zinc/82/92/57/361829257.db2.gz	ATTGTHGOHTZTGV-UHFFFAOYSA-N	1	0	288.351	1.393	50	0		CDAARO
C[C@@H](Cc1cnccn1)[N@H+](C)CCc1ccccn1	ZINC000243901592	361830316	/nfs/dbraw/zinc/83/03/16/361830316.db2.gz	BCYLTBRJNQSATN-ZDUSSCGKSA-N	1	0	256.353	1.977	50	0		CDAARO
C[C@@H](C(=O)N1CCCC1)[N@H+](C)CCCc1nccn1C	ZINC000244858689	361866417	/nfs/dbraw/zinc/86/64/17/361866417.db2.gz	VQJWZODYRRLCSV-ZDUSSCGKSA-N	1	0	278.400	1.295	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCN(c2ccncc2Cl)CC1	ZINC000097234183	342205467	/nfs/dbraw/zinc/20/54/67/342205467.db2.gz	FOPKWEDFJCODFN-NSHDSACASA-N	1	0	282.775	1.121	50	0		CDAARO
CCC1(CC)[C@H](NC(=O)Cn2ccnc2)[C@@H](C)[C@@H]1OC	ZINC000092769684	361972912	/nfs/dbraw/zinc/97/29/12/361972912.db2.gz	FEEMKSHXMUKGFH-BNOWGMLFSA-N	1	0	279.384	1.839	50	0		CDAARO
C[C@H]1CN(C(=O)C[N@H+](C)[C@H]2CCc3ccccc32)CCO1	ZINC000249243161	539067060	/nfs/dbraw/zinc/06/70/60/539067060.db2.gz	RSUSNPMZYCPCIY-BBRMVZONSA-N	1	0	288.391	1.853	50	0		CDAARO
CCc1cnc(NC(=O)NC2CC[NH+](C)CC2)s1	ZINC000098013588	529660949	/nfs/dbraw/zinc/66/09/49/529660949.db2.gz	PMSODKHAKOTQHK-UHFFFAOYSA-N	1	0	268.386	1.921	50	0		CDAARO
COCC(=O)N[C@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000036396638	362064339	/nfs/dbraw/zinc/06/43/39/362064339.db2.gz	USKIETSXNSZZAU-AWEZNQCLSA-N	1	0	262.353	1.414	50	0		CDAARO
Cc1csc(CCCNC(=O)[C@H](C)[NH+](C)C)n1	ZINC000078708210	343597754	/nfs/dbraw/zinc/59/77/54/343597754.db2.gz	ODSMHJQSBQWCEU-JTQLQIEISA-N	1	0	255.387	1.450	50	0		CDAARO
Cc1cc(C)nc(SCC(=O)NCCC[NH+](C)C)n1	ZINC000084114641	362258336	/nfs/dbraw/zinc/25/83/36/362258336.db2.gz	BQDILPGEYQXGGV-UHFFFAOYSA-N	1	0	282.413	1.253	50	0		CDAARO
COc1ccccc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C[NH3+]	ZINC000089108045	362308600	/nfs/dbraw/zinc/30/86/00/362308600.db2.gz	OOHOAQVFRBISSO-NEPJUHHUSA-N	1	0	298.408	1.491	50	0		CDAARO
O[C@H]1C[C@@H]([C@@H]([NH2+]C2CCOCC2)c2ccccn2)C1	ZINC000252551376	362393156	/nfs/dbraw/zinc/39/31/56/362393156.db2.gz	UDHISPRTNDGLCP-OSAQELSMSA-N	1	0	262.353	1.662	50	0		CDAARO
CC(C)[C@H](C[NH2+][C@@H]1CCOC1)ONC(=O)OC(C)(C)C	ZINC000398827649	345586812	/nfs/dbraw/zinc/58/68/12/345586812.db2.gz	CNJHTUQJDFQOBX-NEPJUHHUSA-N	1	0	288.388	1.846	50	0		CDAARO
C[C@@H]1CCC[NH2+][C@@H]1CNC(=O)CCC(F)(F)F	ZINC000088833031	346101166	/nfs/dbraw/zinc/10/11/66/346101166.db2.gz	VESGOPWVXBZQEY-RKDXNWHRSA-N	1	0	252.280	1.833	50	0		CDAARO
C[C@H](NC(=O)N1CCC[C@@H](CO)C1)C(C)(C)C[NH+](C)C	ZINC000085424018	179059790	/nfs/dbraw/zinc/05/97/90/179059790.db2.gz	UOXYRYRHJIZLRN-QWHCGFSZSA-N	1	0	285.432	1.377	50	0		CDAARO
Cc1ccccc1CN1CC[NH+](C[C@@H](O)C2CC2)CC1	ZINC000085436862	179062883	/nfs/dbraw/zinc/06/28/83/179062883.db2.gz	YXXOFWYJRZTOQV-QGZVFWFLSA-N	1	0	274.408	1.884	50	0		CDAARO
C[C@H](NC(=O)N[C@@H]1CCCC[C@@H]1CO)C(C)(C)C[NH+](C)C	ZINC000085425080	179059576	/nfs/dbraw/zinc/05/95/76/179059576.db2.gz	OKKCTEDQBMDOSK-BFHYXJOUSA-N	1	0	299.459	1.813	50	0		CDAARO
C[C@H]1C[NH+](CCCCNC(=O)C2=CCCCO2)C[C@H](C)O1	ZINC000085457338	179067854	/nfs/dbraw/zinc/06/78/54/179067854.db2.gz	HRCALQVMOAWVJK-KBPBESRZSA-N	1	0	296.411	1.686	50	0		CDAARO
CCNC(=O)[C@@H]1CC[N@@H+](C2CSCCSC2)C1	ZINC000584884129	349342161	/nfs/dbraw/zinc/34/21/61/349342161.db2.gz	DFFDNZIQGNPXFR-SNVBAGLBSA-N	1	0	274.455	1.293	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)NCc2cnc3c(c2)CCC3)C1	ZINC000584888064	349346362	/nfs/dbraw/zinc/34/63/62/349346362.db2.gz	GREQEBGUXYLUFA-QWHCGFSZSA-N	1	0	259.353	1.314	50	0		CDAARO
Cc1n[nH]nc1C(=O)N(C)CC[N@H+](C)C1CCCC1	ZINC000584888166	349346545	/nfs/dbraw/zinc/34/65/45/349346545.db2.gz	NOOSUEJPLDIWFB-UHFFFAOYSA-N	1	0	265.361	1.060	50	0		CDAARO
CCOCC(=O)NCC1([NH+]2CCCCC2)CCCC1	ZINC000584888243	349346656	/nfs/dbraw/zinc/34/66/56/349346656.db2.gz	XRQASECNELCASW-UHFFFAOYSA-N	1	0	268.401	1.938	50	0		CDAARO
Cc1nn(CCC[NH2+][C@@H]2CCCOC2)c(C)c1C	ZINC000584888820	349347026	/nfs/dbraw/zinc/34/70/26/349347026.db2.gz	DIUZYRCEHYUUES-CQSZACIVSA-N	1	0	251.374	1.967	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)NCc1ccc2[nH]cnc2c1	ZINC000584892858	349352579	/nfs/dbraw/zinc/35/25/79/349352579.db2.gz	BOVNTDZNHLKPBA-UHFFFAOYSA-N	1	0	272.352	1.569	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)c2cccc3c2CCC3=O)C1	ZINC000584899191	349361484	/nfs/dbraw/zinc/36/14/84/349361484.db2.gz	LGBCODRZJBTBBV-GFCCVEGCSA-N	1	0	286.375	1.887	50	0		CDAARO
CC(C)[C@H](CNc1cccc(C(=O)N(C)C)n1)[NH+](C)C	ZINC000584900405	349362211	/nfs/dbraw/zinc/36/22/11/349362211.db2.gz	KIAOLUBXIZCYOT-ZDUSSCGKSA-N	1	0	278.400	1.782	50	0		CDAARO
COC(=O)c1[nH]c2cnc(OC)cc2c1C[NH+](C)C	ZINC000514264997	350031826	/nfs/dbraw/zinc/03/18/26/350031826.db2.gz	GDPGRRZXMRIMQM-UHFFFAOYSA-N	1	0	263.297	1.420	50	0		CDAARO
FC1(F)Oc2ccc(CN3CC[NH2+]CC3)cc2O1	ZINC000091252487	180114893	/nfs/dbraw/zinc/11/48/93/180114893.db2.gz	MPZINTHEMFDGTH-UHFFFAOYSA-N	1	0	256.252	1.413	50	0		CDAARO
CCC[C@]1(CO)CCC[N@H+](CCn2ccnc2)C1	ZINC000091486105	180167177	/nfs/dbraw/zinc/16/71/77/180167177.db2.gz	DHXBJQYCBZNXTG-AWEZNQCLSA-N	1	0	251.374	1.758	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC000091496690	180172805	/nfs/dbraw/zinc/17/28/05/180172805.db2.gz	PUUVSVOPWBUDRQ-HQJQHLMTSA-N	1	0	272.270	1.974	50	0		CDAARO
Cc1ccc(OCC(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)cc1C	ZINC000091535409	180182603	/nfs/dbraw/zinc/18/26/03/180182603.db2.gz	XTYPWZKQQFXISD-CVEARBPZSA-N	1	0	288.391	1.878	50	0		CDAARO
Cc1ccccc1OCCN(C)C(=O)[C@H]1CC[C@H]([NH3+])C1	ZINC000091544113	180184961	/nfs/dbraw/zinc/18/49/61/180184961.db2.gz	GAWVMXAIRMSFQS-KBPBESRZSA-N	1	0	276.380	1.960	50	0		CDAARO
[NH3+][C@H]1CCN(Cc2cc(=O)c3cc(F)ccc3[nH]2)C1	ZINC000091726134	180243105	/nfs/dbraw/zinc/24/31/05/180243105.db2.gz	WLDMWGNSALAHMJ-JTQLQIEISA-N	1	0	261.300	1.200	50	0		CDAARO
CCOc1ccccc1C[NH2+]C[C@@H]1CN(C)CCO1	ZINC000105472215	186058603	/nfs/dbraw/zinc/05/86/03/186058603.db2.gz	XWTGZPUGGFRHQT-CQSZACIVSA-N	1	0	264.369	1.506	50	0		CDAARO
CN1CCO[C@@H](C[NH2+]Cc2cccc3[nH]ccc32)C1	ZINC000105470718	186059090	/nfs/dbraw/zinc/05/90/90/186059090.db2.gz	PXYWBUHVUHZDNP-ZDUSSCGKSA-N	1	0	259.353	1.588	50	0		CDAARO
CCc1cc(N2CCC[C@@](C)(CO)C2)nc(N(C)C)[nH+]1	ZINC000065381730	362957042	/nfs/dbraw/zinc/95/70/42/362957042.db2.gz	UOGOAJHHCNMUIL-OAHLLOKOSA-N	1	0	278.400	1.704	50	0		CDAARO
CC[C@@H]1CN(C[C@H](O)c2ccccc2)CC[N@@H+]1C[C@H](C)O	ZINC000106841062	186140153	/nfs/dbraw/zinc/14/01/53/186140153.db2.gz	FDVMHAJBRCOAMI-UAGQMJEPSA-N	1	0	292.423	1.497	50	0		CDAARO
COc1cc(C[NH2+][C@H]2CCCOC2)cc2c1OCCO2	ZINC000109545846	186261616	/nfs/dbraw/zinc/26/16/16/186261616.db2.gz	HCMTVWRWKIUSGZ-LBPRGKRZSA-N	1	0	279.336	1.735	50	0		CDAARO
Cc1cccc(CN2CC(n3cc([C@H](C)O)nn3)C2)c1	ZINC000096000056	351469236	/nfs/dbraw/zinc/46/92/36/351469236.db2.gz	GXTDMJXWYJWILB-LBPRGKRZSA-N	1	0	272.352	1.697	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CN(C(=O)c2ccccc2Cl)CCO1	ZINC000122884644	187057623	/nfs/dbraw/zinc/05/76/23/187057623.db2.gz	XUAAUNTWTLFWLS-JOYOIKCWSA-N	1	0	268.744	1.528	50	0		CDAARO
CC(=O)N1CCC([N@H+](C)CCc2scnc2C)CC1	ZINC000065496628	363290608	/nfs/dbraw/zinc/29/06/08/363290608.db2.gz	RPGHAQGKGILYPA-UHFFFAOYSA-N	1	0	281.425	1.937	50	0		CDAARO
COc1cc(N2CC[NH+](CCc3ccccc3)CC2)ncn1	ZINC000065533531	363310942	/nfs/dbraw/zinc/31/09/42/363310942.db2.gz	ALIBBXJHUSSQPN-UHFFFAOYSA-N	1	0	298.390	1.850	50	0		CDAARO
CCCc1cc(C(=O)NC[C@@H](C)C[NH+](C)C)[nH]n1	ZINC000644810281	358486424	/nfs/dbraw/zinc/48/64/24/358486424.db2.gz	FFODGLXHEWGFGY-SNVBAGLBSA-N	1	0	252.362	1.290	50	0		CDAARO
COc1cc(F)c([C@@H](C)[NH2+]C2COCCOC2)cc1OC	ZINC000644553645	366182792	/nfs/dbraw/zinc/18/27/92/366182792.db2.gz	XREGLPFWFZDMJF-SNVBAGLBSA-N	1	0	299.342	1.909	50	0		CDAARO
COc1ccc(OC[C@H](O)C[NH2+]C(C)(C)C)cc1	ZINC000000073751	355884425	/nfs/dbraw/zinc/88/44/25/355884425.db2.gz	FYEVFMXDPUKBJG-LLVKDONJSA-N	1	0	253.342	1.823	50	0		CDAARO
NC(=O)C1CC[NH+](CCC(=O)Nc2ccc(F)cc2)CC1	ZINC000000176624	355893663	/nfs/dbraw/zinc/89/36/63/355893663.db2.gz	ZBPAHQYYVJVEQU-UHFFFAOYSA-N	1	0	293.342	1.352	50	0		CDAARO
COc1ccc(C[NH2+]C2CCN(C(C)=O)CC2)cc1	ZINC000000214630	355897443	/nfs/dbraw/zinc/89/74/43/355897443.db2.gz	FLNCNELEEPAVFG-UHFFFAOYSA-N	1	0	262.353	1.796	50	0		CDAARO
Cc1cc(OCC(=O)NCC[NH+](C)C)ccc1Cl	ZINC000001781560	355951918	/nfs/dbraw/zinc/95/19/18/355951918.db2.gz	JOBUYSSISDHMAT-UHFFFAOYSA-N	1	0	270.760	1.705	50	0		CDAARO
CCCCc1c(C)nc(N2CC[NH+](CC)CC2)[nH]c1=O	ZINC000008914321	356174359	/nfs/dbraw/zinc/17/43/59/356174359.db2.gz	AQVLYZQXEDHHMG-UHFFFAOYSA-N	1	0	278.400	1.975	50	0		CDAARO
C[C@H](Oc1ccc(F)cc1)C(=O)NC1CC[NH+](C)CC1	ZINC000012380605	356296580	/nfs/dbraw/zinc/29/65/80/356296580.db2.gz	KYAMZQAFIBNJJN-NSHDSACASA-N	1	0	280.343	1.803	50	0		CDAARO
O=C(NCCCO)NC1CC[NH+](Cc2ccccc2)CC1	ZINC000032779385	356368270	/nfs/dbraw/zinc/36/82/70/356368270.db2.gz	BJRCYUFDFQBCTG-UHFFFAOYSA-N	1	0	291.395	1.333	50	0		CDAARO
COc1cc(C[NH2+]C[C@@H]2CCCO2)ccc1OCCO	ZINC000013730826	356354559	/nfs/dbraw/zinc/35/45/59/356354559.db2.gz	ILRNSINOUBSKTF-ZDUSSCGKSA-N	1	0	281.352	1.335	50	0		CDAARO
CN1C(=O)N(Cc2ccccc2)C2(CC[NH+](C)CC2)C1=O	ZINC000014540981	356390989	/nfs/dbraw/zinc/39/09/89/356390989.db2.gz	UVQFWELNMPTPTG-UHFFFAOYSA-N	1	0	287.363	1.545	50	0		CDAARO
Cn1ncc(N2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)c(Cl)c1=O	ZINC000095971014	283163085	/nfs/dbraw/zinc/16/30/85/283163085.db2.gz	GOSLKXUZXCPFKA-MNOVXSKESA-N	1	0	296.802	1.354	50	0		CDAARO
Cc1cccc(NC(=O)C(=O)NCCC[NH+](C)C)c1	ZINC000004583597	356432689	/nfs/dbraw/zinc/43/26/89/356432689.db2.gz	WPCPQSXUPDXYME-UHFFFAOYSA-N	1	0	263.341	1.001	50	0		CDAARO
NC(=O)CC[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2	ZINC000016344655	356436902	/nfs/dbraw/zinc/43/69/02/356436902.db2.gz	SPRIQBWEEGSRDV-CYBMUJFWSA-N	1	0	290.363	1.860	50	0		CDAARO
CCNC(=O)NC(=O)CN1CCC[C@H](C(F)(F)F)C1	ZINC000016591162	356442021	/nfs/dbraw/zinc/44/20/21/356442021.db2.gz	ULLSXBACIRPJFE-QMMMGPOBSA-N	1	0	281.278	1.106	50	0		CDAARO
Cc1ccc(C)c(O[C@H](C)C(=O)N2CC[NH2+]CC2)c1	ZINC000019423727	356485210	/nfs/dbraw/zinc/48/52/10/356485210.db2.gz	AJCYJXCFWXNEEF-CYBMUJFWSA-N	1	0	262.353	1.503	50	0		CDAARO
Cc1cccc(C(=O)O[C@@H](C)CN2CC[NH+](C)CC2)c1	ZINC000019897295	356515480	/nfs/dbraw/zinc/51/54/80/356515480.db2.gz	JECSPBDVVSAOTA-AWEZNQCLSA-N	1	0	276.380	1.788	50	0		CDAARO
COc1ccc(COc2cc(C(N)=[NH2+])ccn2)cc1	ZINC000019965680	356519941	/nfs/dbraw/zinc/51/99/41/356519941.db2.gz	CUEOMHGXFUKVHZ-UHFFFAOYSA-N	1	0	257.293	1.953	50	0		CDAARO
CC[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(C(N)=O)cc1	ZINC000023991261	356650708	/nfs/dbraw/zinc/65/07/08/356650708.db2.gz	STQLPDZRQFBAED-AWEZNQCLSA-N	1	0	289.379	1.989	50	0		CDAARO
Cc1noc(C)c1C[NH+]1CCC(NC(=O)C2CC2)CC1	ZINC000030278722	356747521	/nfs/dbraw/zinc/74/75/21/356747521.db2.gz	HZSCLLUSJAFNNH-UHFFFAOYSA-N	1	0	277.368	1.782	50	0		CDAARO
COc1cc(/C=C\C(=O)N2CC[C@H](C[NH3+])C2)cc(OC)c1	ZINC000255516483	356755641	/nfs/dbraw/zinc/75/56/41/356755641.db2.gz	DYCQKMJYVXRNEM-DHCBQETCSA-N	1	0	290.363	1.524	50	0		CDAARO
c1ccc(CCN2CC[NH+](CCc3ccccn3)CC2)nc1	ZINC000019770801	356814659	/nfs/dbraw/zinc/81/46/59/356814659.db2.gz	YYDFKVCSEPWSPE-UHFFFAOYSA-N	1	0	296.418	1.879	50	0		CDAARO
C[NH2+][C@H](C)c1cccc(N2CCCS2(=O)=O)c1	ZINC000036880981	356888775	/nfs/dbraw/zinc/88/87/75/356888775.db2.gz	AGCBTVPOGKFJMO-SNVBAGLBSA-N	1	0	254.355	1.507	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)COc1ccc(F)cc1	ZINC000054460357	357320733	/nfs/dbraw/zinc/32/07/33/357320733.db2.gz	SKLJONDQPWPTBT-CYBMUJFWSA-N	1	0	280.343	1.805	50	0		CDAARO
C[C@H]1C[N@@H+]2CCC[C@H]2CN1S(=O)(=O)Cc1ccccc1	ZINC000247319861	357440723	/nfs/dbraw/zinc/44/07/23/357440723.db2.gz	ONZYZNXQYYPWSN-ZFWWWQNUSA-N	1	0	294.420	1.685	50	0		CDAARO
CCCC[C@H](C[NH3+])NS(=O)(=O)c1sc(C)nc1C	ZINC000095432158	357516156	/nfs/dbraw/zinc/51/61/56/357516156.db2.gz	DUPBJWIFYZCUNO-SNVBAGLBSA-N	1	0	291.442	1.556	50	0		CDAARO
CCc1cnc(C)nc1NC1CCS(=O)(=O)CC1	ZINC000065489064	357543952	/nfs/dbraw/zinc/54/39/52/357543952.db2.gz	UNAYEKSXQNKUEL-UHFFFAOYSA-N	1	0	269.370	1.337	50	0		CDAARO
Cc1ccccc1[C@@H](C(=O)N1CCCOCC1)N(C)C	ZINC000065489745	357544030	/nfs/dbraw/zinc/54/40/30/357544030.db2.gz	SUFPMANWCWWWFN-HNNXBMFYSA-N	1	0	276.380	1.847	50	0		CDAARO
CCCc1cnc(C)nc1N1CCC2(CNC(=O)O2)CC1	ZINC000065488797	357544559	/nfs/dbraw/zinc/54/45/59/357544559.db2.gz	IWDIIYLOKBQILN-UHFFFAOYSA-N	1	0	290.367	1.816	50	0		CDAARO
CNC(=O)[C@@H]1C[C@@H]([NH3+])CN1C(=O)c1cccc2ccccc21	ZINC000067790077	357627034	/nfs/dbraw/zinc/62/70/34/357627034.db2.gz	DESMYCCAECZHGE-DOMZBBRYSA-N	1	0	297.358	1.128	50	0		CDAARO
COCCOC(=O)N1CCC2(CC[N@H+](C)C2)CC1	ZINC000067692747	357618707	/nfs/dbraw/zinc/61/87/07/357618707.db2.gz	ZWWWLTAPASLHCL-UHFFFAOYSA-N	1	0	256.346	1.187	50	0		CDAARO
C[C@@H]1CN(C(=O)c2cnc(-c3ncccn3)s2)CC[NH2+]1	ZINC000188365853	357643040	/nfs/dbraw/zinc/64/30/40/357643040.db2.gz	LOGDGUGYWFMJRV-SECBINFHSA-N	1	0	289.364	1.034	50	0		CDAARO
C[N@@H+]1CC[C@]2(C1)CCCN(C(=O)c1cccc(N)c1)C2	ZINC000067868147	357633506	/nfs/dbraw/zinc/63/35/06/357633506.db2.gz	QGDNNZCULLMWGV-INIZCTEOSA-N	1	0	273.380	1.827	50	0		CDAARO
COCC[N@@H+]1CC[C@H](OC(C)=O)[C@H]2CCCC[C@@H]21	ZINC000004687090	357747531	/nfs/dbraw/zinc/74/75/31/357747531.db2.gz	COHAZZNQVVNWKS-IHRRRGAJSA-N	1	0	255.358	1.829	50	0		CDAARO
CC[NH+](CC)[C@@H]1CCN(C(=O)c2oc(C)nc2C)C1	ZINC000074176828	357903982	/nfs/dbraw/zinc/90/39/82/357903982.db2.gz	VTPRYUOZLSMSIX-GFCCVEGCSA-N	1	0	265.357	1.848	50	0		CDAARO
CNC(=O)c1cccnc1NC[C@@H](C)C[NH+]1CCCC1	ZINC000097104568	357968507	/nfs/dbraw/zinc/96/85/07/357968507.db2.gz	HGCHFINSLAMEKS-GFCCVEGCSA-N	1	0	276.384	1.585	50	0		CDAARO
C[C@@H](NCc1nncn1C)[C@H]1CCC[N@@H+](C2CCC2)C1	ZINC000097110954	357986735	/nfs/dbraw/zinc/98/67/35/357986735.db2.gz	VUZZMUCDIAPGBP-OLZOCXBDSA-N	1	0	277.416	1.558	50	0		CDAARO
O[C@]1(C[NH+]2CCCCC2)CCN(Cc2ccccn2)C1	ZINC000077437337	358018801	/nfs/dbraw/zinc/01/88/01/358018801.db2.gz	UVRLBQMZYSUUGG-INIZCTEOSA-N	1	0	275.396	1.504	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC([NH2+][C@@H]2C=C[C@H](CO)C2)CC1	ZINC000097228297	358043285	/nfs/dbraw/zinc/04/32/85/358043285.db2.gz	FXLZXTPLRZVVRC-GXTWGEPZSA-N	1	0	296.411	1.913	50	0		CDAARO
CC[C@H](C(=O)[O-])[N@@H+]1CC[C@@H](CNc2cc(C)cc[nH+]2)C1	ZINC000364253807	358127103	/nfs/dbraw/zinc/12/71/03/358127103.db2.gz	GMWJYEIZJQRLCX-QWHCGFSZSA-N	1	0	277.368	1.987	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N[C@H]1CCC[NH2+][C@H]1C	ZINC000193451023	358295481	/nfs/dbraw/zinc/29/54/81/358295481.db2.gz	AXVRYIMJJRHDGW-AAEUAGOBSA-N	1	0	282.409	1.668	50	0		CDAARO
COc1cccc(/C=C\C(=O)N2CC[N@H+](C)C[C@H]2C)c1	ZINC000098055861	358344421	/nfs/dbraw/zinc/34/44/21/358344421.db2.gz	BERXWLLLFVNROO-MEJMFZKBSA-N	1	0	274.364	1.871	50	0		CDAARO
C[C@@H](Oc1cccc(OCC[NH+]2CCCCC2)c1)C(N)=O	ZINC000194411367	358519850	/nfs/dbraw/zinc/51/98/50/358519850.db2.gz	OWSPEZDBTPFOLK-CYBMUJFWSA-N	1	0	292.379	1.804	50	0		CDAARO
CCn1ncc(Cl)c1C(=O)NCC[NH+]1CCCC1	ZINC000426407464	358545519	/nfs/dbraw/zinc/54/55/19/358545519.db2.gz	BWHDQSGSALEDKI-UHFFFAOYSA-N	1	0	270.764	1.382	50	0		CDAARO
NC(=O)c1cn(-c2ccccc2)nc1[C@H]1CCC[NH2+]C1	ZINC000216652217	283388302	/nfs/dbraw/zinc/38/83/02/283388302.db2.gz	NXXFERNANCMBDS-NSHDSACASA-N	1	0	270.336	1.438	50	0		CDAARO
Cc1cc(C(=O)NC2CC[NH+](Cc3ccco3)CC2)on1	ZINC000097522621	358782567	/nfs/dbraw/zinc/78/25/67/358782567.db2.gz	DHYYBUCJRMOMSD-UHFFFAOYSA-N	1	0	289.335	1.970	50	0		CDAARO
Cc1n[nH]c(C)c1C[N@@H+](C)Cc1ccc(C(N)=O)cc1	ZINC000097594714	358786805	/nfs/dbraw/zinc/78/68/05/358786805.db2.gz	HKKGHPXJHFBFKL-UHFFFAOYSA-N	1	0	272.352	1.757	50	0		CDAARO
Cc1cc(C)n([C@@H]2CC[N@H+](Cc3[nH]cnc3C)C2)n1	ZINC000097600998	358787484	/nfs/dbraw/zinc/78/74/84/358787484.db2.gz	BYGAGLBVVXUWPS-CYBMUJFWSA-N	1	0	259.357	1.978	50	0		CDAARO
C[N@H+](CCn1cccn1)CCn1c2ccccc2oc1=O	ZINC000215049185	358871256	/nfs/dbraw/zinc/87/12/56/358871256.db2.gz	NZEGLELMTKSRPH-UHFFFAOYSA-N	1	0	286.335	1.423	50	0		CDAARO
C[C@]1(O)CCC[N@H+](Cc2cccc(OCC(N)=O)c2)CC1	ZINC000215546630	358894360	/nfs/dbraw/zinc/89/43/60/358894360.db2.gz	DKZCGCGSTLSQIK-INIZCTEOSA-N	1	0	292.379	1.288	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(C(=O)c2[nH]nc(N)c2Cl)CC1	ZINC000215621762	358896351	/nfs/dbraw/zinc/89/63/51/358896351.db2.gz	DULHNKJHXAFOOZ-QMMMGPOBSA-N	1	0	285.779	1.202	50	0		CDAARO
Cc1noc(C)c1C[N@@H+]1CCC[C@@]2(CNC(=O)O2)CC1	ZINC000215833839	358905448	/nfs/dbraw/zinc/90/54/48/358905448.db2.gz	JQESIGDZBJYEGG-AWEZNQCLSA-N	1	0	279.340	1.756	50	0		CDAARO
CCn1nccc1C(=O)N1CC[C@@H]([NH+](CC)CC)C1	ZINC000216536375	358949262	/nfs/dbraw/zinc/94/92/62/358949262.db2.gz	OEAQYZWSVYDXPN-GFCCVEGCSA-N	1	0	264.373	1.459	50	0		CDAARO
CCN1CCC[C@@H]1C[NH2+]C[C@H](O)COc1ccccc1	ZINC000022029641	359014062	/nfs/dbraw/zinc/01/40/62/359014062.db2.gz	MYZHMUCEOWWVOD-CABCVRRESA-N	1	0	278.396	1.500	50	0		CDAARO
O=C(c1ccnnc1)N1CC[C@@H]([NH+]2CCCCC2)C1	ZINC000219117122	359078344	/nfs/dbraw/zinc/07/83/44/359078344.db2.gz	ZHOVXNJCNWRRCJ-CYBMUJFWSA-N	1	0	260.341	1.177	50	0		CDAARO
COCc1cn(C[C@H]2CCC[N@@H+](C3CCOCC3)C2)nn1	ZINC000257177502	359121369	/nfs/dbraw/zinc/12/13/69/359121369.db2.gz	BEDVIGHBIYQXGR-ZDUSSCGKSA-N	1	0	294.399	1.316	50	0		CDAARO
COCC(=O)N1C[C@H](CF)C2(C1)CC[NH+](C(C)C)CC2	ZINC000257177652	359131427	/nfs/dbraw/zinc/13/14/27/359131427.db2.gz	XNYGUQBKHLTVJY-ZDUSSCGKSA-N	1	0	286.391	1.551	50	0		CDAARO
CC(C)N1CCN(C(=O)c2n[nH]c3ccccc32)CC1	ZINC000045429698	359148157	/nfs/dbraw/zinc/14/81/57/359148157.db2.gz	UDMGDCSLJPIPKD-UHFFFAOYSA-N	1	0	272.352	1.729	50	0		CDAARO
CCNC(=O)N1CCCCC[C@@H]1CN1CCOCC1	ZINC000257180565	359221852	/nfs/dbraw/zinc/22/18/52/359221852.db2.gz	LDYVQAKGNQZKGC-CYBMUJFWSA-N	1	0	269.389	1.293	50	0		CDAARO
COC1CCN(c2cc(N3CCOCC3)cc[nH+]2)CC1	ZINC000408518587	359909542	/nfs/dbraw/zinc/90/95/42/359909542.db2.gz	OZUYYZZDVYZBED-UHFFFAOYSA-N	1	0	277.368	1.533	50	0		CDAARO
Fc1cccc(F)c1Cc1ncnc2c1C[NH2+]CC2	ZINC000228816031	360000324	/nfs/dbraw/zinc/00/03/24/360000324.db2.gz	ZTVMUBGQSUZOBZ-UHFFFAOYSA-N	1	0	261.275	1.991	50	0		CDAARO
O=C([C@@H]1CCC[N@@H+]1C1CCOCC1)N1CC(C2CCC2)C1	ZINC000367666635	296017680	/nfs/dbraw/zinc/01/76/80/296017680.db2.gz	VPHFKNZCIIUHKW-INIZCTEOSA-N	1	0	292.423	1.888	50	0		CDAARO
CS[C@@H](C(=O)N1CC[C@@H]([NH3+])C1)c1ccccc1	ZINC000178350850	189109265	/nfs/dbraw/zinc/10/92/65/189109265.db2.gz	PZLYPYPMRIUDGD-VXGBXAGGSA-N	1	0	250.367	1.650	50	0		CDAARO
C[NH+]1CCC(CCC(=O)N[C@H]2CCc3c[nH]nc3C2)CC1	ZINC000426606698	360687850	/nfs/dbraw/zinc/68/78/50/360687850.db2.gz	FMJDZCZCRHRZAA-AWEZNQCLSA-N	1	0	290.411	1.505	50	0		CDAARO
CC[N@@H+]1CCC[C@](C)(C(=O)NCCc2ncc[nH]2)C1	ZINC000426599773	360687992	/nfs/dbraw/zinc/68/79/92/360687992.db2.gz	RJKNWRHSDAEVAP-AWEZNQCLSA-N	1	0	264.373	1.190	50	0		CDAARO
Cc1c[nH]c(CNC(=O)[C@H](C)N2CCCCC2)c(C)c1=O	ZINC000426370892	360660188	/nfs/dbraw/zinc/66/01/88/360660188.db2.gz	AYNKVVXRIFQTDM-ZDUSSCGKSA-N	1	0	291.395	1.482	50	0		CDAARO
C[C@H](C(=O)NCc1cnc2cnccn12)[NH+]1CCCCC1	ZINC000426383720	360660863	/nfs/dbraw/zinc/66/08/63/360660863.db2.gz	CVAHVKAOSGTTKC-GFCCVEGCSA-N	1	0	287.367	1.220	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1cnc(-c2cccs2)nc1	ZINC000426719804	360698828	/nfs/dbraw/zinc/69/88/28/360698828.db2.gz	FNXLJLHOHSSMKD-UHFFFAOYSA-N	1	0	290.392	1.887	50	0		CDAARO
COc1cccc(OC)c1CC(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179095947	189168954	/nfs/dbraw/zinc/16/89/54/189168954.db2.gz	YOARHHGQGBVPFC-LLVKDONJSA-N	1	0	278.352	1.067	50	0		CDAARO
CC(C)c1nc(CCNC(=O)[C@H]2CCC[NH2+]CC2)no1	ZINC000299773921	200867494	/nfs/dbraw/zinc/86/74/94/200867494.db2.gz	GQNOSVVWNIKJDD-NSHDSACASA-N	1	0	280.372	1.241	50	0		CDAARO
OC1CCC([NH2+]Cc2cccc3c2OCCO3)CC1	ZINC000036167797	361187548	/nfs/dbraw/zinc/18/75/48/361187548.db2.gz	FHAWMRJIBKRYDW-UHFFFAOYSA-N	1	0	263.337	1.851	50	0		CDAARO
C[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)CCCn1cncn1	ZINC000248145587	361274464	/nfs/dbraw/zinc/27/44/64/361274464.db2.gz	RTZWUGMDIFUEPE-UONOGXRCSA-N	1	0	291.399	1.144	50	0		CDAARO
O=C(C1Cc2ccccc2C1)N1C[C@@H]2CC[NH2+][C@@H]2C1	ZINC000236402953	361599264	/nfs/dbraw/zinc/59/92/64/361599264.db2.gz	QGMRIGUPUZIAHA-DZGCQCFKSA-N	1	0	256.349	1.222	50	0		CDAARO
C[N@H+](CCn1cccn1)[C@H]1CCc2ccccc2NC1=O	ZINC000192019491	361586564	/nfs/dbraw/zinc/58/65/64/361586564.db2.gz	HMPUBSHATCMXNG-HNNXBMFYSA-N	1	0	284.363	1.768	50	0		CDAARO
C[NH+](C)CCNc1c(=O)c(=O)c1NC1CCCCC1	ZINC000101700048	364039477	/nfs/dbraw/zinc/03/94/77/364039477.db2.gz	ROTKMZUCLVHRIK-UHFFFAOYSA-N	1	0	265.357	1.001	50	0		CDAARO
O[C@@H](COc1ccc2c(c1)OCO2)C[NH+]1CCCCC1	ZINC000002686874	364636493	/nfs/dbraw/zinc/63/64/93/364636493.db2.gz	ANFLPTDQGKPBFJ-GFCCVEGCSA-N	1	0	279.336	1.641	50	0		CDAARO
C[NH+](C)C[C@H]1CCN(C(=O)Nc2ccncc2F)C1	ZINC000187751552	364814945	/nfs/dbraw/zinc/81/49/45/364814945.db2.gz	YTORJNXFFYAYFX-SNVBAGLBSA-N	1	0	266.320	1.636	50	0		CDAARO
CCC(C)(C)NC(=O)[C@H](C)N(C)CC[NH+]1CCCC1	ZINC000089899647	366961962	/nfs/dbraw/zinc/96/19/62/366961962.db2.gz	QYUIDNONOSYADH-ZDUSSCGKSA-N	1	0	269.433	1.707	50	0		CDAARO
CC(=O)N1CC[C@H]([NH2+]Cc2cccc3c2OCO3)[C@H](C)C1	ZINC000089937611	366972926	/nfs/dbraw/zinc/97/29/26/366972926.db2.gz	VHGBZKGSHZIIDT-RISCZKNCSA-N	1	0	290.363	1.762	50	0		CDAARO
CC[C@@H]1CN(C(=O)C(C)C)CC[C@@H]1[NH2+]Cc1ncc[nH]1	ZINC000089948771	366976046	/nfs/dbraw/zinc/97/60/46/366976046.db2.gz	PTEMDDUWTYWSGN-OLZOCXBDSA-N	1	0	278.400	1.782	50	0		CDAARO
CC[C@H]1CN(C(C)=O)CC[C@H]1[NH2+]Cc1cscn1	ZINC000089949178	366978333	/nfs/dbraw/zinc/97/83/33/366978333.db2.gz	FTKPJGUTMOHVCY-WCQYABFASA-N	1	0	267.398	1.880	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1ncccc1S(N)(=O)=O	ZINC000089977243	366993221	/nfs/dbraw/zinc/99/32/21/366993221.db2.gz	NMSICFJSWDQFCX-LLVKDONJSA-N	1	0	298.412	1.015	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@H]1NS(=O)(=O)c1ccccc1F	ZINC000094345703	367489652	/nfs/dbraw/zinc/48/96/52/367489652.db2.gz	KFFVUHRHKHUWJF-MWLCHTKSSA-N	1	0	272.345	1.102	50	0		CDAARO
C[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)Cn1ccc2ccccc21	ZINC000575609083	370628785	/nfs/dbraw/zinc/62/87/85/370628785.db2.gz	OIBOFHRFELMAMU-VIKVFOODSA-N	1	0	269.348	1.318	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](CNC(=O)c2csnc2N)C1	ZINC000299783138	372758604	/nfs/dbraw/zinc/75/86/04/372758604.db2.gz	XUFWAAPOFVOGCV-SNVBAGLBSA-N	1	0	282.413	1.433	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)Cc2ccc(Cl)cc2)C[C@H]1CO	ZINC000253411949	373721475	/nfs/dbraw/zinc/72/14/75/373721475.db2.gz	PKIOUXWRSSRILP-GXTWGEPZSA-N	1	0	296.798	1.263	50	0		CDAARO
COC(=O)[C@@]12CCC[C@H]1C[N@H+](Cc1nc(C)ccc1O)C2	ZINC000108333167	412824102	/nfs/dbraw/zinc/82/41/02/412824102.db2.gz	UKOURTZGXNRNRN-BLLLJJGKSA-N	1	0	290.363	1.871	50	0		CDAARO
CO[C@H](C(=O)N1CCC[C@H]([C@H](C)[NH3+])C1)c1ccccc1	ZINC000251498832	189970266	/nfs/dbraw/zinc/97/02/66/189970266.db2.gz	HHOWOBJOTQLWAW-QEJZJMRPSA-N	1	0	276.380	1.960	50	0		CDAARO
C[C@H]([NH2+]CC(C)(C)N1CCOCC1)c1ccccn1	ZINC000020120636	374846372	/nfs/dbraw/zinc/84/63/72/374846372.db2.gz	JVOQWVTXDLMTGK-ZDUSSCGKSA-N	1	0	263.385	1.843	50	0		CDAARO
COC[C@@H](C)[NH2+]C1CCN(CCc2ccncc2)CC1	ZINC000095421528	374923380	/nfs/dbraw/zinc/92/33/80/374923380.db2.gz	QZUJVECVFMAPCS-CQSZACIVSA-N	1	0	277.412	1.713	50	0		CDAARO
COCc1nc2n(n1)CCC[C@@H]2N[C@@H]1CC[N@@H+](C2CC2)C1	ZINC000095423838	374923634	/nfs/dbraw/zinc/92/36/34/374923634.db2.gz	IQFPQVSJNAGNIU-YPMHNXCESA-N	1	0	291.399	1.086	50	0		CDAARO
COC[C@@H](O)C[N@H+](CC(=O)Nc1ccc(F)cc1)C(C)C	ZINC000095431910	374933029	/nfs/dbraw/zinc/93/30/29/374933029.db2.gz	XQNBZMZAQIOUMB-AWEZNQCLSA-N	1	0	298.358	1.482	50	0		CDAARO
C[N@@H+]1CCC[C@H]1CCSCCS(C)(=O)=O	ZINC000095442173	374942731	/nfs/dbraw/zinc/94/27/31/374942731.db2.gz	LWCUJHKZYNNWRQ-JTQLQIEISA-N	1	0	251.417	1.249	50	0		CDAARO
OC1(C(F)(F)F)CC[NH+](C[C@@H]2CCOC2)CC1	ZINC000095442030	374943191	/nfs/dbraw/zinc/94/31/91/374943191.db2.gz	DIVBDZXVQGCBRJ-VIFPVBQESA-N	1	0	253.264	1.412	50	0		CDAARO
O=C(c1n[nH]c2c1CCCC2)N1CC[C@@H]([NH+]2CCCC2)C1	ZINC000095469687	374965629	/nfs/dbraw/zinc/96/56/29/374965629.db2.gz	CXPFOWFVYMQLDV-GFCCVEGCSA-N	1	0	288.395	1.599	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCN(c2nncc3ccccc32)CC1	ZINC000095996152	375049544	/nfs/dbraw/zinc/04/95/44/375049544.db2.gz	MRXUGBHAGBHXKX-AWEZNQCLSA-N	1	0	299.378	1.016	50	0		CDAARO
CC(C)CC(=O)N1CCN(c2cc(N(C)C)cn[nH+]2)CC1	ZINC000096098671	375056576	/nfs/dbraw/zinc/05/65/76/375056576.db2.gz	HQIUNSDESISJGI-UHFFFAOYSA-N	1	0	291.399	1.237	50	0		CDAARO
O=C(CSC1=[NH+]CCN1)N1CCc2ccccc21	ZINC000003222026	375593034	/nfs/dbraw/zinc/59/30/34/375593034.db2.gz	NHKMSMQPUTXIGE-UHFFFAOYSA-N	1	0	261.350	1.268	50	0		CDAARO
CC1CCC(NC(=O)C[N@@H+]2C[C@H](C(N)=O)CC[C@H]2C)CC1	ZINC000245833259	376213007	/nfs/dbraw/zinc/21/30/07/376213007.db2.gz	BHLLDWWRNAHJDI-CEUNDQEZSA-N	1	0	295.427	1.267	50	0		CDAARO
COC[C@@H](C)n1ccc(NC(=O)NC2CC[NH+](C)CC2)n1	ZINC000189930333	377479358	/nfs/dbraw/zinc/47/93/58/377479358.db2.gz	RTXHDKPOMNVDBA-LLVKDONJSA-N	1	0	295.387	1.306	50	0		CDAARO
C[C@H]1CN(C(=O)[C@H]2CSc3ccccc32)CC[NH2+]1	ZINC000092239670	377949148	/nfs/dbraw/zinc/94/91/48/377949148.db2.gz	OWPSIYPOLGRTBT-JQWIXIFHSA-N	1	0	262.378	1.696	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N1CCC([NH3+])CC1	ZINC000020267711	291923365	/nfs/dbraw/zinc/92/33/65/291923365.db2.gz	PRQMSXFRENXBGR-UHFFFAOYSA-N	1	0	272.345	1.246	50	0		CDAARO
Cc1cc(S(=O)(=O)N[C@H]2CC[NH2+]C2)sc1C	ZINC000095467161	184994911	/nfs/dbraw/zinc/99/49/11/184994911.db2.gz	MBRADMDSTGOXPP-VIFPVBQESA-N	1	0	260.384	1.005	50	0		CDAARO
CCOCCN1CC[NH+](CC[C@H]2CCCO2)CC1	ZINC000097105175	390791780	/nfs/dbraw/zinc/79/17/80/390791780.db2.gz	IVHRPJSOCQYQQZ-CQSZACIVSA-N	1	0	256.390	1.210	50	0		CDAARO
CN(C(=O)COCc1ccccc1Cl)[C@@H]1CC[NH2+]C1	ZINC000179049466	390938382	/nfs/dbraw/zinc/93/83/82/390938382.db2.gz	AFSSNJHHEIGADK-GFCCVEGCSA-N	1	0	282.771	1.677	50	0		CDAARO
Cc1cnc(N2CCN(C[C@@H]3CCC[N@@H+](C)C3)CC2)nc1	ZINC000095357008	390910894	/nfs/dbraw/zinc/91/08/94/390910894.db2.gz	UXXDDNGXXXOFGC-OAHLLOKOSA-N	1	0	289.427	1.249	50	0		CDAARO
O=C(c1ccc(F)c(F)c1)N1CCN([C@@H]2CC[NH2+]C2)CC1	ZINC000244900149	391043799	/nfs/dbraw/zinc/04/37/99/391043799.db2.gz	ZWXAQZMPZVBKJN-GFCCVEGCSA-N	1	0	295.333	1.085	50	0		CDAARO
CC(=O)N1CCCSC[C@@H]1C[NH+]1CCCCC1	ZINC000085473258	391482805	/nfs/dbraw/zinc/48/28/05/391482805.db2.gz	ILRAEQHIJORTQV-ZDUSSCGKSA-N	1	0	256.415	1.826	50	0		CDAARO
CC1(C)C[C@@H]([NH2+]Cc2cccc(NS(C)(=O)=O)c2)CO1	ZINC000417851295	391509407	/nfs/dbraw/zinc/50/94/07/391509407.db2.gz	FUYXRKJXNCRZPD-CYBMUJFWSA-N	1	0	298.408	1.715	50	0		CDAARO
COc1cc(C[NH+]2[C@@H](C)CC(O)C[C@@H]2C)sn1	ZINC000521396514	391668310	/nfs/dbraw/zinc/66/83/10/391668310.db2.gz	ODRAUKOXYGCVIC-IUCAKERBSA-N	1	0	256.371	1.885	50	0		CDAARO
CC1(C)C[C@H](O)CC[N@H+](CCCn2ccnc2)C1	ZINC000395349646	391807868	/nfs/dbraw/zinc/80/78/68/391807868.db2.gz	QZQIFXUTQFYYRH-CYBMUJFWSA-N	1	0	251.374	1.756	50	0		CDAARO
Cc1ncccc1C[NH2+][C@@]1(CO)COc2ccccc2C1	ZINC000527769523	391943640	/nfs/dbraw/zinc/94/36/40/391943640.db2.gz	QOJPWSKSDPGCHE-KRWDZBQOSA-N	1	0	284.359	1.846	50	0		CDAARO
CCc1cc(C(=O)N2CCC3(CC[NH2+]C3)CC2)[nH]n1	ZINC000261873788	131175084	/nfs/dbraw/zinc/17/50/84/131175084.db2.gz	SQCTZJLIXFDEKF-UHFFFAOYSA-N	1	0	262.357	1.188	50	0		CDAARO
CCn1nccc1C[NH2+]Cc1ccc2[nH]c(=O)[nH]c2c1	ZINC000097106916	397605235	/nfs/dbraw/zinc/60/52/35/397605235.db2.gz	MPJLWJNVOZELKL-UHFFFAOYSA-N	1	0	271.324	1.362	50	0		CDAARO
CCOCCC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C)C1	ZINC000089986734	286037000	/nfs/dbraw/zinc/03/70/00/286037000.db2.gz	GECNANNJQUHQDR-OLZOCXBDSA-N	1	0	254.374	1.356	50	0		CDAARO
CCS(=O)(=O)N1CCC([N@@H+]2CCC[C@@H](C)C2)CC1	ZINC000004744108	170009548	/nfs/dbraw/zinc/00/95/48/170009548.db2.gz	KJHRSAIJHNPEJG-GFCCVEGCSA-N	1	0	274.430	1.532	50	0		CDAARO
Cc1ccc2cc(C[NH2+]C[C@@H](C)O)c(=O)[nH]c2c1C	ZINC000006748263	170239850	/nfs/dbraw/zinc/23/98/50/170239850.db2.gz	UBFORYYZNURFPH-SNVBAGLBSA-N	1	0	260.337	1.615	50	0		CDAARO
COc1ccc([C@@H]2[NH2+]CCc3nc[nH]c32)cc1OC	ZINC000008733357	170351851	/nfs/dbraw/zinc/35/18/51/170351851.db2.gz	BSQOBDOISMSIDT-ZDUSSCGKSA-N	1	0	259.309	1.662	50	0	biogenic	CDAARO
CCCC[C@@H](CC)CNC(=O)CCC(=O)NCC[NH+](C)C	ZINC000008983928	170360272	/nfs/dbraw/zinc/36/02/72/170360272.db2.gz	BBOFKWITADDLGY-CQSZACIVSA-N	1	0	299.459	1.777	50	0		CDAARO
CCN1CCC(CNc2cnccn2)([NH+](C)C)CC1	ZINC000534658200	411829139	/nfs/dbraw/zinc/82/91/39/411829139.db2.gz	RAQLIIUQVIKHNA-UHFFFAOYSA-N	1	0	263.389	1.305	50	0		CDAARO
CCOc1ccc(CNCC[NH2+]C[C@@H](C)O)cc1Cl	ZINC000020177142	171042836	/nfs/dbraw/zinc/04/28/36/171042836.db2.gz	AZYOJBWVEGJPNO-LLVKDONJSA-N	1	0	286.803	1.799	50	0		CDAARO
Cc1ccccc1-c1noc(CN2CC[NH2+]CC2)n1	ZINC000020282146	171132897	/nfs/dbraw/zinc/13/28/97/171132897.db2.gz	VVAKRLDMSXVBOC-UHFFFAOYSA-N	1	0	258.325	1.450	50	0		CDAARO
C[NH+](C)C1(CNc2ccc3nnnn3n2)CCCCCC1	ZINC000032871856	171757023	/nfs/dbraw/zinc/75/70/23/171757023.db2.gz	KHKYMEZTPPYVNQ-UHFFFAOYSA-N	1	0	289.387	1.586	50	0		CDAARO
[NH3+]CCCn1nc(-c2ccc(Cl)cc2)ccc1=O	ZINC000033420635	171792423	/nfs/dbraw/zinc/79/24/23/171792423.db2.gz	RQYPFNZFDUIPBL-UHFFFAOYSA-N	1	0	263.728	1.913	50	0		CDAARO
C[C@H](NC(=O)C[C@H]([NH3+])c1ccccc1)[C@@H]1CCCO1	ZINC000035734944	172386891	/nfs/dbraw/zinc/38/68/91/172386891.db2.gz	HNYUXPNMXOUXHN-UBHSHLNASA-N	1	0	262.353	1.760	50	0		CDAARO
COc1cccc([C@H]2C[C@H]2C(=O)N2CC[NH2+]CC2)c1	ZINC000038478368	174142213	/nfs/dbraw/zinc/14/22/13/174142213.db2.gz	RYLRSJOYKZNHBE-ZIAGYGMSSA-N	1	0	260.337	1.231	50	0		CDAARO
CC(C)[NH+]1CCC(CNS(=O)(=O)C2CC2)CC1	ZINC000038582556	174148503	/nfs/dbraw/zinc/14/85/03/174148503.db2.gz	GDYFRSFHDOKHBK-UHFFFAOYSA-N	1	0	260.403	1.189	50	0		CDAARO
CC(C)C[N@@H+]1CCN(Cc2cccnc2)C[C@@H]1CCO	ZINC000071736222	176257197	/nfs/dbraw/zinc/25/71/97/176257197.db2.gz	MHRPEBBOOJBCJS-INIZCTEOSA-N	1	0	277.412	1.606	50	0		CDAARO
CC[C@H]1CN(C(=O)CCOc2ccccc2C)CC[NH2+]1	ZINC000071763494	176261718	/nfs/dbraw/zinc/26/17/18/176261718.db2.gz	YBCRAAUIXSQVQF-AWEZNQCLSA-N	1	0	276.380	1.974	50	0		CDAARO
[NH3+]C[C@@H]1CCCCN1Cc1cn(-c2ccccc2)nn1	ZINC000072152130	176327568	/nfs/dbraw/zinc/32/75/68/176327568.db2.gz	ALJISQYRRMXMDG-HNNXBMFYSA-N	1	0	271.368	1.581	50	0		CDAARO
Cc1cc(C)cc(C(=O)NC[C@@]2(O)CCC[NH2+]CC2)c1	ZINC000072158979	176329363	/nfs/dbraw/zinc/32/93/63/176329363.db2.gz	DVUPPLXEPNZEDA-MRXNPFEDSA-N	1	0	276.380	1.538	50	0		CDAARO
CC[C@H]1COCC[N@@H+]1CCC(=O)NCc1ccco1	ZINC000077425066	177265967	/nfs/dbraw/zinc/26/59/67/177265967.db2.gz	YSVQHDQUJGXGMZ-LBPRGKRZSA-N	1	0	266.341	1.397	50	0		CDAARO
CCc1cc(C[N@@H+]2CCCC[C@@H]2CN2CCOCC2)on1	ZINC000077505894	177275965	/nfs/dbraw/zinc/27/59/65/177275965.db2.gz	MNOXXMKHFMTFEC-OAHLLOKOSA-N	1	0	293.411	1.924	50	0		CDAARO
CC[NH2+]CCNC(=O)Cc1ccccc1C(F)(F)F	ZINC000096482544	273685349	/nfs/dbraw/zinc/68/53/49/273685349.db2.gz	OUIRRCPPAOLDQX-UHFFFAOYSA-N	1	0	274.286	1.974	50	0		CDAARO
C([C@@H]1CCCCO1)N1CC[NH+]([C@@H]2CCSC2)CC1	ZINC000097014612	275396680	/nfs/dbraw/zinc/39/66/80/275396680.db2.gz	JCZCSGBMCFDWEO-KGLIPLIRSA-N	1	0	270.442	1.679	50	0		CDAARO
CC(C)n1ccnc1CN1CC2(CC1=O)CC[NH+](C)CC2	ZINC000095519636	275786357	/nfs/dbraw/zinc/78/63/57/275786357.db2.gz	BVOFPMQNPPSULN-UHFFFAOYSA-N	1	0	290.411	1.908	50	0		CDAARO
CC1CCC(O)(C[NH+]2CCC3(CC2)OCCO3)CC1	ZINC000089922583	276191627	/nfs/dbraw/zinc/19/16/27/276191627.db2.gz	NPMXJPAMJUFYPX-UHFFFAOYSA-N	1	0	269.385	1.767	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN([C@@H]2CCC[NH2+]C2)CC1	ZINC000068592352	277188568	/nfs/dbraw/zinc/18/85/68/277188568.db2.gz	PCCCSUUBJZRHGJ-GFCCVEGCSA-N	1	0	269.389	1.291	50	0		CDAARO
COc1ccnc(N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)n1	ZINC000108325012	278065598	/nfs/dbraw/zinc/06/55/98/278065598.db2.gz	YBGRACOVWSIJLV-RYUDHWBXSA-N	1	0	262.357	1.406	50	0		CDAARO
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N1CC[NH2+]C[C@H]1C	ZINC000124910218	278108982	/nfs/dbraw/zinc/10/89/82/278108982.db2.gz	ICOMDHXXJVIDRB-GYSYKLTISA-N	1	0	260.337	1.371	50	0		CDAARO
C[C@H]1CCCN(C(=O)c2ccncc2Cl)[C@@H]1C[NH3+]	ZINC000091457051	279665321	/nfs/dbraw/zinc/66/53/21/279665321.db2.gz	RCTRLSJUAKDYIJ-JOYOIKCWSA-N	1	0	267.760	1.934	50	0		CDAARO
CCOC[C@@H]1CCCN(C(=O)[C@@H]2CCC[C@H]2[NH3+])C1	ZINC000299740226	279734424	/nfs/dbraw/zinc/73/44/24/279734424.db2.gz	XEFOJAJPPOJYQQ-JHJVBQTASA-N	1	0	254.374	1.389	50	0		CDAARO
Cc1c(Cl)cccc1S(=O)(=O)N1CCC[NH2+]CC1	ZINC000037463908	280233580	/nfs/dbraw/zinc/23/35/80/280233580.db2.gz	KXRNOJHKKJZGQE-UHFFFAOYSA-N	1	0	288.800	1.632	50	0		CDAARO
C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)NC[C@@H]1CCCO1	ZINC000095467194	298269141	/nfs/dbraw/zinc/26/91/41/298269141.db2.gz	HATHGFYMQLXGHK-OCCSQVGLSA-N	1	0	283.416	1.537	50	0		CDAARO
O=C(N[C@@H]1C[NH2+]C[C@H]1O)C1c2ccccc2-c2ccccc21	ZINC000534585548	328315278	/nfs/dbraw/zinc/31/52/78/328315278.db2.gz	JSMNMEPEPVDUAG-HZPDHXFCSA-N	1	0	294.354	1.248	50	0		CDAARO
Cc1ccc(F)c(C(=O)NC[C@H](O)C[NH+](C)C)c1Cl	ZINC000534592647	328318709	/nfs/dbraw/zinc/31/87/09/328318709.db2.gz	FAGJWTBPMSYLHC-VIFPVBQESA-N	1	0	288.750	1.440	50	0		CDAARO
Cn1nc(C(F)(F)F)cc1C(=O)NCCc1ncc[nH]1	ZINC000534634801	328333284	/nfs/dbraw/zinc/33/32/84/328333284.db2.gz	RHOSBZURJJXRNX-UHFFFAOYSA-N	1	0	287.245	1.135	50	0		CDAARO
O=C(N[C@@H]1CC[NH2+]C[C@H]1O)C12CC3CC(CC(C3)C1)C2	ZINC000534652503	328338333	/nfs/dbraw/zinc/33/83/33/328338333.db2.gz	TZARZZKDVLKMCQ-GQWBEDRXSA-N	1	0	278.396	1.042	50	0		CDAARO
CCC[C@H](CNC(=O)Cn1nc2ccccc2n1)[NH+](C)C	ZINC000534647882	328343129	/nfs/dbraw/zinc/34/31/29/328343129.db2.gz	YFUQFOGOXLGHOR-GFCCVEGCSA-N	1	0	289.383	1.278	50	0		CDAARO
CC(=O)N1CCC([NH2+][C@H](c2ncnn2C)C(C)C)CC1	ZINC000534660576	328339571	/nfs/dbraw/zinc/33/95/71/328339571.db2.gz	SXLXPLNWRLLZTC-ZDUSSCGKSA-N	1	0	279.388	1.113	50	0		CDAARO
CCN(CCn1cccn1)C(=O)[C@H]1CCC[NH2+]CC1	ZINC000534661941	328349836	/nfs/dbraw/zinc/34/98/36/328349836.db2.gz	LPJNFULPINRKEC-ZDUSSCGKSA-N	1	0	264.373	1.121	50	0		CDAARO
Cc1cccc2oc(C[NH2+][C@@H](C)CN3CCOCC3)nc21	ZINC000534676874	328351999	/nfs/dbraw/zinc/35/19/99/328351999.db2.gz	WPXZFFMLIWWTAK-ZDUSSCGKSA-N	1	0	289.379	1.947	50	0		CDAARO
Cc1ncc(Cl)c(C(=O)N2C[C@@H](C)[C@@H]([NH+](C)C)C2)n1	ZINC000084290504	323207303	/nfs/dbraw/zinc/20/73/03/323207303.db2.gz	VSTPFKOBNNCBHT-KCJUWKMLSA-N	1	0	282.775	1.461	50	0		CDAARO
OC[C@@]12C[N@H+](CCOCc3ccccc3)C[C@@H]1COCC2	ZINC001772706704	1159442022	/nfs/dbraw/zinc/44/20/22/1159442022.db2.gz	UUKLGQLJYVBJOG-IAGOWNOFSA-N	1	0	291.391	1.534	50	0		CDAARO
CCOC(=O)N1CCC([NH2+][C@H]2CCOC[C@@H]2OC)CC1	ZINC000312571642	482409765	/nfs/dbraw/zinc/40/97/65/482409765.db2.gz	SACNFCKFZOEEJP-STQMWFEESA-N	1	0	286.372	1.001	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2nn(C)c(C)c2Cl)C[C@@H]1[NH3+]	ZINC000091494445	482568467	/nfs/dbraw/zinc/56/84/67/482568467.db2.gz	ABJKGYODCZSJHM-UWVGGRQHSA-N	1	0	284.791	1.581	50	0		CDAARO
Cc1ncc(CN2C[C@H]([NH+](C)C)[C@@H](C(C)C)C2)n1C	ZINC000091676904	482574305	/nfs/dbraw/zinc/57/43/05/482574305.db2.gz	JJBKTYNDGQNKSS-CABCVRRESA-N	1	0	264.417	1.747	50	0		CDAARO
CC/C(C)=C/CCN1C[C@H](O)[C@@H]([NH+]2CCCC2)C1	ZINC000670440749	482985490	/nfs/dbraw/zinc/98/54/90/482985490.db2.gz	NLMXJJCHJGBWSX-OOHOIJMXSA-N	1	0	252.402	1.874	50	0		CDAARO
CCc1noc(CC[NH2+][C@H](C)Cn2nc(C)cc2C)n1	ZINC000670447947	483003452	/nfs/dbraw/zinc/00/34/52/483003452.db2.gz	XVTRBUFYGOJCBU-LLVKDONJSA-N	1	0	277.372	1.666	50	0		CDAARO
O=C(N1CCCC1)N1CCC([NH2+][C@@H]2CCOC2)CC1	ZINC000670448468	483003615	/nfs/dbraw/zinc/00/36/15/483003615.db2.gz	JZUBLRQFLJVQNV-CYBMUJFWSA-N	1	0	267.373	1.045	50	0		CDAARO
CNC(=O)C[C@H]1CC[N@H+](CCc2cccc(C)n2)C1	ZINC000670450016	483011396	/nfs/dbraw/zinc/01/13/96/483011396.db2.gz	HSPCLBYFNTXFMB-CYBMUJFWSA-N	1	0	261.369	1.391	50	0		CDAARO
CC[C@@H](C(=O)NCCCn1ccnc1)[N@H+](C)CC	ZINC000822555097	1161928809	/nfs/dbraw/zinc/92/88/09/1161928809.db2.gz	QBHMKZMZURSTOH-LBPRGKRZSA-N	1	0	252.362	1.120	50	0		CDAARO
CC(C)[N@H+](C)CC(=O)N[C@@H]1c2ccccc2C[C@@H]1O	ZINC000096449517	528815070	/nfs/dbraw/zinc/81/50/70/528815070.db2.gz	BCUZKGOWZINSQJ-DZGCQCFKSA-N	1	0	262.353	1.101	50	0		CDAARO
CC[NH+]1CCC(Nc2nc3ccccc3c(=O)[nH]2)CC1	ZINC000097994963	528990252	/nfs/dbraw/zinc/99/02/52/528990252.db2.gz	DVYIRTOAHMSSTC-UHFFFAOYSA-N	1	0	272.352	1.819	50	0		CDAARO
CCC1(C(=O)N2CCN([C@@H]3CC[NH2+]C3)CC2)CCCC1	ZINC000261740935	535232708	/nfs/dbraw/zinc/23/27/08/535232708.db2.gz	MAFTXVVPHVOUAK-CQSZACIVSA-N	1	0	279.428	1.463	50	0		CDAARO
C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1ccon1	ZINC000097142609	538437605	/nfs/dbraw/zinc/43/76/05/538437605.db2.gz	NGNRMYJVDBGUHJ-DOMZBBRYSA-N	1	0	285.347	1.925	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]Cc1ccc(-n2cccn2)nc1	ZINC000097159285	567905174	/nfs/dbraw/zinc/90/51/74/567905174.db2.gz	IOUUVFAMCIYNGX-UHFFFAOYSA-N	1	0	282.351	1.897	50	0		CDAARO
CC(C)(O)CC[N@@H+]1CCC[C@H](CNC(=O)C2CCC2)C1	ZINC000952976996	614184365	/nfs/dbraw/zinc/18/43/65/614184365.db2.gz	RLOPCPOWNJAARH-CYBMUJFWSA-N	1	0	282.428	1.776	50	0		CDAARO
COc1ccc(F)c(C[NH2+]CCN2CCC[C@@H](CO)C2)c1	ZINC000952972883	617264273	/nfs/dbraw/zinc/26/42/73/617264273.db2.gz	HCUBPNPNLLRIDR-CYBMUJFWSA-N	1	0	296.386	1.628	50	0		CDAARO
COc1cccc2ccc(C[N@H+](C)[C@H](C)CC(N)=O)nc21	ZINC000952976438	617311977	/nfs/dbraw/zinc/31/19/77/617311977.db2.gz	SDDVMTLAQUHDGY-LLVKDONJSA-N	1	0	287.363	1.939	50	0		CDAARO
CCn1ccc(C[NH2+]C[C@H]2CC(=O)N(C3CCCC3)C2)n1	ZINC000952966476	616031598	/nfs/dbraw/zinc/03/15/98/616031598.db2.gz	WNCLMOVOWJAVEW-CYBMUJFWSA-N	1	0	290.411	1.784	50	0		CDAARO
CSc1nc(N)cc(N[C@H](C)c2nncn2C)n1	ZINC000132508175	1175793338	/nfs/dbraw/zinc/79/33/38/1175793338.db2.gz	CVYZVWAQPXGZFX-ZCFIWIBFSA-N	1	0	265.346	1.082	50	0		CDAARO
Oc1ccc(CC[N@@H+]2C[C@@H](Cc3cnccn3)[C@H](O)C2)cc1	ZINC001704301217	1177680140	/nfs/dbraw/zinc/68/01/40/1177680140.db2.gz	PGJIAVSHOJNCHY-RHSMWYFYSA-N	1	0	299.374	1.260	50	0		CDAARO
OCCC[N@H+]1C[C@@H](Cc2ccc3ccccc3n2)[C@H](O)C1	ZINC001704299373	1177680992	/nfs/dbraw/zinc/68/09/92/1177680992.db2.gz	OYNVJGULIKRQLQ-RHSMWYFYSA-N	1	0	286.375	1.452	50	0		CDAARO
Cc1ncsc1CCNc1cc(C[NH3+])nc(C)n1	ZINC000067841264	755451105	/nfs/dbraw/zinc/45/11/05/755451105.db2.gz	XICHCDNCQWQBNA-UHFFFAOYSA-N	1	0	263.370	1.663	50	0		CDAARO
O=S1(=O)CC[C@H]([NH2+]Cc2ccccc2C(F)(F)F)C1	ZINC000019899711	755699592	/nfs/dbraw/zinc/69/95/92/755699592.db2.gz	WIPXKGCPOJGKFB-JTQLQIEISA-N	1	0	293.310	1.982	50	0		CDAARO
Cn1ncc2c1nc(C1CCCC1)nc2N1CC([NH3+])C1	ZINC000072163042	755860560	/nfs/dbraw/zinc/86/05/60/755860560.db2.gz	DJUMWIAVRXNFBJ-UHFFFAOYSA-N	1	0	272.356	1.168	50	0		CDAARO
c1ccc(N2CCN([C@@H]3C[NH+]4CCC3CC4)CC2)cc1	ZINC000022454660	756815469	/nfs/dbraw/zinc/81/54/69/756815469.db2.gz	YSSWNPOYPNFUGE-QGZVFWFLSA-N	1	0	271.408	1.903	50	0		CDAARO
COCCn1cncc1C[N@@H+]1CCC[C@H](c2ncc[nH]2)C1	ZINC000299794854	758041605	/nfs/dbraw/zinc/04/16/05/758041605.db2.gz	JAMMEUMSNGAXLZ-ZDUSSCGKSA-N	1	0	289.383	1.632	50	0		CDAARO
Cc1nc(CC[NH3+])cc(N2CC[C@@](O)(c3ccccc3)C2)n1	ZINC000067785090	758341812	/nfs/dbraw/zinc/34/18/12/758341812.db2.gz	IOYQAKSFNVYHJE-KRWDZBQOSA-N	1	0	298.390	1.384	50	0		CDAARO
CC(C)(C)CN1CC[N@H+](CC2CC2)[C@@H](CCO)C1	ZINC000032590476	912990565	/nfs/dbraw/zinc/99/05/65/912990565.db2.gz	HDMYBNFBNLSKNI-AWEZNQCLSA-N	1	0	254.418	1.811	50	0		CDAARO
CCC(=O)N1CC([N@@H+](Cc2ccncc2)CC2CC2)C1	ZINC000581776282	899628322	/nfs/dbraw/zinc/62/83/22/899628322.db2.gz	OJEKBNYRVHQFTH-UHFFFAOYSA-N	1	0	273.380	1.914	50	0		CDAARO
COc1cc(NC(=O)CCC[NH+](C)C)ccc1O	ZINC000952860341	910413087	/nfs/dbraw/zinc/41/30/87/910413087.db2.gz	MTFXMICNLXBFCY-UHFFFAOYSA-N	1	0	252.314	1.681	50	0		CDAARO
CN(CCC(N)=O)C(=O)C1([NH+]2CCCCC2)CCCCC1	ZINC000952864856	910459771	/nfs/dbraw/zinc/45/97/71/910459771.db2.gz	MWEAJUIFEVMAGS-UHFFFAOYSA-N	1	0	295.427	1.509	50	0		CDAARO
C[C@H](Cn1ccnc1)[N@@H+]1CCCN(C(=O)C2CCC2)CC1	ZINC000821751104	925595781	/nfs/dbraw/zinc/59/57/81/925595781.db2.gz	FWFJNARUBLFHQD-CQSZACIVSA-N	1	0	290.411	1.606	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](NC(=O)c2cnc(N)s2)C1	ZINC000822922724	925656409	/nfs/dbraw/zinc/65/64/09/925656409.db2.gz	MUIHZJNGWCMXCN-VIFPVBQESA-N	1	0	268.386	1.330	50	0		CDAARO
CNC(=O)C[C@@H]1CC[N@H+](Cc2ccc(Cl)o2)C1	ZINC000823820869	925731924	/nfs/dbraw/zinc/73/19/24/925731924.db2.gz	CBADEUFNYOHQAS-VIFPVBQESA-N	1	0	256.733	1.891	50	0		CDAARO
C[C@@H](C[NH+]1CCCC1)C(=O)N(C)CCn1ccnc1	ZINC000827627207	925951076	/nfs/dbraw/zinc/95/10/76/925951076.db2.gz	QOQWQWVMIPUCMR-ZDUSSCGKSA-N	1	0	264.373	1.073	50	0		CDAARO
Cc1cnccc1CNC(=O)C[NH+]1CCCCCC1	ZINC000827832251	925974553	/nfs/dbraw/zinc/97/45/53/925974553.db2.gz	DMKQWJSQLYPQIR-UHFFFAOYSA-N	1	0	261.369	1.882	50	0		CDAARO
C[NH+](C)[C@@H]1CN(Cc2ccc3cc[nH]c3c2)CC[C@@H]1CO	ZINC000581799043	927199377	/nfs/dbraw/zinc/19/93/77/927199377.db2.gz	HPIBSBFCRAPMRO-NVXWUHKLSA-N	1	0	287.407	1.912	50	0		CDAARO
Cc1ccc(OCC[N@@H+]2CC[C@@H](O)[C@@H](CO)C2)c(C)c1	ZINC001529153760	968998094	/nfs/dbraw/zinc/99/80/94/968998094.db2.gz	VAKHUIONFUVZRO-HUUCEWRRSA-N	1	0	279.380	1.357	50	0		CDAARO
CC(=O)N1CCC[N@@H+](C2CSCCSC2)CC1	ZINC001506398794	975149063	/nfs/dbraw/zinc/14/90/63/975149063.db2.gz	FRSKSUIFJUYJKJ-UHFFFAOYSA-N	1	0	274.455	1.389	50	0		CDAARO
Cc1nncn1CC[N@H+]1CCC[C@@](CO)(CC(C)C)C1	ZINC001506418297	975157431	/nfs/dbraw/zinc/15/74/31/975157431.db2.gz	RWQZJUZWQAOTIM-OAHLLOKOSA-N	1	0	280.416	1.707	50	0		CDAARO
CCS(=O)(=O)N1CC[C@H](C)[N@H+](Cc2ccccc2)CC1	ZINC000098014184	230390909	/nfs/dbraw/zinc/39/09/09/230390909.db2.gz	IOCLUNDYWLGUSC-AWEZNQCLSA-N	1	0	296.436	1.933	50	0		CDAARO
C[C@@H](NC(=O)c1ccncc1F)C(C)(C)C[NH+](C)C	ZINC000096449600	230375568	/nfs/dbraw/zinc/37/55/68/230375568.db2.gz	NCCPGHUQGGJCRF-SNVBAGLBSA-N	1	0	267.348	1.927	50	0		CDAARO
O=C(NC[C@H]1C[N@@H+]2CCC[C@H]2CO1)Nc1cccnc1	ZINC000107319684	398138784	/nfs/dbraw/zinc/13/87/84/398138784.db2.gz	AWIRCKFDCISURP-STQMWFEESA-N	1	0	276.340	1.066	50	0		CDAARO
Cc1nc(C)c(CN2CC3(CC[NH2+]CC3)OC2=O)s1	ZINC000095521506	185002804	/nfs/dbraw/zinc/00/28/04/185002804.db2.gz	MMDHAOPFTWINLX-UHFFFAOYSA-N	1	0	281.381	1.834	50	0		CDAARO
C[C@H]1C[C@@H]([NH3+])CCN1C(=O)Cc1cccc(F)c1	ZINC000124794995	230394611	/nfs/dbraw/zinc/39/46/11/230394611.db2.gz	KUPIMUMTGLKBIB-GWCFXTLKSA-N	1	0	250.317	1.706	50	0		CDAARO
COc1ccc2[nH]c(CN[C@H](C)CS(C)(=O)=O)nc2c1	ZINC000584903868	341993965	/nfs/dbraw/zinc/99/39/65/341993965.db2.gz	NWEOFILGEGTEAP-SECBINFHSA-N	1	0	297.380	1.094	50	0		CDAARO
COC(=O)[C@H](C)C[C@H](C)[NH2+]Cc1ccnc(OC)c1	ZINC000095940676	185036461	/nfs/dbraw/zinc/03/64/61/185036461.db2.gz	WPIOERJJJLZOLQ-MNOVXSKESA-N	1	0	266.341	1.768	50	0		CDAARO
CC1CC[NH+](C[C@@H](O)Cn2cc(-n3cccc3)cn2)CC1	ZINC000095974788	185049913	/nfs/dbraw/zinc/04/99/13/185049913.db2.gz	ISGNNYMQKONTOA-MRXNPFEDSA-N	1	0	288.395	1.767	50	0		CDAARO
CN(C(=O)c1ccc(-n2cccn2)c(F)c1)[C@H]1CC[NH2+]C1	ZINC000179103106	398220944	/nfs/dbraw/zinc/22/09/44/398220944.db2.gz	AGTDKHCPGURXAX-LBPRGKRZSA-N	1	0	288.326	1.445	50	0		CDAARO
Cc1ccc(=O)n(CC[N@@H+](C)Cc2ccc(F)cc2)n1	ZINC000187397288	342090265	/nfs/dbraw/zinc/09/02/65/342090265.db2.gz	DNENJKTWECTZTE-UHFFFAOYSA-N	1	0	275.327	1.823	50	0		CDAARO
C[NH+](C)CCCOc1ccc(-c2cnc(N)cn2)cn1	ZINC000096140445	185105992	/nfs/dbraw/zinc/10/59/92/185105992.db2.gz	UCEQJKGQGZSYPP-UHFFFAOYSA-N	1	0	273.340	1.451	50	0		CDAARO
CC[N@@H+]1CC[C@H](N(C)C(=O)CNc2ccccc2)C1	ZINC000195543811	342626595	/nfs/dbraw/zinc/62/65/95/342626595.db2.gz	BOSYMBQFEBDRIW-AWEZNQCLSA-N	1	0	261.369	1.651	50	0		CDAARO
CCn1cc(CN(C)c2cc([C@H]3C[C@H]([NH3+])C3)ncn2)cn1	ZINC000244708255	361858298	/nfs/dbraw/zinc/85/82/98/361858298.db2.gz	KQDCZEMCYUFGRR-JOCQHMNTSA-N	1	0	286.383	1.534	50	0		CDAARO
Cc1cccnc1CN(C)C(=O)CC[NH+]1CCCC1	ZINC000244734689	361860165	/nfs/dbraw/zinc/86/01/65/361860165.db2.gz	NKEBCTGWBUJADO-UHFFFAOYSA-N	1	0	261.369	1.834	50	0		CDAARO
c1cnn(CCC2CC[NH+](CCc3cn[nH]c3)CC2)c1	ZINC000244899833	361868751	/nfs/dbraw/zinc/86/87/51/361868751.db2.gz	ZRFOFTWQIHCTTL-UHFFFAOYSA-N	1	0	273.384	1.951	50	0		CDAARO
O=C(NCCSCC1CC1)[C@@H]1Cc2ccccc2C[NH2+]1	ZINC000097228764	342204790	/nfs/dbraw/zinc/20/47/90/342204790.db2.gz	QCCWSCVCOIQACM-HNNXBMFYSA-N	1	0	290.432	1.960	50	0		CDAARO
C[C@H](Cc1ccc(F)cc1)NC(=O)C[NH2+]C[C@@H]1CCCO1	ZINC000097229052	342204839	/nfs/dbraw/zinc/20/48/39/342204839.db2.gz	GRUWFDVRQOFPOO-DOMZBBRYSA-N	1	0	294.370	1.642	50	0		CDAARO
CCc1nn(C)cc1C[N@@H+]1CCC[C@H](N2CCCC2=O)C1	ZINC000097033937	185156677	/nfs/dbraw/zinc/15/66/77/185156677.db2.gz	IUZXHVJNMROAIB-AWEZNQCLSA-N	1	0	290.411	1.569	50	0		CDAARO
CCCS(=O)(=O)N1C[C@H]2[C@H](C1)C[N@@H+]1CCCC[C@@H]21	ZINC000249695590	539069306	/nfs/dbraw/zinc/06/93/06/539069306.db2.gz	RFNYQIDRRWCEMC-AVGNSLFASA-N	1	0	272.414	1.142	50	0		CDAARO
CC(C)N1C(=O)N[C@@]2(CC[N@H+](CC3CCC3)C2)C1=O	ZINC000084597327	342265292	/nfs/dbraw/zinc/26/52/92/342265292.db2.gz	YISRXVVNELLTFS-CQSZACIVSA-N	1	0	265.357	1.191	50	0		CDAARO
CCn1c2ccccc2nc1NCc1nccn1C	ZINC000584908598	539102155	/nfs/dbraw/zinc/10/21/55/539102155.db2.gz	OTWJBHMDXLNCAD-UHFFFAOYSA-N	1	0	255.325	1.824	50	0		CDAARO
COc1ccc(C[N@H+](CCO)C2CCCCC2)nn1	ZINC000283219971	362206122	/nfs/dbraw/zinc/20/61/22/362206122.db2.gz	SRIBIGCLARYSMC-UHFFFAOYSA-N	1	0	265.357	1.612	50	0		CDAARO
CC(C)(C)C(=O)NCCNC(=O)CC1C[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000178481855	362243591	/nfs/dbraw/zinc/24/35/91/362243591.db2.gz	SWMKGCQMEQIAHT-YHWZYXNKSA-N	1	0	295.427	1.186	50	0		CDAARO
C[C@H]1C[NH+](CCCCNC(=O)c2ccn[nH]2)C[C@H](C)O1	ZINC000084706189	362273042	/nfs/dbraw/zinc/27/30/42/362273042.db2.gz	IVQKBGMYEMEXRC-RYUDHWBXSA-N	1	0	280.372	1.029	50	0		CDAARO
C[C@H]1C[NH+](CCCCNC(=O)c2ccc[nH]2)C[C@H](C)O1	ZINC000084706214	362273402	/nfs/dbraw/zinc/27/34/02/362273402.db2.gz	MREYJXGIKIZAGY-STQMWFEESA-N	1	0	279.384	1.634	50	0		CDAARO
CN(Cc1ccc2nonc2c1)C(=O)[C@@H]1CCCC[N@@H+]1C	ZINC000097088022	185526778	/nfs/dbraw/zinc/52/67/78/185526778.db2.gz	OAJMBSXTMFSNFF-AWEZNQCLSA-N	1	0	288.351	1.666	50	0		CDAARO
COC(=O)C[C@@]1(C(=O)OC)CC[N@H+](Cc2ccccc2)C1	ZINC000398595429	345573158	/nfs/dbraw/zinc/57/31/58/345573158.db2.gz	RWDLITXDVOCOBQ-INIZCTEOSA-N	1	0	291.347	1.615	50	0		CDAARO
C[N@@H+]1CC[C@H](Oc2ncc(Br)cn2)C1	ZINC000306822623	362784166	/nfs/dbraw/zinc/78/41/66/362784166.db2.gz	NNBYFHZJBJTLNA-QMMMGPOBSA-N	1	0	258.119	1.322	50	0		CDAARO
CCCC12CN3CC(C)(CN(C1)C31CC[NH+](C)CC1)C2=O	ZINC000019331103	282629488	/nfs/dbraw/zinc/62/94/88/282629488.db2.gz	UPPVZNYYCGQEFN-UHFFFAOYSA-N	1	0	291.439	1.415	50	0		CDAARO
COCCn1cncc1C[NH2+]C1Cc2ccccc2C1	ZINC000584889516	349348048	/nfs/dbraw/zinc/34/80/48/349348048.db2.gz	LGVGFXXMJOYYGX-UHFFFAOYSA-N	1	0	271.364	1.787	50	0		CDAARO
C[NH+](C)CC[C@@H](NC(=O)NC(C)(C)CO)c1ccccc1	ZINC000584889754	349348849	/nfs/dbraw/zinc/34/88/49/349348849.db2.gz	WRTMKTSPWAXRGP-CQSZACIVSA-N	1	0	293.411	1.750	50	0		CDAARO
Cc1cc(C)n(CCCC(=O)N(C)C[C@@H]2CC[N@H+](C)C2)n1	ZINC000584890837	349349374	/nfs/dbraw/zinc/34/93/74/349349374.db2.gz	RWKDGVIOFKBNFN-OAHLLOKOSA-N	1	0	292.427	1.690	50	0		CDAARO
C[NH+](C)[C@@H]1CCC[C@H]1NC(=O)c1ccc(O)c(F)c1	ZINC000584899376	349361447	/nfs/dbraw/zinc/36/14/47/349361447.db2.gz	IYDQBNPQMAIVEL-VXGBXAGGSA-N	1	0	266.316	1.744	50	0		CDAARO
CC(C)=CC[N@@H+]1CCN(Cc2ccncc2)C[C@H]1CCO	ZINC000104440021	186002858	/nfs/dbraw/zinc/00/28/58/186002858.db2.gz	IEIVYTIMQVWUQC-QGZVFWFLSA-N	1	0	289.423	1.916	50	0		CDAARO
Cc1cc(NCCc2nc(C)c3c(n2)CCCC3)nc(N)[nH+]1	ZINC000091586749	180200719	/nfs/dbraw/zinc/20/07/19/180200719.db2.gz	JXGKHMYDXBGBBC-UHFFFAOYSA-N	1	0	298.394	1.999	50	0		CDAARO
CCC[N@@H+]1C[C@H]2CC[C@@H]1CN(C(=O)c1ccon1)C2	ZINC000091643308	180213846	/nfs/dbraw/zinc/21/38/46/180213846.db2.gz	VMFGTPLNXBANSY-VXGBXAGGSA-N	1	0	263.341	1.621	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1NCCSc1nncn1C	ZINC000091643972	180213969	/nfs/dbraw/zinc/21/39/69/180213969.db2.gz	UJWZXAXRKLTNDF-UHFFFAOYSA-N	1	0	293.400	1.262	50	0		CDAARO
CN1CCO[C@H](C[NH2+]Cc2ccc(F)c(F)c2)C1	ZINC000105472305	186059291	/nfs/dbraw/zinc/05/92/91/186059291.db2.gz	UJOOXNQJNIKGRA-LLVKDONJSA-N	1	0	256.296	1.385	50	0		CDAARO
Cc1ncnc(NCCCN2CC[NH+](C)CC2)c1C	ZINC000091872124	180277950	/nfs/dbraw/zinc/27/79/50/180277950.db2.gz	UVZYIOBLTJFBMO-UHFFFAOYSA-N	1	0	263.389	1.143	50	0		CDAARO
C[C@@H]1C[N@H+](C[C@@H](O)COCc2ccccc2)[C@@H](C)CO1	ZINC000107331055	186170752	/nfs/dbraw/zinc/17/07/52/186170752.db2.gz	WOHMRMXPSQKRFD-SQWLQELKSA-N	1	0	279.380	1.673	50	0		CDAARO
Cc1cc(O)cc(C(=O)NC[C@H]2C[N@@H+]3CCC[C@H]3CO2)c1	ZINC000107138623	186160361	/nfs/dbraw/zinc/16/03/61/186160361.db2.gz	VIKNQNSMFXMCOY-ZFWWWQNUSA-N	1	0	290.363	1.294	50	0		CDAARO
Cc1ccc2nc(CN3CC[N@@H+](C)C[C@H]3C)cc(=O)n2c1	ZINC000107581062	186180567	/nfs/dbraw/zinc/18/05/67/186180567.db2.gz	SDIPSFMRZZZOMM-CYBMUJFWSA-N	1	0	286.379	1.139	50	0		CDAARO
CCN(C(=O)CSc1nc(N)cc(N)[nH+]1)C1=CCCC1	ZINC000012632729	366222915	/nfs/dbraw/zinc/22/29/15/366222915.db2.gz	ZUGBBNVXPPQWOU-UHFFFAOYSA-N	1	0	293.396	1.649	50	0		CDAARO
NC(=O)C1CC[NH+](C[C@@H](O)CSc2ccccc2)CC1	ZINC000000119051	355888494	/nfs/dbraw/zinc/88/84/94/355888494.db2.gz	YSMQPPNUHYMINC-CYBMUJFWSA-N	1	0	294.420	1.337	50	0		CDAARO
C[C@H](CNC(=O)[C@@H](C)Oc1ccccc1)C[NH+](C)C	ZINC000002881515	355986698	/nfs/dbraw/zinc/98/66/98/355986698.db2.gz	POVREMZLKFLXJK-CHWSQXEVSA-N	1	0	264.369	1.768	50	0		CDAARO
Cc1nc(N2CC[NH+](C)CC2)[nH]c(=O)c1CCC(C)C	ZINC000009196343	356206194	/nfs/dbraw/zinc/20/61/94/356206194.db2.gz	ZAGFWHSCVBWIIQ-UHFFFAOYSA-N	1	0	278.400	1.419	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCCN(Cc2ccc(F)c(F)c2)C1=O	ZINC000012031634	356286598	/nfs/dbraw/zinc/28/65/98/356286598.db2.gz	ZPSPJBPNECTHMD-HNNXBMFYSA-N	1	0	298.333	1.380	50	0		CDAARO
O=C1N(Cc2ccc(F)cc2)CCC[C@]1(O)C[NH2+]C1CC1	ZINC000012592921	356310464	/nfs/dbraw/zinc/31/04/64/356310464.db2.gz	QLKLEGCSOGXXER-INIZCTEOSA-N	1	0	292.354	1.431	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC[C@H]2CCC[NH2+]C2)cc1	ZINC000019393595	356483798	/nfs/dbraw/zinc/48/37/98/356483798.db2.gz	GBCVMVUEBVZOSD-LBPRGKRZSA-N	1	0	268.382	1.273	50	0		CDAARO
CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1[NH3+]	ZINC000072187476	538428677	/nfs/dbraw/zinc/42/86/77/538428677.db2.gz	ORRVKLSXTZZGJV-VHSXEESVSA-N	1	0	272.345	1.134	50	0		CDAARO
CC(C)=CC[N@@H+]1CCN(Cc2cccnc2)C[C@@H]1CCO	ZINC000019227990	356477642	/nfs/dbraw/zinc/47/76/42/356477642.db2.gz	GJAVRJRMWUNXKF-KRWDZBQOSA-N	1	0	289.423	1.916	50	0		CDAARO
Cc1cccc(Cl)c1OCCOCCNCC[NH3+]	ZINC000019772346	356501199	/nfs/dbraw/zinc/50/11/99/356501199.db2.gz	VMKIQZDPNIOOLO-UHFFFAOYSA-N	1	0	272.776	1.592	50	0		CDAARO
NS(=O)(=O)c1ccc(CC[NH2+]Cc2ccco2)cc1	ZINC000020051633	356523989	/nfs/dbraw/zinc/52/39/89/356523989.db2.gz	KPMDAPSHUTZFMM-UHFFFAOYSA-N	1	0	280.349	1.259	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)c2cc(OC)cs2)C1	ZINC000128860919	538442679	/nfs/dbraw/zinc/44/26/79/538442679.db2.gz	CMRFRTIXFNFPQN-VIFPVBQESA-N	1	0	254.355	1.581	50	0		CDAARO
O=C(NCC1(C(F)(F)F)CC[NH2+]CC1)C1CC1	ZINC000725264677	538455669	/nfs/dbraw/zinc/45/56/69/538455669.db2.gz	GTEQLILTNRXRQY-UHFFFAOYSA-N	1	0	250.264	1.445	50	0		CDAARO
COC(=O)c1ccc(C[N@@H+]2CCC[C@H](CO)C2)cc1	ZINC000023280674	356639263	/nfs/dbraw/zinc/63/92/63/356639263.db2.gz	HLIDJWDAXLUQKV-ZDUSSCGKSA-N	1	0	263.337	1.678	50	0		CDAARO
C[C@@H]1CCCC[C@H]1NC(=O)CN1CCC2(CC1)OCCO2	ZINC000026933595	356701156	/nfs/dbraw/zinc/70/11/56/356701156.db2.gz	MPKVAKHQQUZQHR-ZIAGYGMSSA-N	1	0	296.411	1.520	50	0		CDAARO
C[NH+](C)[C@@H](Cc1ccccc1)C(=O)NCC1(CO)CCC1	ZINC000183272276	356820546	/nfs/dbraw/zinc/82/05/46/356820546.db2.gz	MIQDZYIOOYJPJJ-HNNXBMFYSA-N	1	0	290.407	1.438	50	0		CDAARO
Cn1cc(CN2CC[N@H+](C)[C@H](CCO)C2)c2ccccc21	ZINC000036379409	356872887	/nfs/dbraw/zinc/87/28/87/356872887.db2.gz	YDAZIVCXKDZRRN-OAHLLOKOSA-N	1	0	287.407	1.677	50	0		CDAARO
Cn1cnnc1-c1ccc(NC(=O)[C@H]2CC[C@@H]([NH3+])C2)cc1	ZINC000072421867	356930353	/nfs/dbraw/zinc/93/03/53/356930353.db2.gz	HQUAMRVPQNKLDB-NWDGAFQWSA-N	1	0	285.351	1.548	50	0		CDAARO
[NH3+]CC(=O)Nc1ccc(NC(=O)c2ccco2)cc1	ZINC000040856765	357010795	/nfs/dbraw/zinc/01/07/95/357010795.db2.gz	FUFPLQGIUFSDNN-UHFFFAOYSA-N	1	0	259.265	1.429	50	0		CDAARO
Cn1cc(CC[NH2+][C@H](CO)c2c(F)cccc2F)cn1	ZINC000272959779	363574190	/nfs/dbraw/zinc/57/41/90/363574190.db2.gz	ANCTUNYSMGUCQD-CYBMUJFWSA-N	1	0	281.306	1.564	50	0		CDAARO
[NH2+]=C(NC(=S)Nc1ccccc1)N1CCOCC1	ZINC000000085403	357192984	/nfs/dbraw/zinc/19/29/84/357192984.db2.gz	PYSKTZUZFVTLGK-UHFFFAOYSA-N	1	0	264.354	1.240	50	0		CDAARO
CCOc1ncccc1C(=O)NC[C@@H]1CCC[N@@H+]1CC	ZINC000058160889	357380711	/nfs/dbraw/zinc/38/07/11/357380711.db2.gz	XDJOYFIBJSNQOP-LBPRGKRZSA-N	1	0	277.368	1.694	50	0		CDAARO
CCOC[C@H](O)C[NH2+][C@@]1(CO)C[C@H](C)CC(C)(C)C1	ZINC000095432071	357513566	/nfs/dbraw/zinc/51/35/66/357513566.db2.gz	ANXDBOQKBDETAP-NFAWXSAZSA-N	1	0	273.417	1.551	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1cccc(F)c1F	ZINC000095432143	357516435	/nfs/dbraw/zinc/51/64/35/357516435.db2.gz	BVJQIQWPZZQGKN-QMMMGPOBSA-N	1	0	278.324	1.371	50	0		CDAARO
COc1ncccc1-c1ccc(CN2CC[NH+](C)CC2)cn1	ZINC000065370554	357532362	/nfs/dbraw/zinc/53/23/62/357532362.db2.gz	KCMMQGAYKWNMDI-UHFFFAOYSA-N	1	0	298.390	1.900	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N(C)C[C@H]2CCCO2)c1C	ZINC000065394759	357535632	/nfs/dbraw/zinc/53/56/32/357535632.db2.gz	QKZGAERPTXFBBC-GFCCVEGCSA-N	1	0	264.373	1.775	50	0		CDAARO
O=C1CC2(CN1)CC[NH+](CCOCc1ccccc1)CC2	ZINC000065397587	357536441	/nfs/dbraw/zinc/53/64/41/357536441.db2.gz	FPHNRMHWAIBSST-UHFFFAOYSA-N	1	0	288.391	1.805	50	0		CDAARO
C[NH2+]CCc1noc(COc2ccccc2F)n1	ZINC000066323478	357562129	/nfs/dbraw/zinc/56/21/29/357562129.db2.gz	QSMDQWNPTTUVSM-UHFFFAOYSA-N	1	0	251.261	1.550	50	0		CDAARO
Cc1ccc2[nH]cc(C[N@@H+]3C[C@H](N(C)C)C[C@H]3CO)c2c1	ZINC000067755436	357624655	/nfs/dbraw/zinc/62/46/55/357624655.db2.gz	KADKCDYSMISSGU-CABCVRRESA-N	1	0	287.407	1.973	50	0		CDAARO
Cc1cnc(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@@H+]3C)cn1	ZINC000067758457	357625164	/nfs/dbraw/zinc/62/51/64/357625164.db2.gz	DMZSEIRVUZWGQT-NWDGAFQWSA-N	1	0	260.341	1.094	50	0		CDAARO
Cc1ccc(CC(=O)NCC[N@@H+]2CCCC[C@H]2CO)cc1	ZINC000067540871	357611782	/nfs/dbraw/zinc/61/17/82/357611782.db2.gz	LUPXBIGULNWEFZ-INIZCTEOSA-N	1	0	290.407	1.501	50	0		CDAARO
C[C@H]1CNC(=O)CC[N@@H+]1Cc1ccccc1Cn1cccn1	ZINC000067675596	357617553	/nfs/dbraw/zinc/61/75/53/357617553.db2.gz	FRCNIMOTGJYDQM-AWEZNQCLSA-N	1	0	298.390	1.642	50	0		CDAARO
CNC(=O)[C@@H](C)N(C)Cc1cccc(C(=O)OC)c1	ZINC000067695042	357618642	/nfs/dbraw/zinc/61/86/42/357618642.db2.gz	WFDKSWJIMSMCNP-SNVBAGLBSA-N	1	0	264.325	1.040	50	0		CDAARO
CCCC(=O)N1CCC([NH2+][C@@H]2CC(=O)N(CCC)C2)CC1	ZINC000067695450	357619245	/nfs/dbraw/zinc/61/92/45/357619245.db2.gz	WCWJOWGSRCJCGL-CQSZACIVSA-N	1	0	295.427	1.378	50	0		CDAARO
C[C@@H](Oc1ccccc1Cl)C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188448104	357686512	/nfs/dbraw/zinc/68/65/12/357686512.db2.gz	XIEFHKLFFULDAW-GHMZBOCLSA-N	1	0	282.771	1.928	50	0		CDAARO
CNC(=O)C(C)(C)[N@H+](C)C[C@@H]1CCOC(C)(C)C1	ZINC000065490926	283281911	/nfs/dbraw/zinc/28/19/11/283281911.db2.gz	HKCQMBNVNZNBIP-LLVKDONJSA-N	1	0	256.390	1.648	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1CCNc1ccc2cc[nH]c2n1	ZINC000072430779	357834991	/nfs/dbraw/zinc/83/49/91/357834991.db2.gz	YNEMGRGMQANMLI-CYBMUJFWSA-N	1	0	274.368	1.822	50	0		CDAARO
COC(=O)[C@H]1[C@@H](O)CCCN1Cc1ccc(F)c(C)c1	ZINC000188781477	357888443	/nfs/dbraw/zinc/88/84/43/357888443.db2.gz	QRESKCTYKULCBG-UONOGXRCSA-N	1	0	281.327	1.632	50	0		CDAARO
Cc1ccc(S(=O)(=O)C[C@@H](C)[NH2+]C2CCOCC2)cc1	ZINC000097113258	357983017	/nfs/dbraw/zinc/98/30/17/357983017.db2.gz	UIBCDMHUMATMGQ-CYBMUJFWSA-N	1	0	297.420	1.926	50	0		CDAARO
CCN(CC)C(=O)C[N@@H+]1CCC[C@H](c2nccn2C)C1	ZINC000082119926	358147960	/nfs/dbraw/zinc/14/79/60/358147960.db2.gz	AJTFYJNTEYBBMA-ZDUSSCGKSA-N	1	0	278.400	1.468	50	0		CDAARO
CC(C)c1cc(C(=O)NCC[NH+]2CCCC2)no1	ZINC000082157237	358149407	/nfs/dbraw/zinc/14/94/07/358149407.db2.gz	VMORMDVDBPWDKX-UHFFFAOYSA-N	1	0	251.330	1.624	50	0		CDAARO
C[NH+](C)[C@H]1CCCCN(C(=O)c2ccc3nonc3c2)C1	ZINC000082156826	358149514	/nfs/dbraw/zinc/14/95/14/358149514.db2.gz	QLMMLTNVNIBPPW-LBPRGKRZSA-N	1	0	288.351	1.779	50	0		CDAARO
CCN1CCC[C@@H]1C[NH2+]CC(=O)NC1CCCCC1	ZINC000020054454	358319718	/nfs/dbraw/zinc/31/97/18/358319718.db2.gz	CFOKNTFHPVLPGY-CQSZACIVSA-N	1	0	267.417	1.509	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1C(=O)/C=C\c1cscn1	ZINC000098055832	358342589	/nfs/dbraw/zinc/34/25/89/358342589.db2.gz	LJTHYDJLQYLIET-XOULXFPDSA-N	1	0	251.355	1.319	50	0		CDAARO
OCC[NH+](CCO)CCc1cc(Cl)cc(Cl)c1	ZINC000194476205	358518526	/nfs/dbraw/zinc/51/85/26/358518526.db2.gz	AKYLWLOKNHVYEG-UHFFFAOYSA-N	1	0	278.179	1.823	50	0		CDAARO
CC[C@H](C)[C@H]([NH3+])C(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1	ZINC000195554602	358557581	/nfs/dbraw/zinc/55/75/81/358557581.db2.gz	UUIVQKHBAVRWQA-XRGAULLZSA-N	1	0	293.455	1.835	50	0		CDAARO
c1c([C@@H]2CCC[NH2+]C2)nnn1CCNc1ccccc1	ZINC000095368119	358686655	/nfs/dbraw/zinc/68/66/55/358686655.db2.gz	XFGXRXICZHPGEJ-CYBMUJFWSA-N	1	0	271.368	1.857	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1Cn1c(=O)cnc2ccccc21	ZINC000095385130	358691241	/nfs/dbraw/zinc/69/12/41/358691241.db2.gz	SIDUAHDJXPNJNS-LBPRGKRZSA-N	1	0	257.337	1.881	50	0		CDAARO
CN(C)[C@@H](C(=O)NCC[NH+]1CCCC1)c1ccc(F)cc1	ZINC000095389047	358692345	/nfs/dbraw/zinc/69/23/45/358692345.db2.gz	RRHJGZUDBTVBEP-OAHLLOKOSA-N	1	0	293.386	1.640	50	0		CDAARO
Cn1nccc1CC[NH2+]C1CCN(c2ncccn2)CC1	ZINC000095496988	358694992	/nfs/dbraw/zinc/69/49/92/358694992.db2.gz	XPAYXEZIKWJPBP-UHFFFAOYSA-N	1	0	286.383	1.011	50	0		CDAARO
CNC(=O)[C@H]1CCCC[N@@H+]1Cc1cccc2nonc21	ZINC000097463564	358778412	/nfs/dbraw/zinc/77/84/12/358778412.db2.gz	QTSDYTXMCZYDFR-GFCCVEGCSA-N	1	0	274.324	1.323	50	0		CDAARO
CNc1ncccc1C(=O)N1CC([N@@H+]2CCCC[C@H]2C)C1	ZINC000097717299	358794819	/nfs/dbraw/zinc/79/48/19/358794819.db2.gz	UULWWSXCJBQKET-GFCCVEGCSA-N	1	0	288.395	1.822	50	0		CDAARO
O=C(CCCc1cn[nH]c1)N1CCN(c2cc[nH+]cc2)CC1	ZINC000097742803	358795189	/nfs/dbraw/zinc/79/51/89/358795189.db2.gz	LMAXBNWKHBRICK-UHFFFAOYSA-N	1	0	299.378	1.476	50	0		CDAARO
COC(=O)CC1(NCc2nc(C)cs2)CC[NH+](C)CC1	ZINC000088744160	366495443	/nfs/dbraw/zinc/49/54/43/366495443.db2.gz	PMFCLOXUFCVKRL-UHFFFAOYSA-N	1	0	297.424	1.569	50	0		CDAARO
CC(C)(Cc1ccc(O)cc1)NC(=O)C[C@@H]1CC[NH2+]C1	ZINC000215748885	358901289	/nfs/dbraw/zinc/90/12/89/358901289.db2.gz	KDHAHIKRPLRLPB-ZDUSSCGKSA-N	1	0	276.380	1.829	50	0		CDAARO
CO[C@@H]1CCCC[C@H]1[NH+]1CCN(C(=O)c2ccco2)CC1	ZINC000000759069	359007709	/nfs/dbraw/zinc/00/77/09/359007709.db2.gz	HRVLJQXAERGABT-ZIAGYGMSSA-N	1	0	292.379	1.995	50	0		CDAARO
COc1cc(CN2CCC[N@H+](C)CC2)cc(OC)c1O	ZINC000022027587	359014321	/nfs/dbraw/zinc/01/43/21/359014321.db2.gz	YQEJHYJKQGHPIO-UHFFFAOYSA-N	1	0	280.368	1.547	50	0		CDAARO
c1ncnc(NCC2([NH+]3CCOCC3)CCCCCC2)n1	ZINC000222363334	359337346	/nfs/dbraw/zinc/33/73/46/359337346.db2.gz	ZGICDLOQJHOTGY-UHFFFAOYSA-N	1	0	291.399	1.709	50	0		CDAARO
Cc1nccn1[C@@H](C)C(=O)NCCC12CCC[NH+]1CCC2	ZINC000222921107	359384051	/nfs/dbraw/zinc/38/40/51/359384051.db2.gz	UNSATGCQLGHBSW-ZDUSSCGKSA-N	1	0	290.411	1.887	50	0		CDAARO
C[C@@]1(O)CCOC2(CC[NH+](Cc3ccc[nH]3)CC2)C1	ZINC000257191578	359585924	/nfs/dbraw/zinc/58/59/24/359585924.db2.gz	QREMXWRODWSOJT-CQSZACIVSA-N	1	0	264.369	1.911	50	0		CDAARO
Cc1cccc(C[N@@H+]2CCCOCCNC(=O)CC2)c1	ZINC000257191691	359586443	/nfs/dbraw/zinc/58/64/43/359586443.db2.gz	PYJJADIOWOSRRX-UHFFFAOYSA-N	1	0	276.380	1.724	50	0		CDAARO
CN(Cc1cn2c(n1)CCCC2)C[C@@H]1CCC[NH2+]C1	ZINC000261966942	359591430	/nfs/dbraw/zinc/59/14/30/359591430.db2.gz	PZBQJXUIEWJRLH-CYBMUJFWSA-N	1	0	262.401	1.651	50	0		CDAARO
CC[NH+](CC)CCn1c2ccccc2c2nnc(=NN)[nH]c21	ZINC000000530405	366535875	/nfs/dbraw/zinc/53/58/75/366535875.db2.gz	UNSHOJAQTQULGG-UHFFFAOYSA-N	1	0	299.382	1.607	50	0		CDAARO
CCCC[C@@H](C)C(=O)N1CC(C[NH+]2CCN(C)CC2)C1	ZINC000408517298	359901782	/nfs/dbraw/zinc/90/17/82/359901782.db2.gz	FZLCOBSZSRBDNE-CQSZACIVSA-N	1	0	281.444	1.519	50	0		CDAARO
C[C@H](C(=O)NC1CC1)N1CC[NH+](CC2CCC2)CC1	ZINC000089448690	359913628	/nfs/dbraw/zinc/91/36/28/359913628.db2.gz	WUPWLEOEUSIQIS-GFCCVEGCSA-N	1	0	265.401	1.071	50	0		CDAARO
C[C@H](C(=O)N1CCNC1=O)N(C)Cc1ccccc1Cl	ZINC000012786089	360078106	/nfs/dbraw/zinc/07/81/06/360078106.db2.gz	FOHYJLQEJLMKOJ-SNVBAGLBSA-N	1	0	295.770	1.712	50	0		CDAARO
CCOC(=O)[C@@H](CC)Sc1ncnc2c1C[N@H+](C)CC2	ZINC000267009595	360116465	/nfs/dbraw/zinc/11/64/65/360116465.db2.gz	HLVSKJIWBFOJEH-GFCCVEGCSA-N	1	0	295.408	1.898	50	0		CDAARO
Cc1nnc([C@@H]2CCCN2C(=O)C2(C)CC[NH+](C)CC2)[nH]1	ZINC000426563123	360684391	/nfs/dbraw/zinc/68/43/91/360684391.db2.gz	JOPXLAKVVYLTCK-LBPRGKRZSA-N	1	0	291.399	1.509	50	0		CDAARO
CC(C)[C@H]1C=CCN1C(=O)Cc1ccc(OCC[NH3+])cc1	ZINC000426394621	360663968	/nfs/dbraw/zinc/66/39/68/360663968.db2.gz	PFBLTVKLAVEKPE-MRXNPFEDSA-N	1	0	288.391	1.990	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2nc(C3CC3)no2)n1C	ZINC000426405735	360666084	/nfs/dbraw/zinc/66/60/84/360666084.db2.gz	OWWLQWPOHWJLEL-UHFFFAOYSA-N	1	0	280.357	1.087	50	0		CDAARO
Cc1ccc(OCCC(=O)N2CC[C@@H](C[NH3+])C2)cc1C	ZINC000178586381	189128548	/nfs/dbraw/zinc/12/85/48/189128548.db2.gz	QIQUDMURCHVSCC-AWEZNQCLSA-N	1	0	276.380	1.880	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)CCn2cnc3ccccc32)C1	ZINC000178535557	189124892	/nfs/dbraw/zinc/12/48/92/189124892.db2.gz	HLKUVMAYALSXDB-LBPRGKRZSA-N	1	0	272.352	1.234	50	0		CDAARO
CCn1nc(C)c(C(=O)N2CC[C@H](C[NH2+]C)C2)c1Cl	ZINC000179028864	189163164	/nfs/dbraw/zinc/16/31/64/189163164.db2.gz	PMAKUHNBDLQRMN-SNVBAGLBSA-N	1	0	284.791	1.546	50	0		CDAARO
COc1cc(C)sc1C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179114931	189170758	/nfs/dbraw/zinc/17/07/58/189170758.db2.gz	UTUJHAZFBPEQJO-VIFPVBQESA-N	1	0	254.355	1.499	50	0		CDAARO
COc1ccc(C(=O)NC[C@H](C)[NH+]2CCCC2)cc1	ZINC000036076999	360832250	/nfs/dbraw/zinc/83/22/50/360832250.db2.gz	YARDBZSQXLVOHE-LBPRGKRZSA-N	1	0	262.353	1.909	50	0		CDAARO
CC[C@H](O)C[N@H+](CCOC)Cc1cc(OC)cc(OC)c1	ZINC000036095044	360907032	/nfs/dbraw/zinc/90/70/32/360907032.db2.gz	YQQBMMYFONHLEP-AWEZNQCLSA-N	1	0	297.395	1.923	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)Cc2ccc(OC)cc2Cl)C1	ZINC000299738695	200849634	/nfs/dbraw/zinc/84/96/34/200849634.db2.gz	FIPJXIMJENRQLY-NSHDSACASA-N	1	0	296.798	1.959	50	0		CDAARO
CSCCNC(=O)c1ccc(C)c(OCC[NH3+])c1	ZINC000426599842	361073557	/nfs/dbraw/zinc/07/35/57/361073557.db2.gz	YZXIFZHEJYQVTK-UHFFFAOYSA-N	1	0	268.382	1.425	50	0		CDAARO
C[C@H](CN1CC[NH+](C)CC1)OC(=O)c1ccc(F)cc1	ZINC000019370403	361426217	/nfs/dbraw/zinc/42/62/17/361426217.db2.gz	ZLSVQEWOSQJTNW-GFCCVEGCSA-N	1	0	280.343	1.618	50	0		CDAARO
Cc1n[nH]c(C)c1S(=O)(=O)NC[C@@H]([NH3+])c1ccccc1	ZINC000036297713	361462352	/nfs/dbraw/zinc/46/23/52/361462352.db2.gz	MLGZAODPTFIEBZ-GFCCVEGCSA-N	1	0	294.380	1.005	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)N(C)CCc1ccccn1	ZINC000105777814	361593608	/nfs/dbraw/zinc/59/36/08/361593608.db2.gz	VQVUNSBETSGORA-OAHLLOKOSA-N	1	0	290.411	1.750	50	0		CDAARO
CCc1nnc(C[NH2+][C@H]2CC(C)(C)OC2(C)C)n1C	ZINC000189230706	361654525	/nfs/dbraw/zinc/65/45/25/361654525.db2.gz	ZDMMKNZYEPFLSX-JTQLQIEISA-N	1	0	266.389	1.813	50	0		CDAARO
CC[C@@H](CO)[NH2+]C[C@@H](O)COc1cccc2ccccc21	ZINC000017269036	364016790	/nfs/dbraw/zinc/01/67/90/364016790.db2.gz	OWASUJBWCYEWTB-LSDHHAIUSA-N	1	0	289.375	1.940	50	0		CDAARO
Cc1cnccc1CC[NH2+][C@H]1CCC[C@@H](S(C)(=O)=O)C1	ZINC000293603059	370709407	/nfs/dbraw/zinc/70/94/07/370709407.db2.gz	LGSJUNCURCYXLE-LSDHHAIUSA-N	1	0	296.436	1.878	50	0		CDAARO
CCOc1ccc(C(=O)NCC[NH+](C)C)c(OCC)c1	ZINC000013320374	364785365	/nfs/dbraw/zinc/78/53/65/364785365.db2.gz	QDHLRMFSXFNTTD-UHFFFAOYSA-N	1	0	280.368	1.775	50	0		CDAARO
C[C@H](OCc1ccccc1)C(=O)N1CC[C@@H]([NH3+])C[C@H]1C	ZINC000404484270	365256393	/nfs/dbraw/zinc/25/63/93/365256393.db2.gz	VMSUJJNGGKWMTC-VNHYZAJKSA-N	1	0	276.380	1.930	50	0		CDAARO
O=C1[C@H]([NH2+][C@@H]2CCC[C@H]3OCC[C@H]32)CCN1C1CC1	ZINC000089598042	366881274	/nfs/dbraw/zinc/88/12/74/366881274.db2.gz	NSQUBYSQBRZJRW-REWJHTLYSA-N	1	0	264.369	1.297	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2cnc(C)s2)CC1	ZINC000089730066	366922581	/nfs/dbraw/zinc/92/25/81/366922581.db2.gz	YUONNSWXJLRYAG-UHFFFAOYSA-N	1	0	297.424	1.540	50	0		CDAARO
C[C@]1(C(=O)NCCSC(F)(F)F)CCC[NH2+]C1	ZINC000227419585	291361328	/nfs/dbraw/zinc/36/13/28/291361328.db2.gz	FJWPURBQLGJOAF-VIFPVBQESA-N	1	0	270.320	1.745	50	0		CDAARO
COCCn1cc(NC(=O)[C@H](C(C)C)[NH+](C)C)ccc1=O	ZINC000089791109	366936061	/nfs/dbraw/zinc/93/60/61/366936061.db2.gz	DDSGOKCAADCMAN-AWEZNQCLSA-N	1	0	295.383	1.019	50	0		CDAARO
COc1ccccc1NC(=O)NC[C@@](C)(O)C[NH+](C)C	ZINC000089901168	366962253	/nfs/dbraw/zinc/96/22/53/366962253.db2.gz	PJLMSJIKCXADSB-CQSZACIVSA-N	1	0	281.356	1.129	50	0		CDAARO
O=C1C[C@@H]([NH2+]CCCNc2ccccc2)CCCN1	ZINC000630059702	366966770	/nfs/dbraw/zinc/96/67/70/366966770.db2.gz	DZQMCALJCIOGSC-AWEZNQCLSA-N	1	0	261.369	1.747	50	0		CDAARO
CCCCC[N@H+](CC1(O)CCS(=O)(=O)CC1)C(C)C	ZINC000089953428	366980696	/nfs/dbraw/zinc/98/06/96/366980696.db2.gz	HZAUKZDHRNZWCX-UHFFFAOYSA-N	1	0	291.457	1.827	50	0		CDAARO
CC(C)[NH+](CCSc1ccc2nnnn2n1)C(C)C	ZINC000090147499	367019583	/nfs/dbraw/zinc/01/95/83/367019583.db2.gz	LRECVVLRTJWLCF-UHFFFAOYSA-N	1	0	280.401	1.730	50	0		CDAARO
CCOc1cc(C[NH2+][C@H](C)CC(N)=O)ccc1OC	ZINC000089990986	367004706	/nfs/dbraw/zinc/00/47/06/367004706.db2.gz	LSKNZUQSTHKHOL-SNVBAGLBSA-N	1	0	266.341	1.447	50	0		CDAARO
O=C(NCCN1CCO[C@@H](c2ccccc2)C1)C1CC1	ZINC000017178658	367034117	/nfs/dbraw/zinc/03/41/17/367034117.db2.gz	FIUDFTDHOPNMCZ-OAHLLOKOSA-N	1	0	274.364	1.586	50	0		CDAARO
O=C(N[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(C2CC2)on1	ZINC000252527967	367785777	/nfs/dbraw/zinc/78/57/77/367785777.db2.gz	DVQNAUDUYWZIEJ-RYUDHWBXSA-N	1	0	275.352	1.909	50	0		CDAARO
COC(=O)[C@@H]1[C@H](O)CCCN1Cc1ccc(F)c(C)c1	ZINC000252549066	368155052	/nfs/dbraw/zinc/15/50/52/368155052.db2.gz	QRESKCTYKULCBG-KGLIPLIRSA-N	1	0	281.327	1.632	50	0		CDAARO
[NH3+]C[C@@H]1CCCC[C@H]1NS(=O)(=O)CCc1ccccc1	ZINC000089108080	368997061	/nfs/dbraw/zinc/99/70/61/368997061.db2.gz	KSGFQRYBDVEAHW-LSDHHAIUSA-N	1	0	296.436	1.666	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCCC[C@H]2C[NH3+])s1	ZINC000089107947	368997494	/nfs/dbraw/zinc/99/74/94/368997494.db2.gz	OKPKJKRHOAZBCS-QWRGUYRKSA-N	1	0	288.438	1.852	50	0		CDAARO
CC(C)[C@H](O)C[N@@H+]1CCC[C@H](c2ccnc(N)n2)C1	ZINC000367928100	369291396	/nfs/dbraw/zinc/29/13/96/369291396.db2.gz	HVVVGZZCRFCNFU-WCQYABFASA-N	1	0	264.373	1.085	50	0		CDAARO
CC(C)(O)C[NH+]1CCN(c2ccccc2F)CC1	ZINC000037746734	370046255	/nfs/dbraw/zinc/04/62/55/370046255.db2.gz	LJHKSFYBADNLGT-UHFFFAOYSA-N	1	0	252.333	1.719	50	0		CDAARO
Cc1ccc(OC[C@@H](O)C[NH2+][C@H](C)CCO)c(C)c1	ZINC000019146176	370141865	/nfs/dbraw/zinc/14/18/65/370141865.db2.gz	DEOOYKKCFLVNMU-KGLIPLIRSA-N	1	0	267.369	1.404	50	0		CDAARO
COC(=O)[C@@H]1[C@H](O)CCC[N@@H+]1C[C@@H]1CC=CCC1	ZINC000252549062	284213501	/nfs/dbraw/zinc/21/35/01/284213501.db2.gz	QRDSPMVLVNJYBD-UPJWGTAASA-N	1	0	253.342	1.341	50	0		CDAARO
Cc1nnc(CN2CC[C@@H]3CC[C@H](C2)[N@@H+]3C)s1	ZINC000299767679	372750666	/nfs/dbraw/zinc/75/06/66/372750666.db2.gz	MWULHAZCQZUORJ-WDEREUQCSA-N	1	0	252.387	1.515	50	0		CDAARO
COc1cccc(C(=O)NC2CC2)c1OCCC[NH3+]	ZINC000299770861	372751023	/nfs/dbraw/zinc/75/10/23/372751023.db2.gz	RREFPEVVOABQRE-UHFFFAOYSA-N	1	0	264.325	1.315	50	0		CDAARO
[NH3+][C@@H](Cc1ccccc1)C(=O)N1CCO[C@H]2CCCC[C@@H]21	ZINC000037815407	373419520	/nfs/dbraw/zinc/41/95/20/373419520.db2.gz	CWKNNFWJPOEPCW-JYJNAYRXSA-N	1	0	288.391	1.726	50	0		CDAARO
Cc1noc(C)c1NC(=O)NC1(C[NH+](C)C)CCC1	ZINC000253429827	373734910	/nfs/dbraw/zinc/73/49/10/373734910.db2.gz	UVTOJDGKYHLZTQ-UHFFFAOYSA-N	1	0	266.345	1.897	50	0		CDAARO
COC[C@H]1CCCCN(Cc2ncnn2CCF)C1	ZINC000253429053	373736217	/nfs/dbraw/zinc/73/62/17/373736217.db2.gz	BYJRYCPYNISLPZ-LBPRGKRZSA-N	1	0	270.352	1.496	50	0		CDAARO
CC[C@@H]1CN(c2ncnc3[nH]ccc32)CC[N@@H+]1C[C@H](C)O	ZINC000107136554	373798677	/nfs/dbraw/zinc/79/86/77/373798677.db2.gz	KSTFUXVVZPKJAJ-NWDGAFQWSA-N	1	0	289.383	1.239	50	0		CDAARO
Cn1c(C[NH2+][C@@H]2CCCC[C@@H]2O)nc2ccccc21	ZINC000104313576	374268088	/nfs/dbraw/zinc/26/80/88/374268088.db2.gz	OJLPVMGSZNPXDL-OCCSQVGLSA-N	1	0	259.353	1.966	50	0		CDAARO
COc1ccc(OC)c(CN2CCC[N@H+](C)CC2)c1	ZINC000019536892	374749660	/nfs/dbraw/zinc/74/96/60/374749660.db2.gz	VFZGNMRLICHPEZ-UHFFFAOYSA-N	1	0	264.369	1.841	50	0		CDAARO
CC(C)COc1ccccc1CNC(=O)[C@H]1C[C@H](O)C[NH2+]1	ZINC000277360937	374783673	/nfs/dbraw/zinc/78/36/73/374783673.db2.gz	BWELRUUBCSAIJX-UONOGXRCSA-N	1	0	292.379	1.060	50	0		CDAARO
Cn1ncc(N[C@@H]2CC[N@H+](CC3CC3)C2)c(Cl)c1=O	ZINC000095394080	374899548	/nfs/dbraw/zinc/89/95/48/374899548.db2.gz	GWBMNLHTMFVLNZ-SNVBAGLBSA-N	1	0	282.775	1.330	50	0		CDAARO
C[C@@H](Sc1nnnn1CC[NH+](C)C)C(F)(F)F	ZINC000095427374	374926878	/nfs/dbraw/zinc/92/68/78/374926878.db2.gz	CQMGERSJAHVUBI-ZCFIWIBFSA-N	1	0	269.296	1.278	50	0		CDAARO
C[NH2+]C(C)(C)CNC(=O)Nc1cc(OC)ccc1OC	ZINC000095446451	374946396	/nfs/dbraw/zinc/94/63/96/374946396.db2.gz	UGLVWKRJELIHQC-UHFFFAOYSA-N	1	0	281.356	1.823	50	0		CDAARO
c1ccc(C[C@H](CN2CCOCC2)[NH2+][C@H]2CCOC2)cc1	ZINC000095967902	375045002	/nfs/dbraw/zinc/04/50/02/375045002.db2.gz	YLGIGSOWUQYDQL-DLBZAZTESA-N	1	0	290.407	1.308	50	0		CDAARO
C[C@@H](C(=O)[O-])[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000299742283	375202234	/nfs/dbraw/zinc/20/22/34/375202234.db2.gz	AYTGETIPXZBJQM-UPJWGTAASA-N	1	0	284.400	1.281	50	0		CDAARO
Cc1cc(=O)oc2cc(OC[C@H](O)C[NH2+]C3CC3)ccc12	ZINC000003241714	375598664	/nfs/dbraw/zinc/59/86/64/375598664.db2.gz	XENZZKHMDFKELA-GFCCVEGCSA-N	1	0	289.331	1.593	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)/C=C\c2ccc3c(c2)OCCO3)C1	ZINC000254950268	375927309	/nfs/dbraw/zinc/92/73/09/375927309.db2.gz	RLVLLDXNMFQEBC-QDOCKXBDSA-N	1	0	288.347	1.278	50	0		CDAARO
O=C(CN1CC[N@@H+]2CCC[C@H]2C1)Nc1ccc(Cl)cn1	ZINC000239338595	376015262	/nfs/dbraw/zinc/01/52/62/376015262.db2.gz	KUKLMGBYMHFFPB-LBPRGKRZSA-N	1	0	294.786	1.454	50	0		CDAARO
Cn1cccc1[C@@H]1NC(=[NH2+])Nc2nc3ccccc3n21	ZINC000001408246	377917226	/nfs/dbraw/zinc/91/72/26/377917226.db2.gz	CVAOVQAFJATNEY-GFCCVEGCSA-N	1	0	266.308	1.471	50	0		CDAARO
CC[C@@H]1CN(CC(=O)NC[C@H]2CCCO2)CCS1	ZINC000245289594	378045526	/nfs/dbraw/zinc/04/55/26/378045526.db2.gz	CXQBRDKFVRYGKN-VXGBXAGGSA-N	1	0	272.414	1.109	50	0		CDAARO
C[N@H+](Cc1cnc2ccccn12)CC1(O)CCOCC1	ZINC000189783022	378238037	/nfs/dbraw/zinc/23/80/37/378238037.db2.gz	VLONWTYZTFLXMJ-UHFFFAOYSA-N	1	0	275.352	1.308	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CC(=O)NC(=O)NC(C)(C)C	ZINC000007486437	296310381	/nfs/dbraw/zinc/31/03/81/296310381.db2.gz	AGDAIYKWLUXYBF-SNVBAGLBSA-N	1	0	255.362	1.485	50	0		CDAARO
Cc1ccc(C(=O)N[C@H](CO)C[NH+]2CCCCC2)o1	ZINC000288672546	197142184	/nfs/dbraw/zinc/14/21/84/197142184.db2.gz	ZJKAWWZCHJKMLG-LBPRGKRZSA-N	1	0	266.341	1.165	50	0		CDAARO
O=c1c2cccc(C(F)(F)F)c2ncn1[C@@H]1CC[NH2+]C1	ZINC000042963320	285210051	/nfs/dbraw/zinc/21/00/51/285210051.db2.gz	FZFPKRLKDHAHPE-MRVPVSSYSA-N	1	0	283.253	1.950	50	0		CDAARO
CC[N@@H+]1CCC[C@H](N2C(=O)OC(C)(C)[C@]2(C)O)C1	ZINC000245257281	285264189	/nfs/dbraw/zinc/26/41/89/285264189.db2.gz	YNKAKTJZJSXZAA-GWCFXTLKSA-N	1	0	256.346	1.410	50	0		CDAARO
CN(C)c1nccc(C[NH2+]C2CCSCC2)n1	ZINC000095988213	256882521	/nfs/dbraw/zinc/88/25/21/256882521.db2.gz	ZCVDAPUOVZEGTF-UHFFFAOYSA-N	1	0	252.387	1.528	50	0		CDAARO
O=C(NCC1CC[NH2+]CC1)c1ccc(F)c(F)c1F	ZINC000094184017	184760318	/nfs/dbraw/zinc/76/03/18/184760318.db2.gz	JVPMSIKRDFQEEY-UHFFFAOYSA-N	1	0	272.270	1.833	50	0		CDAARO
CC[C@H]([NH2+][C@H](C)C(=O)NC(N)=O)c1ccc(C)cc1	ZINC000012798232	390205879	/nfs/dbraw/zinc/20/58/79/390205879.db2.gz	VBUXGDAJPNQTCS-PWSUYJOCSA-N	1	0	263.341	1.619	50	0		CDAARO
Cc1cc(N2CC[NH+](C)CC2)ncc1Br	ZINC000019721225	390229326	/nfs/dbraw/zinc/22/93/26/390229326.db2.gz	WCOZEBJJPANQBY-UHFFFAOYSA-N	1	0	270.174	1.904	50	0		CDAARO
CCc1ocnc1C(=O)OC[C@@H]1C[N@H+](CC(C)C)CCO1	ZINC000096420381	390514104	/nfs/dbraw/zinc/51/41/04/390514104.db2.gz	FTRYHCYICSRLAB-LBPRGKRZSA-N	1	0	296.367	1.751	50	0		CDAARO
C[NH+](C)CCn1ccc(NC(=O)NC[C@@H]2CC=CCC2)n1	ZINC000096424055	390516410	/nfs/dbraw/zinc/51/64/10/390516410.db2.gz	BUHJXTLHWVTLST-CYBMUJFWSA-N	1	0	291.399	1.923	50	0		CDAARO
Cc1ccc(C)c([C@@H]2CN(C(=O)CC[NH3+])[C@@H](C)CO2)c1	ZINC000119066148	390476983	/nfs/dbraw/zinc/47/69/83/390476983.db2.gz	LKEVFEUBNCOJDV-ZFWWWQNUSA-N	1	0	276.380	1.941	50	0		CDAARO
Cc1cc(F)ccc1NC(=O)C[NH2+][C@H](C)Cn1cncn1	ZINC000067741561	390575740	/nfs/dbraw/zinc/57/57/40/390575740.db2.gz	FYAFUUOCRBXGDA-LLVKDONJSA-N	1	0	291.330	1.342	50	0		CDAARO
CCOC(=O)CN1CCCN(c2cc[nH+]cc2C)CC1	ZINC000067975568	390577140	/nfs/dbraw/zinc/57/71/40/390577140.db2.gz	XIYGXTYZULYWIR-UHFFFAOYSA-N	1	0	277.368	1.465	50	0		CDAARO
CC[C@H](CO)[NH+]1CCN([C@@H]2Cc3ccccc3[C@H]2O)CC1	ZINC000247853798	390663011	/nfs/dbraw/zinc/66/30/11/390663011.db2.gz	XIIZVMWTCZSXIW-DJIMGWMZSA-N	1	0	290.407	1.033	50	0		CDAARO
O=C(N[C@@H]1CCC[NH2+]C1)c1ccccc1Br	ZINC000070949919	391858409	/nfs/dbraw/zinc/85/84/09/391858409.db2.gz	CYCXIVMAOXYDPU-SECBINFHSA-N	1	0	283.169	1.931	50	0		CDAARO
Cc1c[nH]c(CNC(=O)N2CC([N@H+]3CCCC[C@@H]3C)C2)n1	ZINC000426661366	391860089	/nfs/dbraw/zinc/86/00/89/391860089.db2.gz	RAXPSKWSWUNTQG-LBPRGKRZSA-N	1	0	291.399	1.486	50	0		CDAARO
CC(C)[N@H+](C)CC(=O)NC[C@]1(C)CCCC[C@H]1O	ZINC000245316877	391979547	/nfs/dbraw/zinc/97/95/47/391979547.db2.gz	LAHTXJTZEGNJJI-OCCSQVGLSA-N	1	0	256.390	1.384	50	0		CDAARO
C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccon1	ZINC000248837996	131119077	/nfs/dbraw/zinc/11/90/77/131119077.db2.gz	NGNRMYJVDBGUHJ-SWLSCSKDSA-N	1	0	285.347	1.925	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)/C=C/c1cnc(C)s1	ZINC000269191402	132128067	/nfs/dbraw/zinc/12/80/67/132128067.db2.gz	LZYJJYKWGVQIEN-QRGHLMKCSA-N	1	0	265.382	1.675	50	0		CDAARO
COC[C@H]1CCN(C(=O)[C@H]2CCCC[N@@H+]2C(C)C)C1	ZINC000096421744	393184774	/nfs/dbraw/zinc/18/47/74/393184774.db2.gz	TYLQKQOETFMNHF-UONOGXRCSA-N	1	0	268.401	1.744	50	0		CDAARO
Cc1cc(C)nc(NC[C@@H](O)C[NH+]2CCC(C)CC2)n1	ZINC000096456201	393187184	/nfs/dbraw/zinc/18/71/84/393187184.db2.gz	CTJVDORZWOTWMU-CQSZACIVSA-N	1	0	278.400	1.598	50	0		CDAARO
CC[C@H](C)[C@H]([NH3+])C(=O)N1CCC(N2CCCCC2=O)CC1	ZINC000096499724	393189022	/nfs/dbraw/zinc/18/90/22/393189022.db2.gz	ZEABLEHPLRBBNZ-WFASDCNBSA-N	1	0	295.427	1.363	50	0		CDAARO
CCCC[C@@H]1C(=O)N(C)CC[N@@H+]1C1CCN(C(C)=O)CC1	ZINC000065409490	393401849	/nfs/dbraw/zinc/40/18/49/393401849.db2.gz	AMPAXBYDEWVVFD-OAHLLOKOSA-N	1	0	295.427	1.330	50	0		CDAARO
CCO/C=C\C(=O)N1CCC(OCCC[NH+](C)C)CC1	ZINC000493672695	393440246	/nfs/dbraw/zinc/44/02/46/393440246.db2.gz	IGWTXWQMSLYFLS-JYRVWZFOSA-N	1	0	284.400	1.496	50	0		CDAARO
CO[C@@H](C[NH2+][C@H]1CCC(=O)NC1(C)C)C1CCCC1	ZINC000658317409	413367338	/nfs/dbraw/zinc/36/73/38/413367338.db2.gz	VSZIMXMVLJCXAK-STQMWFEESA-N	1	0	268.401	1.838	50	0		CDAARO
Cc1nnc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)s1	ZINC000660691094	413378582	/nfs/dbraw/zinc/37/85/82/413378582.db2.gz	FWPVOWQPAXHOME-QJPTWQEYSA-N	1	0	267.398	1.972	50	0		CDAARO
CC[NH+](CC)CCN1c2ccc(F)cc2C(=O)C1=O	ZINC000006759901	170241772	/nfs/dbraw/zinc/24/17/72/170241772.db2.gz	ZCIRSLUEIWOGAB-UHFFFAOYSA-N	1	0	264.300	1.697	50	0		CDAARO
[NH3+]CCS[C@@H]1CC(=O)N(c2cccc(F)c2)C1=O	ZINC000019765725	170855257	/nfs/dbraw/zinc/85/52/57/170855257.db2.gz	CMOPJIJUGAPTQO-SNVBAGLBSA-N	1	0	268.313	1.150	50	0		CDAARO
CC(C)OC[C@H](O)C[NH+]1CCN(Cc2ccccc2)CC1	ZINC000020234166	171095669	/nfs/dbraw/zinc/09/56/69/171095669.db2.gz	XRZBMJMYZAJPFV-QGZVFWFLSA-N	1	0	292.423	1.590	50	0		CDAARO
COc1cc([C@@H](C[NH3+])N(C)C)cc(OC)c1OC	ZINC000038827621	174157186	/nfs/dbraw/zinc/15/71/86/174157186.db2.gz	VNKKIJXJEPUFJP-SNVBAGLBSA-N	1	0	254.330	1.274	50	0		CDAARO
CN(Cc1ccsc1)Cc1cc2n(n1)CC[NH2+]C2	ZINC000072166700	176331514	/nfs/dbraw/zinc/33/15/14/176331514.db2.gz	ZMLKLMGFCWNFII-UHFFFAOYSA-N	1	0	262.382	1.680	50	0		CDAARO
c1cnc(Nc2cncc(C3CC[NH2+]CC3)n2)nc1	ZINC000072354382	176374745	/nfs/dbraw/zinc/37/47/45/176374745.db2.gz	PCFKHVNAVSIPRX-UHFFFAOYSA-N	1	0	256.313	1.477	50	0		CDAARO
O[C@]1(CNCc2csc3c2CCCC3)C[NH2+]CCOC1	ZINC000077389435	177262380	/nfs/dbraw/zinc/26/23/80/177262380.db2.gz	NSXSEIHMZPFXAH-HNNXBMFYSA-N	1	0	296.436	1.067	50	0		CDAARO
COc1ccc(OC)c(NC(=O)CN2CCC([NH3+])CC2)c1	ZINC000019688425	260114753	/nfs/dbraw/zinc/11/47/53/260114753.db2.gz	QNKOUYHWYZUCGO-UHFFFAOYSA-N	1	0	293.367	1.065	50	0		CDAARO
C[C@@H]1C[C@@H](C(=O)N2CC[N@@H+]3C[C@H](O)C[C@H]3C2)CC(C)(C)C1	ZINC000655296008	424314728	/nfs/dbraw/zinc/31/47/28/424314728.db2.gz	KUDLAXRKMMEGNE-APIJFGDWSA-N	1	0	294.439	1.726	50	0		CDAARO
CC(C)[NH+]1CCN(c2ncnc3c2CCCC3)CC1	ZINC000129143674	273533144	/nfs/dbraw/zinc/53/31/44/273533144.db2.gz	QDUFSXVEJWAOJA-UHFFFAOYSA-N	1	0	260.385	1.886	50	0		CDAARO
CNC(=O)c1nn(-c2cccc(Cl)c2)sc1=[NH2+]	ZINC000004468854	277262013	/nfs/dbraw/zinc/26/20/13/277262013.db2.gz	DBECNYGRXAFLGQ-UHFFFAOYSA-N	1	0	268.729	1.426	50	0		CDAARO
COC(=O)C1CCC([NH2+][C@@H]2CCC[C@H](C(N)=O)C2)CC1	ZINC000192443079	277311921	/nfs/dbraw/zinc/31/19/21/277311921.db2.gz	HCKPNJHIVPOGLZ-PYNQCMFNSA-N	1	0	282.384	1.352	50	0		CDAARO
COC(=O)[C@@H]1[C@H](O)CCC[N@@H+]1C[C@H]1CC=CCC1	ZINC000188782153	277374250	/nfs/dbraw/zinc/37/42/50/277374250.db2.gz	QRDSPMVLVNJYBD-XQQFMLRXSA-N	1	0	253.342	1.341	50	0		CDAARO
CCN(CC[NH+]1CCCCCC1)C(=O)[C@H]1CCOC1	ZINC000055042012	279187714	/nfs/dbraw/zinc/18/77/14/279187714.db2.gz	KKRMPTIJBULPCV-AWEZNQCLSA-N	1	0	268.401	1.747	50	0		CDAARO
CN(C(=O)[C@H](C[NH3+])c1ccc(F)cc1)[C@@H]1CCOC1	ZINC000262048645	281847035	/nfs/dbraw/zinc/84/70/35/281847035.db2.gz	HBMDBNFNGXXBKE-CHWSQXEVSA-N	1	0	266.316	1.115	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)/C=C\c2c(C)nn(C)c2Cl)C1	ZINC000254988909	289348819	/nfs/dbraw/zinc/34/88/19/289348819.db2.gz	BELXTNSSNJNKID-ZADCQDASSA-N	1	0	296.802	1.606	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CCCCC[C@@H]1C[C@H](O)c1ccco1	ZINC000095413237	293174760	/nfs/dbraw/zinc/17/47/60/293174760.db2.gz	SULMRBFTBGXNGF-KFWWJZLASA-N	1	0	297.395	1.955	50	0		CDAARO
COc1cccc([C@@]2(O)CC[S@](=O)C[C@@H]2C[NH+](C)C)c1	ZINC000004128813	295322650	/nfs/dbraw/zinc/32/26/50/295322650.db2.gz	SMRSCUYCLLYTCF-ZQGRQUNCSA-N	1	0	297.420	1.213	50	0		CDAARO
C[C@@H]1C[C@@H](C)C[NH+](CCNC(=O)[C@H]2CCCO2)C1	ZINC000106077846	297228091	/nfs/dbraw/zinc/22/80/91/297228091.db2.gz	CSEXSBQZRCLGLX-JHJVBQTASA-N	1	0	254.374	1.260	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCNC(=O)CCc2cn[nH]c2)C1	ZINC000534584967	328314901	/nfs/dbraw/zinc/31/49/01/328314901.db2.gz	UQYYGCGMLXENLJ-GFCCVEGCSA-N	1	0	264.373	1.190	50	0		CDAARO
CN(Cc1noc2c1CCCC2)C(=O)[C@H]1C=CC[NH2+]1	ZINC000534587864	328316378	/nfs/dbraw/zinc/31/63/78/328316378.db2.gz	KLOIEKYNSCXMNY-LLVKDONJSA-N	1	0	261.325	1.040	50	0		CDAARO
O=C(NCC[C@@H]1CCOC1)C1([NH+]2CCCC2)CCCC1	ZINC000534658121	328341027	/nfs/dbraw/zinc/34/10/27/328341027.db2.gz	YOIGRCDHLPBHTP-CQSZACIVSA-N	1	0	280.412	1.938	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)c1ccc2sc(C)nc2c1	ZINC000534661272	328349357	/nfs/dbraw/zinc/34/93/57/328349357.db2.gz	OYUWBDRMFCEQHZ-RYUDHWBXSA-N	1	0	291.376	1.321	50	0		CDAARO
Cc1ncn(C)c1C(=O)N[C@H](C)C1CC[NH+](C)CC1	ZINC000534676208	328351786	/nfs/dbraw/zinc/35/17/86/328351786.db2.gz	CMKWLEFUQWHHNX-SNVBAGLBSA-N	1	0	264.373	1.189	50	0		CDAARO
CC[C@@H](C(=O)N1CCC(OC[C@H]2CCOC2)CC1)[NH+](C)C	ZINC000097372838	323207869	/nfs/dbraw/zinc/20/78/69/323207869.db2.gz	GRGOTYQUZWQTNR-ZFWWWQNUSA-N	1	0	298.427	1.371	50	0		CDAARO
CCc1cc(N[C@H](C)C2CC[NH+](C)CC2)nc(C)n1	ZINC000396454996	328450471	/nfs/dbraw/zinc/45/04/71/328450471.db2.gz	MDGMKKUGDPFSAG-LLVKDONJSA-N	1	0	262.401	1.912	50	0		CDAARO
CCc1ccccc1OCCN1C[C@H]2C[NH2+]C[C@]2(CO)C1	ZINC001772705226	1159439644	/nfs/dbraw/zinc/43/96/44/1159439644.db2.gz	GAWAPFNLOXJMJS-NVXWUHKLSA-N	1	0	290.407	1.142	50	0		CDAARO
CN1CC[C@H]([NH2+]C[C@@]2(O)CCCOC2)[C@@H]1c1ccccc1	ZINC000585094279	482828725	/nfs/dbraw/zinc/82/87/25/482828725.db2.gz	AFPQUXSEPKLJMZ-ULQDDVLXSA-N	1	0	290.407	1.563	50	0		CDAARO
O=c1c2c(F)cccc2ncn1CC[C@@H]1CCC[NH2+]1	ZINC000670436365	482974638	/nfs/dbraw/zinc/97/46/38/482974638.db2.gz	SIZPKDJQYOSCNX-JTQLQIEISA-N	1	0	261.300	1.678	50	0		CDAARO
C[C@H]1CC[C@H](C(=O)N2C[C@H](O)[C@@H]([NH+]3CCCCC3)C2)CC1	ZINC000670437814	482978436	/nfs/dbraw/zinc/97/84/36/482978436.db2.gz	PLHTWCFPTNUCMO-VGWMRTNUSA-N	1	0	294.439	1.870	50	0		CDAARO
CCCc1nc(NCC[N@@H+]2CCC[C@H](CO)C2)no1	ZINC000670455463	483031323	/nfs/dbraw/zinc/03/13/23/483031323.db2.gz	FXFYLCJPZISQIG-NSHDSACASA-N	1	0	268.361	1.138	50	0		CDAARO
COc1ccc2c(c1)CC[N@@H+](C[C@H]1CCC(=O)O1)C2	ZINC000670465861	483055975	/nfs/dbraw/zinc/05/59/75/483055975.db2.gz	BYTCNIRYKPYHOQ-CQSZACIVSA-N	1	0	261.321	1.759	50	0		CDAARO
CCn1cc(C[NH+]2CCC3(CC2)CCNC(=O)CC3)cn1	ZINC000670470423	483070609	/nfs/dbraw/zinc/07/06/09/483070609.db2.gz	FZYHYTPAHAMTDW-UHFFFAOYSA-N	1	0	290.411	1.785	50	0		CDAARO
Cc1cc(C)n(CC[N@@H+](C)Cc2ccc(CO)o2)n1	ZINC000670472313	483080345	/nfs/dbraw/zinc/08/03/45/483080345.db2.gz	VUECWPDPMZRSHO-UHFFFAOYSA-N	1	0	263.341	1.717	50	0		CDAARO
C[NH+]1CCC(NC(=S)N2CCO[C@@H]3CCCC[C@@H]32)CC1	ZINC000083877625	483216300	/nfs/dbraw/zinc/21/63/00/483216300.db2.gz	HIKKYDUIKONYIQ-UONOGXRCSA-N	1	0	297.468	1.599	50	0		CDAARO
COc1cc(C)ccc1OCC(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179098491	522277111	/nfs/dbraw/zinc/27/71/11/522277111.db2.gz	BDJUJKPLUJFZCP-LBPRGKRZSA-N	1	0	278.352	1.203	50	0		CDAARO
CCOc1cc(N2CC[C@H]([NH+](C)C)[C@H]2C)ncn1	ZINC000408523539	528312891	/nfs/dbraw/zinc/31/28/91/528312891.db2.gz	LBGDICQUHBGCRH-MNOVXSKESA-N	1	0	250.346	1.404	50	0		CDAARO
O=C(C1CC[NH+](C[C@H](O)C(F)(F)F)CC1)N1CCCC1	ZINC000097141793	567905080	/nfs/dbraw/zinc/90/50/80/567905080.db2.gz	PJQXEKXILALOMI-NSHDSACASA-N	1	0	294.317	1.244	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1C(=O)NC1(CO)CCCCC1	ZINC000952989718	615143507	/nfs/dbraw/zinc/14/35/07/615143507.db2.gz	OMXCIFRIBFVEDS-LBPRGKRZSA-N	1	0	254.374	1.282	50	0		CDAARO
COCCC(=O)N(C)CCC[NH+]1CCCCCC1	ZINC000952986641	616827855	/nfs/dbraw/zinc/82/78/55/616827855.db2.gz	HBDVQZRLXVLQIT-UHFFFAOYSA-N	1	0	256.390	1.747	50	0		CDAARO
Cc1ncc(Cl)c(N2CCC[C@@](O)(C[NH+](C)C)C2)n1	ZINC001772709375	1159443595	/nfs/dbraw/zinc/44/35/95/1159443595.db2.gz	GTVKGWBKYOJBFV-CYBMUJFWSA-N	1	0	284.791	1.331	50	0		CDAARO
CN(C)c1nccnc1NC[C@H](O)C[NH+]1CCCCCC1	ZINC001704302399	1177680689	/nfs/dbraw/zinc/68/06/89/1177680689.db2.gz	JHRJFJRALFNTFB-ZDUSSCGKSA-N	1	0	293.415	1.191	50	0		CDAARO
CO[C@@H]1CCC[C@@]12CCC[N@H+](CCS(C)(=O)=O)C2	ZINC001704358426	1177701399	/nfs/dbraw/zinc/70/13/99/1177701399.db2.gz	LIEQMBGUMKBSQF-OLZOCXBDSA-N	1	0	275.414	1.312	50	0		CDAARO
Cc1ccc2n[nH]c(C[N@H+](C)C[C@H]3COCCO3)c2c1	ZINC000023340224	769852724	/nfs/dbraw/zinc/85/27/24/769852724.db2.gz	VQLMLFMXVJGQLQ-LBPRGKRZSA-N	1	0	275.352	1.719	50	0		CDAARO
O=C(NCC[N@H+]1CCC[C@@H](CO)C1)NCC1CCCCC1	ZINC000952971899	770513357	/nfs/dbraw/zinc/51/33/57/770513357.db2.gz	YLGQQISYRFFXSJ-OAHLLOKOSA-N	1	0	297.443	1.570	50	0		CDAARO
Cc1cccnc1C[C@@H](C)Nc1nc(N)nc2c1CC[NH2+]C2	ZINC000067867831	771062323	/nfs/dbraw/zinc/06/23/23/771062323.db2.gz	HEPGWLCTEOLMFD-LLVKDONJSA-N	1	0	298.394	1.451	50	0		CDAARO
COc1ncc(C[NH2+]Cc2ccc3c(c2)nc(C)n3C)cn1	ZINC000952989432	771308849	/nfs/dbraw/zinc/30/88/49/771308849.db2.gz	QWYPXDDMQXHDGX-UHFFFAOYSA-N	1	0	297.362	1.970	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1NC[C@@H]1CCC[N@H+](CCO)C1	ZINC000095369793	772023818	/nfs/dbraw/zinc/02/38/18/772023818.db2.gz	LARUNIYMHMYCLF-LBPRGKRZSA-N	1	0	293.415	1.046	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1C(=O)/C=C/c1nccs1	ZINC000089937795	772606663	/nfs/dbraw/zinc/60/66/63/772606663.db2.gz	YKZFLZQIXRUOKJ-HMDXOVGESA-N	1	0	251.355	1.319	50	0		CDAARO
Cc1cnn([C@@H]2c3ccccc3C3(CC[NH2+]CC3)[C@H]2O)c1	ZINC000023506638	772713467	/nfs/dbraw/zinc/71/34/67/772713467.db2.gz	BRJPOZPTVPIQSB-CVEARBPZSA-N	1	0	283.375	1.777	50	0		CDAARO
[NH3+]CCCOc1ccc(F)cc1C(=O)N1CCC[C@@H]1CO	ZINC000426534076	772714667	/nfs/dbraw/zinc/71/46/67/772714667.db2.gz	PXLHTNUMBXQDCE-GFCCVEGCSA-N	1	0	296.342	1.150	50	0		CDAARO
COc1cc(N2CC(C)(C)[N@H+](C)C[C@@H]2C)ncn1	ZINC000065493285	772857046	/nfs/dbraw/zinc/85/70/46/772857046.db2.gz	SAZKDWNVIBLJMQ-JTQLQIEISA-N	1	0	250.346	1.404	50	0		CDAARO
CCc1noc(CCNC(=O)C(C)(C)[NH+]2CCCC2)n1	ZINC000426370504	772864642	/nfs/dbraw/zinc/86/46/42/772864642.db2.gz	MFOSSBCEIPNKDR-UHFFFAOYSA-N	1	0	280.372	1.165	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)N1CCC[C@H](c2nnc[nH]2)C1	ZINC000952991788	773669378	/nfs/dbraw/zinc/66/93/78/773669378.db2.gz	SOOWSMGOIAUFPX-ZDUSSCGKSA-N	1	0	291.399	1.387	50	0		CDAARO
Cc1[nH]c(=O)c(C(=O)N[C@@H]2CC[C@@H]([NH3+])C2)c(C)c1Cl	ZINC000067872773	773715574	/nfs/dbraw/zinc/71/55/74/773715574.db2.gz	QQYLKTCLCATEIG-RKDXNWHRSA-N	1	0	283.759	1.255	50	0		CDAARO
CNc1ncccc1CN1CCC[C@]2(CC[NH2+]C2)C1	ZINC000426622946	902750543	/nfs/dbraw/zinc/75/05/43/902750543.db2.gz	MOKQUWPAWWWQOB-OAHLLOKOSA-N	1	0	260.385	1.699	50	0		CDAARO
CC(C)C1=NO[C@@H](C(=O)N2CC([NH+]3CCCCC3)C2)C1	ZINC000952874052	910429573	/nfs/dbraw/zinc/42/95/73/910429573.db2.gz	UADOMZNXVSQQFK-CQSZACIVSA-N	1	0	279.384	1.484	50	0		CDAARO
CCCC[C@H]1C=CCN1C(=O)[C@H]1CCC[N@H+](CC(N)=O)C1	ZINC000952867554	910463467	/nfs/dbraw/zinc/46/34/67/910463467.db2.gz	OYMAASWJWSBAPR-KBPBESRZSA-N	1	0	293.411	1.141	50	0		CDAARO
Cc1nncn1CC[NH+]1CCC([C@@H](O)C(C)C)CC1	ZINC000820684180	925544461	/nfs/dbraw/zinc/54/44/61/925544461.db2.gz	LZMLTRAXSWNJCO-AWEZNQCLSA-N	1	0	266.389	1.315	50	0		CDAARO
COCCC1CC[NH+](CCn2cnnc2C)CC1	ZINC000824384079	925818853	/nfs/dbraw/zinc/81/88/53/925818853.db2.gz	AILOTVLOJZHNLK-UHFFFAOYSA-N	1	0	252.362	1.335	50	0		CDAARO
Cc1nccn1CCC[N@@H+](C)C[C@H]1CCCCN1C	ZINC000243956736	937588626	/nfs/dbraw/zinc/58/86/26/937588626.db2.gz	CCZLXCAKDBMDIK-OAHLLOKOSA-N	1	0	264.417	1.998	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1COc1nccc(C(F)(F)F)n1	ZINC000585651007	932837078	/nfs/dbraw/zinc/83/70/78/932837078.db2.gz	IFSKLILCKCWFCF-MRVPVSSYSA-N	1	0	261.247	1.968	50	0		CDAARO
CC(C)[C@@H](CNc1cc2nncn2c(N)n1)[NH+]1CCCC1	ZINC001529168007	969001943	/nfs/dbraw/zinc/00/19/43/969001943.db2.gz	UAGMRNRODKYAGK-LLVKDONJSA-N	1	0	289.387	1.239	50	0		CDAARO
CCC[C@]1(CO)C[N@H+](CCc2ccc(O)cc2)CC[C@H]1O	ZINC001529190988	969009407	/nfs/dbraw/zinc/00/94/07/969009407.db2.gz	QVLYVCYHTRKPAA-IAGOWNOFSA-N	1	0	293.407	1.780	50	0		CDAARO
Cc1nncn1CC[N@@H+]1CCOc2ccccc2C1	ZINC001506404040	975150117	/nfs/dbraw/zinc/15/01/17/975150117.db2.gz	ARRKNSIUXXERLV-UHFFFAOYSA-N	1	0	258.325	1.481	50	0		CDAARO
CCc1noc(NC(=O)CN2CCC[N@H+](C)CC2)c1C	ZINC001506401914	975150206	/nfs/dbraw/zinc/15/02/06/975150206.db2.gz	OORVDIPJRWETKP-UHFFFAOYSA-N	1	0	280.372	1.121	50	0		CDAARO
CNC(=O)C[C@@H]1CC[N@H+](Cc2cncn2CC(C)C)C1	ZINC001506424315	975159135	/nfs/dbraw/zinc/15/91/35/975159135.db2.gz	BQSWLDBEVOOJML-ZDUSSCGKSA-N	1	0	278.400	1.497	50	0		CDAARO
CC(=O)NC(C)(C)C[C@@H](C)[NH2+]Cc1cnc(C)cn1	ZINC001506425034	975159613	/nfs/dbraw/zinc/15/96/13/975159613.db2.gz	BTNZUXZHGOVJLD-SNVBAGLBSA-N	1	0	264.373	1.568	50	0		CDAARO
Cn1ncnc1CC[NH2+]C1CCN(Cc2ccco2)CC1	ZINC001506425799	975160712	/nfs/dbraw/zinc/16/07/12/975160712.db2.gz	RTKPBKGKDKKWHY-UHFFFAOYSA-N	1	0	289.383	1.205	50	0		CDAARO
Cc1cccc(C[NH+]2CCC(NS(C)(=O)=O)CC2)c1C	ZINC000096489546	230382343	/nfs/dbraw/zinc/38/23/43/230382343.db2.gz	XRQDUJAHFCZEOD-UHFFFAOYSA-N	1	0	296.436	1.817	50	0		CDAARO
Cn1cccc1C[NH2+][C@@H](CC(N)=O)C1CCCCC1	ZINC000096494761	230383924	/nfs/dbraw/zinc/38/39/24/230383924.db2.gz	YQLRTUWEESCHNE-AWEZNQCLSA-N	1	0	263.385	1.939	50	0		CDAARO
c1ccc2[nH]c(C3C[NH+](C[C@H]4CCOC4)C3)nc2c1	ZINC000097742702	230386753	/nfs/dbraw/zinc/38/67/53/230386753.db2.gz	BXAQXGHAKKPOPJ-LLVKDONJSA-N	1	0	257.337	1.999	50	0		CDAARO
CC(C)SCC(=O)N1CCC(O)(C[NH+](C)C)CC1	ZINC000584902172	341986810	/nfs/dbraw/zinc/98/68/10/341986810.db2.gz	MVWPIHVDGQXLBO-UHFFFAOYSA-N	1	0	274.430	1.043	50	0		CDAARO
C[N@@H+]1CC[C@@](C)(Cn2cnc3ccc(F)cc3c2=O)C1	ZINC000584902262	341986868	/nfs/dbraw/zinc/98/68/68/341986868.db2.gz	HNGRHIPAPUTGJR-OAHLLOKOSA-N	1	0	275.327	1.877	50	0		CDAARO
C[C@H]1C[C@H]([NH3+])CCN1C(=O)Cc1noc2ccccc21	ZINC000129266112	230394551	/nfs/dbraw/zinc/39/45/51/230394551.db2.gz	JZUDIZMCCZSVLD-WDEREUQCSA-N	1	0	273.336	1.709	50	0		CDAARO
c1ccc(C[C@@H](CN2CCOCC2)[NH2+][C@@H]2CCOC2)cc1	ZINC000095967899	185046823	/nfs/dbraw/zinc/04/68/23/185046823.db2.gz	YLGIGSOWUQYDQL-SJORKVTESA-N	1	0	290.407	1.308	50	0		CDAARO
CC(C)CSCC[N@@H+]1CCC[C@@H](N2CCNC2=O)C1	ZINC000095976150	185051017	/nfs/dbraw/zinc/05/10/17/185051017.db2.gz	UHGBMSZWWRWVDK-CYBMUJFWSA-N	1	0	285.457	1.865	50	0		CDAARO
CCCC[C@@H](NC1CC[NH+](CCOC)CC1)C(=O)OC	ZINC000095977471	185051955	/nfs/dbraw/zinc/05/19/55/185051955.db2.gz	WAQHSLYBXNLZSK-CQSZACIVSA-N	1	0	286.416	1.419	50	0		CDAARO
CCC[C@H]1CN(C(=O)NC2CC=CC2)CC[N@@H+]1CCOC	ZINC000095980826	185052545	/nfs/dbraw/zinc/05/25/45/185052545.db2.gz	CKPSZBGHTUQGNU-HNNXBMFYSA-N	1	0	295.427	1.847	50	0		CDAARO
COCC[C@H]1CCCC[N@H+](C[C@@H]2CCS(=O)(=O)C2)C1	ZINC000241965751	361754768	/nfs/dbraw/zinc/75/47/68/361754768.db2.gz	UVIGCKKYVRJHBO-KGLIPLIRSA-N	1	0	289.441	1.560	50	0		CDAARO
COCCOc1cccc(C(=O)N2CC[NH2+]C[C@H]2C)c1	ZINC000125218294	187175260	/nfs/dbraw/zinc/17/52/60/187175260.db2.gz	CABVAUITXVAWTI-GFCCVEGCSA-N	1	0	278.352	1.146	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)[C@@H](C)c1c(F)cccc1F	ZINC000195554086	342625767	/nfs/dbraw/zinc/62/57/67/342625767.db2.gz	CXGNCIGNRVUNIA-AXTRIDKLSA-N	1	0	284.306	1.171	50	0		CDAARO
[NH3+][C@@H](C(=O)N1CCOC2(CCOCC2)C1)c1ccccc1	ZINC000195554444	342625881	/nfs/dbraw/zinc/62/58/81/342625881.db2.gz	HJENACZVSIBLBQ-CQSZACIVSA-N	1	0	290.363	1.094	50	0		CDAARO
CCC(O)(CC)C[N@@H+]1CCCC[C@@H](N2CCN(C)CC2)C1	ZINC000195553351	342626753	/nfs/dbraw/zinc/62/67/53/342626753.db2.gz	MXLLXSXRVMEAPU-MRXNPFEDSA-N	1	0	297.487	1.639	50	0		CDAARO
COc1ccc(N2C(=O)C[C@@H]([NH2+]CC3CC3)C2=O)cc1	ZINC000083251950	178370151	/nfs/dbraw/zinc/37/01/51/178370151.db2.gz	QATLTGNYAGNVSK-CYBMUJFWSA-N	1	0	274.320	1.327	50	0		CDAARO
CN(CCn1cncn1)CC[N@H+](C)C1CCCC1	ZINC000243893325	361828559	/nfs/dbraw/zinc/82/85/59/361828559.db2.gz	APUPKNDKWJKAHE-UHFFFAOYSA-N	1	0	251.378	1.084	50	0		CDAARO
c1ccc(CC[NH+]2CCC(Oc3ncccn3)CC2)nc1	ZINC000243893827	361828940	/nfs/dbraw/zinc/82/89/40/361828940.db2.gz	AUPCIJLQYZLDTE-UHFFFAOYSA-N	1	0	284.363	1.958	50	0		CDAARO
C[C@H](Cc1cnccn1)[N@H+](C)CCc1ccccn1	ZINC000243901591	361831306	/nfs/dbraw/zinc/83/13/06/361831306.db2.gz	BCYLTBRJNQSATN-CYBMUJFWSA-N	1	0	256.353	1.977	50	0		CDAARO
C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1C[C@@H](O)CN1CCOCC1	ZINC000252581982	361857173	/nfs/dbraw/zinc/85/71/73/361857173.db2.gz	VMDZXINKFCTKOC-FXUDXRNXSA-N	1	0	282.428	1.333	50	0		CDAARO
CC(C)Cc1noc(CNC(=O)C[N@@H+]2C[C@@H]3CC[C@H]2C3)n1	ZINC000244811585	361865496	/nfs/dbraw/zinc/86/54/96/361865496.db2.gz	SHGABLRYNLYUTF-NEPJUHHUSA-N	1	0	292.383	1.369	50	0		CDAARO
COCCn1cncc1C[N@H+](C)CCc1ccccn1	ZINC000244866492	361866492	/nfs/dbraw/zinc/86/64/92/361866492.db2.gz	VXBDONINRRFURV-UHFFFAOYSA-N	1	0	274.368	1.599	50	0		CDAARO
Cc1cccc(NC(=O)CC[N@@H+]2CC[C@](O)(CO)C2)c1C	ZINC000244884245	361869537	/nfs/dbraw/zinc/86/95/37/361869537.db2.gz	YIHPIQQCBGZUHE-MRXNPFEDSA-N	1	0	292.379	1.061	50	0		CDAARO
C[C@H](C(=O)NC1CCCC1)[N@H+](C)CC1(C)COC1	ZINC000625788364	342198839	/nfs/dbraw/zinc/19/88/39/342198839.db2.gz	PLHDIXBTRMSAHZ-LLVKDONJSA-N	1	0	254.374	1.402	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1cc(C)cc(F)c1	ZINC000097229410	342204803	/nfs/dbraw/zinc/20/48/03/342204803.db2.gz	KYGAATWFZWMXTK-NSHDSACASA-N	1	0	274.361	1.540	50	0		CDAARO
Cc1cc(=O)[nH]c(N2CC[NH+](Cc3ccccc3)CC2)n1	ZINC000008602242	361996065	/nfs/dbraw/zinc/99/60/65/361996065.db2.gz	AQSRLOWDIDQDBF-UHFFFAOYSA-N	1	0	284.363	1.401	50	0	biogenic,in-vitro	CDAARO
CN1C[C@H]2CC[C@@H](C1)N2C(=O)c1noc2c1CCCC2	ZINC000585134345	342215453	/nfs/dbraw/zinc/21/54/53/342215453.db2.gz	OVZSEHXVPSXJIQ-PHIMTYICSA-N	1	0	275.352	1.472	50	0		CDAARO
Cc1cc([C@@H]2CCC[N@@H+]([C@H]3CCN(C)C3=O)C2)[nH]n1	ZINC000685939594	539045783	/nfs/dbraw/zinc/04/57/83/539045783.db2.gz	WOQNZAFQRHURBK-YPMHNXCESA-N	1	0	262.357	1.128	50	0		CDAARO
C[C@@H]1CN(C(=O)C[N@H+](C)[C@H]2CCc3ccccc32)CCO1	ZINC000249243165	539067070	/nfs/dbraw/zinc/06/70/70/539067070.db2.gz	RSUSNPMZYCPCIY-CJNGLKHVSA-N	1	0	288.391	1.853	50	0		CDAARO
C[C@@H]1CN(C(=O)C[N@H+](C)[C@@H]2CCc3ccccc32)CCO1	ZINC000040489809	539147592	/nfs/dbraw/zinc/14/75/92/539147592.db2.gz	RSUSNPMZYCPCIY-CZUORRHYSA-N	1	0	288.391	1.853	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)[C@H]1CCCO1)c1ccccc1	ZINC000033028897	282178896	/nfs/dbraw/zinc/17/88/96/282178896.db2.gz	KESNIGSTNSUANP-UONOGXRCSA-N	1	0	262.353	1.585	50	0		CDAARO
CN1CCN(Cc2ccc(Cl)s2)[C@@H](CO)C1	ZINC000585116656	362045544	/nfs/dbraw/zinc/04/55/44/362045544.db2.gz	DLXXQYFXQKTSRZ-SECBINFHSA-N	1	0	260.790	1.510	50	0		CDAARO
Cc1cnccc1CC[NH2+][C@@H](C)C[C@@H]1CCCC(=O)N1	ZINC000585117552	362046306	/nfs/dbraw/zinc/04/63/06/362046306.db2.gz	LFRLBLBTBNEXCR-ZFWWWQNUSA-N	1	0	275.396	1.969	50	0		CDAARO
Cc1ccc(O[C@H](C)C(=O)N2CC[C@H](C[NH3+])C2)cc1	ZINC000178556472	362247068	/nfs/dbraw/zinc/24/70/68/362247068.db2.gz	LPVSALNRXDSZAR-CHWSQXEVSA-N	1	0	262.353	1.570	50	0		CDAARO
C[C@@H]1CN(C(=O)COc2ccc(F)cc2F)C[C@@H](C)[NH2+]1	ZINC000179151462	362252576	/nfs/dbraw/zinc/25/25/76/362252576.db2.gz	FWGNGZADWNGSEE-NXEZZACHSA-N	1	0	284.306	1.552	50	0		CDAARO
O=S(=O)(C1CC1)N1CCC([NH2+]C2CCCCC2)CC1	ZINC000084962050	362279406	/nfs/dbraw/zinc/27/94/06/362279406.db2.gz	XUBIVAALTDLLEE-UHFFFAOYSA-N	1	0	286.441	1.865	50	0		CDAARO
C[C@@H](C(=O)Nc1ccccn1)[N@H+](C)CC1(C)COC1	ZINC000252478787	362384298	/nfs/dbraw/zinc/38/42/98/362384298.db2.gz	AVDATUBFEULIEN-NSHDSACASA-N	1	0	263.341	1.377	50	0		CDAARO
C[N@H+](CCC(=O)NCc1cccs1)Cc1cnccn1	ZINC000252500574	362388992	/nfs/dbraw/zinc/38/89/92/362388992.db2.gz	SYAZMVNZKZNWCZ-UHFFFAOYSA-N	1	0	290.392	1.676	50	0		CDAARO
CN(CCC1CCOCC1)c1cc([C@H]2C[C@@H]([NH3+])C2)ncn1	ZINC000252572230	362393850	/nfs/dbraw/zinc/39/38/50/362393850.db2.gz	YZXPYQPTVUPJKO-OKILXGFUSA-N	1	0	290.411	1.934	50	0		CDAARO
CNS(=O)(=O)CC[NH2+]C[C@@H]1C(C)=CCC[C@@H]1C	ZINC000190301570	530017757	/nfs/dbraw/zinc/01/77/57/530017757.db2.gz	RRRROPMCVRZLQF-NWDGAFQWSA-N	1	0	260.403	1.118	50	0		CDAARO
C[C@@H]1CC[NH2+]C[C@@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC000086996425	179376615	/nfs/dbraw/zinc/37/66/15/179376615.db2.gz	JGJCAMQSEJPZRW-HQJQHLMTSA-N	1	0	272.270	1.832	50	0		CDAARO
COCC1(C[NH3+])CCN(C(=O)OC(C)(C)C)CC1	ZINC000215324453	348754729	/nfs/dbraw/zinc/75/47/29/348754729.db2.gz	HBOLSRPBIJXHRR-UHFFFAOYSA-N	1	0	258.362	1.609	50	0		CDAARO
O=C(c1cc(C2CC[NH2+]CC2)ccn1)N1CCC[C@H]1CO	ZINC000584889037	349347896	/nfs/dbraw/zinc/34/78/96/349347896.db2.gz	OGBARLDBGSNUJF-AWEZNQCLSA-N	1	0	289.379	1.146	50	0		CDAARO
CN(CCCn1cccn1)C(=O)C[NH+]1CCCCCCC1	ZINC000584890268	349349496	/nfs/dbraw/zinc/34/94/96/349349496.db2.gz	XOAJIQVKWWAHTH-UHFFFAOYSA-N	1	0	292.427	1.998	50	0		CDAARO
Cc1cc(N[C@@H](Cc2ccccc2)C(N)=O)nc(N(C)C)[nH+]1	ZINC000065370649	362947229	/nfs/dbraw/zinc/94/72/29/362947229.db2.gz	QWUQPLTXDJUQPP-ZDUSSCGKSA-N	1	0	299.378	1.360	50	0		CDAARO
Cc1noc(C)c1C(=O)N1CCCSC[C@@H]1C[NH+](C)C	ZINC000090700192	180027794	/nfs/dbraw/zinc/02/77/94/180027794.db2.gz	JYDIMUBTRBKNHC-LBPRGKRZSA-N	1	0	297.424	1.801	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2cc(-c3ccccn3)n[nH]2)C[C@@H]1C1CC1	ZINC000091364950	180142428	/nfs/dbraw/zinc/14/24/28/180142428.db2.gz	OAEPQEBKGRIBKB-NEPJUHHUSA-N	1	0	297.362	1.281	50	0		CDAARO
CC[N@H+](C)C[C@@H]1CN(C(=O)NC2CCCCC2)C[C@@H]1CO	ZINC000091643992	180214199	/nfs/dbraw/zinc/21/41/99/180214199.db2.gz	KCLQTMCKJAAPRG-ZIAGYGMSSA-N	1	0	297.443	1.521	50	0		CDAARO
CCCn1ncc(C(=O)N(C)CC[NH+](C)C)c1C	ZINC000091624971	180209242	/nfs/dbraw/zinc/20/92/42/180209242.db2.gz	LRAWFGKEEGWGAS-UHFFFAOYSA-N	1	0	252.362	1.235	50	0		CDAARO
COCCN1CCO[C@@H](c2noc(-c3ccccc3)n2)C1	ZINC000096000265	351469112	/nfs/dbraw/zinc/46/91/12/351469112.db2.gz	DTNQJSYZUBVBFB-CYBMUJFWSA-N	1	0	289.335	1.756	50	0		CDAARO
O=C(NCC[NH2+]C1CCCCCC1)c1csnn1	ZINC000122233835	187022353	/nfs/dbraw/zinc/02/23/53/187022353.db2.gz	AWFBJCVCBYZKFS-UHFFFAOYSA-N	1	0	268.386	1.580	50	0		CDAARO
CC(C)c1ccc([C@H](C)NC(=O)[C@@H]2C[C@H](O)C[NH2+]2)cc1	ZINC000037027822	363315104	/nfs/dbraw/zinc/31/51/04/363315104.db2.gz	CLARUPUMSWGCBT-CQDKDKBSSA-N	1	0	276.380	1.710	50	0		CDAARO
C[C@H](NC(=O)[C@H]1C[C@H](O)C[NH2+]1)c1cc2ccccc2o1	ZINC000037030711	363316245	/nfs/dbraw/zinc/31/62/45/363316245.db2.gz	MEQCBFDXUMIDRU-ZMLRMANQSA-N	1	0	274.320	1.333	50	0		CDAARO
NC(=O)c1ccc(N2CCC[N@@H+](C3CCCC3)CC2)nc1	ZINC000265571942	363344438	/nfs/dbraw/zinc/34/44/38/363344438.db2.gz	LQSXLPYWYAJUJA-UHFFFAOYSA-N	1	0	288.395	1.635	50	0		CDAARO
COc1ccc(/C(C)=C\C(=O)N2CC[C@@H](C[NH3+])C2)cc1	ZINC000255034310	355930825	/nfs/dbraw/zinc/93/08/25/355930825.db2.gz	YTUXGPMBHSTNHM-SUIFULHWSA-N	1	0	274.364	1.906	50	0		CDAARO
COc1cc([C@H]2[NH2+]CCc3nc[nH]c32)cc(OC)c1OC	ZINC000003182923	355996451	/nfs/dbraw/zinc/99/64/51/355996451.db2.gz	VYKDKBZUOBCVTK-CYBMUJFWSA-N	1	0	289.335	1.671	50	0	biogenic	CDAARO
CCOC(=O)CSc1nnc([C@@H](N)C(C)C)o1	ZINC000002342436	356072943	/nfs/dbraw/zinc/07/29/43/356072943.db2.gz	WDTNYSGLAURVRU-QMMMGPOBSA-N	1	0	259.331	1.381	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)NCc1ccc(F)cc1)[C@H]1CCCO1	ZINC000097374125	356094713	/nfs/dbraw/zinc/09/47/13/356094713.db2.gz	NNPSNGLPANITQW-BXUZGUMPSA-N	1	0	280.343	1.599	50	0		CDAARO
CCCOc1ccc(CN2CCO[C@@H](C[NH3+])C2)cc1	ZINC000067868882	356096994	/nfs/dbraw/zinc/09/69/94/356096994.db2.gz	BHGMOAWWFCJJTG-HNNXBMFYSA-N	1	0	264.369	1.635	50	0		CDAARO
NC(=O)NC(=O)C[NH2+][C@@H](Cc1ccccc1)c1ccccc1	ZINC000014634166	356393328	/nfs/dbraw/zinc/39/33/28/356393328.db2.gz	KHLYZACJYPMLEG-HNNXBMFYSA-N	1	0	297.358	1.755	50	0		CDAARO
COc1ccccc1NC(=S)NCCC[NH+](C)C	ZINC000004562515	356413655	/nfs/dbraw/zinc/41/36/55/356413655.db2.gz	LEQMYMOWTQELTO-UHFFFAOYSA-N	1	0	267.398	1.933	50	0		CDAARO
Cc1cc(N2CC[NH+](C)CC2)nc2ccc(N)cc12	ZINC000017014089	356451876	/nfs/dbraw/zinc/45/18/76/356451876.db2.gz	AEYTVTXTVQVNJQ-UHFFFAOYSA-N	1	0	256.353	1.877	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COc2ccc(F)cc2)CC1	ZINC000019371871	356483736	/nfs/dbraw/zinc/48/37/36/356483736.db2.gz	VRANUJVVTDQIPC-AWEZNQCLSA-N	1	0	282.359	1.203	50	0		CDAARO
O=C(CN1CC[NH2+]CC1)Nc1ccc(Br)cc1	ZINC000019384518	356484371	/nfs/dbraw/zinc/48/43/71/356484371.db2.gz	TZWKWBPSTJXRFJ-UHFFFAOYSA-N	1	0	298.184	1.293	50	0		CDAARO
[NH3+][C@H]1CCc2ccc(S(=O)(=O)NC3CCCC3)cc21	ZINC000019746045	356499134	/nfs/dbraw/zinc/49/91/34/356499134.db2.gz	ZPIPJWXLRUZXSO-AWEZNQCLSA-N	1	0	280.393	1.854	50	0		CDAARO
C[NH+]1CCN(CCOCCOc2ccccc2Cl)CC1	ZINC000019792468	356504044	/nfs/dbraw/zinc/50/40/44/356504044.db2.gz	BKXWAPZSRGYJQJ-UHFFFAOYSA-N	1	0	298.814	1.983	50	0		CDAARO
[NH3+][C@H](CO)c1ccccc1I	ZINC000072199352	356651814	/nfs/dbraw/zinc/65/18/14/356651814.db2.gz	TVWLODOUGJQDKV-MRVPVSSYSA-N	1	0	263.078	1.283	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)/C=C\c2ccc(-n3ccnc3)cc2)C1	ZINC000255602089	356759189	/nfs/dbraw/zinc/75/91/89/356759189.db2.gz	MLWYFTSHBBNXSJ-BYPUDFOVSA-N	1	0	296.374	1.693	50	0		CDAARO
CC1(C)CC(=O)[C@@H](C[NH+]2CCN(N=O)CC2)C(C)(C)N1O	ZINC000100708549	356807582	/nfs/dbraw/zinc/80/75/82/356807582.db2.gz	DXQPQBLTMFAUFH-LLVKDONJSA-N	1	0	297.379	1.079	50	0		CDAARO
O=S(=O)(c1c(Cl)cccc1Cl)N1CCNCC1	ZINC000034781250	356820205	/nfs/dbraw/zinc/82/02/05/356820205.db2.gz	UIEZGAMKNSOGET-UHFFFAOYSA-N	1	0	295.191	1.587	50	0		CDAARO
CCOc1ccc(C)cc1S(=O)(=O)N1CCN(C)CC1	ZINC000036173490	356863978	/nfs/dbraw/zinc/86/39/78/356863978.db2.gz	QLUNZATXOLAOPL-UHFFFAOYSA-N	1	0	298.408	1.330	50	0		CDAARO
Cc1cc(CN(C)C(=O)[C@@H]([NH3+])c2ccccc2)no1	ZINC000036200374	356865739	/nfs/dbraw/zinc/86/57/39/356865739.db2.gz	QRJKTENJUDTKGU-ZDUSSCGKSA-N	1	0	259.309	1.641	50	0		CDAARO
CN(Cc1ccccc1Br)C(=O)CC[NH3+]	ZINC000037798064	356932501	/nfs/dbraw/zinc/93/25/01/356932501.db2.gz	ZMJJFHRCXVOPOD-UHFFFAOYSA-N	1	0	271.158	1.756	50	0		CDAARO
Ic1ccc(OC2C[NH2+]C2)cc1	ZINC000042769956	357079079	/nfs/dbraw/zinc/07/90/79/357079079.db2.gz	NEJYPHMSMQSEOM-UHFFFAOYSA-N	1	0	275.089	1.642	50	0		CDAARO
COC[C@H]([NH3+])C(=O)N(Cc1cccc(C)c1)C(C)C	ZINC000055060491	357328582	/nfs/dbraw/zinc/32/85/82/357328582.db2.gz	JNLKFBCIGVWEFB-AWEZNQCLSA-N	1	0	264.369	1.706	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1CCN(C(=O)NC1CCCC1)C2	ZINC000067643091	283260702	/nfs/dbraw/zinc/26/07/02/283260702.db2.gz	AQXHMINPOSNYSI-QWHCGFSZSA-N	1	0	251.374	1.807	50	0		CDAARO
COc1cc(NC(=O)C[NH2+]C[C@@H]2CCCO2)cc(OC)c1	ZINC000065396525	357537156	/nfs/dbraw/zinc/53/71/56/357537156.db2.gz	CMPFVOAOUAHLPB-LBPRGKRZSA-N	1	0	294.351	1.411	50	0		CDAARO
CC[N@H+](CCn1cccn1)C1CCN(C(C)=O)CC1	ZINC000065425157	357540118	/nfs/dbraw/zinc/54/01/18/357540118.db2.gz	FSSJXXHLDNRQMZ-UHFFFAOYSA-N	1	0	264.373	1.216	50	0		CDAARO
CCc1nc(CN(C)C(=O)CC[C@H]2CCCC[N@@H+]2C)no1	ZINC000065536468	357548013	/nfs/dbraw/zinc/54/80/13/357548013.db2.gz	RNVVOADDMGZFRZ-GFCCVEGCSA-N	1	0	294.399	1.855	50	0		CDAARO
[NH3+][C@@H](CSc1ccccc1)CC(=O)N1CCOCC1	ZINC000065734271	357550476	/nfs/dbraw/zinc/55/04/76/357550476.db2.gz	GRCXARDDTSJXTN-GFCCVEGCSA-N	1	0	280.393	1.355	50	0	in-vitro	CDAARO
C[NH+](C)CC(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000067726541	357621549	/nfs/dbraw/zinc/62/15/49/357621549.db2.gz	BRUBBEKXHNFSJG-ZDUSSCGKSA-N	1	0	282.771	1.802	50	0		CDAARO
CCn1c(=O)n(CCn2cccc2)nc1[C@H]1CCC[NH2+]C1	ZINC000067515034	357611289	/nfs/dbraw/zinc/61/12/89/357611289.db2.gz	FXUGARYVSKVLBF-ZDUSSCGKSA-N	1	0	289.383	1.033	50	0		CDAARO
C[N@@H+]1CC[C@@H](CNC(=O)C(=O)Nc2ccccc2Cl)C1	ZINC000067675162	357618130	/nfs/dbraw/zinc/61/81/30/357618130.db2.gz	UXZLAYJKDYAFEO-JTQLQIEISA-N	1	0	295.770	1.346	50	0		CDAARO
CN1C(=O)N[C@@](Cc2ccccc2)(C2CC[NH2+]CC2)C1=O	ZINC000067883631	357634732	/nfs/dbraw/zinc/63/47/32/357634732.db2.gz	GRMLZSWAEWMJPX-INIZCTEOSA-N	1	0	287.363	1.149	50	0		CDAARO
Cc1nc(C(C)C)sc1C(=O)N1CCO[C@H](C[NH3+])C1	ZINC000067908000	357636042	/nfs/dbraw/zinc/63/60/42/357636042.db2.gz	NBCRPJJHWJPYCO-SNVBAGLBSA-N	1	0	283.397	1.375	50	0		CDAARO
CN(CC[NH+]1CCCCCC1)C(=O)[C@H]1CCCCO1	ZINC000067895969	357636526	/nfs/dbraw/zinc/63/65/26/357636526.db2.gz	UCFRWPGFQFZDKC-CQSZACIVSA-N	1	0	268.401	1.890	50	0		CDAARO
C[C@@H](C(=O)[O-])[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1	ZINC000299750537	357730529	/nfs/dbraw/zinc/73/05/29/357730529.db2.gz	NTCABUITIDBDLJ-UONOGXRCSA-N	1	0	268.401	1.903	50	0		CDAARO
c1cncc(C[C@@H]2CC[C@H](C[N@@H+]3CCCOCC3)O2)c1	ZINC000072423526	357834043	/nfs/dbraw/zinc/83/40/43/357834043.db2.gz	ODCHZESAOVOBDG-JKSUJKDBSA-N	1	0	276.380	1.894	50	0		CDAARO
Cc1cc(N2CCC[C@@H]([NH+](C)C)C2)n2nccc2n1	ZINC000072440136	357836241	/nfs/dbraw/zinc/83/62/41/357836241.db2.gz	VPMRHAILHJMFER-GFCCVEGCSA-N	1	0	259.357	1.568	50	0		CDAARO
NC(=O)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1F	ZINC000097113851	357982773	/nfs/dbraw/zinc/98/27/73/357982773.db2.gz	QPQSDZYZTPNSQW-YPMHNXCESA-N	1	0	250.317	1.959	50	0		CDAARO
CCS(=O)(=O)NCCCNc1cccc(C)[nH+]1	ZINC000097163274	358004422	/nfs/dbraw/zinc/00/44/22/358004422.db2.gz	IEALVKUAYCXYLG-UHFFFAOYSA-N	1	0	257.359	1.131	50	0		CDAARO
C(CN1CCOCC1)[NH2+]C1C2CC3CC(C2)CC1C3	ZINC000019636635	358103469	/nfs/dbraw/zinc/10/34/69/358103469.db2.gz	BSUNWRLDTPWIDK-UHFFFAOYSA-N	1	0	264.413	1.733	50	0		CDAARO
CCCc1cc(C(=O)N[C@H]2Cc3ccccc3[C@@H]2[NH3+])n(C)n1	ZINC000082161561	358149505	/nfs/dbraw/zinc/14/95/05/358149505.db2.gz	HAQUEXHXXKVCNU-HOCLYGCPSA-N	1	0	298.390	1.727	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)c1ccccc1OC	ZINC000130050474	358297517	/nfs/dbraw/zinc/29/75/17/358297517.db2.gz	MFZSHQCFXZZIQI-UHFFFAOYSA-N	1	0	286.397	1.491	50	0		CDAARO
CC[N@@H+]1CC[C@H](N(C)S(=O)(=O)c2cccnc2)[C@@H](C)C1	ZINC000195530979	358559317	/nfs/dbraw/zinc/55/93/17/358559317.db2.gz	GVTGNSHPRCJXKX-JSGCOSHPSA-N	1	0	297.424	1.432	50	0		CDAARO
[NH3+]CCCNS(=O)(=O)Cc1c(Cl)cccc1Cl	ZINC000195544495	358559852	/nfs/dbraw/zinc/55/98/52/358559852.db2.gz	ULDVKJDYAHYWRQ-UHFFFAOYSA-N	1	0	297.207	1.762	50	0		CDAARO
COC(=O)c1cc2cc(N3CC[NH2+]CC3)ccc2o1	ZINC000220448517	358626473	/nfs/dbraw/zinc/62/64/73/358626473.db2.gz	KQFZJWQYXVMNHM-UHFFFAOYSA-N	1	0	260.293	1.629	50	0		CDAARO
Cc1cc(C)n(C2CN(c3nc(N)[nH+]c4c3CCCC4)C2)n1	ZINC000095366075	358686470	/nfs/dbraw/zinc/68/64/70/358686470.db2.gz	FYNDTQYEEOYLHO-UHFFFAOYSA-N	1	0	298.394	1.812	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)NCCCNc1cccnc1	ZINC000095372307	358687645	/nfs/dbraw/zinc/68/76/45/358687645.db2.gz	AKXAFPZMMILZFU-HNNXBMFYSA-N	1	0	290.411	1.874	50	0		CDAARO
CCCCn1ccnc1[C@@H]1CCC[N@H+](CCC(N)=O)C1	ZINC000095376079	358689561	/nfs/dbraw/zinc/68/95/61/358689561.db2.gz	HGHVJBNSSSHUCA-CYBMUJFWSA-N	1	0	278.400	1.738	50	0		CDAARO
COCC1(C(=O)N2CCN(c3cc[nH+]cc3)CC2)CCC1	ZINC000097436781	358775957	/nfs/dbraw/zinc/77/59/57/358775957.db2.gz	KJPIYLIKHOJKPW-UHFFFAOYSA-N	1	0	289.379	1.547	50	0		CDAARO
CCc1nccc(C[N@@H+]2CC[C@@]3(C2)CCCN(C)C3=O)n1	ZINC000215122112	358875567	/nfs/dbraw/zinc/87/55/67/358875567.db2.gz	ISMPCNCAZUVLJG-MRXNPFEDSA-N	1	0	288.395	1.483	50	0		CDAARO
C[N@H+]1C[C@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C[C@H]2C1	ZINC000218878883	359069336	/nfs/dbraw/zinc/06/93/36/359069336.db2.gz	ZYOFETBRKFRORK-XUWVNRHRSA-N	1	0	270.376	1.810	50	0		CDAARO
Fc1ccc(N2CC[NH+](CCc3cn[nH]c3)CC2)cc1	ZINC000219897325	359136059	/nfs/dbraw/zinc/13/60/59/359136059.db2.gz	WZVVYGWYLYDANK-UHFFFAOYSA-N	1	0	274.343	1.914	50	0		CDAARO
CSCCC[N@@H+]1CCCn2nc([C@H](C)O)cc2C1	ZINC000221419281	359247819	/nfs/dbraw/zinc/24/78/19/359247819.db2.gz	ZWRWQZXEZRJPDV-NSHDSACASA-N	1	0	269.414	1.895	50	0		CDAARO
CCCC[C@@H]([NH3+])C(=O)NCc1ccccc1-n1cncn1	ZINC000222543294	359352926	/nfs/dbraw/zinc/35/29/26/359352926.db2.gz	MDQZVBZQKDKIQG-CYBMUJFWSA-N	1	0	287.367	1.401	50	0		CDAARO
COc1ccc(C2[C@H](C)N(O)C(C)(C)[N+]2=O)cc1	ZINC000000269044	359416338	/nfs/dbraw/zinc/41/63/38/359416338.db2.gz	QRRMSHOONXKTDS-VIFPVBQESA-N	1	0	250.298	1.824	50	0		CDAARO
CCN(CC[NH+]1CCCCCC1)C(=O)c1c[nH]cn1	ZINC000223967911	359479897	/nfs/dbraw/zinc/47/98/97/359479897.db2.gz	DQMVTFFSSREAPQ-UHFFFAOYSA-N	1	0	264.373	1.748	50	0		CDAARO
COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)C(=O)NC(N)=O	ZINC000012781969	359660536	/nfs/dbraw/zinc/66/05/36/359660536.db2.gz	FKKBGXLWSHSIKZ-VHSXEESVSA-N	1	0	279.340	1.238	50	0		CDAARO
OCC[NH+]1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000032498059	359681723	/nfs/dbraw/zinc/68/17/23/359681723.db2.gz	GNOJXFPWCNLOKG-UHFFFAOYSA-N	1	0	284.787	1.329	50	0		CDAARO
Cc1ccc(C)c(OCC(=O)N2CCC([NH3+])CC2)c1	ZINC000033439545	359695361	/nfs/dbraw/zinc/69/53/61/359695361.db2.gz	GPWIVFYEYBEYLU-UHFFFAOYSA-N	1	0	262.353	1.632	50	0		CDAARO
Cc1[nH]c2ccccc2c1CC(=O)N1CC[NH2+][C@H](C)C1	ZINC000189015377	360651891	/nfs/dbraw/zinc/65/18/91/360651891.db2.gz	FMURVLVDJGEXLV-LLVKDONJSA-N	1	0	271.364	1.839	50	0		CDAARO
Cc1cccc(CSc2nnc(CC[NH3+])n2C)c1	ZINC000426529194	360680250	/nfs/dbraw/zinc/68/02/50/360680250.db2.gz	CJMGQUGJXHGTEC-UHFFFAOYSA-N	1	0	262.382	1.917	50	0		CDAARO
CC(C)Cn1c(C[NH3+])nnc1SCC[C@@H]1CCOC1	ZINC000426545504	360682357	/nfs/dbraw/zinc/68/23/57/360682357.db2.gz	XBWIDXRGBIIEFV-NSHDSACASA-N	1	0	284.429	1.912	50	0		CDAARO
O=C(NC1CCCCC1)N1CCC2(CC1)C[NH2+]CCO2	ZINC000426628105	360690874	/nfs/dbraw/zinc/69/08/74/360690874.db2.gz	BWVRTPOBHXTJGH-UHFFFAOYSA-N	1	0	281.400	1.483	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1C(=O)NCCCOc1cccnc1	ZINC000426382780	360661497	/nfs/dbraw/zinc/66/14/97/360661497.db2.gz	OFKACDFFOQCJEP-OAHLLOKOSA-N	1	0	291.395	1.841	50	0		CDAARO
COCCN(Cc1ccc(F)cc1)C(=O)[C@@H](C)[NH+](C)C	ZINC000426396398	360664098	/nfs/dbraw/zinc/66/40/98/360664098.db2.gz	JWWFHCCSQKSMNU-GFCCVEGCSA-N	1	0	282.359	1.751	50	0		CDAARO
Cc1ncc(/C=C/C(=O)N2CC[C@H](C[NH3+])C2)s1	ZINC000178531777	189124495	/nfs/dbraw/zinc/12/44/95/189124495.db2.gz	CMPFILFBWDFXPD-VMZHVLLKSA-N	1	0	251.355	1.272	50	0		CDAARO
O=C(c1ccc(C[NH+]2CCCC2)cc1)N1CCOCC1	ZINC000013677207	361415084	/nfs/dbraw/zinc/41/50/84/361415084.db2.gz	SZEOQHVMHORYTE-UHFFFAOYSA-N	1	0	274.364	1.755	50	0		CDAARO
CN1C[C@@H](C[NH+]2CCC(C(F)(F)F)CC2)CC1=O	ZINC000618254038	364031721	/nfs/dbraw/zinc/03/17/21/364031721.db2.gz	ATBJIHSNZHRGMS-VIFPVBQESA-N	1	0	264.291	1.739	50	0		CDAARO
CC[N@H+](C)C[C@@H]1CCN(C(=O)N[C@@H](C)c2cn[nH]c2)C1	ZINC000270377594	364572513	/nfs/dbraw/zinc/57/25/13/364572513.db2.gz	VDQXQGUMPCRGIG-RYUDHWBXSA-N	1	0	279.388	1.454	50	0		CDAARO
O=C1NCCCC[C@@H]1[NH2+][C@@H]1CCc2ccccc2C1	ZINC000004022738	364791301	/nfs/dbraw/zinc/79/13/01/364791301.db2.gz	IIXXQBNVBPXGSJ-CABCVRRESA-N	1	0	258.365	1.802	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)c1ccc(-n2cnnc2)cc1	ZINC000172126302	365475081	/nfs/dbraw/zinc/47/50/81/365475081.db2.gz	TYCNMJYINJJMFX-UHFFFAOYSA-N	1	0	285.351	1.093	50	0		CDAARO
CCC1(CC)[C@@H](OC)C[C@@H]1[N@H+](C)CCn1cncn1	ZINC000089948129	366975296	/nfs/dbraw/zinc/97/52/96/366975296.db2.gz	DBHLLYUGMWDOSZ-STQMWFEESA-N	1	0	266.389	1.804	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)COCc1ccccc1Cl	ZINC000126428830	367266838	/nfs/dbraw/zinc/26/68/38/367266838.db2.gz	IBTIXTIXUPDNOV-NSHDSACASA-N	1	0	282.771	1.677	50	0		CDAARO
Cc1ccc(F)cc1C(=O)N[C@@H]1CC[NH2+]C[C@@H]1C	ZINC000094345415	367435696	/nfs/dbraw/zinc/43/56/96/367435696.db2.gz	ZBCSOGYAIKSGKV-GXFFZTMASA-N	1	0	250.317	1.862	50	0		CDAARO
CCOC[C@H](O)C[N@@H+]1CC[C@@H](c2ccccn2)C1	ZINC000252527508	367783206	/nfs/dbraw/zinc/78/32/06/367783206.db2.gz	CSQLBMVRESQGGG-CHWSQXEVSA-N	1	0	250.342	1.268	50	0		CDAARO
CO[C@]1(C)C[C@@H](NC(=O)[C@@H]2CCCC[NH2+]2)C1(C)C	ZINC000121681388	367971430	/nfs/dbraw/zinc/97/14/30/367971430.db2.gz	ZXOAFLJOGGXRMQ-MISXGVKJSA-N	1	0	254.374	1.448	50	0		CDAARO
C[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(C(N)=O)cc2)C1	ZINC000003564663	370225106	/nfs/dbraw/zinc/22/51/06/370225106.db2.gz	YXPAIYNRSPTRGS-LLVKDONJSA-N	1	0	275.352	1.456	50	0		CDAARO
O=c1onc(-c2ccncc2)n1CC[NH+]1CCCCC1	ZINC000193462755	370547626	/nfs/dbraw/zinc/54/76/26/370547626.db2.gz	SPSCRKMHMSKSBH-UHFFFAOYSA-N	1	0	274.324	1.384	50	0		CDAARO
O=C(N[C@H]1C[NH+]2CCC1CC2)c1ccc2c(c1)OCCO2	ZINC000035636071	284244321	/nfs/dbraw/zinc/24/43/21/284244321.db2.gz	LUVXHMJTVXZFPD-ZDUSSCGKSA-N	1	0	288.347	1.282	50	0	in-vitro	CDAARO
CN1CC[N@H+](C)C[C@H]1CNc1nccc2ccccc21	ZINC000168687885	371697874	/nfs/dbraw/zinc/69/78/74/371697874.db2.gz	PBBKXKGOLUOMEI-CQSZACIVSA-N	1	0	270.380	1.893	50	0		CDAARO
Cc1ccc2[nH]c(CCNC(=O)C[C@@H]3CC[NH2+]C3)nc2c1	ZINC000299778800	372754983	/nfs/dbraw/zinc/75/49/83/372754983.db2.gz	OAHZXMGFVTYDKD-LBPRGKRZSA-N	1	0	286.379	1.530	50	0		CDAARO
CC(C)NC(=O)C[C@H](C)[NH2+][C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000107515641	412800386	/nfs/dbraw/zinc/80/03/86/412800386.db2.gz	RVLZQKRZMPYGSR-MELADBBJSA-N	1	0	269.433	1.608	50	0		CDAARO
O=C(Cc1ccc(F)cc1F)NCC[C@H]1CC[NH2+]C1	ZINC000095067642	373708481	/nfs/dbraw/zinc/70/84/81/373708481.db2.gz	ABPLOLFILRRXME-SNVBAGLBSA-N	1	0	268.307	1.623	50	0		CDAARO
CC[N@@H+]1CC[C@@H]2[C@@H](C1)OCCN2C(=O)CC(F)(F)F	ZINC000253416355	373725413	/nfs/dbraw/zinc/72/54/13/373725413.db2.gz	IIEQZEFGDMADIB-NXEZZACHSA-N	1	0	280.290	1.260	50	0		CDAARO
COc1cc(CN2C[C@H](C)O[C@@]3(CCOC3)C2)ccc1O	ZINC000253426119	373734236	/nfs/dbraw/zinc/73/42/36/373734236.db2.gz	FUIGFZQMSNWVRF-LRDDRELGSA-N	1	0	293.363	1.781	50	0		CDAARO
OC1(C[NH2+]Cc2ncc(C3OCCO3)s2)CCCCC1	ZINC000253428267	373734309	/nfs/dbraw/zinc/73/43/09/373734309.db2.gz	IUNNFJZMZIPVFN-UHFFFAOYSA-N	1	0	298.408	1.973	50	0		CDAARO
Cc1ncsc1C(=O)N1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1	ZINC000248561163	189949526	/nfs/dbraw/zinc/94/95/26/189949526.db2.gz	AXEQUSCPSYJJOK-GUBZILKMSA-N	1	0	251.355	1.261	50	0		CDAARO
COCC[C@@H]1CCC[N@H+](CCn2cnnc2C)C1	ZINC000670455480	483031240	/nfs/dbraw/zinc/03/12/40/483031240.db2.gz	HUMZESFHUPGYQX-ZDUSSCGKSA-N	1	0	252.362	1.335	50	0		CDAARO
COc1ccccc1/C=C1\SC(=O)N(CC[NH3+])C1=O	ZINC000012561820	374538649	/nfs/dbraw/zinc/53/86/49/374538649.db2.gz	NSCDHFLVIQHIHK-FLIBITNWSA-N	1	0	278.333	1.690	50	0		CDAARO
c1ccc2c(c1)CC[C@@H]([NH2+]CCc1nnc3n1CCC3)C2	ZINC000095419904	374921356	/nfs/dbraw/zinc/92/13/56/374921356.db2.gz	IFDLSXGKIWLXJA-OAHLLOKOSA-N	1	0	282.391	1.914	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1n[nH]c2c1CCCC2	ZINC000095478539	374970282	/nfs/dbraw/zinc/97/02/82/374970282.db2.gz	LYZHYOWXVLZHPW-LLVKDONJSA-N	1	0	276.384	1.503	50	0		CDAARO
CC[NH+](CC)CCN1CCCC[C@@H]1c1nc[nH]n1	ZINC000096500212	375106701	/nfs/dbraw/zinc/10/67/01/375106701.db2.gz	OABXLPWUWFYVGW-GFCCVEGCSA-N	1	0	251.378	1.674	50	0		CDAARO
NC(=O)C[C@H]([NH2+]Cc1ccsc1)C1CCOCC1	ZINC000097037631	375139619	/nfs/dbraw/zinc/13/96/19/375139619.db2.gz	RQMJYDDFGMMVPK-LBPRGKRZSA-N	1	0	268.382	1.508	50	0		CDAARO
C[C@@H](Cc1ccc(F)cc1)[NH2+]CC(C)(C)C(N)=O	ZINC000097084670	375146418	/nfs/dbraw/zinc/14/64/18/375146418.db2.gz	KPYSITKLVBCHCV-JTQLQIEISA-N	1	0	252.333	1.858	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C[C@@H](O)COCC(C)C	ZINC000097160027	375151578	/nfs/dbraw/zinc/15/15/78/375151578.db2.gz	SQZQLGVHCHUJJU-GFCCVEGCSA-N	1	0	255.362	1.150	50	0		CDAARO
CC(C)[C@H](Oc1ccc(F)cc1F)C(=O)N1CC[C@H]([NH3+])C1	ZINC000299738955	375199172	/nfs/dbraw/zinc/19/91/72/375199172.db2.gz	ITXMYRGMCPTXMT-FZMZJTMJSA-N	1	0	298.333	1.928	50	0		CDAARO
O=C(NCc1cc2cc(F)ccc2s1)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000299749645	375207116	/nfs/dbraw/zinc/20/71/16/375207116.db2.gz	LDGGVKKZUDIVNB-JQWIXIFHSA-N	1	0	294.351	1.379	50	0		CDAARO
Cn1ccnc1C(=O)N1CCCC[C@@H]1C[NH+]1CCCC1	ZINC000215695354	375278383	/nfs/dbraw/zinc/27/83/83/375278383.db2.gz	UAVVQYHULSTLNB-CYBMUJFWSA-N	1	0	276.384	1.511	50	0		CDAARO
CC(C)c1nn(C)c(N(C)C)c1C[NH2+][C@@H]1CCCN(C)C1	ZINC000058428409	375757505	/nfs/dbraw/zinc/75/75/05/375757505.db2.gz	XXIRMLPUZRMQTM-CYBMUJFWSA-N	1	0	293.459	1.793	50	0		CDAARO
C1CC1c1noc(N2C[C@@H]3[C@H]4CCCC[N@H+]4C[C@@H]3C2)n1	ZINC000242100113	376021894	/nfs/dbraw/zinc/02/18/94/376021894.db2.gz	WEKSKOIGLMVQFK-FRRDWIJNSA-N	1	0	274.368	1.868	50	0		CDAARO
Cc1ccc(CN2C[C@H]([C@H](C)O)[NH2+]C[C@H]2[C@@H](C)O)cc1F	ZINC000585657553	376360962	/nfs/dbraw/zinc/36/09/62/376360962.db2.gz	LOAGMTIBSYNWDE-OJDYBEQGSA-N	1	0	296.386	1.038	50	0		CDAARO
CCn1cc(CN2CC[N@H+](C)C[C@H]2C(C)C)cn1	ZINC000248416924	377840717	/nfs/dbraw/zinc/84/07/17/377840717.db2.gz	QKIJORZJRJEAPJ-AWEZNQCLSA-N	1	0	250.390	1.675	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CCC[C@@H]2C[NH3+])cc1OC	ZINC000492998436	253344438	/nfs/dbraw/zinc/34/44/38/253344438.db2.gz	YJWWXMNTYOHCTM-FWPCIQOSSA-N	1	0	290.363	1.667	50	0		CDAARO
CCOC(=O)C1(C(=O)c2ccccc2)CC[NH2+]CC1	ZINC000093517674	184687244	/nfs/dbraw/zinc/68/72/44/184687244.db2.gz	OQRIKIODRKYYBW-UHFFFAOYSA-N	1	0	261.321	1.802	50	0		CDAARO
CC[NH+]1CCC(CC(=O)N[C@H](C)Cc2cnccn2)CC1	ZINC000095355885	184950640	/nfs/dbraw/zinc/95/06/40/184950640.db2.gz	NRTCGWNWUMRVLZ-CYBMUJFWSA-N	1	0	290.411	1.646	50	0		CDAARO
O=S(=O)(/C=C\c1ccccc1)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000255583067	390280433	/nfs/dbraw/zinc/28/04/33/390280433.db2.gz	PDHTVMCUUHTGJD-PINLSGDHSA-N	1	0	292.404	1.767	50	0		CDAARO
CC(C)CNC(=O)C[NH2+][C@@](C)(CO)C1CCCCC1	ZINC000096420072	390514182	/nfs/dbraw/zinc/51/41/82/390514182.db2.gz	SYOOOIFQZCOPBW-HNNXBMFYSA-N	1	0	270.417	1.680	50	0		CDAARO
O=C(N[C@@H]1CC[N@H+](CC2CCCC2)C1)[C@@H]1CCCOC1	ZINC000096431854	390520091	/nfs/dbraw/zinc/52/00/91/390520091.db2.gz	YZJRSFOBPNVZRI-HUUCEWRRSA-N	1	0	280.412	1.794	50	0		CDAARO
COc1cc(F)c(C(=O)N(C)[C@@H]2CC[NH2+]C2)cc1OC	ZINC000179053935	390938682	/nfs/dbraw/zinc/93/86/82/390938682.db2.gz	SZYAJEWXRGUIJU-SECBINFHSA-N	1	0	282.315	1.277	50	0		CDAARO
CC(C)(C)c1ncc2c(n1)CC(C)(C)C[C@@H]2NC(=O)C[NH3+]	ZINC000091535469	390890650	/nfs/dbraw/zinc/89/06/50/390890650.db2.gz	FHUQTVLDWYFSHJ-NSHDSACASA-N	1	0	290.411	1.863	50	0		CDAARO
CCC[N@@H+]1CC[C@H](CNC(=O)Cc2cc(C)no2)C1	ZINC000220214755	391078404	/nfs/dbraw/zinc/07/84/04/391078404.db2.gz	BKFVBIHLVPPCKN-GFCCVEGCSA-N	1	0	265.357	1.374	50	0		CDAARO
Cc1cccc(S(=O)(=O)N2CCC[C@H]([NH3+])C2)c1	ZINC000019874270	391264652	/nfs/dbraw/zinc/26/46/52/391264652.db2.gz	ATORHJOYADWXAP-NSHDSACASA-N	1	0	254.355	1.107	50	0		CDAARO
C[C@@H]1CCSCC[N@@H+]1C[C@@H](O)COC(C)(C)C	ZINC000241644158	391333202	/nfs/dbraw/zinc/33/32/02/391333202.db2.gz	POSIQBPLJALLAP-VXGBXAGGSA-N	1	0	261.431	1.990	50	0		CDAARO
CC[C@H](C(=O)[O-])[N@@H+]1CC[C@@H](CNc2cccc(C)[nH+]2)C1	ZINC000248963034	391541063	/nfs/dbraw/zinc/54/10/63/391541063.db2.gz	NELRWQPZGWPYAU-QWHCGFSZSA-N	1	0	277.368	1.987	50	0		CDAARO
Nc1ccncc1C(=O)N1CC[NH+](C2CCCC2)CC1	ZINC000178006578	391755541	/nfs/dbraw/zinc/75/55/41/391755541.db2.gz	DDWUKJXXZBTJCR-UHFFFAOYSA-N	1	0	274.368	1.364	50	0		CDAARO
O=C(c1n[nH]c2c1CCCC2)N1CCc2[nH]cnc2C1	ZINC000646257052	392211475	/nfs/dbraw/zinc/21/14/75/392211475.db2.gz	PRMIHSHYUQMBBC-UHFFFAOYSA-N	1	0	271.324	1.210	50	0		CDAARO
CN(C[C@@H]1CCCCO1)C(=O)[C@H]1CCCCC[C@@H]1[NH3+]	ZINC000094752828	392509369	/nfs/dbraw/zinc/50/93/69/392509369.db2.gz	BEENGRHAQNSIEJ-IHRRRGAJSA-N	1	0	268.401	1.922	50	0		CDAARO
C[C@H](C[NH+]1CCCCC1)NC(=O)c1cnn2c1CCCC2	ZINC000126914001	392598429	/nfs/dbraw/zinc/59/84/29/392598429.db2.gz	PBSADFBYAFOBBZ-CYBMUJFWSA-N	1	0	290.411	1.824	50	0		CDAARO
COC(=O)CCC[N@@H+]1C[C@H](O)C[C@@H]1c1cccc(F)c1	ZINC000281894686	393161184	/nfs/dbraw/zinc/16/11/84/393161184.db2.gz	QFRCSYHMLNCSRO-ZIAGYGMSSA-N	1	0	281.327	1.887	50	0		CDAARO
COC[C@@H](O)C[N@@H+]1CCc2c(Cl)cccc2C1	ZINC000096417902	393183231	/nfs/dbraw/zinc/18/32/31/393183231.db2.gz	HVKHHZHSASSUSD-NSHDSACASA-N	1	0	255.745	1.705	50	0		CDAARO
O=C1[C@H]([NH2+]C2CCOCC2)CCCN1CC(F)(F)F	ZINC000090592357	483266289	/nfs/dbraw/zinc/26/62/89/483266289.db2.gz	LCXVVASMEKDMNN-SNVBAGLBSA-N	1	0	280.290	1.308	50	0		CDAARO
CNC(=O)CC[N@H+](C)[C@H]1CCCN(c2ccccc2)C1	ZINC000089386069	135059457	/nfs/dbraw/zinc/05/94/57/135059457.db2.gz	WNGBIQZTWSATDF-HNNXBMFYSA-N	1	0	275.396	1.723	50	0		CDAARO
C[C@@H]1C[C@H](C[NH3+])CN1C(=O)c1cccc2[nH]ncc21	ZINC000261623404	140364836	/nfs/dbraw/zinc/36/48/36/140364836.db2.gz	CELBKIFQXGOIQI-NXEZZACHSA-N	1	0	258.325	1.372	50	0		CDAARO
C[C@@H](NC(=O)N1CC[C@H](C[NH+](C)C)C1)c1ccco1	ZINC000097101594	397967007	/nfs/dbraw/zinc/96/70/07/397967007.db2.gz	CBYLHNZOQCEATP-VXGBXAGGSA-N	1	0	265.357	1.934	50	0		CDAARO
C[C@H](C(=O)NC(=O)NC1CCCC1)[N@@H+]1CCC[C@H](C)C1	ZINC000103422583	397902249	/nfs/dbraw/zinc/90/22/49/397902249.db2.gz	DLPYQIMDWHNFQY-NWDGAFQWSA-N	1	0	281.400	1.875	50	0		CDAARO
[NH3+]C[C@H]1CC[C@@H](C(=O)Nc2ccc3n[nH]cc3c2)O1	ZINC000094566275	147091687	/nfs/dbraw/zinc/09/16/87/147091687.db2.gz	NHZKFLVMPGQEEV-PWSUYJOCSA-N	1	0	260.297	1.008	50	0		CDAARO
O=C(Cc1ccc(F)cc1F)NC1C[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000095067585	147110589	/nfs/dbraw/zinc/11/05/89/147110589.db2.gz	ZRCDVUXLWGJWCG-FUNVUKJBSA-N	1	0	280.318	1.907	50	0		CDAARO
Cc1ccc(OCCC(=O)N(C)[C@@H]2CC[NH2+]C2)cc1C	ZINC000179120123	292167240	/nfs/dbraw/zinc/16/72/40/292167240.db2.gz	FXUBFQIRONYXDV-CQSZACIVSA-N	1	0	276.380	1.893	50	0		CDAARO
CCOc1c(F)cccc1C(=O)NC[C@@H]1CCC[NH2+]1	ZINC000178723799	148080986	/nfs/dbraw/zinc/08/09/86/148080986.db2.gz	LLGSONCZWQXAES-JTQLQIEISA-N	1	0	266.316	1.706	50	0		CDAARO
COCCCNC(=O)[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C	ZINC000034938542	292362403	/nfs/dbraw/zinc/36/24/03/292362403.db2.gz	RIQBSKGFCAYSLS-AVGNSLFASA-N	1	0	256.390	1.696	50	0		CDAARO
C[C@](C[NH3+])(NS(=O)(=O)c1ccccc1)c1ccccc1	ZINC000004854935	170031195	/nfs/dbraw/zinc/03/11/95/170031195.db2.gz	CVDKJMWPWHYCTA-OAHLLOKOSA-N	1	0	290.388	1.839	50	0		CDAARO
Cn1nnnc1SCC[NH2+]Cc1ccccc1Cl	ZINC000004998031	170052264	/nfs/dbraw/zinc/05/22/64/170052264.db2.gz	USXKNIHECQCJDF-UHFFFAOYSA-N	1	0	283.788	1.745	50	0		CDAARO
COC(=O)c1ccc(OC[C@@H](O)C[NH2+]C2CCCC2)cc1	ZINC000005068359	170063482	/nfs/dbraw/zinc/06/34/82/170063482.db2.gz	KRVPGTVVOMNKKV-AWEZNQCLSA-N	1	0	293.363	1.745	50	0		CDAARO
COc1ccc(/C=C/C(=O)NCCC[NH+](C)C)cc1OC	ZINC000006125805	170178210	/nfs/dbraw/zinc/17/82/10/170178210.db2.gz	JXRUEARERFJWTJ-VQHVLOKHSA-N	1	0	292.379	1.785	50	0		CDAARO
CC(C)=CCC/C(C)=C/C[NH2+]C[C@@H](O)CN1CCOCC1	ZINC000006651172	170222418	/nfs/dbraw/zinc/22/24/18/170222418.db2.gz	YDVLBLYSTSGULM-DYFCPDHGSA-N	1	0	296.455	1.962	50	0		CDAARO
[NH3+][C@@H]1CCCN(S(=O)(=O)c2cccc(Cl)c2)C1	ZINC000020432362	171197129	/nfs/dbraw/zinc/19/71/29/171197129.db2.gz	BSSRXMXIPCTWMF-SNVBAGLBSA-N	1	0	274.773	1.452	50	0		CDAARO
C[NH+](C)CCNC(=O)c1ccc(CN2CCCC2=O)cc1	ZINC000020491331	171226939	/nfs/dbraw/zinc/22/69/39/171226939.db2.gz	CDTFDBWSSUJAMF-UHFFFAOYSA-N	1	0	289.379	1.100	50	0		CDAARO
CC[NH+](CC)CCn1c(=O)c2ccc[nH]c-2nc1=S	ZINC000020618219	171267936	/nfs/dbraw/zinc/26/79/36/171267936.db2.gz	GPVUSGXAIJKSKX-UHFFFAOYSA-N	1	0	278.381	1.422	50	0		CDAARO
C[C@@H]1CN(CCOc2ccccc2C=O)C[C@@H](C)O1	ZINC000020652934	171269219	/nfs/dbraw/zinc/26/92/19/171269219.db2.gz	MEFQSSDZWAILIF-CHWSQXEVSA-N	1	0	263.337	1.987	50	0		CDAARO
O=C(c1cc(F)ccc1Br)N1CC[NH2+]CC1	ZINC000021956527	171341479	/nfs/dbraw/zinc/34/14/79/171341479.db2.gz	LXHLVBUDHFHDGH-UHFFFAOYSA-N	1	0	287.132	1.634	50	0		CDAARO
COc1ccccc1C[C@H](C)[NH2+][C@@H]1CCS(=O)(=O)C1	ZINC000037509963	173243546	/nfs/dbraw/zinc/24/35/46/173243546.db2.gz	KGYVVSVHOHKTCK-WCQYABFASA-N	1	0	283.393	1.403	50	0		CDAARO
C[C@H](CO)[NH2+]C1CCN(CCc2ccccc2)CC1	ZINC000037515635	173247520	/nfs/dbraw/zinc/24/75/20/173247520.db2.gz	UBCPOHABJFUGBE-CQSZACIVSA-N	1	0	262.397	1.664	50	0		CDAARO
Cc1cc2c(c(-c3cncc(N(C)C)n3)c1)O[C@@H](C[NH3+])C2	ZINC000067541289	175777184	/nfs/dbraw/zinc/77/71/84/175777184.db2.gz	JYTWIOFZGFFSNK-GFCCVEGCSA-N	1	0	284.363	1.780	50	0		CDAARO
COc1ccc(-c2cc(N3CC[C@H]([NH3+])C3)n[nH]2)cc1	ZINC000070460192	175942292	/nfs/dbraw/zinc/94/22/92/175942292.db2.gz	WLRGIABPSCXRCE-NSHDSACASA-N	1	0	258.325	1.623	50	0		CDAARO
Cc1nnsc1CN(C)C(=O)[C@H]([NH3+])CC(C)C	ZINC000071707953	176248699	/nfs/dbraw/zinc/24/86/99/176248699.db2.gz	XGGWQOSWZPGXOC-SECBINFHSA-N	1	0	256.375	1.178	50	0		CDAARO
CN1C[C@@]2(CCC[N@H+](Cc3cccnc3N)CC2)OC1=O	ZINC000072141664	176323776	/nfs/dbraw/zinc/32/37/76/176323776.db2.gz	IIJDVPWREHGHAO-HNNXBMFYSA-N	1	0	290.367	1.471	50	0		CDAARO
CSc1cccc(CN(C)C(=O)C[C@H]2COCC[NH2+]2)c1	ZINC000072168001	176331533	/nfs/dbraw/zinc/33/15/33/176331533.db2.gz	BSPQLVGZTLDGOA-ZDUSSCGKSA-N	1	0	294.420	1.745	50	0		CDAARO
CCc1cc(NCC[NH+]2CCCC2)n2nccc2n1	ZINC000072425291	176401816	/nfs/dbraw/zinc/40/18/16/176401816.db2.gz	ITVBJRLCQURLKL-UHFFFAOYSA-N	1	0	259.357	1.799	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1cc(-c2ccco2)n[nH]1	ZINC000079098392	177433489	/nfs/dbraw/zinc/43/34/89/177433489.db2.gz	ZLCJHDNHXHBZHF-UHFFFAOYSA-N	1	0	262.313	1.351	50	0		CDAARO
C[C@@H]1CCCC[C@H]1NC(=O)CN1CCCC[C@@H]1C(N)=O	ZINC000009727196	260037597	/nfs/dbraw/zinc/03/75/97/260037597.db2.gz	WYMKZSHLTVPKQF-JHJVBQTASA-N	1	0	281.400	1.021	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2ccnc(-n3ccnc3)c2)[C@H]1C[NH3+]	ZINC000179226521	274289843	/nfs/dbraw/zinc/28/98/43/274289843.db2.gz	HARKAPMUXJLUDN-OCCSQVGLSA-N	1	0	299.378	1.467	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)[C@@H]2CSc3ccccc32)C1	ZINC000092239194	274956226	/nfs/dbraw/zinc/95/62/26/274956226.db2.gz	KLEBOJXWEVYRFZ-ZYHUDNBSSA-N	1	0	262.378	1.826	50	0		CDAARO
CC(C)(C)[C@H]([NH3+])C(=O)N1CCC(c2ccncn2)CC1	ZINC000252491976	275530061	/nfs/dbraw/zinc/53/00/61/275530061.db2.gz	MAOHHDBBISIYOM-CYBMUJFWSA-N	1	0	276.384	1.556	50	0		CDAARO
C([NH2+]C(C1CC1)C1CC1)[C@@H]1COC2(CCOCC2)O1	ZINC000097039012	275725573	/nfs/dbraw/zinc/72/55/73/275725573.db2.gz	KVFHWXRFGMIOOV-CYBMUJFWSA-N	1	0	267.369	1.687	50	0		CDAARO
CC(=O)N1CCC([NH2+]Cc2ccc(F)cc2)CC1	ZINC000032916993	275759791	/nfs/dbraw/zinc/75/97/91/275759791.db2.gz	FDCNRTNMLPCSNN-UHFFFAOYSA-N	1	0	250.317	1.926	50	0		CDAARO
CC[NH+](CC)CCc1nc2c([nH]1)C(=O)NCC(C)(C)C2	ZINC000095372940	276101938	/nfs/dbraw/zinc/10/19/38/276101938.db2.gz	KYSGPFWEXFRLLD-UHFFFAOYSA-N	1	0	278.400	1.606	50	0		CDAARO
CCS(=O)(=O)N1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1	ZINC000019850716	276505298	/nfs/dbraw/zinc/50/52/98/276505298.db2.gz	DSKJNSAMSJTGHR-STQMWFEESA-N	1	0	274.430	1.532	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)[C@@H]2CCOc3ccccc32)C1	ZINC000111189056	277033427	/nfs/dbraw/zinc/03/34/27/277033427.db2.gz	MNBQZSURIZHWTP-TZMCWYRMSA-N	1	0	274.364	1.621	50	0		CDAARO
C[NH+]1CCN(c2ccc(Br)nc2)CC1	ZINC000072193004	277112715	/nfs/dbraw/zinc/11/27/15/277112715.db2.gz	VCDWKCPGKQANIF-UHFFFAOYSA-N	1	0	256.147	1.596	50	0		CDAARO
CC(C)(C)OC(=O)N1CCO[C@]2(CCCC[C@@H]2[NH3+])C1	ZINC000306140504	277189984	/nfs/dbraw/zinc/18/99/84/277189984.db2.gz	UVNQOHDCZZUHKK-SMDDNHRTSA-N	1	0	270.373	1.894	50	0		CDAARO
COc1cc(C)c(S(=O)(=O)N2CCC[C@H]([NH3+])C2)c(C)c1	ZINC000036296968	277372997	/nfs/dbraw/zinc/37/29/97/277372997.db2.gz	ATDVKODZNPCLHC-LBPRGKRZSA-N	1	0	298.408	1.424	50	0		CDAARO
CCC(CC)n1ncc(C)c1NC(=O)C[C@@H]1C[NH2+]CCO1	ZINC000055385626	278614057	/nfs/dbraw/zinc/61/40/57/278614057.db2.gz	JXUIGYYLYRYUMC-CYBMUJFWSA-N	1	0	294.399	1.870	50	0		CDAARO
CCC1(CC)[C@H]([NH2+][C@H]2CCN(C)C2=O)C[C@H]1OC	ZINC000247972899	278636797	/nfs/dbraw/zinc/63/67/97/278636797.db2.gz	JUUQWCUWCHJGIM-QJPTWQEYSA-N	1	0	254.374	1.400	50	0		CDAARO
Cc1ccc(C[NH2+]C2CCN(S(C)(=O)=O)CC2)c(C)c1	ZINC000030656235	279138228	/nfs/dbraw/zinc/13/82/28/279138228.db2.gz	ZSYGOMDTYBSBLI-UHFFFAOYSA-N	1	0	296.436	1.817	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)[C@@H]2COc3ccc(Cl)cc3C2)C1	ZINC000195115063	279686424	/nfs/dbraw/zinc/68/64/24/279686424.db2.gz	QPHJJVDCHBTVBD-AAEUAGOBSA-N	1	0	294.782	1.841	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCO[C@@H](c2ccccc2Cl)C1	ZINC000129742112	280164048	/nfs/dbraw/zinc/16/40/48/280164048.db2.gz	INOOKBWGCMMTOX-CHWSQXEVSA-N	1	0	282.771	1.977	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1C[C@@H](C)OC[C@H]1c1ccccc1	ZINC000253432749	280874365	/nfs/dbraw/zinc/87/43/65/280874365.db2.gz	NKALIXWFNBCPJQ-XBFCOCLRSA-N	1	0	262.353	1.712	50	0		CDAARO
Cc1ccccc1CN1CCN([C@@H]2CC[NH2+]C2)C1=O	ZINC000085347889	281342214	/nfs/dbraw/zinc/34/22/14/281342214.db2.gz	DCDZNBZQZCZEGM-CQSZACIVSA-N	1	0	259.353	1.595	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)/C=C\c2ccnc3ccccc23)C1	ZINC000255054902	289352984	/nfs/dbraw/zinc/35/29/84/289352984.db2.gz	RFTPGSMEPGPQLE-SZZPACECSA-N	1	0	267.332	1.808	50	0		CDAARO
C[C@@H]([NH2+]CCN1CCC(O)CC1)c1cn2ccccc2n1	ZINC000568411007	294033544	/nfs/dbraw/zinc/03/35/44/294033544.db2.gz	DXYANAFFVRJWAG-CYBMUJFWSA-N	1	0	288.395	1.442	50	0		CDAARO
[NH2+]=C1N[C@H](C(=O)c2ccccc2)[C@H](c2ccccc2)N1	ZINC000000173756	295210267	/nfs/dbraw/zinc/21/02/67/295210267.db2.gz	HVZBMAKCDGCFLE-KBPBESRZSA-N	1	0	265.316	1.897	50	0		CDAARO
C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1CCCS(N)(=O)=O	ZINC000247646496	297313716	/nfs/dbraw/zinc/31/37/16/297313716.db2.gz	UMPXEJBOHSSRQR-GRYCIOLGSA-N	1	0	260.403	1.318	50	0		CDAARO
COc1ccc(CC[C@@H](C)[NH2+]Cc2nc(N)n[nH]2)cc1	ZINC000534574447	328309489	/nfs/dbraw/zinc/30/94/89/328309489.db2.gz	LLZQDJLOMCIKSP-SNVBAGLBSA-N	1	0	275.356	1.337	50	0		CDAARO
CC(C)(C(=O)NCC[C@H]1CCOC1)[NH+]1CCCC1	ZINC000534580367	328311627	/nfs/dbraw/zinc/31/16/27/328311627.db2.gz	MCJXFFPMSUKGET-LBPRGKRZSA-N	1	0	254.374	1.404	50	0		CDAARO
CC[C@@H](C[NH+](C)C)NC(=O)N1CC(Oc2ccccc2)C1	ZINC000534588401	328316443	/nfs/dbraw/zinc/31/64/43/328316443.db2.gz	OBTLGJCKRGYYCW-ZDUSSCGKSA-N	1	0	291.395	1.799	50	0		CDAARO
CCN1CCC(CNc2nc(C)cnc2C)([NH+](C)C)CC1	ZINC000534635629	328333553	/nfs/dbraw/zinc/33/35/53/328333553.db2.gz	GCSQYCVBYQOMJB-UHFFFAOYSA-N	1	0	291.443	1.921	50	0		CDAARO
O=C(NC[C@@]1(O)CCC[NH2+]C1)C12CC3CC(CC(C3)C1)C2	ZINC000534640020	328335375	/nfs/dbraw/zinc/33/53/75/328335375.db2.gz	BLQOGPNHYGSKSW-BQAHKBOESA-N	1	0	292.423	1.434	50	0		CDAARO
Cc1cccc(N2CCN(C(=O)[C@@H]3C=CC[NH2+]3)CC2)c1C	ZINC000534653042	328338183	/nfs/dbraw/zinc/33/81/83/328338183.db2.gz	QABMGZJSRQMLSJ-HNNXBMFYSA-N	1	0	285.391	1.480	50	0		CDAARO
CC(C)C1=NO[C@H](C(=O)NCC2(C[NH+]3CCCC3)CC2)C1	ZINC000534659164	328341871	/nfs/dbraw/zinc/34/18/71/328341871.db2.gz	WAEJNCWWXVFYIE-AWEZNQCLSA-N	1	0	293.411	1.780	50	0		CDAARO
CCC[C@H](CNc1cncc(N(C)C)n1)[NH+](C)C	ZINC000534667045	328345753	/nfs/dbraw/zinc/34/57/53/328345753.db2.gz	UDNDJLQNHIVVHO-LLVKDONJSA-N	1	0	251.378	1.685	50	0		CDAARO
CC(C)[C@@H](CNC(=O)CCc1nc(Cl)n[nH]1)[NH+](C)C	ZINC000534673088	328348621	/nfs/dbraw/zinc/34/86/21/328348621.db2.gz	IMZLSPCQNKJNBG-SECBINFHSA-N	1	0	287.795	1.093	50	0		CDAARO
CC1(C)C[C@H]([NH2+]CC(=O)NC2CCOCC2)C(C)(C)O1	ZINC000097100434	323207337	/nfs/dbraw/zinc/20/73/37/323207337.db2.gz	YXGPCFOOJBMWPG-LBPRGKRZSA-N	1	0	284.400	1.217	50	0		CDAARO
CC(C)c1nc(C2(NC(=O)C[NH+](C)C)CCCC2)no1	ZINC000097104311	323207659	/nfs/dbraw/zinc/20/76/59/323207659.db2.gz	CZQDCDDYOLMYPP-UHFFFAOYSA-N	1	0	280.372	1.640	50	0		CDAARO
O=C(NCC1(CO)CCCC1)[C@H]1CC12CC[NH2+]CC2	ZINC000135100385	328448965	/nfs/dbraw/zinc/44/89/65/328448965.db2.gz	KPLIGRYWPGRHJB-GFCCVEGCSA-N	1	0	266.385	1.045	50	0		CDAARO
CCOc1cccc(OCCCN2CC[NH2+]CC2)c1	ZINC000019728658	326856586	/nfs/dbraw/zinc/85/65/86/326856586.db2.gz	GKSQJKANCMXLES-UHFFFAOYSA-N	1	0	264.369	1.759	50	0		CDAARO
[NH3+]CC(=O)N1CCC[C@@H](COc2ccc(F)cc2)C1	ZINC000077421156	327132179	/nfs/dbraw/zinc/13/21/79/327132179.db2.gz	VYOYHHSEIPCSEW-LLVKDONJSA-N	1	0	266.316	1.402	50	0		CDAARO
O=C(NCCCCc1ccccc1)NC[C@H]1C[NH2+]CCO1	ZINC000426538262	330511504	/nfs/dbraw/zinc/51/15/04/330511504.db2.gz	BZJVSYIYPMTWJB-OAHLLOKOSA-N	1	0	291.395	1.297	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]Cc1cccc(OCC(F)F)n1	ZINC000090971909	482522827	/nfs/dbraw/zinc/52/28/27/482522827.db2.gz	ZDXAWNDSQMAVNP-ONGXEEELSA-N	1	0	272.295	1.993	50	0		CDAARO
Cc1ccc2[nH]nc(C(=O)N3C[C@H]([NH3+])[C@@H](C4CC4)C3)c2c1	ZINC000091390817	482563654	/nfs/dbraw/zinc/56/36/54/482563654.db2.gz	UWQFNAKZGWQKTE-OLZOCXBDSA-N	1	0	284.363	1.681	50	0		CDAARO
CCn1nccc1C[NH2+]C1CCN([C@H]2CCOC2)CC1	ZINC000585093601	482828775	/nfs/dbraw/zinc/82/87/75/482828775.db2.gz	KEQQHIKEKHCBOC-HNNXBMFYSA-N	1	0	278.400	1.246	50	0		CDAARO
C[C@@H](Cn1cccn1)[NH2+]CCCn1ccccc1=O	ZINC000670438661	482981235	/nfs/dbraw/zinc/98/12/35/482981235.db2.gz	JUELQOWZNPCYLJ-ZDUSSCGKSA-N	1	0	260.341	1.113	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]C2CCS(=O)(=O)CC2)n1	ZINC000670442274	482989959	/nfs/dbraw/zinc/98/99/59/482989959.db2.gz	KSQKLKWYUNXHCG-LLVKDONJSA-N	1	0	285.413	1.055	50	0		CDAARO
CN1CCC(CNc2ncc(Cl)cn2)([NH+](C)C)CC1	ZINC000670456858	483035986	/nfs/dbraw/zinc/03/59/86/483035986.db2.gz	LYPPAGOJIZVFFI-UHFFFAOYSA-N	1	0	283.807	1.568	50	0		CDAARO
CSCCN1CCN(C(=O)C[NH+]2CCC(C)CC2)CC1	ZINC000670458889	483040504	/nfs/dbraw/zinc/04/05/04/483040504.db2.gz	MLCXUULUGFJNFC-UHFFFAOYSA-N	1	0	299.484	1.226	50	0		CDAARO
CCCOC[C@@H]1CC[N@H+](CCN2CCCC2=O)C1	ZINC000670460676	483042085	/nfs/dbraw/zinc/04/20/85/483042085.db2.gz	HMQDHQRUFFZFRN-CYBMUJFWSA-N	1	0	254.374	1.357	50	0		CDAARO
C[C@H](CCC(=O)NCCc1cn[nH]c1)[NH+]1CCCC1	ZINC000426689964	533792139	/nfs/dbraw/zinc/79/21/39/533792139.db2.gz	VFIJNLZKUDFQJR-GFCCVEGCSA-N	1	0	264.373	1.333	50	0		CDAARO
CSCc1cccc(CNC(=O)C[NH+](C)C)c1	ZINC000190071707	533851693	/nfs/dbraw/zinc/85/16/93/533851693.db2.gz	PMZBZCNIVYABMU-UHFFFAOYSA-N	1	0	252.383	1.727	50	0		CDAARO
CC(=O)NCC1CC[NH+](CC[C@H]2CCOC2)CC1	ZINC000437688103	534357410	/nfs/dbraw/zinc/35/74/10/534357410.db2.gz	PVRHWUJPUQOUOY-AWEZNQCLSA-N	1	0	254.374	1.261	50	0		CDAARO
COc1ccc(Cl)cc1C[NH2+]CCN1CCOCC1	ZINC000019872383	524211129	/nfs/dbraw/zinc/21/11/29/524211129.db2.gz	KPKSCNMFHDIAGQ-UHFFFAOYSA-N	1	0	284.787	1.770	50	0		CDAARO
[NH3+]Cc1cc(C(=O)N[C@@H]2CCC[C@@H]3OCC[C@@H]32)co1	ZINC000188015683	527246923	/nfs/dbraw/zinc/24/69/23/527246923.db2.gz	JKCHHYXZWKSVSL-UPJWGTAASA-N	1	0	264.325	1.426	50	0		CDAARO
Cc1ncncc1C(=O)N1CCC2(CC[NH2+]C2)CC1	ZINC000257662804	527464695	/nfs/dbraw/zinc/46/46/95/527464695.db2.gz	GQPZSXRJCXSSDX-UHFFFAOYSA-N	1	0	260.341	1.001	50	0		CDAARO
CC(C)n1cc([C@@H](C)[NH2+]CC(C)(C)S(C)(=O)=O)cn1	ZINC000096479039	528575089	/nfs/dbraw/zinc/57/50/89/528575089.db2.gz	DBYYDLVHZGAGHG-LLVKDONJSA-N	1	0	287.429	1.938	50	0		CDAARO
CCOC(=O)N1CCC([NH2+][C@@H](CO)c2ccco2)CC1	ZINC000096494306	528957899	/nfs/dbraw/zinc/95/78/99/528957899.db2.gz	QSWMDYPTZTWFRP-LBPRGKRZSA-N	1	0	282.340	1.524	50	0		CDAARO
[NH3+][C@H]1CCc2cc(Br)ccc2NC1=O	ZINC000118537346	538370287	/nfs/dbraw/zinc/37/02/87/538370287.db2.gz	MLCIKXLZQSZZQS-QMMMGPOBSA-N	1	0	255.115	1.661	50	0		CDAARO
C[C@@H](SC1=[NH+]CCN1)C(=O)Nc1ccc(F)cc1	ZINC000001994516	574930772	/nfs/dbraw/zinc/93/07/72/574930772.db2.gz	NMJVRKOTIYNGJZ-MRVPVSSYSA-N	1	0	267.329	1.845	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@H](C2=[NH+]CCN2)C1	ZINC000757073974	575931066	/nfs/dbraw/zinc/93/10/66/575931066.db2.gz	QBEXMMVPQIDOBG-JTQLQIEISA-N	1	0	253.346	1.635	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@](O)([C@H]([NH3+])C2CCC2)C1	ZINC000958528750	613980809	/nfs/dbraw/zinc/98/08/09/613980809.db2.gz	UGABYRSCXBBBBQ-BXUZGUMPSA-N	1	0	270.373	1.486	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)S(=O)(=O)N1CCCC1	ZINC000952985787	616083983	/nfs/dbraw/zinc/08/39/83/616083983.db2.gz	FBVHESIKSCJZDV-UHFFFAOYSA-N	1	0	289.445	1.133	50	0		CDAARO
O=C(N[C@H]1CCCOC12CC[NH2+]CC2)c1cccc(O)c1	ZINC001772705959	1159440654	/nfs/dbraw/zinc/44/06/54/1159440654.db2.gz	UIAVWQPMBMFYFI-AWEZNQCLSA-N	1	0	290.363	1.423	50	0		CDAARO
Cc1cc(C[C@@H]2CN(c3cc[nH+]cc3C)C[C@@H]2O)n[nH]1	ZINC001704304824	1177682057	/nfs/dbraw/zinc/68/20/57/1177682057.db2.gz	OJNGMCIFVOPFIJ-DOMZBBRYSA-N	1	0	272.352	1.461	50	0		CDAARO
Cc1cc(C(N)=O)c(NCC[C@H]2CCC[N@@H+](C)C2)nc1C	ZINC001704313376	1177686618	/nfs/dbraw/zinc/68/66/18/1177686618.db2.gz	OXAZKAKFOBKDGR-CYBMUJFWSA-N	1	0	290.411	1.941	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3cccnc3C)C[C@H]2O)on1	ZINC001704327236	1177689615	/nfs/dbraw/zinc/68/96/15/1177689615.db2.gz	AUSMXNCBDSPTDK-GDBMZVCRSA-N	1	0	287.363	1.722	50	0		CDAARO
CN(C(=O)c1ccno1)[C@@H]1C[C@@H]2C[C@H]([NH+](C)C)C[C@@H]2C1	ZINC001704352135	1177699749	/nfs/dbraw/zinc/69/97/49/1177699749.db2.gz	UCSBTLXOBIVUTG-MPZDIEGVSA-N	1	0	277.368	1.865	50	0		CDAARO
Cn1ncc2c1nc(NCC(C)(C)[NH+]1CCCC1)nc2N	ZINC000952988411	773846763	/nfs/dbraw/zinc/84/67/63/773846763.db2.gz	QHRGLAZNAUOVIH-UHFFFAOYSA-N	1	0	289.387	1.232	50	0		CDAARO
C[C@H]1CN(c2cnc(Cl)cn2)C[C@H]1N1CCOCC1	ZINC000952995326	774570633	/nfs/dbraw/zinc/57/06/33/774570633.db2.gz	IRCSADCXBZCKGQ-WDEREUQCSA-N	1	0	282.775	1.287	50	0		CDAARO
OC[C@@H]1CCCCN1CC[NH2+]Cc1cccc2nonc21	ZINC000952970991	774808611	/nfs/dbraw/zinc/80/86/11/774808611.db2.gz	CSWHROIOEMOOCS-ZDUSSCGKSA-N	1	0	290.367	1.159	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)N1CCC(c2cc[nH]n2)CC1	ZINC000952989046	775365156	/nfs/dbraw/zinc/36/51/56/775365156.db2.gz	BRNMLLZLDLKOPY-UHFFFAOYSA-N	1	0	290.411	1.992	50	0		CDAARO
O[C@@H]1CN(C2CC[NH+](C3CCCC3)CC2)C[C@H]1F	ZINC000952989679	775656194	/nfs/dbraw/zinc/65/61/94/775656194.db2.gz	SPLPPOBHEUHYTK-ZIAGYGMSSA-N	1	0	256.365	1.408	50	0		CDAARO
CCOc1cnc(C(=O)N[C@H]2CCC[N@H+](CC)C2)cn1	ZINC000189202237	775851619	/nfs/dbraw/zinc/85/16/19/775851619.db2.gz	ZFQPCATYXNSUQA-NSHDSACASA-N	1	0	278.356	1.089	50	0		CDAARO
O=C1CC[C@H]([NH2+]Cc2cnc(C3CC3)o2)C2(CCC2)N1	ZINC000952994795	776632179	/nfs/dbraw/zinc/63/21/79/776632179.db2.gz	RJOJWVWPJWSPNR-LBPRGKRZSA-N	1	0	275.352	1.843	50	0		CDAARO
CC/C=C(\C)C[N@@H+]1CC[C@H](CNC(=O)c2nnc[nH]2)C1	ZINC000067879041	777251298	/nfs/dbraw/zinc/25/12/98/777251298.db2.gz	VXMKLOHBYZZZSM-KBVBDRTLSA-N	1	0	277.372	1.213	50	0		CDAARO
CC(C)C[N@@H+]1CCN(CCCn2cccn2)C[C@@H]1CCO	ZINC000019227992	779136226	/nfs/dbraw/zinc/13/62/26/779136226.db2.gz	JULKFGCENXZHFE-INIZCTEOSA-N	1	0	294.443	1.298	50	0		CDAARO
C[C@H]([NH2+]C1Cc2ccccc2C1)c1nnc(N)s1	ZINC000822280889	925614930	/nfs/dbraw/zinc/61/49/30/925614930.db2.gz	CBCKTFPQSDKBQP-QMMMGPOBSA-N	1	0	260.366	1.938	50	0		CDAARO
CCCc1ccc(OCCNC(=O)[C@H]2C=CC[NH2+]2)cc1	ZINC000823010350	925662122	/nfs/dbraw/zinc/66/21/22/925662122.db2.gz	CNZRZTWRJVNKMS-OAHLLOKOSA-N	1	0	274.364	1.662	50	0		CDAARO
CCN(CC[NH+](C)C)C(=O)c1cc(C)nc(C)n1	ZINC000823056190	925671594	/nfs/dbraw/zinc/67/15/94/925671594.db2.gz	ZRFJTVKPSJRFPS-UHFFFAOYSA-N	1	0	250.346	1.117	50	0		CDAARO
Cc1cc(CNC(=O)N2CCCC[C@@H]2C[NH3+])cnc1C	ZINC000827267963	925936695	/nfs/dbraw/zinc/93/66/95/925936695.db2.gz	HMCMECAGAZIDID-CQSZACIVSA-N	1	0	276.384	1.721	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)NC[C@H]1CCCOC1	ZINC000827832307	925972426	/nfs/dbraw/zinc/97/24/26/925972426.db2.gz	XJEYSSILSKUCPW-CYBMUJFWSA-N	1	0	254.374	1.405	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)NCCCC(C)(C)CO	ZINC000828655360	926157927	/nfs/dbraw/zinc/15/79/27/926157927.db2.gz	JIUJNDIDMATLGH-CYBMUJFWSA-N	1	0	270.417	1.776	50	0		CDAARO
CC1(C)CC(CC(=O)N2CCC[C@H]2CO)CC(C)(C)[NH2+]1	ZINC000828784106	926181594	/nfs/dbraw/zinc/18/15/94/926181594.db2.gz	QTMQJBXDEHHVTN-ZDUSSCGKSA-N	1	0	282.428	1.917	50	0		CDAARO
CCC(CC)[N@@H+]1CC[C@H](CO)[C@H](NC(=O)C2CC2)C1	ZINC000581799370	927201334	/nfs/dbraw/zinc/20/13/34/927201334.db2.gz	SYRGGEZGAWPOBK-TZMCWYRMSA-N	1	0	268.401	1.384	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1CCNC(=O)c1ccccn1	ZINC000581813045	927203680	/nfs/dbraw/zinc/20/36/80/927203680.db2.gz	OEYKIUOXTFDDHF-UHFFFAOYSA-N	1	0	270.336	1.894	50	0		CDAARO
Cc1cc(C(=O)N[C@H](C[NH+](C)C)C(C)C)ns1	ZINC000585079519	930851688	/nfs/dbraw/zinc/85/16/88/930851688.db2.gz	GBUIROKQVMGEOG-LLVKDONJSA-N	1	0	255.387	1.768	50	0		CDAARO
CC(C)SCC[N@H+](C)C[C@@H]1CCCN(CCO)C1	ZINC001529102165	968980603	/nfs/dbraw/zinc/98/06/03/968980603.db2.gz	YWXJMWQXCFEVJS-AWEZNQCLSA-N	1	0	274.474	1.764	50	0		CDAARO
O[C@@H]1C[N@H+](CCc2ccccc2)C[C@H]1Cc1cnccn1	ZINC001529120067	968985458	/nfs/dbraw/zinc/98/54/58/968985458.db2.gz	RZSTYIADPMPFMS-NVXWUHKLSA-N	1	0	283.375	1.555	50	0		CDAARO
CCCO[C@H]1CCC[N@H+](CCN2CCCC2=O)C1	ZINC001529154944	968996950	/nfs/dbraw/zinc/99/69/50/968996950.db2.gz	MDEJTFAVCBISQS-ZDUSSCGKSA-N	1	0	254.374	1.500	50	0		CDAARO
CCCO[C@@H]1CCC[N@H+](CCN2CCCC2=O)C1	ZINC001529154941	968997311	/nfs/dbraw/zinc/99/73/11/968997311.db2.gz	MDEJTFAVCBISQS-CYBMUJFWSA-N	1	0	254.374	1.500	50	0		CDAARO
CC1(C[N@H+]2C[C@@H](Cc3ccccn3)[C@H](O)C2)CCOCC1	ZINC001529173635	969004308	/nfs/dbraw/zinc/00/43/08/969004308.db2.gz	ZSRXPLXFPVCQTL-GDBMZVCRSA-N	1	0	290.407	1.734	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]CCCc1csc(N)n1	ZINC001506426457	975160945	/nfs/dbraw/zinc/16/09/45/975160945.db2.gz	OUOSQOVVLHPLIP-UHFFFAOYSA-N	1	0	265.386	1.788	50	0		CDAARO
O=C(N[C@H]1CC[NH2+]C1)c1cnc(-c2ccncc2)s1	ZINC000178452852	342450482	/nfs/dbraw/zinc/45/04/82/342450482.db2.gz	ZFSWSQCZPWUQCY-JTQLQIEISA-N	1	0	274.349	1.297	50	0		CDAARO
C[C@H]1CC(C)(C)C[C@](CO)([NH2+]CCn2cncn2)C1	ZINC000096452930	230376403	/nfs/dbraw/zinc/37/64/03/230376403.db2.gz	YRPHQYGUKHQZEE-GXTWGEPZSA-N	1	0	266.389	1.445	50	0		CDAARO
O=C(c1ccc[nH]1)N1CC[N@H+](Cc2ccccc2)C[C@@H](O)C1	ZINC000095503348	185000082	/nfs/dbraw/zinc/00/00/82/185000082.db2.gz	AOIKIPWYNMHAIK-OAHLLOKOSA-N	1	0	299.374	1.334	50	0		CDAARO
CCO[C@@H](CC)CNC(=O)c1cccc(C[NH3+])c1	ZINC000584903031	341986558	/nfs/dbraw/zinc/98/65/58/341986558.db2.gz	MMMTWASJDKVNJH-ZDUSSCGKSA-N	1	0	250.342	1.690	50	0		CDAARO
CN1CCC[C@@H]1C[N@H+](C)C1CSCCSC1	ZINC000584903001	341986571	/nfs/dbraw/zinc/98/65/71/341986571.db2.gz	HPOHFJYHWUNHET-LLVKDONJSA-N	1	0	260.472	1.861	50	0		CDAARO
Cc1noc(C)c1CN1CC2(CC[NH2+]CC2)OC1=O	ZINC000095524985	185004120	/nfs/dbraw/zinc/00/41/20/185004120.db2.gz	SHGCISDTLAEZAZ-UHFFFAOYSA-N	1	0	265.313	1.366	50	0		CDAARO
O=C(Cn1ccc([C@@H]2CCC[NH2+]C2)n1)NCc1ccoc1	ZINC000426550093	230422751	/nfs/dbraw/zinc/42/27/51/230422751.db2.gz	VWALBQBECVAOFT-CYBMUJFWSA-N	1	0	288.351	1.260	50	0		CDAARO
Cc1c[nH+]ccc1N1CCN(C(=O)Cn2cccc2)CC1	ZINC000584903770	341994010	/nfs/dbraw/zinc/99/40/10/341994010.db2.gz	PSKIFQJKCIALBD-UHFFFAOYSA-N	1	0	284.363	1.540	50	0		CDAARO
COC(=O)C1(C[NH2+]Cc2cccs2)CCOCC1	ZINC000097372951	342002695	/nfs/dbraw/zinc/00/26/95/342002695.db2.gz	YMYMTGCLLLAGHW-UHFFFAOYSA-N	1	0	269.366	1.808	50	0		CDAARO
C[C@@H](C1CC1)N(C(=O)C[NH2+][C@H](CO)C1CC1)C1CC1	ZINC000095941349	185036675	/nfs/dbraw/zinc/03/66/75/185036675.db2.gz	AAOWXUJORDKYJQ-IINYFYTJSA-N	1	0	266.385	1.136	50	0		CDAARO
CCc1cccc(S(=O)(=O)N2CCC(C[NH3+])CC2)c1	ZINC000095972594	185049218	/nfs/dbraw/zinc/04/92/18/185049218.db2.gz	GRSXTNYQIHSTMH-UHFFFAOYSA-N	1	0	282.409	1.608	50	0		CDAARO
COC(=O)N1CCC[C@@H]([NH2+][C@H](C)c2ccccn2)C1	ZINC000095980731	185053333	/nfs/dbraw/zinc/05/33/33/185053333.db2.gz	MIHWMBXPSKWOOP-VXGBXAGGSA-N	1	0	263.341	1.963	50	0		CDAARO
COC(=O)c1ccc([C@H](C)N2C[C@H]3OCCN(C)[C@H]3C2)o1	ZINC000252512596	361854385	/nfs/dbraw/zinc/85/43/85/361854385.db2.gz	STBLZYNSQCKHJE-COPLHBTASA-N	1	0	294.351	1.142	50	0		CDAARO
C[NH2+][C@@]1(c2nnnn2-c2ccccc2)CCOC(C)(C)C1	ZINC000005164877	361840933	/nfs/dbraw/zinc/84/09/33/361840933.db2.gz	AYFZWHGTBVLBLC-HNNXBMFYSA-N	1	0	287.367	1.666	50	0		CDAARO
CCc1nc(CN2CC[NH2+][C@@H](c3ccccc3)C2)no1	ZINC000244872943	361866744	/nfs/dbraw/zinc/86/67/44/361866744.db2.gz	WHJDHYBTZFAPBX-CYBMUJFWSA-N	1	0	272.352	1.779	50	0		CDAARO
CC(C)=CCC/C(C)=C\C[NH2+]C[C@@H](O)CN1CCOCC1	ZINC000096878878	342178707	/nfs/dbraw/zinc/17/87/07/342178707.db2.gz	YDVLBLYSTSGULM-BOVGMKJQSA-N	1	0	296.455	1.962	50	0		CDAARO
Cc1cccc(CS(=O)(=O)N2CCC[C@H]([C@H](C)[NH3+])C2)c1	ZINC000269608075	190519999	/nfs/dbraw/zinc/51/99/99/190519999.db2.gz	DHMHMTQVPHPJDA-ZFWWWQNUSA-N	1	0	296.436	1.884	50	0		CDAARO
CC(C)Oc1cccc([C@@H](C)[NH2+][C@H](C)C(N)=O)c1	ZINC000097033093	185156269	/nfs/dbraw/zinc/15/62/69/185156269.db2.gz	RCTDPMPWLMYCBW-GHMZBOCLSA-N	1	0	250.342	1.998	50	0		CDAARO
CSC[C@H](C)NC(=O)N1C[C@@H]2C[N@@H+]3CCCC[C@@H]3[C@H]2C1	ZINC000245343996	539041493	/nfs/dbraw/zinc/04/14/93/539041493.db2.gz	WWTWCMKWMPGOFA-XDQVBPFNSA-N	1	0	297.468	1.864	50	0		CDAARO
NC(=O)[C@@H]1CC[N@H+](C[C@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC000585140648	342218671	/nfs/dbraw/zinc/21/86/71/342218671.db2.gz	HXAPIPIDIYPYEL-BZPMIXESSA-N	1	0	262.328	1.736	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1ccc(-n2cccn2)c(F)c1	ZINC000126288883	187230937	/nfs/dbraw/zinc/23/09/37/187230937.db2.gz	SPSCJCDMLMVNSX-NSHDSACASA-N	1	0	288.326	1.445	50	0		CDAARO
CC[C@H](C)C[C@H](C)NC(=O)NC[C@@H]1C[N@H+](C)CCN1C	ZINC000096440114	529681605	/nfs/dbraw/zinc/68/16/05/529681605.db2.gz	FBABSUKKOSXUSX-MELADBBJSA-N	1	0	284.448	1.356	50	0		CDAARO
CC[NH+]1CCN(CC(=O)N[C@@H](C)Cc2ccsc2)CC1	ZINC000081284346	342366211	/nfs/dbraw/zinc/36/62/11/342366211.db2.gz	FABFKQLJNYENSH-ZDUSSCGKSA-N	1	0	295.452	1.433	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F)[C@H]1CC[NH2+]C1	ZINC000179125902	362252088	/nfs/dbraw/zinc/25/20/88/362252088.db2.gz	YRDHOFBTDRPKKO-MVWJERBFSA-N	1	0	280.318	1.889	50	0		CDAARO
C[C@@H]1C[NH+](CCCCNC(=O)c2ccc[nH]2)C[C@@H](C)O1	ZINC000084706218	362272875	/nfs/dbraw/zinc/27/28/75/362272875.db2.gz	MREYJXGIKIZAGY-CHWSQXEVSA-N	1	0	279.384	1.634	50	0		CDAARO
COC(C)(C)CNc1cc([C@H]2C[C@@H]([NH3+])C2)nc(N)n1	ZINC000252551378	362393490	/nfs/dbraw/zinc/39/34/90/362393490.db2.gz	UDKXWUFTQKGCKX-DTORHVGOSA-N	1	0	265.361	1.100	50	0		CDAARO
CC1=C[C@H](C)[C@@H]2C(=O)N(CCC[NH+](C)C)C(=O)[C@H]2C1	ZINC000101788748	362446957	/nfs/dbraw/zinc/44/69/57/362446957.db2.gz	OLVIZFKZLFJCGX-AVGNSLFASA-N	1	0	264.369	1.525	50	0		CDAARO
C[C@@H](NC(=O)N1CCC[C@H](CO)C1)C(C)(C)C[NH+](C)C	ZINC000085424016	179059869	/nfs/dbraw/zinc/05/98/69/179059869.db2.gz	UOXYRYRHJIZLRN-OLZOCXBDSA-N	1	0	285.432	1.377	50	0		CDAARO
COC[C@H](O)C[NH2+]Cc1ccc(Br)c(C)c1	ZINC000085706992	179121995	/nfs/dbraw/zinc/12/19/95/179121995.db2.gz	PSQJORCBLBVSTC-LLVKDONJSA-N	1	0	288.185	1.854	50	0		CDAARO
Nc1nc(C2CC([NH3+])C2)cc(N2CCC(F)(F)CC2)n1	ZINC000222326552	136583641	/nfs/dbraw/zinc/58/36/41/136583641.db2.gz	CKENLCVQJMTVAS-UHFFFAOYSA-N	1	0	283.326	1.499	50	0		CDAARO
CCn1cc([C@@H]2OCC[C@@H]2C[NH2+]C2CCOCC2)cn1	ZINC000089305957	346755641	/nfs/dbraw/zinc/75/56/41/346755641.db2.gz	CKMDKBBQNOVWAU-IUODEOHRSA-N	1	0	279.384	1.749	50	0		CDAARO
O=C(NCC1CC1)C1([NH2+]CC2CCOCC2)CCCC1	ZINC000085936563	179202808	/nfs/dbraw/zinc/20/28/08/179202808.db2.gz	WZTZBMIKYRUSKQ-UHFFFAOYSA-N	1	0	280.412	1.842	50	0		CDAARO
C[C@H](CN(C)CCO)[NH2+]Cc1cnc2ccccc2c1	ZINC000584888931	349346963	/nfs/dbraw/zinc/34/69/63/349346963.db2.gz	HCJWPRSNEMGYMV-CYBMUJFWSA-N	1	0	273.380	1.637	50	0		CDAARO
CCCSCC(=O)N(C)C[C@@]1(C)CC[N@H+](C)C1	ZINC000584890698	349349504	/nfs/dbraw/zinc/34/95/04/349349504.db2.gz	VHBWSOJYGGMVBO-ZDUSSCGKSA-N	1	0	258.431	1.930	50	0		CDAARO
CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000584890569	349349609	/nfs/dbraw/zinc/34/96/09/349349609.db2.gz	RPIZCGGJMARRNZ-AWEZNQCLSA-N	1	0	273.311	1.793	50	0		CDAARO
Cc1nccn1C[C@H](C)[NH2+]CCc1nccs1	ZINC000584891078	349350180	/nfs/dbraw/zinc/35/01/80/349350180.db2.gz	LBZQWKCQIUIRAR-JTQLQIEISA-N	1	0	250.371	1.869	50	0		CDAARO
C[C@H](C[NH+]1CCCC1)C(=O)N(C)CCC1(O)CCCC1	ZINC000584899668	349361257	/nfs/dbraw/zinc/36/12/57/349361257.db2.gz	OMFPTPHOQRUVLH-CQSZACIVSA-N	1	0	282.428	1.872	50	0		CDAARO
Cc1cnn(CCC(=O)N2C[C@H]([NH+](C)C)[C@@H](C(C)C)C2)c1	ZINC000091325859	180135250	/nfs/dbraw/zinc/13/52/50/180135250.db2.gz	LZJAKFXEEYAHGH-CABCVRRESA-N	1	0	292.427	1.626	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@@H]1NC(=O)Cc1ccccc1F	ZINC000091496334	180172038	/nfs/dbraw/zinc/17/20/38/180172038.db2.gz	SCCIZZOGZJVCDA-MFKMUULPSA-N	1	0	250.317	1.625	50	0		CDAARO
COc1ccc(S(=O)(=O)N[C@@H]2CCC[NH2+][C@H]2C)cc1	ZINC000091496953	180172575	/nfs/dbraw/zinc/17/25/75/180172575.db2.gz	ZDCITDQMJRNFNM-GXFFZTMASA-N	1	0	284.381	1.114	50	0		CDAARO
C[C@@H]1C[N@H+](C)CC[C@H]1N(C)C(=O)CCOCC(F)(F)F	ZINC000110619404	350205078	/nfs/dbraw/zinc/20/50/78/350205078.db2.gz	KZVWNVRTBQICIR-GHMZBOCLSA-N	1	0	296.333	1.754	50	0		CDAARO
Cc1c[nH]c(CN(C)C(=O)[C@@H]2CCCCC[N@@H+]2C)n1	ZINC000091535069	180182164	/nfs/dbraw/zinc/18/21/64/180182164.db2.gz	JGXYGGPWGDEONK-LBPRGKRZSA-N	1	0	264.373	1.551	50	0		CDAARO
Cc1ccc(O)c(C(=O)N2C[C@H]3CC[C@H](C[N@H+]3C)C2)c1	ZINC000091643613	180214160	/nfs/dbraw/zinc/21/41/60/180214160.db2.gz	JHRCGVQNANPIAH-CHWSQXEVSA-N	1	0	274.364	1.867	50	0		CDAARO
COc1ccc(C[NH2+][C@@H]2CCC[C@H]2O)c(OC)c1	ZINC000109554305	186262873	/nfs/dbraw/zinc/26/28/73/186262873.db2.gz	FRYKMYDSYUUBRI-CHWSQXEVSA-N	1	0	251.326	1.707	50	0		CDAARO
COP(=O)(OC)[C@]1(O)C[C@@H](C)[N@H+](C)C[C@H]1C	ZINC000005355814	362974655	/nfs/dbraw/zinc/97/46/55/362974655.db2.gz	ANRNCSUBAGMGGV-OPRDCNLKSA-N	1	0	251.263	1.521	50	0		CDAARO
Cc1c[nH]c(CN(C)CC(C)(C)C[NH+]2CCOCC2)n1	ZINC000583650821	366007467	/nfs/dbraw/zinc/00/74/67/366007467.db2.gz	CCVSHUSPUZSPBC-UHFFFAOYSA-N	1	0	280.416	1.508	50	0		CDAARO
CC[N@H+]1C[C@H](NS(=O)(=O)c2ccc(F)cc2)[C@@H](C)C1	ZINC000257366252	350964483	/nfs/dbraw/zinc/96/44/83/350964483.db2.gz	PLUJUVWAZQIWFQ-GWCFXTLKSA-N	1	0	286.372	1.444	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)NCCSc2nc[nH]n2)CC1	ZINC000065434060	363268415	/nfs/dbraw/zinc/26/84/15/363268415.db2.gz	FQXHCBFAEOZREB-UHFFFAOYSA-N	1	0	297.428	1.133	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNc1ncnc2c1cnn2C	ZINC000014212173	366132855	/nfs/dbraw/zinc/13/28/55/366132855.db2.gz	BMWFMIQNUOPKJA-JTQLQIEISA-N	1	0	260.345	1.260	50	0		CDAARO
CC(=O)Oc1ccccc1C(=O)OC1CC[NH+](C)CC1	ZINC000000362695	355906361	/nfs/dbraw/zinc/90/63/61/355906361.db2.gz	CYGKCUDLZSSWKN-UHFFFAOYSA-N	1	0	277.320	1.863	50	0		CDAARO
CCOC(=O)[C@@H]1CCC[N@@H+](C2CCN(CC)CC2)C1	ZINC000000221270	355897588	/nfs/dbraw/zinc/89/75/88/355897588.db2.gz	PUIJDEPPTRRDJD-CYBMUJFWSA-N	1	0	268.401	1.746	50	0		CDAARO
CCOc1ccc(OCCCC[NH2+]CCO)cc1	ZINC000003002069	355990748	/nfs/dbraw/zinc/99/07/48/355990748.db2.gz	PIEJLPGZHOAYRQ-UHFFFAOYSA-N	1	0	253.342	1.826	50	0		CDAARO
CC[NH+](CC)CCNC(=O)COc1ccc(F)cc1	ZINC000002180654	355962265	/nfs/dbraw/zinc/96/22/65/355962265.db2.gz	QRRBYFRYJBZUNM-UHFFFAOYSA-N	1	0	268.332	1.663	50	0		CDAARO
COc1ccc(C[NH2+]CCCN2CCOCC2)cc1	ZINC000002380317	355968198	/nfs/dbraw/zinc/96/81/98/355968198.db2.gz	SLWQNNULQQDKPW-UHFFFAOYSA-N	1	0	264.369	1.507	50	0		CDAARO
C[C@@H](O)C1CCN(C(=O)[C@H]2[NH2+]CCc3ccccc32)CC1	ZINC000195543393	363458898	/nfs/dbraw/zinc/45/88/98/363458898.db2.gz	LNVOSNSYMLUQSS-WBMJQRKESA-N	1	0	288.391	1.493	50	0		CDAARO
COc1cccc(C(=O)N(C)C2CC[NH+](C)CC2)c1	ZINC000012975045	356333806	/nfs/dbraw/zinc/33/38/06/356333806.db2.gz	INRWNWCZSSQCTH-UHFFFAOYSA-N	1	0	262.353	1.861	50	0		CDAARO
CC(C)[C@@H]([NH2+]CC(=O)NC(N)=O)c1ccc(Cl)cc1	ZINC000014898103	356399546	/nfs/dbraw/zinc/39/95/46/356399546.db2.gz	ZOBXBWBJIXHSES-GFCCVEGCSA-N	1	0	283.759	1.822	50	0		CDAARO
C[NH+]1CCC(NC(=O)Nc2ccc3c(c2)OCCO3)CC1	ZINC000017022601	356451950	/nfs/dbraw/zinc/45/19/50/356451950.db2.gz	SEYKCXRMZMVLHJ-UHFFFAOYSA-N	1	0	291.351	1.674	50	0		CDAARO
CCC(=O)n1c2cc(C)ccc2c(C)n/c1=N\C(N)=[NH2+]	ZINC000004588617	356438068	/nfs/dbraw/zinc/43/80/68/356438068.db2.gz	CONDGASRTHFXSS-NBVRZTHBSA-N	1	0	271.324	1.498	50	0		CDAARO
CCOC(=O)N1CCC([NH+]2CCN(CC)CC2)CC1	ZINC000019636158	356494167	/nfs/dbraw/zinc/49/41/67/356494167.db2.gz	YCJKAGGJNBSBQF-UHFFFAOYSA-N	1	0	269.389	1.245	50	0		CDAARO
FC(F)(F)Oc1cccc(CN2CC[NH2+]CC2)c1	ZINC000022942249	356625337	/nfs/dbraw/zinc/62/53/37/356625337.db2.gz	GOLWWZWJWXGGPC-UHFFFAOYSA-N	1	0	260.259	1.990	50	0		CDAARO
CC(C)=CCC[C@@H](C)C[NH+]1CCN(CCO)CC1	ZINC000023281355	356638398	/nfs/dbraw/zinc/63/83/98/356638398.db2.gz	UBYXKDQTFDGSGI-OAHLLOKOSA-N	1	0	254.418	1.979	50	0		CDAARO
COc1ccc(S(=O)(=O)N[C@@H]2C[N@H+](C)C[C@H]2C)cc1C	ZINC000257366244	538486517	/nfs/dbraw/zinc/48/65/17/538486517.db2.gz	OZIDBLWYALJSCC-DGCLKSJQSA-N	1	0	298.408	1.232	50	0		CDAARO
O=C(NC1CC1)[C@@H]([NH2+]C[C@@H]1CCCO1)c1ccccc1	ZINC000024515302	356656797	/nfs/dbraw/zinc/65/67/97/356656797.db2.gz	CYUJPCVMCZCWRV-GJZGRUSLSA-N	1	0	274.364	1.775	50	0		CDAARO
CCOCC[N@@H+]1CCN(CCc2ccccn2)C[C@H]1C	ZINC000247127024	356669290	/nfs/dbraw/zinc/66/92/90/356669290.db2.gz	KCFFAWGSCGVHJR-OAHLLOKOSA-N	1	0	277.412	1.667	50	0		CDAARO
COCC[N@H+](C)Cc1ccc(C(=O)NC2CC2)cc1	ZINC000027291153	356706327	/nfs/dbraw/zinc/70/63/27/356706327.db2.gz	MVOYHEPMVMUYPY-UHFFFAOYSA-N	1	0	262.353	1.657	50	0		CDAARO
CNC(=O)NC(=O)C[N@H+](Cc1ccc(C)cc1)C1CC1	ZINC000027593637	356711391	/nfs/dbraw/zinc/71/13/91/356711391.db2.gz	WKCDVMONHGZGBR-UHFFFAOYSA-N	1	0	275.352	1.415	50	0		CDAARO
O=S(=O)(c1ccc(Cl)c(Cl)c1)N1CCNCC1	ZINC000034781404	356820022	/nfs/dbraw/zinc/82/00/22/356820022.db2.gz	MBRYMRUOJNZKCW-UHFFFAOYSA-N	1	0	295.191	1.587	50	0		CDAARO
O=c1c2ccccc2ncn1CC[N@H+]1CCCC[C@@H]1CO	ZINC000032560990	356782432	/nfs/dbraw/zinc/78/24/32/356782432.db2.gz	OZWADIQAZMHKKL-CYBMUJFWSA-N	1	0	287.363	1.243	50	0		CDAARO
[NH3+]CCc1cn(Cc2ccc(C(F)(F)F)cc2)nn1	ZINC000036719709	356878767	/nfs/dbraw/zinc/87/87/67/356878767.db2.gz	RPMFURKFXOYCRA-UHFFFAOYSA-N	1	0	270.258	1.846	50	0		CDAARO
Cn1nccc1CC[NH2+][C@H]1CCOC2(CCOCC2)C1	ZINC000082161865	357066588	/nfs/dbraw/zinc/06/65/88/357066588.db2.gz	LZBVSZYPVKQYNU-ZDUSSCGKSA-N	1	0	279.384	1.280	50	0		CDAARO
CCN(Cc1ccccc1)C(=O)c1[nH]nc2c1C[NH2+]CC2	ZINC000042783814	357080315	/nfs/dbraw/zinc/08/03/15/357080315.db2.gz	HFILOXLWZQPXJO-UHFFFAOYSA-N	1	0	284.363	1.718	50	0		CDAARO
[NH3+][C@@H](Cc1ccccc1)C(=O)NCC1CCOCC1	ZINC000042784078	357080662	/nfs/dbraw/zinc/08/06/62/357080662.db2.gz	BYBFCRJFKPIKHG-AWEZNQCLSA-N	1	0	262.353	1.099	50	0		CDAARO
CCCN(C/C=C/c1ccccc1)C(=O)[C@H]([NH3+])CO	ZINC000055253621	357330854	/nfs/dbraw/zinc/33/08/54/357330854.db2.gz	CMJXCUKGRUCBRR-VIIAAUOXSA-N	1	0	262.353	1.258	50	0		CDAARO
C[C@H](CCSc1ccccc1)[N@@H+]1CCO[C@H](C(N)=O)C1	ZINC000095428288	357357462	/nfs/dbraw/zinc/35/74/62/357357462.db2.gz	NVDOKMLTOGMXNN-OCCSQVGLSA-N	1	0	294.420	1.743	50	0		CDAARO
C[C@@H]1C[N@@H+](C[C@H](O)COCc2ccccc2)C[C@H](C)O1	ZINC000016310623	357491509	/nfs/dbraw/zinc/49/15/09/357491509.db2.gz	YTWHNHAFBLEEKO-LZWOXQAQSA-N	1	0	279.380	1.673	50	0		CDAARO
COc1ccc(OCC(=O)N2CC[C@H]3CC[C@@H](C2)[NH2+]3)cc1	ZINC000065381476	357534798	/nfs/dbraw/zinc/53/47/98/357534798.db2.gz	QXPGBSXDHHHYNQ-OLZOCXBDSA-N	1	0	290.363	1.427	50	0		CDAARO
CNc1ccnc(N(C)CC[N@@H+]2CCCC[C@H]2C)n1	ZINC000065405013	357538065	/nfs/dbraw/zinc/53/80/65/357538065.db2.gz	CQZPUYVQCBICBE-GFCCVEGCSA-N	1	0	263.389	1.829	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)NCC1(Cn2ccnc2)CC1	ZINC000065409858	357539356	/nfs/dbraw/zinc/53/93/56/357539356.db2.gz	NBIQEJQDCKMWBU-UHFFFAOYSA-N	1	0	290.411	1.656	50	0		CDAARO
CC(=O)NCCNc1nc(N2CCCCC2)cc(C)[nH+]1	ZINC000067604727	357613925	/nfs/dbraw/zinc/61/39/25/357613925.db2.gz	JSFFMHQABPTFOZ-UHFFFAOYSA-N	1	0	277.372	1.323	50	0		CDAARO
CC[C@H](C[NH2+]C1CSCCSC1)N1CCOCC1	ZINC000067714565	357619625	/nfs/dbraw/zinc/61/96/25/357619625.db2.gz	QNORZEADUMRSLV-CYBMUJFWSA-N	1	0	290.498	1.535	50	0		CDAARO
CCc1noc(C)c1C(=O)N(C)C[C@@]1(C)CC[N@H+](C)C1	ZINC000067975007	357642135	/nfs/dbraw/zinc/64/21/35/357642135.db2.gz	ZXSQTHVLMWAYOO-HNNXBMFYSA-N	1	0	279.384	1.959	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN([C@H]2CCC[NH2+]C2)CC1	ZINC000068592354	357651570	/nfs/dbraw/zinc/65/15/70/357651570.db2.gz	PCCCSUUBJZRHGJ-LBPRGKRZSA-N	1	0	269.389	1.291	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCN(Cc2c(F)cccc2F)C1	ZINC000072480375	357838638	/nfs/dbraw/zinc/83/86/38/357838638.db2.gz	FJRUVSISPAUJOE-CQSZACIVSA-N	1	0	270.323	1.463	50	0		CDAARO
CCOC(=O)C[C@@H]1CCCC[N@@H+]1Cc1cccnc1N	ZINC000072481592	357839057	/nfs/dbraw/zinc/83/90/57/357839057.db2.gz	NTWZJNIMDHOETP-ZDUSSCGKSA-N	1	0	277.368	1.972	50	0		CDAARO
C[C@H]([NH2+][C@@H]1CCN(CC(F)(F)F)C1=O)[C@H]1CCCO1	ZINC000097108813	357983562	/nfs/dbraw/zinc/98/35/62/357983562.db2.gz	WZUBIPCYLBHRCY-IVZWLZJFSA-N	1	0	280.290	1.307	50	0		CDAARO
Cn1cccc1-c1cc(C(=O)N2C[C@@H]3CC[N@H+](C)[C@@H]3C2)[nH]n1	ZINC000077437789	358018810	/nfs/dbraw/zinc/01/88/10/358018810.db2.gz	MAIJUXDSRGSPOK-XHDPSFHLSA-N	1	0	299.378	1.191	50	0		CDAARO
COC[C@@H]1CCC[N@H+](CC(=O)Nc2ccccc2)C1	ZINC000056908317	358022192	/nfs/dbraw/zinc/02/21/92/358022192.db2.gz	DXSKKGRUGZGYAR-CYBMUJFWSA-N	1	0	262.353	1.984	50	0		CDAARO
COc1ccc(CN2CC[NH+](C)CC2)cc1OC	ZINC000019536702	358099699	/nfs/dbraw/zinc/09/96/99/358099699.db2.gz	GUAKUQMPNSSVAV-UHFFFAOYSA-N	1	0	250.342	1.451	50	0		CDAARO
CCC[C@@H]1C[N@H+](Cc2cccnc2N)C[C@H]1NC(C)=O	ZINC000082109340	358146979	/nfs/dbraw/zinc/14/69/79/358146979.db2.gz	ZSJAZXOYGVZKHD-TZMCWYRMSA-N	1	0	276.384	1.400	50	0		CDAARO
COCc1cccc(S(=O)(=O)N[C@H]2CCC[NH2+][C@@H]2C)c1	ZINC000193455659	358294806	/nfs/dbraw/zinc/29/48/06/358294806.db2.gz	SWRZQDYROQAWKE-RISCZKNCSA-N	1	0	298.408	1.252	50	0		CDAARO
Cc1cccc(NC(=O)CSc2nc(N)cc(N)[nH+]2)c1	ZINC000000077124	358374271	/nfs/dbraw/zinc/37/42/71/358374271.db2.gz	FZZKHTPWUCGKML-UHFFFAOYSA-N	1	0	289.364	1.680	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1S(=O)(=O)c1cc(C)c(C)s1	ZINC000195555313	358557628	/nfs/dbraw/zinc/55/76/28/358557628.db2.gz	UASBPVGUNBNMQM-NSHDSACASA-N	1	0	288.438	1.737	50	0		CDAARO
Cc1ccnc(NCCCC[NH+]2CCN(CCO)CC2)c1	ZINC000195539188	358559901	/nfs/dbraw/zinc/55/99/01/358559901.db2.gz	SUWUCNZSPNSSFJ-UHFFFAOYSA-N	1	0	292.427	1.192	50	0		CDAARO
C[C@H](O)CN(C)c1cc(N2CCCCC2)ncn1	ZINC000195575082	358567224	/nfs/dbraw/zinc/56/72/24/358567224.db2.gz	GOEFMOIDNZIUIR-NSHDSACASA-N	1	0	250.346	1.284	50	0		CDAARO
COC(=O)N1C[C@H]2[C@H](C[N@H+](C)CCn3ccnc3C)[C@H]2C1	ZINC000102373425	358876389	/nfs/dbraw/zinc/87/63/89/358876389.db2.gz	GGFCIYHLRZVELU-ZSOGYDGISA-N	1	0	292.383	1.068	50	0		CDAARO
Cc1cc(CN(C)Cc2cccc(-c3nn[nH]n3)c2)on1	ZINC000215635335	358897014	/nfs/dbraw/zinc/89/70/14/358897014.db2.gz	BNMNULSAOPSVOA-UHFFFAOYSA-N	1	0	284.323	1.795	50	0		CDAARO
C[N@@H+]1CCC[C@H](C(=O)NCCc2nc3ccccc3o2)C1	ZINC000218983283	359073643	/nfs/dbraw/zinc/07/36/43/359073643.db2.gz	HOCSMNBTEJCDJK-LBPRGKRZSA-N	1	0	287.363	1.828	50	0		CDAARO
CC[NH+](CC)CC(=O)NCc1cccnc1N(C)C	ZINC000014964123	359082243	/nfs/dbraw/zinc/08/22/43/359082243.db2.gz	AKHUUTCXDYKXON-UHFFFAOYSA-N	1	0	264.373	1.106	50	0		CDAARO
Cc1cccnc1NCCNC(=O)CC[NH+]1CCCCC1	ZINC000219717192	359117627	/nfs/dbraw/zinc/11/76/27/359117627.db2.gz	QZNNOYJLVJVNMR-UHFFFAOYSA-N	1	0	290.411	1.794	50	0		CDAARO
Cn1nc(CN2CCOCC2)c2c1CC[N@@H+](C1CCC1)C2	ZINC000257184323	359502454	/nfs/dbraw/zinc/50/24/54/359502454.db2.gz	IKRQOHDAUJMFIQ-UHFFFAOYSA-N	1	0	290.411	1.163	50	0		CDAARO
OC[C@@H]1C[N@@H+](C2CCCC2)C[C@H]1c1nc(C2CC2)no1	ZINC000257191298	359584122	/nfs/dbraw/zinc/58/41/22/359584122.db2.gz	PPJBJBPVBDPCJI-WCQYABFASA-N	1	0	277.368	1.897	50	0		CDAARO
C[N@H+](CCN1C(=O)NC(C)(C)C1=O)C1CCCCCC1	ZINC000026910927	359898757	/nfs/dbraw/zinc/89/87/57/359898757.db2.gz	ZKCWDDNBKSAOCJ-UHFFFAOYSA-N	1	0	281.400	1.971	50	0		CDAARO
CN(CC1([NH+](C)C)CCC1)C(=O)NCCc1cscn1	ZINC000187316064	359920731	/nfs/dbraw/zinc/92/07/31/359920731.db2.gz	LAPJHFIGARGYMS-UHFFFAOYSA-N	1	0	296.440	1.811	50	0		CDAARO
O=C(NC[C@@H](O)c1ccccc1)[C@H]1Cc2ccccc2C[NH2+]1	ZINC000035876624	360169102	/nfs/dbraw/zinc/16/91/02/360169102.db2.gz	ABYODZCNDMDCOU-IAGOWNOFSA-N	1	0	296.370	1.551	50	0		CDAARO
O=C(Cn1nccc1[C@@H]1CCC[NH2+]C1)NCc1cccnc1	ZINC000426477545	360567941	/nfs/dbraw/zinc/56/79/41/360567941.db2.gz	JYGACLKKVHJAMS-CQSZACIVSA-N	1	0	299.378	1.062	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2cc(C3CC3)on2)n1C	ZINC000426387730	360662913	/nfs/dbraw/zinc/66/29/13/360662913.db2.gz	PWFFZDQLRNMFEC-UHFFFAOYSA-N	1	0	279.369	1.692	50	0		CDAARO
C[NH2+]Cc1nnc(SCC[C@@H]2CCOC2)n1C	ZINC000426412645	360665908	/nfs/dbraw/zinc/66/59/08/360665908.db2.gz	CWEUUICKBUIYRI-VIFPVBQESA-N	1	0	256.375	1.053	50	0		CDAARO
CC1(CNC(=O)c2ccc(-c3c[nH+]ccc3N)cc2)COC1	ZINC000426486107	360675669	/nfs/dbraw/zinc/67/56/69/360675669.db2.gz	YAIRPSAYOGUPHQ-UHFFFAOYSA-N	1	0	297.358	1.927	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)CCOc2ccc(Cl)cc2)C1	ZINC000178527668	189124138	/nfs/dbraw/zinc/12/41/38/189124138.db2.gz	WDKRYLYIPIKEDH-LLVKDONJSA-N	1	0	282.771	1.916	50	0		CDAARO
Cc1ccc(OCC(=O)NC[C@H](C)[NH+]2CCCC2)cc1	ZINC000036077103	360833347	/nfs/dbraw/zinc/83/33/47/360833347.db2.gz	DHPARMNRSZMGLR-AWEZNQCLSA-N	1	0	276.380	1.974	50	0		CDAARO
C[NH+]1CCC(C)(C(=O)N2CCC[C@@H](c3ncon3)C2)CC1	ZINC000426535665	361003968	/nfs/dbraw/zinc/00/39/68/361003968.db2.gz	RIHLVEUPGOJJPN-GFCCVEGCSA-N	1	0	292.383	1.508	50	0		CDAARO
O=C(COc1ccccc1)N1CC[C@@H]2[NH2+]CCC[C@@H]2C1	ZINC000299780604	200870547	/nfs/dbraw/zinc/87/05/47/200870547.db2.gz	TZPDCGZOFAUVLM-HIFRSBDPSA-N	1	0	274.364	1.666	50	0		CDAARO
C[N@H+](CC(C)(C)N1CCOCC1)CC1(C)COC1	ZINC000639364595	361266109	/nfs/dbraw/zinc/26/61/09/361266109.db2.gz	FZFFDEYBBCGRKO-UHFFFAOYSA-N	1	0	256.390	1.066	50	0		CDAARO
c1cc(CN2C[C@@H]3CC[NH2+][C@@H]3C2)cc2nsnc12	ZINC000426635293	361340257	/nfs/dbraw/zinc/34/02/57/361340257.db2.gz	IOTRPEHUTPDHJK-GXFFZTMASA-N	1	0	260.366	1.485	50	0		CDAARO
C[NH+](C)CCCNc1c(=O)c(=O)c1NCc1ccccc1	ZINC000101666036	364010404	/nfs/dbraw/zinc/01/04/04/364010404.db2.gz	IDLOUXDNCPBDFB-UHFFFAOYSA-N	1	0	287.363	1.258	50	0		CDAARO
Cc1c(CNC(=O)C[C@@H]2C[NH2+]CCO2)oc2ccccc12	ZINC000269237357	364165303	/nfs/dbraw/zinc/16/53/03/364165303.db2.gz	XDMHZTVZWYQGPN-GFCCVEGCSA-N	1	0	288.347	1.736	50	0		CDAARO
COc1cccc(/C=C2/SC(=O)N(CC[NH3+])C2=O)c1	ZINC000003208519	364717122	/nfs/dbraw/zinc/71/71/22/364717122.db2.gz	FSWHESQQOMFRNE-DHZHZOJOSA-N	1	0	278.333	1.690	50	0		CDAARO
Cc1cc(C(=O)N2CCC[C@H]([NH3+])C2)nn1C(C)(C)C	ZINC000195119488	189672467	/nfs/dbraw/zinc/67/24/67/189672467.db2.gz	DAJGOYDFOVMDNV-NSHDSACASA-N	1	0	264.373	1.510	50	0		CDAARO
CC[NH+](CC)CCNc1ccc(N)c(C(N)=O)c1	ZINC000041079981	365285974	/nfs/dbraw/zinc/28/59/74/365285974.db2.gz	NVWLRSMBVHPIIU-UHFFFAOYSA-N	1	0	250.346	1.121	50	0		CDAARO
CCCCOCC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@H]21	ZINC000089954804	366982612	/nfs/dbraw/zinc/98/26/12/366982612.db2.gz	RTYOFXOCISMPOK-UONOGXRCSA-N	1	0	268.401	1.746	50	0		CDAARO
COc1cc(N2CCC[C@]3(CC[N@H+](C)C3)C2)ncn1	ZINC000067712567	367286257	/nfs/dbraw/zinc/28/62/57/367286257.db2.gz	OXCPIIGJSUMBJR-CQSZACIVSA-N	1	0	262.357	1.407	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2CC[NH2+]C[C@@H]2C)ccc1F	ZINC000094345012	367405757	/nfs/dbraw/zinc/40/57/57/367405757.db2.gz	VRECQTRJNSHGGO-GWCFXTLKSA-N	1	0	250.317	1.862	50	0		CDAARO
COC(=O)CC(C)(C)C(=O)N[C@@H]1C[C@@H](C)[N@@H+](C2CC2)C1	ZINC000252508580	367657441	/nfs/dbraw/zinc/65/74/41/367657441.db2.gz	XPIYNGPWQAOGKE-GHMZBOCLSA-N	1	0	282.384	1.317	50	0		CDAARO
C[C@H](C[NH2+]C(C1CC1)C1CC1)N1CCOC[C@H]1C	ZINC000252512385	367684856	/nfs/dbraw/zinc/68/48/56/367684856.db2.gz	QABMJDGBHGTZNB-VXGBXAGGSA-N	1	0	252.402	1.874	50	0		CDAARO
CC[C@@H]1CN(c2ccc(F)cn2)CC[N@@H+]1CCOC	ZINC000252527495	367784047	/nfs/dbraw/zinc/78/40/47/367784047.db2.gz	CRMVTCLZXBXJTG-CYBMUJFWSA-N	1	0	267.348	1.768	50	0		CDAARO
O=C(N[C@@H](C[NH+]1CCCC1)c1ccccc1)c1cn[nH]n1	ZINC000072171211	284015174	/nfs/dbraw/zinc/01/51/74/284015174.db2.gz	MZLBTZFIJOSDAM-AWEZNQCLSA-N	1	0	285.351	1.372	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C[C@@H]1CCN(CC(F)(F)F)C1	ZINC000037648507	369521689	/nfs/dbraw/zinc/52/16/89/369521689.db2.gz	CKVYZNZASQVWKQ-JTQLQIEISA-N	1	0	276.306	1.692	50	0		CDAARO
Cc1ccc(OC[C@H](O)C[NH2+][C@H](C)CCO)c(C)c1	ZINC000019146170	370141882	/nfs/dbraw/zinc/14/18/82/370141882.db2.gz	DEOOYKKCFLVNMU-ZIAGYGMSSA-N	1	0	267.369	1.404	50	0		CDAARO
CC(C)[C@@H](O)C[N@@H+]1CCCN(c2cccnn2)CC1	ZINC000292774734	370386190	/nfs/dbraw/zinc/38/61/90/370386190.db2.gz	YRHIKDWWWDBONI-ZDUSSCGKSA-N	1	0	264.373	1.006	50	0		CDAARO
Cc1nn(CCCNC(=O)[C@H]2CCC[NH2+]CC2)c(C)c1C	ZINC000299757213	372745298	/nfs/dbraw/zinc/74/52/98/372745298.db2.gz	JKJOMMUXIFUKKM-HNNXBMFYSA-N	1	0	292.427	1.704	50	0		CDAARO
CCn1nc(CO)c2c1CC[N@H+](C[C@H]1CCCOC1)C2	ZINC000299768870	372750918	/nfs/dbraw/zinc/75/09/18/372750918.db2.gz	ZPKNYUHZNIKKPZ-GFCCVEGCSA-N	1	0	279.384	1.180	50	0		CDAARO
Cc1ccc2[nH]c(CCNC(=O)C[C@H]3CC[NH2+]C3)nc2c1	ZINC000299778759	372755450	/nfs/dbraw/zinc/75/54/50/372755450.db2.gz	OAHZXMGFVTYDKD-GFCCVEGCSA-N	1	0	286.379	1.530	50	0		CDAARO
CC[N@@H+]1CCn2nc(CNc3cnccn3)cc2C1	ZINC000299787269	372761414	/nfs/dbraw/zinc/76/14/14/372761414.db2.gz	SJKPUIPPBNXKSR-UHFFFAOYSA-N	1	0	258.329	1.121	50	0		CDAARO
C[NH+](C)[C@H]1[C@@H]2CC[C@H]1CN(C(=O)C(=O)c1cccnc1)C2	ZINC000299792450	372766874	/nfs/dbraw/zinc/76/68/74/372766874.db2.gz	FPFWSFHKOYKKCF-WDNDVIMCSA-N	1	0	287.363	1.063	50	0		CDAARO
c1csc(-c2nnc(N3CC[NH2+]CC3)s2)c1	ZINC000031978354	373033976	/nfs/dbraw/zinc/03/39/76/373033976.db2.gz	XNBGEIVKVHKHAI-UHFFFAOYSA-N	1	0	252.368	1.676	50	0		CDAARO
CC(C)C[C@@H](C[NH3+])NS(=O)(=O)CC1CCCC1	ZINC000253415954	373726665	/nfs/dbraw/zinc/72/66/65/373726665.db2.gz	FOSRUVZSJYXDSY-LBPRGKRZSA-N	1	0	262.419	1.469	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)Nc1cnn(CC2CC2)c1	ZINC000253431616	373746249	/nfs/dbraw/zinc/74/62/49/373746249.db2.gz	HRMHYHNIWYGBDF-UHFFFAOYSA-N	1	0	262.357	1.621	50	0		CDAARO
COc1cccc(C[NH+]2CCC(N3CCNC3=O)CC2)c1	ZINC000052215083	374132428	/nfs/dbraw/zinc/13/24/28/374132428.db2.gz	KQTAXXXJHNXZQD-UHFFFAOYSA-N	1	0	289.379	1.685	50	0		CDAARO
OC1(C[NH2+]Cc2c(F)cccc2F)CCOCC1	ZINC000112717073	374227403	/nfs/dbraw/zinc/22/74/03/374227403.db2.gz	MHASWVMHZJOYTB-UHFFFAOYSA-N	1	0	257.280	1.596	50	0		CDAARO
COC(=O)[C@]1(C)C[C@@H](CO)[C@@H](c2cccs2)N1C	ZINC000012336747	374492505	/nfs/dbraw/zinc/49/25/05/374492505.db2.gz	KKFUGEBPCPHMNW-GAFUQQFSSA-N	1	0	269.366	1.665	50	0		CDAARO
OC[C@H]1C=C[C@@H]([NH2+]Cc2ccccc2N2CCOCC2)C1	ZINC000095420678	374923315	/nfs/dbraw/zinc/92/33/15/374923315.db2.gz	YDGVWIGIIXHCRX-GOEBONIOSA-N	1	0	288.391	1.550	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCN(c2nncc3ccccc32)CC1	ZINC000095996153	375049941	/nfs/dbraw/zinc/04/99/41/375049941.db2.gz	MRXUGBHAGBHXKX-CQSZACIVSA-N	1	0	299.378	1.016	50	0		CDAARO
O=C(NC[C@H](O)c1ccccc1Cl)[C@@]1(F)CC[NH2+]C1	ZINC000299739185	375199727	/nfs/dbraw/zinc/19/97/27/375199727.db2.gz	LQMIKYNNNXMUTA-WCQYABFASA-N	1	0	286.734	1.191	50	0		CDAARO
Cc1ccc(CC(=O)N2CCC[C@@H]([C@@H](C)[NH3+])C2)cn1	ZINC000299738822	375200194	/nfs/dbraw/zinc/20/01/94/375200194.db2.gz	GWEGYSOPVGKASS-TZMCWYRMSA-N	1	0	261.369	1.518	50	0		CDAARO
O=C(Nc1cccc(C[NH+]2CCCC2)c1)[C@H]1COCCO1	ZINC000031237685	375763700	/nfs/dbraw/zinc/76/37/00/375763700.db2.gz	BNWNCUKFFATSDS-OAHLLOKOSA-N	1	0	290.363	1.636	50	0		CDAARO
C[C@H]([NH2+]Cc1cccc(OCc2ccccn2)c1)C(N)=O	ZINC000032511670	375961471	/nfs/dbraw/zinc/96/14/71/375961471.db2.gz	SHQVPGJAEZFQEX-LBPRGKRZSA-N	1	0	285.347	1.624	50	0		CDAARO
CC(=O)NCc1cnc2cc(C)nn2c1[C@H]1CCC[NH2+]1	ZINC000242687742	376021700	/nfs/dbraw/zinc/02/17/00/376021700.db2.gz	UUAFRIIMJPHDJB-GFCCVEGCSA-N	1	0	273.340	1.098	50	0		CDAARO
C[NH+](C)CCNC(=O)COc1ccccc1Cl	ZINC000001895651	376653846	/nfs/dbraw/zinc/65/38/46/376653846.db2.gz	JMBVDYGCVVNDDH-UHFFFAOYSA-N	1	0	256.733	1.397	50	0		CDAARO
Nc1nccc(N2CCCC3(CC[NH2+]CC3)CC2)n1	ZINC000067841778	377251475	/nfs/dbraw/zinc/25/14/75/377251475.db2.gz	PEAPNMKGARFKHG-UHFFFAOYSA-N	1	0	261.373	1.419	50	0		CDAARO
Nc1ncccc1C[N@@H+]1CCC[C@H](c2cc[nH]n2)C1	ZINC000067847264	377259685	/nfs/dbraw/zinc/25/96/85/377259685.db2.gz	ZQJKHTPYRIDMFA-NSHDSACASA-N	1	0	257.341	1.767	50	0		CDAARO
CNC(=O)c1cccc(CC[NH2+][C@@H]2CCOC[C@H]2C)c1	ZINC000192593854	378208032	/nfs/dbraw/zinc/20/80/32/378208032.db2.gz	PVROWHDGBXUMMR-IUODEOHRSA-N	1	0	276.380	1.603	50	0		CDAARO
O=C(N1CCC[C@@H]([C@H]2CCCC[NH2+]2)C1)C(F)(F)F	ZINC000306254359	256865196	/nfs/dbraw/zinc/86/51/96/256865196.db2.gz	OTDXOACONCIDHG-NXEZZACHSA-N	1	0	264.291	1.929	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)Cc2cccc(F)c2F)C1	ZINC000094713515	184845465	/nfs/dbraw/zinc/84/54/65/184845465.db2.gz	LJXFIEJDGDSLMI-NSHDSACASA-N	1	0	282.334	1.965	50	0		CDAARO
CC1CCC([NH+]2CCN(S(C)(=O)=O)CC2)CC1	ZINC000019841720	390229054	/nfs/dbraw/zinc/22/90/54/390229054.db2.gz	AKMKIDOGCSRKEI-UHFFFAOYSA-N	1	0	260.403	1.142	50	0		CDAARO
CC[C@H]([NH2+]C[C@@H]1CCCO1)C(=O)Nc1cc(C)on1	ZINC000028624079	390255710	/nfs/dbraw/zinc/25/57/10/390255710.db2.gz	RPVQLHHCGROIMC-QWRGUYRKSA-N	1	0	267.329	1.469	50	0		CDAARO
COCCc1ccc(OC[C@@H](O)C[NH2+]C(C)C)cc1	ZINC000001530717	169711923	/nfs/dbraw/zinc/71/19/23/169711923.db2.gz	IUBSYMUCCVWXPE-AWEZNQCLSA-N	1	0	267.369	1.613	50	0	fda	CDAARO
c1cnc(N2CC[NH+](C3Cc4ccccc4C3)CC2)nc1	ZINC000096876698	390404160	/nfs/dbraw/zinc/40/41/60/390404160.db2.gz	VEHURVPMXFNHTC-UHFFFAOYSA-N	1	0	280.375	1.766	50	0		CDAARO
CC[N@@H+]1CC[C@@H](N(C)S(=O)(=O)c2cccnc2)[C@H](C)C1	ZINC000096428230	390518486	/nfs/dbraw/zinc/51/84/86/390518486.db2.gz	GVTGNSHPRCJXKX-TZMCWYRMSA-N	1	0	297.424	1.432	50	0		CDAARO
CC(C)=CCC[N@@H+]1CC[C@]2(C1)CCCN(CCO)C2=O	ZINC000091562826	390890522	/nfs/dbraw/zinc/89/05/22/390890522.db2.gz	ISKYEXKJQRWTFS-INIZCTEOSA-N	1	0	280.412	1.650	50	0		CDAARO
COCC[C@@H]1CCCC[N@H+](C[C@H]2CCS(=O)(=O)C2)C1	ZINC000241965752	391333058	/nfs/dbraw/zinc/33/30/58/391333058.db2.gz	UVIGCKKYVRJHBO-UONOGXRCSA-N	1	0	289.441	1.560	50	0		CDAARO
Cc1cnccc1CC[NH2+][C@@H]1CCC[C@H](S(C)(=O)=O)C1	ZINC000293603040	391658428	/nfs/dbraw/zinc/65/84/28/391658428.db2.gz	LGSJUNCURCYXLE-CABCVRRESA-N	1	0	296.436	1.878	50	0		CDAARO
COc1cc(OC)nc(NCC[N@H+]2[C@H](C)CCC[C@@H]2C)n1	ZINC000342227540	130399821	/nfs/dbraw/zinc/39/98/21/130399821.db2.gz	RRVOSFSDNIDWKC-TXEJJXNPSA-N	1	0	294.399	1.591	50	0		CDAARO
C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccon1	ZINC000248837994	131118912	/nfs/dbraw/zinc/11/89/12/131118912.db2.gz	NGNRMYJVDBGUHJ-IUODEOHRSA-N	1	0	285.347	1.925	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)c2cnc3ccccc3n2)C1	ZINC000195123760	393064076	/nfs/dbraw/zinc/06/40/76/393064076.db2.gz	QWJQJAHEQSEDQP-GFCCVEGCSA-N	1	0	284.363	1.701	50	0		CDAARO
COCC(=O)N(C)CCC1CCN(c2cc[nH+]cc2)CC1	ZINC000092516156	135076986	/nfs/dbraw/zinc/07/69/86/135076986.db2.gz	MLMFBDZOYWMQJN-UHFFFAOYSA-N	1	0	291.395	1.793	50	0		CDAARO
CCNC(=O)NC(=O)[C@H](C)[N@@H+]1CC[C@H]2CCCC[C@@H]2C1	ZINC000102520010	397862158	/nfs/dbraw/zinc/86/21/58/397862158.db2.gz	VOMLNBIKGLAHPU-YNEHKIRRSA-N	1	0	281.400	1.733	50	0		CDAARO
C[C@H](C(=O)NC(=O)NC1CCCC1)[N@@H+]1CCC[C@@H](C)C1	ZINC000103422580	397902159	/nfs/dbraw/zinc/90/21/59/397902159.db2.gz	DLPYQIMDWHNFQY-VXGBXAGGSA-N	1	0	281.400	1.875	50	0		CDAARO
Cc1nnc2c(NCc3ccc4c(c3)C[NH2+]C4)nccn12	ZINC000097830021	147126200	/nfs/dbraw/zinc/12/62/00/147126200.db2.gz	VYTRIIMCIAFIAJ-UHFFFAOYSA-N	1	0	280.335	1.648	50	0		CDAARO
CCOC(=O)[C@]12CC[NH2+][C@H]1CCN2C(=O)OC(C)(C)C	ZINC000095707244	285959106	/nfs/dbraw/zinc/95/91/06/285959106.db2.gz	QLPXWVCIJGAGHW-HZMBPMFUSA-N	1	0	284.356	1.291	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(S(=O)(=O)CC2CCCC2)C1	ZINC000178340236	148052333	/nfs/dbraw/zinc/05/23/33/148052333.db2.gz	RCOHXIFJDPSONJ-ZDUSSCGKSA-N	1	0	274.430	1.390	50	0		CDAARO
CC(C)([NH3+])C(=O)Nc1ccc(NC(=O)C2CC2)nc1	ZINC000262664774	149092254	/nfs/dbraw/zinc/09/22/54/149092254.db2.gz	IUKUCQWJDININA-UHFFFAOYSA-N	1	0	262.313	1.106	50	0		CDAARO
O=C(c1cn2ccccc2n1)N1CCC[C@@]2(CC[NH2+]C2)C1	ZINC000367408539	159483155	/nfs/dbraw/zinc/48/31/55/159483155.db2.gz	VTRHLPAHILRVGB-INIZCTEOSA-N	1	0	284.363	1.550	50	0		CDAARO
CC(C)CC(=O)c1c[nH]c(C(=O)NCCC[NH+](C)C)c1	ZINC000005613840	170119605	/nfs/dbraw/zinc/11/96/05/170119605.db2.gz	GPKXJEQRYKSDMH-UHFFFAOYSA-N	1	0	279.384	1.925	50	0		CDAARO
CCOC(=O)[C@@H]1[C@H](C(=O)OCC)[C@@H]([NH+]2CCCC2)C1(C)C	ZINC000005796669	170141063	/nfs/dbraw/zinc/14/10/63/170141063.db2.gz	RJAIFMNTFDYYIO-RWMBFGLXSA-N	1	0	297.395	1.849	50	0		CDAARO
CC(=O)c1ccc(S(=O)(=O)NC2CC[NH+](C)CC2)cc1	ZINC000006905899	170254309	/nfs/dbraw/zinc/25/43/09/170254309.db2.gz	AYEKVBORNBQDGZ-UHFFFAOYSA-N	1	0	296.392	1.262	50	0		CDAARO
COc1ccc(S(=O)(=O)[C@H](C[NH3+])c2ccco2)cc1	ZINC000007951924	170309243	/nfs/dbraw/zinc/30/92/43/170309243.db2.gz	JPOTVNMYTULOKV-CYBMUJFWSA-N	1	0	281.333	1.762	50	0		CDAARO
[NH3+]CCSCc1nc2cc(Cl)ccc2c(=O)[nH]1	ZINC000008031573	170315357	/nfs/dbraw/zinc/31/53/57/170315357.db2.gz	ZLAZJJIRUXIEIS-UHFFFAOYSA-N	1	0	269.757	1.768	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CC(=O)NC(=O)NCc1cccs1	ZINC000008338755	170331796	/nfs/dbraw/zinc/33/17/96/170331796.db2.gz	QYIHEEUKIFFWIA-NSHDSACASA-N	1	0	295.408	1.948	50	0		CDAARO
Nc1cc(N)[nH+]c(SCc2ccc3nonc3c2)n1	ZINC000008814458	170356706	/nfs/dbraw/zinc/35/67/06/170356706.db2.gz	OIQFNWZLBXAUKW-UHFFFAOYSA-N	1	0	274.309	1.470	50	0		CDAARO
CC[C@@H](C)[NH2+]C[C@@H](O)COc1ccccc1OC	ZINC000008844748	170357272	/nfs/dbraw/zinc/35/72/72/170357272.db2.gz	VXJQVAMMFVYRJF-VXGBXAGGSA-N	1	0	253.342	1.823	50	0		CDAARO
COc1cc(C[NH2+]CC(C)C)ccc1OCCO	ZINC000012382291	170482837	/nfs/dbraw/zinc/48/28/37/170482837.db2.gz	WTXNAFZFXVUIHO-UHFFFAOYSA-N	1	0	253.342	1.812	50	0		CDAARO
Cc1cc(OC[C@H](O)C[NH2+][C@H](C)CCO)ccc1Cl	ZINC000020109927	170997555	/nfs/dbraw/zinc/99/75/55/170997555.db2.gz	ZEOGYNAGHYBYCU-VXGBXAGGSA-N	1	0	287.787	1.749	50	0		CDAARO
C[NH+]1CCC(NC(=O)Cc2ccccc2F)CC1	ZINC000020220073	171081829	/nfs/dbraw/zinc/08/18/29/171081829.db2.gz	GCEOWCWFBTYQNT-UHFFFAOYSA-N	1	0	250.317	1.579	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000020294532	171135654	/nfs/dbraw/zinc/13/56/54/171135654.db2.gz	ICHMUGPGJJQWCL-AWEZNQCLSA-N	1	0	264.369	1.064	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000020595114	171263976	/nfs/dbraw/zinc/26/39/76/171263976.db2.gz	GOWJAAKVCNZFGY-UHFFFAOYSA-N	1	0	275.396	1.330	50	0		CDAARO
C[NH+]1CCN(CCCNC(=O)Nc2ccccc2)CC1	ZINC000020727020	171270673	/nfs/dbraw/zinc/27/06/73/171270673.db2.gz	SOQPQMYCZVESKR-UHFFFAOYSA-N	1	0	276.384	1.446	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1nc(-c2cccs2)no1	ZINC000020745772	171271648	/nfs/dbraw/zinc/27/16/48/171271648.db2.gz	ARFAJWREXXUGHY-UHFFFAOYSA-N	1	0	280.353	1.480	50	0		CDAARO
CCc1cccc(OCC[N@H+](C)C[C@H]2COCCO2)c1	ZINC000661603883	414201245	/nfs/dbraw/zinc/20/12/45/414201245.db2.gz	MAIZKAJUKJMYMZ-INIZCTEOSA-N	1	0	279.380	1.975	50	0		CDAARO
[NH3+][C@@H]1CCCC[C@H]1NS(=O)(=O)CCc1ccccc1	ZINC000038050250	174061515	/nfs/dbraw/zinc/06/15/15/174061515.db2.gz	PPUFKGOUHMBSLT-ZIAGYGMSSA-N	1	0	282.409	1.418	50	0		CDAARO
CCC1CCC(C(=O)NCC(=O)N2CC[C@H](C[NH3+])C2)CC1	ZINC000067605291	175779231	/nfs/dbraw/zinc/77/92/31/175779231.db2.gz	PXZDSHQLHXTDCJ-ROKHWSDSSA-N	1	0	295.427	1.126	50	0		CDAARO
CC/C=C\CCCN1C[C@@H]([NH3+])C[C@H]1C(=O)NC(C)C	ZINC000071278841	176107996	/nfs/dbraw/zinc/10/79/96/176107996.db2.gz	HUYITDYXVGLURW-LAWSMPECSA-N	1	0	267.417	1.659	50	0		CDAARO
CCCc1nnc(C(=O)N2CCC[C@@]3(CC[N@H+](C)C3)C2)o1	ZINC000071764964	176261819	/nfs/dbraw/zinc/26/18/19/176261819.db2.gz	IMFYLFBYMDRLSM-HNNXBMFYSA-N	1	0	292.383	1.580	50	0		CDAARO
Cc1ccc(C[N@@H+]2CCN[C@H](C(=O)NC3CC3)C2)cc1C	ZINC000072162354	176329853	/nfs/dbraw/zinc/32/98/53/176329853.db2.gz	BUFULMBHTROTJG-INIZCTEOSA-N	1	0	287.407	1.356	50	0		CDAARO
O=C(N[C@@H]1C[NH+]2CCC1CC2)c1cn(-c2ccccc2)nn1	ZINC000072164973	176330990	/nfs/dbraw/zinc/33/09/90/176330990.db2.gz	JXELNNAUCLLLSX-CQSZACIVSA-N	1	0	297.362	1.091	50	0		CDAARO
COc1ccccc1CC(=O)N1CCCC[C@H]2C[NH2+]C[C@H]21	ZINC000077010809	177146327	/nfs/dbraw/zinc/14/63/27/177146327.db2.gz	VANASYYVGCDCDD-LSDHHAIUSA-N	1	0	288.391	1.838	50	0		CDAARO
CSc1nc(N2CC[NH2+]CC2)cc(C(F)(F)F)n1	ZINC000020286697	274189389	/nfs/dbraw/zinc/18/93/89/274189389.db2.gz	RFHKRABBZUBJAT-UHFFFAOYSA-N	1	0	278.303	1.627	50	0		CDAARO
CC[N@H+](C)C[C@@H](C)c1nc2c([nH]1)C(=O)NCCC2	ZINC000095529477	276072000	/nfs/dbraw/zinc/07/20/00/276072000.db2.gz	SUYJWSIJKOTNEF-SECBINFHSA-N	1	0	250.346	1.141	50	0		CDAARO
CC[NH+](CC)C[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000005073776	276331282	/nfs/dbraw/zinc/33/12/82/276331282.db2.gz	LQHAKJFBKRVIHB-LLVKDONJSA-N	1	0	267.325	1.497	50	0		CDAARO
CNc1ncccc1C(=O)N1CC([N@@H+]2CCCC[C@@H]2C)C1	ZINC000097717301	277046346	/nfs/dbraw/zinc/04/63/46/277046346.db2.gz	UULWWSXCJBQKET-LBPRGKRZSA-N	1	0	288.395	1.822	50	0		CDAARO
C[N@@H+]1CC[C@@]23c4c5c(O)ccc4C[C@@H]1[C@@H]2CC[C@H](O)[C@@H]3O5	ZINC000004102205	277161441	/nfs/dbraw/zinc/16/14/41/277161441.db2.gz	IJVCSMSMFSCRME-KBQPJGBKSA-N	1	0	287.359	1.422	50	0	world	CDAARO
CC(C)(C)NC(=O)NC(=O)C[NH+]1CCCCCC1	ZINC000006906143	277169099	/nfs/dbraw/zinc/16/90/99/277169099.db2.gz	GXNGUGUDKGHSDY-UHFFFAOYSA-N	1	0	255.362	1.487	50	0		CDAARO
COc1ccc(C[NH2+][C@@H](CO)c2ccccc2)cn1	ZINC000096499733	533690237	/nfs/dbraw/zinc/69/02/37/533690237.db2.gz	HXWDKJXCLAHLLC-AWEZNQCLSA-N	1	0	258.321	1.913	50	0		CDAARO
CC(=O)NCc1ccccc1C[N@@H+]1CCC[C@@H]1CO	ZINC000096007044	278125207	/nfs/dbraw/zinc/12/52/07/278125207.db2.gz	WOSASUFEKXCFII-OAHLLOKOSA-N	1	0	262.353	1.279	50	0		CDAARO
C[C@H]1CC([NH2+]CC2(O)CCS(=O)(=O)CC2)C[C@H](C)C1	ZINC000097020467	278326621	/nfs/dbraw/zinc/32/66/21/278326621.db2.gz	GWMNMLHSZUDSKF-VXGBXAGGSA-N	1	0	289.441	1.340	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CCC[C@H]2C[NH3+])cc1F	ZINC000089091769	278839803	/nfs/dbraw/zinc/83/98/03/278839803.db2.gz	BJEIJVRQPLEWIP-GXFFZTMASA-N	1	0	286.372	1.540	50	0		CDAARO
CC(C)[NH+]1CCC(n2c(=O)[nH]c3ccccc3c2=O)CC1	ZINC000095947779	279291619	/nfs/dbraw/zinc/29/16/19/279291619.db2.gz	HKJLMWWCBMNHKY-UHFFFAOYSA-N	1	0	287.363	1.735	50	0		CDAARO
CCOc1ccc(/C=C\C(=O)N2CC[C@@H]([NH3+])C2)cc1	ZINC000254956166	289346809	/nfs/dbraw/zinc/34/68/09/289346809.db2.gz	LRYGTBYNGZYVGT-DMTLFAOVSA-N	1	0	260.337	1.658	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C\C(=O)N1C[C@H](C)[NH2+][C@@H](C)C1	ZINC000255088141	289355592	/nfs/dbraw/zinc/35/55/92/289355592.db2.gz	AFQFNUSLXGIVGQ-QEJZFVATSA-N	1	0	296.802	1.604	50	0		CDAARO
[NH3+]C[C@@H]1CCCN1C(=O)/C=C\c1ccc2c(c1)OCCO2	ZINC000255344752	289367425	/nfs/dbraw/zinc/36/74/25/289367425.db2.gz	LJGJITNLXXZTBE-AGLBCWCQSA-N	1	0	288.347	1.421	50	0		CDAARO
C[C@H]1CCNC(=O)[C@H]1[NH2+]Cc1ccc(Cl)cc1	ZINC000193592631	290600369	/nfs/dbraw/zinc/60/03/69/290600369.db2.gz	BHFNTYUJMQZJJC-CABZTGNLSA-N	1	0	252.745	1.954	50	0		CDAARO
COc1ccc2c3c1O[C@@H]1C[C@@H](O)C=C[C@]31CC[N@@H+](C)C2	ZINC000044091982	295278636	/nfs/dbraw/zinc/27/86/36/295278636.db2.gz	ASUTZQLVASHGKV-DXCKQFNASA-N	1	0	287.359	1.850	50	0	biogenic,in-vitro	CDAARO
[NH3+][C@@H]1CCCN(C(=O)c2ccc3c(c2)CCC(=O)N3)C1	ZINC000084663765	295302552	/nfs/dbraw/zinc/30/25/52/295302552.db2.gz	BFIMXHMNYQIFNL-GFCCVEGCSA-N	1	0	273.336	1.135	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)CCc2ccncc2)C[C@@H]1C1CC1	ZINC000091809185	295342556	/nfs/dbraw/zinc/34/25/56/295342556.db2.gz	CILIJEWPOARKGS-KGLIPLIRSA-N	1	0	259.353	1.210	50	0		CDAARO
C[C@@H]1C[C@@H]([NH2+]CC(C)(C)CCS(C)(=O)=O)C[C@H](C)O1	ZINC000241466013	297283085	/nfs/dbraw/zinc/28/30/85/297283085.db2.gz	NTWVVVQVZYZKAZ-CLLJXQQHSA-N	1	0	291.457	1.993	50	0		CDAARO
COc1ccnc(N[C@@H]2CCC[N@H+](Cc3cccnc3)C2)n1	ZINC000534578190	328310801	/nfs/dbraw/zinc/31/08/01/328310801.db2.gz	UXFIQANLSNOOMT-CQSZACIVSA-N	1	0	299.378	1.957	50	0		CDAARO
COc1ccccc1C1CCN(C(=O)[C@@H]2C=CC[NH2+]2)CC1	ZINC000534580389	328311594	/nfs/dbraw/zinc/31/15/94/328311594.db2.gz	DRVKUGPOVBFSMV-HNNXBMFYSA-N	1	0	286.375	1.929	50	0		CDAARO
O=C(CCC[NH+]1Cc2ccccc2C1)N1CCC[NH2+]CC1	ZINC000534585948	328315207	/nfs/dbraw/zinc/31/52/07/328315207.db2.gz	XYFDNVCELLEVBY-UHFFFAOYSA-N	1	0	287.407	1.604	50	0		CDAARO
Cc1cc(C)cc(N2CCC([NH2+][C@H]3CCNC3=O)CC2)c1	ZINC000534635223	328333409	/nfs/dbraw/zinc/33/34/09/328333409.db2.gz	MEKJLUIHKMPFOX-INIZCTEOSA-N	1	0	287.407	1.750	50	0		CDAARO
COc1cccc(CCC(=O)N2C[C@H]3CC[C@@H](C2)[C@H]3[NH3+])c1	ZINC000534636997	328334032	/nfs/dbraw/zinc/33/40/32/328334032.db2.gz	MXOSCJVORHSUBP-HALDLXJZSA-N	1	0	288.391	1.824	50	0		CDAARO
NC(=O)c1cncc(NCC2CC[NH+](CC3CC3)CC2)n1	ZINC000534659583	328342226	/nfs/dbraw/zinc/34/22/26/328342226.db2.gz	IUOUYSMLSLJYDM-UHFFFAOYSA-N	1	0	289.383	1.109	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1C1CN(C(=O)NCCc2ncc[nH]2)C1	ZINC000534659528	328342267	/nfs/dbraw/zinc/34/22/67/328342267.db2.gz	HOLHRQPAQGHXLL-GFCCVEGCSA-N	1	0	291.399	1.220	50	0		CDAARO
O=C(NCC1CC[NH2+]CC1)c1cccc(-c2cn[nH]c2)c1	ZINC000534647307	328342858	/nfs/dbraw/zinc/34/28/58/328342858.db2.gz	ITVHESLLIGWOQI-UHFFFAOYSA-N	1	0	284.363	1.806	50	0		CDAARO
Cc1cc(NC[C@@H]2CC[NH2+]C[C@H]2O)nc(-c2ccccc2)n1	ZINC000072438355	327110476	/nfs/dbraw/zinc/11/04/76/327110476.db2.gz	BWROFYHDOHAMFN-LSDHHAIUSA-N	1	0	298.390	1.834	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(C[NH2+]C2)C(F)(F)C1	ZINC000079035619	329111963	/nfs/dbraw/zinc/11/19/63/329111963.db2.gz	DPKMOHMENJEEJV-UHFFFAOYSA-N	1	0	262.300	1.852	50	0		CDAARO
CCc1cnc(N)nc1NCC1([NH+](C)C)CCN(C)CC1	ZINC001772706226	1159440566	/nfs/dbraw/zinc/44/05/66/1159440566.db2.gz	RAQBDSLZCSJEAB-UHFFFAOYSA-N	1	0	292.431	1.059	50	0		CDAARO
Cc1cnccc1C(=O)N1C[C@H]2CCC[C@@H](C1)[N@H+](C)C2	ZINC000670439277	482979737	/nfs/dbraw/zinc/97/97/37/482979737.db2.gz	IVPONOVVBGMTKM-KBPBESRZSA-N	1	0	273.380	1.946	50	0		CDAARO
COc1nc(N2CC[C@@H](C[NH+](C)C)C2)ncc1F	ZINC000670460137	483042066	/nfs/dbraw/zinc/04/20/66/483042066.db2.gz	NQNFATNIUAWIRN-VIFPVBQESA-N	1	0	254.309	1.012	50	0		CDAARO
c1nnc([C@@H]2CCC[N@H+](C3CSCCSC3)C2)[nH]1	ZINC000670465123	483055515	/nfs/dbraw/zinc/05/55/15/483055515.db2.gz	WIWAATDIHQJUCH-SNVBAGLBSA-N	1	0	284.454	1.833	50	0		CDAARO
Cc1cnc(C[NH+]2CCC(c3nnc[nH]3)CC2)cn1	ZINC000670467761	483060249	/nfs/dbraw/zinc/06/02/49/483060249.db2.gz	DRDPUJKUYPZHOX-UHFFFAOYSA-N	1	0	258.329	1.283	50	0		CDAARO
CCn1cnnc1CC[NH2+][C@@H]1CCN(c2ccccc2)C1	ZINC000674882494	483167793	/nfs/dbraw/zinc/16/77/93/483167793.db2.gz	ODRZTZZGXRTSQO-CQSZACIVSA-N	1	0	285.395	1.709	50	0		CDAARO
OC[C@@H](O)C[N@H+](CCC(F)(F)F)[C@@H]1C=CCCC1	ZINC000096461005	534380818	/nfs/dbraw/zinc/38/08/18/534380818.db2.gz	GMJNMMBUANRRBK-MNOVXSKESA-N	1	0	267.291	1.703	50	0		CDAARO
C[NH+](C)C[C@H]1CCCN1S(=O)(=O)c1ccccc1F	ZINC000061644676	521871125	/nfs/dbraw/zinc/87/11/25/521871125.db2.gz	RKKLZJBWZOXWHO-LLVKDONJSA-N	1	0	286.372	1.540	50	0		CDAARO
CCOc1cc(N2CC[C@@H]([NH+](C)C)[C@H]2C)ncn1	ZINC000408523535	528312628	/nfs/dbraw/zinc/31/26/28/528312628.db2.gz	LBGDICQUHBGCRH-GHMZBOCLSA-N	1	0	250.346	1.404	50	0		CDAARO
CC[C@@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)C(=O)N1CCOCC1	ZINC000096479178	529207068	/nfs/dbraw/zinc/20/70/68/529207068.db2.gz	YSXKTDZKHZXBBH-OLZOCXBDSA-N	1	0	298.427	1.560	50	0		CDAARO
CCCCc1c(C)[nH+]c(N)nc1N1CCC[C@@H](CO)C1	ZINC000091943648	535078058	/nfs/dbraw/zinc/07/80/58/535078058.db2.gz	OKVVDSWLFONOEU-GFCCVEGCSA-N	1	0	278.400	1.919	50	0		CDAARO
NC[C@@H]1C[C@H]([C@@H]2CC[C@@H](C(F)(F)F)NC2)CC[NH2+]1	ZINC000757207445	577035823	/nfs/dbraw/zinc/03/58/23/577035823.db2.gz	BEYZMBORRMATFB-ZNSHCXBVSA-N	1	0	265.323	1.244	50	0		CDAARO
C[C@@H]1CC[C@H]([NH3+])[C@H]([C@H]2CC[C@@H](C(F)(F)F)NC2)N1	ZINC000757216091	577036239	/nfs/dbraw/zinc/03/62/39/577036239.db2.gz	XPGJYWYAEPVISB-NMUGVGKYSA-N	1	0	265.323	1.385	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@](O)([C@@H]([NH3+])C2CCC2)C1	ZINC000958528751	613979082	/nfs/dbraw/zinc/97/90/82/613979082.db2.gz	UGABYRSCXBBBBQ-FZMZJTMJSA-N	1	0	270.373	1.486	50	0		CDAARO
CC(C)C[C@H]([NH2+]C1CSCCSC1)C(N)=O	ZINC000952974184	614221359	/nfs/dbraw/zinc/22/13/59/614221359.db2.gz	LIRBNXLBBQFHEF-JTQLQIEISA-N	1	0	262.444	1.325	50	0		CDAARO
CCCO[C@@H]1CCCN(C(=O)CN2CCC[N@H+](C)CC2)C1	ZINC000952963255	614951998	/nfs/dbraw/zinc/95/19/98/614951998.db2.gz	GOVHRNBCMSAVMI-OAHLLOKOSA-N	1	0	297.443	1.042	50	0		CDAARO
CCNC(=O)c1ccc(NC(=O)[C@H]2C=CC[NH2+]2)cc1Cl	ZINC000952966414	615067894	/nfs/dbraw/zinc/06/78/94/615067894.db2.gz	ITIBETBCTWVCJL-GFCCVEGCSA-N	1	0	293.754	1.556	50	0		CDAARO
CN(C)c1ccc(C[NH2+]Cc2cccc(CO)c2)cn1	ZINC000952965697	616016082	/nfs/dbraw/zinc/01/60/82/616016082.db2.gz	RDQROHWALWUZQH-UHFFFAOYSA-N	1	0	271.364	1.930	50	0		CDAARO
COC[C@@H](O)C[NH2+]C1CC(Sc2ccccc2)C1	ZINC000888099228	617761937	/nfs/dbraw/zinc/76/19/37/617761937.db2.gz	XJJNJDNCOKSWMA-LXVYMNJGSA-N	1	0	267.394	1.907	50	0		CDAARO
CN(C)c1nc(NCC2(C[NH+]3CCCC3)CC2)ncc1F	ZINC001772704584	1159439149	/nfs/dbraw/zinc/43/91/49/1159439149.db2.gz	NXVGXNDMGSXVTL-UHFFFAOYSA-N	1	0	293.390	1.970	50	0		CDAARO
CNC(=O)c1cccnc1NC[C@H](C)[NH+]1CCCC1	ZINC001704346956	1177697049	/nfs/dbraw/zinc/69/70/49/1177697049.db2.gz	DAAPQKVYMFCUHM-NSHDSACASA-N	1	0	262.357	1.337	50	0		CDAARO
C[C@@H]1CC[C@H](C)[N@H+]1Cc1cccc(OCC(N)=O)c1	ZINC001704351103	1177697681	/nfs/dbraw/zinc/69/76/81/1177697681.db2.gz	SWTWAODNAGAGDV-TXEJJXNPSA-N	1	0	262.353	1.924	50	0		CDAARO
COc1ccccc1[C@H](O)C[NH2+][C@H]1CCC1(OC)OC	ZINC000864097176	783087984	/nfs/dbraw/zinc/08/79/84/783087984.db2.gz	POWLMUVYIKQHMG-OCCSQVGLSA-N	1	0	281.352	1.470	50	0		CDAARO
C[C@@H]1CN(C(=O)c2csc(Cl)n2)C[C@@H](C)[NH2+]1	ZINC000864096084	780845780	/nfs/dbraw/zinc/84/57/80/780845780.db2.gz	ZRSVOPLSFDJULF-RNFRBKRXSA-N	1	0	259.762	1.619	50	0		CDAARO
O=C(Nc1ccc(F)cc1F)[C@@H]1C[N@@H+]2CC3CC2(C3)CO1	ZINC000952994587	780911125	/nfs/dbraw/zinc/91/11/25/780911125.db2.gz	YWSRSNXGWXDIBR-MEXZMNCTSA-N	1	0	294.301	1.767	50	0		CDAARO
CC[C@H](C)[C@H]([NH3+])C(=O)Nc1ccc(NC(=O)COC)cc1	ZINC000037029352	894369337	/nfs/dbraw/zinc/36/93/37/894369337.db2.gz	JWJSQLTZRPYZPI-HZMBPMFUSA-N	1	0	293.367	1.583	50	0		CDAARO
COCCC1([NH+](C)C)CCN(C(=O)c2ccoc2)CC1	ZINC000581804763	898363938	/nfs/dbraw/zinc/36/39/38/898363938.db2.gz	IGPASVFDSGMZFJ-UHFFFAOYSA-N	1	0	280.368	1.853	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@@H](Nc2ccc3nccnc3n2)C12CCC2	ZINC000857760844	907833407	/nfs/dbraw/zinc/83/34/07/907833407.db2.gz	RDDXGZJSTNKEGO-CHWSQXEVSA-N	1	0	283.379	1.683	50	0		CDAARO
Cc1cccc([C@H](CNC(=O)c2nccn2C)[NH+](C)C)c1	ZINC000952989638	910556908	/nfs/dbraw/zinc/55/69/08/910556908.db2.gz	XUUKYWRIAGNGRO-AWEZNQCLSA-N	1	0	286.379	1.761	50	0		CDAARO
CCCc1nnc(C(=O)N(C)C[C@]2(C)CC[N@H+](C)C2)o1	ZINC000071750980	917535366	/nfs/dbraw/zinc/53/53/66/917535366.db2.gz	JPAZEXBBVPCAEF-CQSZACIVSA-N	1	0	280.372	1.436	50	0		CDAARO
CC(C)c1nc(-c2cccc3c2O[C@@H](C[NH3+])C3)n[nH]1	ZINC000067834111	936620465	/nfs/dbraw/zinc/62/04/65/936620465.db2.gz	QOHXSMLAPNQSNE-SNVBAGLBSA-N	1	0	258.325	1.857	50	0		CDAARO
CC[N@H+](C)C1(CNc2ccc(C(N)=O)cn2)CCCC1	ZINC000534589473	922707194	/nfs/dbraw/zinc/70/71/94/922707194.db2.gz	KGIPHMGKBCGPAR-UHFFFAOYSA-N	1	0	276.384	1.857	50	0		CDAARO
CC(C)CC1(CNC(=O)CN2CC[C@@H]([NH+](C)C)C2)CCC1	ZINC000821011648	925561275	/nfs/dbraw/zinc/56/12/75/925561275.db2.gz	HMECZYAKBVGDOG-OAHLLOKOSA-N	1	0	295.471	1.955	50	0		CDAARO
CC[C@@H](CNC(=O)N1CC[NH2+]CC1)Cc1ccccc1	ZINC000822620671	925642098	/nfs/dbraw/zinc/64/20/98/925642098.db2.gz	KWCNCCMPDFKGRL-CQSZACIVSA-N	1	0	275.396	1.870	50	0		CDAARO
COCC1(CNC(=O)C[NH+]2CCCCCC2)CCC1	ZINC000824346919	925816937	/nfs/dbraw/zinc/81/69/37/925816937.db2.gz	KWEAWRFGIJVNDY-UHFFFAOYSA-N	1	0	268.401	1.795	50	0		CDAARO
Cc1nc2cc(CNC(=O)[C@@H]3C=CC[NH2+]3)ccc2n1C	ZINC000827690935	925956076	/nfs/dbraw/zinc/95/60/76/925956076.db2.gz	QNJXPTNXAIYLEZ-LBPRGKRZSA-N	1	0	270.336	1.026	50	0		CDAARO
Cc1c(O)cccc1C(=O)NCC[N@@H+]1CCC[C@@H](CO)C1	ZINC000828711236	926169028	/nfs/dbraw/zinc/16/90/28/926169028.db2.gz	TWJNZXIYDFSVKS-CYBMUJFWSA-N	1	0	292.379	1.135	50	0		CDAARO
CC[N@H+](C1CN(C(=O)CC(C)C)C1)C1CCN(C)CC1	ZINC000581799367	927201310	/nfs/dbraw/zinc/20/13/10/927201310.db2.gz	SVJXYYSUHWUHTA-UHFFFAOYSA-N	1	0	281.444	1.659	50	0		CDAARO
C[N@@H+]1CCN(C(=O)[C@]2(C)CCC(=O)NC2)C[C@H]1C(C)(C)C	ZINC000863947406	934305274	/nfs/dbraw/zinc/30/52/74/934305274.db2.gz	HBFIBGJBPYRUJB-BLLLJJGKSA-N	1	0	295.427	1.091	50	0		CDAARO
CC(C)=CC[NH+]1CCC(CNC(=O)[C@@H]2CCC(=O)N2)CC1	ZINC001002063798	967788765	/nfs/dbraw/zinc/78/87/65/967788765.db2.gz	YLQIUYGNFKRZIG-AWEZNQCLSA-N	1	0	293.411	1.059	50	0		CDAARO
CC(C)n1cnnc1CN(C)[C@@H]1C[C@@H]2C[C@H](O)C[C@@H]2C1	ZINC001529198950	969011055	/nfs/dbraw/zinc/01/10/55/969011055.db2.gz	QOGGJISTPWWUHK-KPWCQOOUSA-N	1	0	278.400	1.840	50	0		CDAARO
COc1cccc(OCC[N@H+](C)CCn2cnnc2C)c1	ZINC001506406078	975151403	/nfs/dbraw/zinc/15/14/03/975151403.db2.gz	FIRFROJJBYAJKZ-UHFFFAOYSA-N	1	0	290.367	1.606	50	0		CDAARO
C[C@@H](Cn1cncn1)[NH2+]C1CSCCSC1	ZINC001506408457	975152952	/nfs/dbraw/zinc/15/29/52/975152952.db2.gz	SDNFMILYSGGJSS-VIFPVBQESA-N	1	0	258.416	1.105	50	0		CDAARO
C[C@@H](C[N@H+](C)CCO)NCc1noc(C2CCCC2)n1	ZINC001506419638	975157033	/nfs/dbraw/zinc/15/70/33/975157033.db2.gz	UHPXTTWZEFTDPH-NSHDSACASA-N	1	0	282.388	1.129	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@@H](NC(=O)[C@H]2CC[C@@H](O)CC2)C1	ZINC000584902390	341986818	/nfs/dbraw/zinc/98/68/18/341986818.db2.gz	RILJPOZSAGSILK-UPJWGTAASA-N	1	0	268.401	1.527	50	0		CDAARO
Cc1ccc(C(=O)NC[C@]2(O)CCC[NH2+]C2)n1C(F)F	ZINC000426628341	230424965	/nfs/dbraw/zinc/42/49/65/230424965.db2.gz	VCFOTKSKFQGREV-ZDUSSCGKSA-N	1	0	287.310	1.036	50	0		CDAARO
Cc1csc2c1ncn(C[C@@H]1COCC[N@@H+](C)C1)c2=O	ZINC000584887017	341999106	/nfs/dbraw/zinc/99/91/06/341999106.db2.gz	DYNKQAKAFMZHSG-LLVKDONJSA-N	1	0	293.392	1.345	50	0		CDAARO
CCOc1cccc(C[NH2+]C(C)(C)CC(N)=O)c1	ZINC000095940892	185036694	/nfs/dbraw/zinc/03/66/94/185036694.db2.gz	JNJKSWYNOPPGCB-UHFFFAOYSA-N	1	0	250.342	1.829	50	0		CDAARO
CSC[C@H]1CCN(C(=O)[C@@H]([NH3+])Cc2ccccc2)C1	ZINC000095971148	185048496	/nfs/dbraw/zinc/04/84/96/185048496.db2.gz	JGFZARNUHWSIMM-KBPBESRZSA-N	1	0	278.421	1.768	50	0		CDAARO
CC(C)(C)C[NH2+][C@H]1CCCc2cn(CC(N)=O)nc21	ZINC000096002669	185062099	/nfs/dbraw/zinc/06/20/99/185062099.db2.gz	VVAGJABCPHWSIN-NSHDSACASA-N	1	0	264.373	1.382	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@H](C)c1ccc(Cl)s1	ZINC000096013975	185066735	/nfs/dbraw/zinc/06/67/35/185066735.db2.gz	VSLKSXANHIQCKU-MRVPVSSYSA-N	1	0	296.845	1.991	50	0		CDAARO
CC[NH+](CC)CCSc1nnnn1-c1ccc(O)cc1	ZINC000037993090	361753050	/nfs/dbraw/zinc/75/30/50/361753050.db2.gz	WJDVEYUALURNAY-UHFFFAOYSA-N	1	0	293.396	1.802	50	0		CDAARO
CCOCc1nc(CCSC)nn1C1CC[NH+](C)CC1	ZINC000096138653	185105674	/nfs/dbraw/zinc/10/56/74/185105674.db2.gz	WMTAIRQBZQIVCY-UHFFFAOYSA-N	1	0	298.456	1.987	50	0		CDAARO
COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)[C@@H]([NH3+])C(C)C)C1	ZINC000195555047	342626187	/nfs/dbraw/zinc/62/61/87/342626187.db2.gz	MDZJRSBRGYJICT-NEPJUHHUSA-N	1	0	284.400	1.408	50	0		CDAARO
Cc1c([C@@H](C)[NH2+][C@@H]2C=C[C@H](CO)C2)cnc2ccnn21	ZINC000195558614	342628548	/nfs/dbraw/zinc/62/85/48/342628548.db2.gz	XCBZHXYYBIPJBT-KGYLQXTDSA-N	1	0	272.352	1.625	50	0		CDAARO
CN1C(=O)CCC12CC[NH+](C[C@@H](O)c1ccccc1)CC2	ZINC000244840250	361866609	/nfs/dbraw/zinc/86/66/09/361866609.db2.gz	UJRXYALPUJEPNY-OAHLLOKOSA-N	1	0	288.391	1.807	50	0		CDAARO
CCc1nc2ccccc2n1CC(=O)N1CC[C@@H]([NH3+])C1	ZINC000097019596	185152472	/nfs/dbraw/zinc/15/24/72/185152472.db2.gz	UAEOLGVUDHYLTM-LLVKDONJSA-N	1	0	272.352	1.158	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)NC1CC1)c1ccc(-n2ccnn2)cc1	ZINC000097033689	185156084	/nfs/dbraw/zinc/15/60/84/185156084.db2.gz	BTZRALRLAOMUDT-LLVKDONJSA-N	1	0	285.351	1.197	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)CCOc1ccc(F)cc1	ZINC000125488379	187187384	/nfs/dbraw/zinc/18/73/84/187187384.db2.gz	WOKAWRHZDNLJGW-NSHDSACASA-N	1	0	266.316	1.415	50	0		CDAARO
COc1ccc(S(=O)(=O)NC2CC[NH2+]CC2)cc1C	ZINC000020272031	539035534	/nfs/dbraw/zinc/03/55/34/539035534.db2.gz	AXNPXPFTEGJMTH-UHFFFAOYSA-N	1	0	284.381	1.034	50	0		CDAARO
C[N@@H+]1CCN(CCCc2c(F)cccc2F)C[C@@H]1CO	ZINC000585136504	342216048	/nfs/dbraw/zinc/21/60/48/342216048.db2.gz	IMBYXTNIHAFCET-GFCCVEGCSA-N	1	0	284.350	1.506	50	0		CDAARO
NC(=O)[C@@H]1CC[N@H+](C[C@H]2CCN(c3ccccc3)C2)C1	ZINC000585141360	342219020	/nfs/dbraw/zinc/21/90/20/342219020.db2.gz	ULHGKWXZOONNPH-ZIAGYGMSSA-N	1	0	273.380	1.320	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)/C=C/c1ccc(-n2ccnc2)cc1	ZINC000125582456	187191677	/nfs/dbraw/zinc/19/16/77/187191677.db2.gz	NSQVXHDSSXLMRW-GBXSZLQWSA-N	1	0	296.374	1.706	50	0		CDAARO
C[C@@H](C(=O)N1CCO[C@](C)(c2ccccc2)C1)[NH+](C)C	ZINC000584907918	539102440	/nfs/dbraw/zinc/10/24/40/539102440.db2.gz	COCWGOAPPSRHFE-BBRMVZONSA-N	1	0	276.380	1.711	50	0		CDAARO
C[C@H]1CN(C(=O)C2CC2)CC[C@H]1[NH2+]Cc1cccnc1	ZINC000084714969	342267890	/nfs/dbraw/zinc/26/78/90/342267890.db2.gz	PWVVJGQIMULXIL-SWLSCSKDSA-N	1	0	273.380	1.818	50	0		CDAARO
CSCCC[N@@H+]1C[C@@H](C)[C@@H](N2CCN(C(C)=O)CC2)C1	ZINC000084714516	342268038	/nfs/dbraw/zinc/26/80/38/342268038.db2.gz	MFLUMRARBCPHCN-HIFRSBDPSA-N	1	0	299.484	1.224	50	0		CDAARO
CCCS(=O)(=O)CC[NH2+][C@@H]1CC(C)(C)OC1(C)C	ZINC000119793051	342270058	/nfs/dbraw/zinc/27/00/58/342270058.db2.gz	ATIRWVPUNWPQKK-LLVKDONJSA-N	1	0	277.430	1.747	50	0		CDAARO
CC(C)Oc1ccccc1CC(=O)N1CC[NH2+]C[C@@H]1C	ZINC000126284839	187229537	/nfs/dbraw/zinc/22/95/37/187229537.db2.gz	LWXBTRMBCGWOFY-ZDUSSCGKSA-N	1	0	276.380	1.837	50	0		CDAARO
Cn1ccc(C(=O)N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)n1	ZINC000585126903	362060248	/nfs/dbraw/zinc/06/02/48/362060248.db2.gz	KWPWCDAWYUFFCY-GFCCVEGCSA-N	1	0	264.373	1.222	50	0		CDAARO
C[C@H](NC(=O)N[C@H]1CCCC[C@@H]1O)C(C)(C)C[NH+](C)C	ZINC000084139564	362258964	/nfs/dbraw/zinc/25/89/64/362258964.db2.gz	BZASLPIMKDGYFN-AVGNSLFASA-N	1	0	285.432	1.565	50	0		CDAARO
C[NH+](C)CCN(Cc1cccs1)C(=O)[C@H]1CCOC1	ZINC000084250896	362259144	/nfs/dbraw/zinc/25/91/44/362259144.db2.gz	JOVMGCUKQREMHN-LBPRGKRZSA-N	1	0	282.409	1.675	50	0		CDAARO
CC[N@H+](C[C@H](O)COC)[C@H]1CCN(c2ccccc2)C1=O	ZINC000182317098	362289822	/nfs/dbraw/zinc/28/98/22/362289822.db2.gz	ZMDFTMCWVHVLQY-GJZGRUSLSA-N	1	0	292.379	1.121	50	0		CDAARO
CN(Cc1ccon1)C(=O)Cc1ccc(OCC[NH3+])cc1	ZINC000426361922	530013301	/nfs/dbraw/zinc/01/33/01/530013301.db2.gz	JUFOPFPVISPFAF-UHFFFAOYSA-N	1	0	289.335	1.213	50	0		CDAARO
C[C@H]([NH2+]Cc1cnn(C)c1)c1ccc(-n2cncn2)cc1	ZINC000097123812	185541500	/nfs/dbraw/zinc/54/15/00/185541500.db2.gz	YQKRZDNGYLRFOF-LBPRGKRZSA-N	1	0	282.351	1.852	50	0		CDAARO
NC(=O)C1([NH2+]CCSCc2ccccc2)CC1	ZINC000192770616	362702815	/nfs/dbraw/zinc/70/28/15/362702815.db2.gz	SCXAEMUOOIKRKX-UHFFFAOYSA-N	1	0	250.367	1.527	50	0		CDAARO
NC(=O)C1CC[NH+](CCCNc2ncccc2F)CC1	ZINC000584896353	349357297	/nfs/dbraw/zinc/35/72/97/349357297.db2.gz	QTRILZTVXLBJOE-UHFFFAOYSA-N	1	0	280.347	1.220	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]CCc2noc(CC)n2)CC1	ZINC000584886475	349344956	/nfs/dbraw/zinc/34/49/56/349344956.db2.gz	WCBGSJZATPGERO-UHFFFAOYSA-N	1	0	296.371	1.385	50	0		CDAARO
O=C(C[C@H]1C[NH2+]CCO1)N1CC=C(c2ccccc2)CC1	ZINC000091300723	180128002	/nfs/dbraw/zinc/12/80/02/180128002.db2.gz	CHRZWUWMVXDPRY-INIZCTEOSA-N	1	0	286.375	1.681	50	0		CDAARO
Cc1cccc(S(=O)(=O)N[C@@H]2CCC[NH2+][C@@H]2C)c1	ZINC000091496960	180172642	/nfs/dbraw/zinc/17/26/42/180172642.db2.gz	OYPFHDCQEYMPRI-DGCLKSJQSA-N	1	0	268.382	1.414	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2scnc2C)C[C@@H]1[NH3+]	ZINC000091594019	180201347	/nfs/dbraw/zinc/20/13/47/180201347.db2.gz	BTVJWMUIEZZINX-UWVGGRQHSA-N	1	0	253.371	1.651	50	0		CDAARO
O=C(c1cccc(F)c1F)N1CC[C@@]2(O)CC[NH2+]C[C@H]2C1	ZINC000091504816	180176376	/nfs/dbraw/zinc/17/63/76/180176376.db2.gz	GGCGRVOFFFTZIP-BONVTDFDSA-N	1	0	296.317	1.151	50	0		CDAARO
O[C@H](CNc1ccncn1)C[NH+]1CCCCCC1	ZINC000091779473	180251676	/nfs/dbraw/zinc/25/16/76/180251676.db2.gz	AQXKRBAXNBDRHJ-GFCCVEGCSA-N	1	0	250.346	1.125	50	0		CDAARO
COCC[C@]1(CO)CCC[N@H+](Cc2cc(C)n[nH]2)C1	ZINC000092064755	180316552	/nfs/dbraw/zinc/31/65/52/180316552.db2.gz	WCRJFRYHMHFJEQ-CQSZACIVSA-N	1	0	267.373	1.329	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1ncnc2c1ncn2C	ZINC000583652257	366019498	/nfs/dbraw/zinc/01/94/98/366019498.db2.gz	SLJKBRWGYKQEBZ-LLVKDONJSA-N	1	0	274.372	1.650	50	0		CDAARO
CCOC(=O)[C@]1(C(C)C)CC[N@H+](C[C@H](O)C(F)(F)F)C1	ZINC000194879631	363250273	/nfs/dbraw/zinc/25/02/73/363250273.db2.gz	QPHCDQWMHLTTEK-CMPLNLGQSA-N	1	0	297.317	1.821	50	0		CDAARO
COc1ccc(-c2ccc([C@H]([NH3+])CO)cc2)c(CO)c1	ZINC000629740866	363389841	/nfs/dbraw/zinc/38/98/41/363389841.db2.gz	LEACDZOJKLKRST-MRXNPFEDSA-N	1	0	273.332	1.847	50	0		CDAARO
COc1cccc([C@]2(O)CC[S@@](=O)C[C@@H]2C[NH+](C)C)c1	ZINC000000347486	355906423	/nfs/dbraw/zinc/90/64/23/355906423.db2.gz	SMRSCUYCLLYTCF-AGKSTNPPSA-N	1	0	297.420	1.213	50	0		CDAARO
C[NH+](C)CCNC(=O)C(=O)c1c[nH]c2ccccc12	ZINC000003156284	355995376	/nfs/dbraw/zinc/99/53/76/355995376.db2.gz	JSODZBJQWIZURB-UHFFFAOYSA-N	1	0	259.309	1.028	50	0		CDAARO
O=C(CSC1=[NH+]CCN1)NC1CCCCCC1	ZINC000003222013	355995907	/nfs/dbraw/zinc/99/59/07/355995907.db2.gz	MINNXTQGIRDHAI-UHFFFAOYSA-N	1	0	255.387	1.518	50	0		CDAARO
CC[C@H](C)[NH2+]C[C@H](O)COc1cccc(OC)c1	ZINC000002451792	355970158	/nfs/dbraw/zinc/97/01/58/355970158.db2.gz	DKKSGKTWOPLXOM-RYUDHWBXSA-N	1	0	253.342	1.823	50	0		CDAARO
COc1ccccc1NC(=S)NCC[NH+](C)C	ZINC000004561846	356036048	/nfs/dbraw/zinc/03/60/48/356036048.db2.gz	WGGARZSAXKSVFS-UHFFFAOYSA-N	1	0	253.371	1.543	50	0		CDAARO
NC(=[NH2+])SCC(=O)NCCc1c[nH]c2ccccc12	ZINC000004666879	356039699	/nfs/dbraw/zinc/03/96/99/356039699.db2.gz	WMDDRFQUVRRHLY-UHFFFAOYSA-N	1	0	276.365	1.453	50	0		CDAARO
CCOC[C@H]([NH2+]CC(=O)Nc1cc(C)on1)C(C)C	ZINC000286308221	356249180	/nfs/dbraw/zinc/24/91/80/356249180.db2.gz	VXLIUBRTXCRZNX-NSHDSACASA-N	1	0	269.345	1.572	50	0		CDAARO
[NH3+]Cc1ccc(N2CCN(c3ccccc3)CC2)nc1	ZINC000019396583	356484416	/nfs/dbraw/zinc/48/44/16/356484416.db2.gz	KHCQCDYQQHCGJY-UHFFFAOYSA-N	1	0	268.364	1.867	50	0		CDAARO
[NH3+]CCCNC(=O)c1ccc(Br)cc1	ZINC000019477668	356486576	/nfs/dbraw/zinc/48/65/76/356486576.db2.gz	BHYKTSGYXJTFQT-UHFFFAOYSA-N	1	0	257.131	1.528	50	0		CDAARO
C[NH+]1CCN(CCC(=O)Nc2ccc(F)cc2)CC1	ZINC000019590021	356493504	/nfs/dbraw/zinc/49/35/04/356493504.db2.gz	QYMHDQMXJWUQDU-UHFFFAOYSA-N	1	0	265.332	1.402	50	0		CDAARO
CC(C)[C@@H]([NH3+])C(=O)Nc1cnn(Cc2ccccc2)c1	ZINC000037770069	356530707	/nfs/dbraw/zinc/53/07/07/356530707.db2.gz	NHCOBJWPUOFLSS-CQSZACIVSA-N	1	0	272.352	1.853	50	0		CDAARO
C[NH+](C)CCCN1C(=S)N=NC1c1ccncc1	ZINC000019913256	356515343	/nfs/dbraw/zinc/51/53/43/356515343.db2.gz	GKPVTSZZNQZVQF-UHFFFAOYSA-N	1	0	263.370	1.581	50	0		CDAARO
CCCS(=O)(=O)N1CCC(C[NH3+])(C(F)(F)F)CC1	ZINC000725264654	538455611	/nfs/dbraw/zinc/45/56/11/538455611.db2.gz	AUTKSGBAVULUII-UHFFFAOYSA-N	1	0	288.335	1.329	50	0		CDAARO
FC(F)(F)Oc1ccccc1CN1CC[NH2+]CC1	ZINC000022942234	356625086	/nfs/dbraw/zinc/62/50/86/356625086.db2.gz	AWMKJBNANKOBIA-UHFFFAOYSA-N	1	0	260.259	1.990	50	0		CDAARO
COc1cccc(OC/C=C/CN2CC[NH+](C)CC2)c1	ZINC000023116716	356628800	/nfs/dbraw/zinc/62/88/00/356628800.db2.gz	CSQBOXQBBUUQFF-ONEGZZNKSA-N	1	0	276.380	1.878	50	0		CDAARO
NC(=O)[C@@H]([NH2+]CCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000026221685	356689270	/nfs/dbraw/zinc/68/92/70/356689270.db2.gz	WNXUIQBYQXTZFZ-INIZCTEOSA-N	1	0	298.342	1.774	50	0		CDAARO
CCN1CCN(S(=O)(=O)c2ccc(F)c(C)c2)CC1	ZINC000032497859	356780642	/nfs/dbraw/zinc/78/06/42/356780642.db2.gz	HBIOTKNLAYYZAU-UHFFFAOYSA-N	1	0	286.372	1.460	50	0		CDAARO
O=C(C1CC[NH2+]CC1)N1CCN(c2ccc(F)cc2)CC1	ZINC000019410137	356808409	/nfs/dbraw/zinc/80/84/09/356808409.db2.gz	IPYUMXDBUSYYOC-UHFFFAOYSA-N	1	0	291.370	1.474	50	0		CDAARO
CCN1CCN(C(=S)c2ccc(O)c(OC)c2)CC1	ZINC000033903528	356808457	/nfs/dbraw/zinc/80/84/57/356808457.db2.gz	SGSAAABEQAPDHG-UHFFFAOYSA-N	1	0	280.393	1.714	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@@H](O)C2)c(OC)c1	ZINC000000207301	356812387	/nfs/dbraw/zinc/81/23/87/356812387.db2.gz	UACNZXHUXSAGAV-GFCCVEGCSA-N	1	0	251.326	1.661	50	0		CDAARO
CO[C@@H]1C=CC2=CC[N@@H+]3CC[C@H]4COC(=O)C=C4[C@]23C1	ZINC000034911981	356822079	/nfs/dbraw/zinc/82/20/79/356822079.db2.gz	IXPDLJKEPLTCOU-GHJWDPDVSA-N	1	0	273.332	1.445	50	0		CDAARO
C[NH2+]CCc1noc(-c2ccc(C(=O)OC)cc2)n1	ZINC000034928826	356824690	/nfs/dbraw/zinc/82/46/90/356824690.db2.gz	MFHKQYFUUYRGKD-UHFFFAOYSA-N	1	0	261.281	1.285	50	0		CDAARO
Cc1cc(C)nc(N2CCC(C[NH+]3CCOCC3)CC2)n1	ZINC000096453502	357476729	/nfs/dbraw/zinc/47/67/29/357476729.db2.gz	VRGQCTYJKMWXGK-UHFFFAOYSA-N	1	0	290.411	1.642	50	0		CDAARO
CC(C)(C)c1nccc(N2CC[NH+](CCCO)CC2)n1	ZINC000096453643	357476762	/nfs/dbraw/zinc/47/67/62/357476762.db2.gz	ZHHLCJPFHXQSSZ-UHFFFAOYSA-N	1	0	278.400	1.279	50	0		CDAARO
CC(=O)N1CCC([N@@H+](C)CCCc2cnn(C)c2)CC1	ZINC000065398291	357537029	/nfs/dbraw/zinc/53/70/29/357537029.db2.gz	XDQPBBQLRADXPG-UHFFFAOYSA-N	1	0	278.400	1.295	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](c2nc3c([nH]2)C(=O)NCCC3)C1	ZINC000065399285	357538161	/nfs/dbraw/zinc/53/81/61/357538161.db2.gz	OTJILPAKOHHGHX-LLVKDONJSA-N	1	0	276.384	1.675	50	0		CDAARO
COC[C@@H](C)[NH2+]CCC(=O)Nc1cc(F)ccc1F	ZINC000065399073	357538329	/nfs/dbraw/zinc/53/83/29/357538329.db2.gz	NLQADYVWJDMVGP-SECBINFHSA-N	1	0	272.295	1.918	50	0		CDAARO
C[N@@H+]1CCC[C@H](c2n[nH]c(=O)n2CCc2ccccc2)C1	ZINC000065461786	357543707	/nfs/dbraw/zinc/54/37/07/357543707.db2.gz	XJYLUROHRDARMD-AWEZNQCLSA-N	1	0	286.379	1.623	50	0		CDAARO
Cc1cnc(N(C)CCc2ccncc2)nc1N(C)C	ZINC000065488791	357544427	/nfs/dbraw/zinc/54/44/27/357544427.db2.gz	BPNFWMMVBMIIMB-UHFFFAOYSA-N	1	0	271.368	1.925	50	0		CDAARO
O=C(NC1CC1)c1ccc(OC[C@@H]2CCC[NH2+]2)cc1	ZINC000066323514	357561991	/nfs/dbraw/zinc/56/19/91/357561991.db2.gz	OASWAUFWLHENJR-ZDUSSCGKSA-N	1	0	260.337	1.710	50	0		CDAARO
C[C@@H](Cn1ccnc1)[NH2+]Cc1ccc2nonc2c1	ZINC000067563158	357613186	/nfs/dbraw/zinc/61/31/86/357613186.db2.gz	QFKLWOVHYMYTJF-JTQLQIEISA-N	1	0	257.297	1.598	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1CCN(C(=O)CCc1csc(N)n1)C2	ZINC000067674974	357618032	/nfs/dbraw/zinc/61/80/32/357618032.db2.gz	ZJEOZZGSADQVTP-NWDGAFQWSA-N	1	0	294.424	1.353	50	0		CDAARO
O=C(Cc1ccncc1)N1CCC[N@@H+]2CCC[C@H]2C1	ZINC000067975848	357641763	/nfs/dbraw/zinc/64/17/63/357641763.db2.gz	VPDWOSVPRWNPMB-AWEZNQCLSA-N	1	0	259.353	1.321	50	0		CDAARO
Cc1nc(C2CC[NH2+]CC2)cc(N(C)Cc2ncc[nH]2)n1	ZINC000067894474	357635374	/nfs/dbraw/zinc/63/53/74/357635374.db2.gz	DCPXXILVFNFJSO-UHFFFAOYSA-N	1	0	286.383	1.612	50	0		CDAARO
CC(C)c1cc(C(=O)NCC[C@@H]2CCC[N@@H+]2C)n(C)n1	ZINC000072422295	357834036	/nfs/dbraw/zinc/83/40/36/357834036.db2.gz	DGIIHZLSNSFFMC-LBPRGKRZSA-N	1	0	278.400	1.758	50	0		CDAARO
CC[C@@]1(C)NC(=O)N(CCCNc2cccc(C)[nH+]2)C1=O	ZINC000097163303	358004811	/nfs/dbraw/zinc/00/48/11/358004811.db2.gz	ALFLQVDYYGOBNP-OAHLLOKOSA-N	1	0	290.367	1.913	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)c2sccc2Br)C1	ZINC000097212425	358036898	/nfs/dbraw/zinc/03/68/98/358036898.db2.gz	OKPOECCGGIAWQX-LURJTMIESA-N	1	0	275.171	1.684	50	0		CDAARO
CCC(=O)c1cccc(S(=O)(=O)N[C@H](C[NH3+])C2CC2)c1	ZINC000097229431	358043296	/nfs/dbraw/zinc/04/32/96/358043296.db2.gz	DLGDHAKQNSNZON-CYBMUJFWSA-N	1	0	296.392	1.295	50	0		CDAARO
CC(C)(C)COC(=O)NCc1cc2n(n1)CC[NH2+]C2	ZINC000082083790	358145848	/nfs/dbraw/zinc/14/58/48/358145848.db2.gz	ZMKNEQQICZGBBU-UHFFFAOYSA-N	1	0	266.345	1.259	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+]Cc1cc2ccccc2[nH]c1=O	ZINC000097081569	358160947	/nfs/dbraw/zinc/16/09/47/358160947.db2.gz	MHHGSVPNMDNNAZ-UHFFFAOYSA-N	1	0	288.347	1.817	50	0		CDAARO
CC(=O)NCc1cccc(C[NH2+]Cc2cnn(C)c2C)c1	ZINC000095440124	358230419	/nfs/dbraw/zinc/23/04/19/358230419.db2.gz	CLYFAOHLSFROTM-UHFFFAOYSA-N	1	0	286.379	1.654	50	0		CDAARO
C[NH+]1CCC(C2CCN(C(=O)c3cccnn3)CC2)CC1	ZINC000091617009	358520374	/nfs/dbraw/zinc/52/03/74/358520374.db2.gz	SZONTWXBUKYFQU-UHFFFAOYSA-N	1	0	288.395	1.671	50	0		CDAARO
CCC[C@@H]([NH3+])C(=O)N(C)Cc1cccc(N(C)C)c1	ZINC000195554515	358556670	/nfs/dbraw/zinc/55/66/70/358556670.db2.gz	GUMBAMQGTGWRMM-CQSZACIVSA-N	1	0	263.385	1.838	50	0		CDAARO
CC(C)(C(=O)N[C@H]1CCC[NH2+]C1)c1ccc(F)cc1	ZINC000195542727	358559882	/nfs/dbraw/zinc/55/98/82/358559882.db2.gz	CIRDJAOCGMJUFY-ZDUSSCGKSA-N	1	0	264.344	1.972	50	0		CDAARO
Cc1cccc(-n2ncc3c2CCC[C@@H]3NC(=O)C[NH3+])c1C	ZINC000091847294	358529978	/nfs/dbraw/zinc/52/99/78/358529978.db2.gz	XRFBORDNYDAPEG-AWEZNQCLSA-N	1	0	298.390	1.941	50	0		CDAARO
Cc1ccc(C(=O)N2CC[N@@H+]3CCC[C@@H]3C2)cc1N	ZINC000027932718	358611982	/nfs/dbraw/zinc/61/19/82/358611982.db2.gz	YZMUKZHCWRIACT-CYBMUJFWSA-N	1	0	259.353	1.497	50	0		CDAARO
CC(C)c1nccn1[C@H](C)C(=O)NCC[NH+]1CCCC1	ZINC000095358490	358684153	/nfs/dbraw/zinc/68/41/53/358684153.db2.gz	GWHYWIGZRJAZIC-CYBMUJFWSA-N	1	0	278.400	1.780	50	0		CDAARO
COCc1cc(NC[C@H](c2ccco2)[NH+](C)C)ncn1	ZINC000095365820	358686442	/nfs/dbraw/zinc/68/64/42/358686442.db2.gz	VGPCBGAYIBDVJW-GFCCVEGCSA-N	1	0	276.340	1.931	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CCn1ncc(N2CCCC2)cc1=O	ZINC000095387817	358691398	/nfs/dbraw/zinc/69/13/98/358691398.db2.gz	FQVMPFYWBTYTDM-CQSZACIVSA-N	1	0	290.411	1.718	50	0		CDAARO
C[NH2+]CCCNC(=O)c1ccccc1-c1ncc[nH]1	ZINC000097272486	358763850	/nfs/dbraw/zinc/76/38/50/358763850.db2.gz	CUJIKHNHCVWIGE-UHFFFAOYSA-N	1	0	258.325	1.416	50	0		CDAARO
CN(C)Cc1ccc(C(=O)N2C[C@H]3CC[C@@H]2C[N@H+](C)C3)o1	ZINC000097610227	358787617	/nfs/dbraw/zinc/78/76/17/358787617.db2.gz	HKCWOSWQLPHKNC-QWHCGFSZSA-N	1	0	291.395	1.507	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)c1ccccc1-c1nc[nH]n1	ZINC000097618992	358788231	/nfs/dbraw/zinc/78/82/31/358788231.db2.gz	DZCYWXCIHLSASP-UHFFFAOYSA-N	1	0	285.351	1.297	50	0		CDAARO
C[NH+](C)[C@H]1CN(Cc2ccc(Cl)cc2)C[C@@H]1O	ZINC000097694673	358793961	/nfs/dbraw/zinc/79/39/61/358793961.db2.gz	LEQBSFRKFFDZBB-STQMWFEESA-N	1	0	254.761	1.447	50	0		CDAARO
[NH3+]CC[C@@H]1C[N@H+](Cc2cccc3[nH]ccc32)CCO1	ZINC000097785216	358798706	/nfs/dbraw/zinc/79/87/06/358798706.db2.gz	UGPBYYPGBIBMOL-CYBMUJFWSA-N	1	0	259.353	1.718	50	0		CDAARO
CCN(CC)C(=O)[C@H]1CCC[N@H+](Cc2c(C)cnn2C)C1	ZINC000215742854	358900610	/nfs/dbraw/zinc/90/06/10/358900610.db2.gz	QXAYOBJERCKRGQ-AWEZNQCLSA-N	1	0	292.427	1.809	50	0		CDAARO
COc1cccc2ccc(C[N@@H+]3CC[C@@H](NC(C)=O)C3)nc21	ZINC000216339557	358938634	/nfs/dbraw/zinc/93/86/34/358938634.db2.gz	SAMJGZKPSGJLPS-OAHLLOKOSA-N	1	0	299.374	1.954	50	0		CDAARO
C[C@H](c1ccc(-c2cc3nncn3c(N)n2)cc1)[NH+](C)C	ZINC000216432611	358944549	/nfs/dbraw/zinc/94/45/49/358944549.db2.gz	XMQLVQXQJLTDRH-SNVBAGLBSA-N	1	0	282.351	1.996	50	0		CDAARO
CSc1cccc(CN(C)C(=O)[C@@H]2C[C@H]([NH3+])CN2C)c1	ZINC000216535324	358949295	/nfs/dbraw/zinc/94/92/95/358949295.db2.gz	FHLSRKMGVJZANX-JSGCOSHPSA-N	1	0	293.436	1.398	50	0		CDAARO
COc1ccc(C[NH+]2CCC(C(N)=O)CC2)c(OC)c1	ZINC000000819563	359115829	/nfs/dbraw/zinc/11/58/29/359115829.db2.gz	LCFDSEJWWUFFJU-UHFFFAOYSA-N	1	0	278.352	1.401	50	0		CDAARO
O=C1CCCN1CCN1CCO[C@H](c2ccc(F)cc2)C1	ZINC000032916357	359260310	/nfs/dbraw/zinc/26/03/10/359260310.db2.gz	KWMHESIYQCJGIL-HNNXBMFYSA-N	1	0	292.354	1.821	50	0		CDAARO
O[C@@H]1COCC[C@H]1[NH2+]C1CCN(c2ccc(F)cc2)CC1	ZINC000222499234	359349367	/nfs/dbraw/zinc/34/93/67/359349367.db2.gz	PANZHGBJBGTJMK-HZPDHXFCSA-N	1	0	294.370	1.534	50	0		CDAARO
C[NH+](C)[C@H]1[C@@H]2OCC[C@@H]2[C@@H]1Nc1cc(C2CC2)ncn1	ZINC000223697381	359447853	/nfs/dbraw/zinc/44/78/53/359447853.db2.gz	VXODSQOLEOPWAY-AQNFWKISSA-N	1	0	274.368	1.483	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)CCC2CCCC2)C[C@H]1CO	ZINC000257183173	359487289	/nfs/dbraw/zinc/48/72/89/359487289.db2.gz	HGULFVDDNGZPCK-UONOGXRCSA-N	1	0	268.401	1.338	50	0		CDAARO
CN(CC(=O)Nc1ccccc1C(F)(F)F)C1C[NH2+]C1	ZINC000261920557	359588545	/nfs/dbraw/zinc/58/85/45/359588545.db2.gz	KKUXMGOCVQSWEM-UHFFFAOYSA-N	1	0	287.285	1.548	50	0		CDAARO
CN1C(=O)N(C)[C@@]2(CC[N@H+](CCc3ccccc3)C2)C1=O	ZINC000257197409	359630041	/nfs/dbraw/zinc/63/00/41/359630041.db2.gz	AFWLRBQIBOFPNF-MRXNPFEDSA-N	1	0	287.363	1.197	50	0		CDAARO
CNC(=O)CN1CCC([NH2+]Cc2ccccc2F)CC1	ZINC000030905566	359634027	/nfs/dbraw/zinc/63/40/27/359634027.db2.gz	QHAUTKWBHBGNSA-UHFFFAOYSA-N	1	0	279.359	1.126	50	0		CDAARO
O=C(NC[C@H]1CCCOC1)C1C[NH+](C2CCCCC2)C1	ZINC000408520174	359907894	/nfs/dbraw/zinc/90/78/94/359907894.db2.gz	PGKSFCFATRYTLQ-CYBMUJFWSA-N	1	0	280.412	1.794	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@@H]1CCCN(C(=O)c2ccn(C)n2)C1	ZINC000409421169	360230631	/nfs/dbraw/zinc/23/06/31/360230631.db2.gz	ULEBCZWXYWQVTD-CYBMUJFWSA-N	1	0	287.367	1.711	50	0		CDAARO
O=C(Cc1ccccc1)N1C[C@@H](CO)C2(C1)CC[NH2+]CC2	ZINC000409421517	360231718	/nfs/dbraw/zinc/23/17/18/360231718.db2.gz	GWPIWXWSPMGGCW-HNNXBMFYSA-N	1	0	288.391	1.050	50	0		CDAARO
O=C(NC1CC1)C1(F)CC[NH+](Cc2ccccn2)CC1	ZINC000409421588	360232010	/nfs/dbraw/zinc/23/20/10/360232010.db2.gz	PITJHSDGYDTXOV-UHFFFAOYSA-N	1	0	277.343	1.664	50	0		CDAARO
Cc1ncn(CCNC(=O)CC2CC[NH+](C)CC2)c1C	ZINC000426621535	360689717	/nfs/dbraw/zinc/68/97/17/360689717.db2.gz	BUXLWSAOZSCIBO-UHFFFAOYSA-N	1	0	278.400	1.348	50	0		CDAARO
CCCCCNC(=O)Cn1nccc1[C@@H]1CCC[NH2+]C1	ZINC000426477923	360673843	/nfs/dbraw/zinc/67/38/43/360673843.db2.gz	MOBRHXXQGDXKRL-CYBMUJFWSA-N	1	0	278.400	1.657	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)[C@H]1CCCO1)c1cccs1	ZINC000036079481	360841810	/nfs/dbraw/zinc/84/18/10/360841810.db2.gz	QWPOANHMPNVXFA-WDEREUQCSA-N	1	0	268.382	1.646	50	0		CDAARO
COc1ccnc(-c2cccc(C(=O)N3CC[C@H]([NH3+])C3)c2)n1	ZINC000426504632	360935404	/nfs/dbraw/zinc/93/54/04/360935404.db2.gz	RBAIZODOLZXLKF-ZDUSSCGKSA-N	1	0	298.346	1.325	50	0		CDAARO
C[N@@H+]1CCC[C@@]2(CCCN(C(=O)c3csnc3N)C2)C1	ZINC000299796217	200877446	/nfs/dbraw/zinc/87/74/46/200877446.db2.gz	MZFFJAMCRVAKKS-CQSZACIVSA-N	1	0	294.424	1.673	50	0		CDAARO
COc1ccc(NC(=O)N2CC[C@H]3C[NH2+]C[C@H]32)c(C)c1	ZINC000299798429	200877913	/nfs/dbraw/zinc/87/79/13/200877913.db2.gz	RZYPQNIQXKNUQN-SMDDNHRTSA-N	1	0	275.352	1.829	50	0		CDAARO
C[C@H](C(=O)N1CC(Oc2ccc(F)cc2)C1)[NH+](C)C	ZINC000426683790	361472285	/nfs/dbraw/zinc/47/22/85/361472285.db2.gz	JQKXYSQAEDFWBW-SNVBAGLBSA-N	1	0	266.316	1.365	50	0		CDAARO
CC(=O)c1cccc(OC[C@@H](O)C[N@@H+]2CCC[C@H](O)C2)c1	ZINC000036316617	361603914	/nfs/dbraw/zinc/60/39/14/361603914.db2.gz	FPNOPAJNRCQVRK-GJZGRUSLSA-N	1	0	293.363	1.086	50	0		CDAARO
O=C(C[C@@H]1C[NH2+]CCO1)N1CCC[C@H]1c1ccccc1	ZINC000091299512	283861417	/nfs/dbraw/zinc/86/14/17/283861417.db2.gz	WMYVKKFCIFSXOQ-CABCVRRESA-N	1	0	274.364	1.729	50	0		CDAARO
CC(=O)N1CC[C@@H]([NH2+]Cc2cccc3c2OCO3)[C@@H](C)C1	ZINC000089937618	366972227	/nfs/dbraw/zinc/97/22/27/366972227.db2.gz	VHGBZKGSHZIIDT-SMDDNHRTSA-N	1	0	290.363	1.762	50	0		CDAARO
CCC(CC)[C@H](O)CNC(=O)C[N@@H+]1CCC[C@@H]1C	ZINC000089943100	366975566	/nfs/dbraw/zinc/97/55/66/366975566.db2.gz	ALHFOLYQTHYDHP-WCQYABFASA-N	1	0	256.390	1.384	50	0		CDAARO
CCOCCN1CC[N@@H+]([C@@H]2CCCOC2)C[C@@H]1CC	ZINC000089949232	366979844	/nfs/dbraw/zinc/97/98/44/366979844.db2.gz	OPPOSKYGJCEKHR-LSDHHAIUSA-N	1	0	270.417	1.598	50	0		CDAARO
COCc1cc(C(=O)NC[C@@H]([NH3+])c2ccccc2)no1	ZINC000090254257	367027522	/nfs/dbraw/zinc/02/75/22/367027522.db2.gz	XYBYKSRFKOGQHI-GFCCVEGCSA-N	1	0	275.308	1.251	50	0		CDAARO
CN1CCN(C(=O)C[C@H]([NH3+])c2ccccc2)C(C)(C)C1=O	ZINC000094866059	367458024	/nfs/dbraw/zinc/45/80/24/367458024.db2.gz	OEGAWZPNWJMBRT-ZDUSSCGKSA-N	1	0	289.379	1.156	50	0		CDAARO
CC[C@H](C(=O)N[C@H]1CCCCC[C@H]1CO)[NH+](C)C	ZINC000252477454	367545908	/nfs/dbraw/zinc/54/59/08/367545908.db2.gz	OFDYGMKALQZFSO-RWMBFGLXSA-N	1	0	256.390	1.384	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(CN(CC[NH3+])C2)CC1	ZINC000224815288	367636421	/nfs/dbraw/zinc/63/64/21/367636421.db2.gz	LHSGKXRWODTZBO-UHFFFAOYSA-N	1	0	269.389	1.278	50	0		CDAARO
COCCN(C)c1ccc(C[N@@H+]2CC[C@@H](O)[C@H](C)C2)cn1	ZINC000252536921	367793669	/nfs/dbraw/zinc/79/36/69/367793669.db2.gz	JUNGOBWGANKIAL-UKRRQHHQSA-N	1	0	293.411	1.367	50	0		CDAARO
[NH3+]C[C@@H]1CCCC[C@@H]1NS(=O)(=O)CCc1ccccc1	ZINC000089108081	368997328	/nfs/dbraw/zinc/99/73/28/368997328.db2.gz	KSGFQRYBDVEAHW-GJZGRUSLSA-N	1	0	296.436	1.666	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1CCNC(=O)CCn1cccn1	ZINC000575554782	369133513	/nfs/dbraw/zinc/13/35/13/369133513.db2.gz	UYYPIVAZHCDWCY-UHFFFAOYSA-N	1	0	287.367	1.472	50	0		CDAARO
CCNC(=O)N1CCC[N@@H+](C2CCSCC2)CC1	ZINC000575618491	371896722	/nfs/dbraw/zinc/89/67/22/371896722.db2.gz	WFQCZEYBBHAMLY-UHFFFAOYSA-N	1	0	271.430	1.619	50	0		CDAARO
Cc1nc(N)sc1-c1ccn(CC[NH+]2CCCC2)n1	ZINC000299761600	372747179	/nfs/dbraw/zinc/74/71/79/372747179.db2.gz	LSSALLBOWLKAKZ-UHFFFAOYSA-N	1	0	277.397	1.993	50	0		CDAARO
CCc1ncc(NC(=O)N2CCC[N@H+](C)CC2)cn1	ZINC000097052276	541882177	/nfs/dbraw/zinc/88/21/77/541882177.db2.gz	RRYYDCBEEXSQPG-UHFFFAOYSA-N	1	0	263.345	1.208	50	0		CDAARO
CN(Cc1ccccc1Cl)C(=O)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000037798678	373120610	/nfs/dbraw/zinc/12/06/10/373120610.db2.gz	DHTAFAAUTDCRCT-ZYHUDNBSSA-N	1	0	268.744	1.021	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2F)C1	ZINC000095067583	373707247	/nfs/dbraw/zinc/70/72/47/373707247.db2.gz	AYSDDTGJFGXUFS-NSHDSACASA-N	1	0	282.334	1.965	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)c3ccc(Br)o3)C[C@H]12	ZINC000248584398	374248828	/nfs/dbraw/zinc/24/88/28/374248828.db2.gz	FXOWRZULMKWGHY-HRDYMLBCSA-N	1	0	299.168	1.851	50	0		CDAARO
O=C([C@@H]1CC12CC[NH2+]CC2)N1CCc2ccccc2C1	ZINC000070251967	284459308	/nfs/dbraw/zinc/45/93/08/284459308.db2.gz	PYJZIIIDYDGEIR-HNNXBMFYSA-N	1	0	270.376	1.961	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCN(C(=O)[C@H]2COc3ccccc32)C1	ZINC000251672889	189970336	/nfs/dbraw/zinc/97/03/36/189970336.db2.gz	VDDQKABIPCSTSC-SCRDCRAPSA-N	1	0	274.364	1.748	50	0		CDAARO
C[C@H]1C[C@H]([NH2+]CCCNC(=O)OC(C)(C)C)CN1C	ZINC000095421833	374924172	/nfs/dbraw/zinc/92/41/72/374924172.db2.gz	XUILBISTRDRGNR-RYUDHWBXSA-N	1	0	271.405	1.583	50	0		CDAARO
Cc1nc(C(C)(C)[NH2+]CCN2C(=O)CCC2=O)sc1C	ZINC000095432222	374932171	/nfs/dbraw/zinc/93/21/71/374932171.db2.gz	UNWMBYFAZKHWIR-UHFFFAOYSA-N	1	0	295.408	1.734	50	0		CDAARO
CCCC[C@@H]([NH3+])C(=O)N1CC[C@@H](Oc2cccnc2)C1	ZINC000095466802	374961229	/nfs/dbraw/zinc/96/12/29/374961229.db2.gz	DMHWQAQTDLBLIY-ZIAGYGMSSA-N	1	0	277.368	1.579	50	0		CDAARO
Cc1ccc(C(=O)NCC[NH2+]Cc2cnn(C)c2)cc1F	ZINC000097197984	375152731	/nfs/dbraw/zinc/15/27/31/375152731.db2.gz	LAJXTLGNPDCDGU-UHFFFAOYSA-N	1	0	290.342	1.387	50	0		CDAARO
CC[C@@H](O)CN1C(=O)CC[C@H]1CC[NH2+]Cc1ccccc1	ZINC000299768949	375210892	/nfs/dbraw/zinc/21/08/92/375210892.db2.gz	HBXPXHXRUPXXLV-JKSUJKDBSA-N	1	0	290.407	1.928	50	0		CDAARO
CC[NH+]1CCC(CNC(=O)c2nc(C)c[nH]2)CC1	ZINC000215557916	375211192	/nfs/dbraw/zinc/21/11/92/375211192.db2.gz	ZOFLRCASFRWJCH-UHFFFAOYSA-N	1	0	250.346	1.180	50	0		CDAARO
C[C@H]1CCC[N@H+](CC(=O)NC(=O)NC2CCCCC2)C1	ZINC000003564884	375750505	/nfs/dbraw/zinc/75/05/05/375750505.db2.gz	NTLKBOLVSKXUTR-LBPRGKRZSA-N	1	0	281.400	1.877	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CC[NH2+]C[C@@H]2C)cc1F	ZINC000606441883	375823055	/nfs/dbraw/zinc/82/30/55/375823055.db2.gz	RHWUQWYODQKAFK-QZPNVGJNSA-N	1	0	278.327	1.668	50	0		CDAARO
C[C@@H]1CCCN(C(=O)/C=C\C2CCOCC2)[C@@H]1C[NH3+]	ZINC000606441874	375823234	/nfs/dbraw/zinc/82/32/34/375823234.db2.gz	PVXPDIPTOKQNQN-YKEDUJKTSA-N	1	0	266.385	1.555	50	0		CDAARO
C[C@@H](NC(=O)c1ccc(CC[NH3+])cc1)C(F)(F)F	ZINC000389522942	375829828	/nfs/dbraw/zinc/82/98/28/375829828.db2.gz	FARNHLQTUGUFLW-MRVPVSSYSA-N	1	0	260.259	1.868	50	0		CDAARO
CCOc1ccc(C[N@@H+]2CC[C@@H](C)[C@H]2CO)nc1	ZINC000241466152	376019506	/nfs/dbraw/zinc/01/95/06/376019506.db2.gz	NVDVKJWJAUQYII-BXUZGUMPSA-N	1	0	250.342	1.683	50	0		CDAARO
CCC/C=C/C[N@@H+]1CCCN(C(=O)COC)CC1	ZINC000067757027	377235041	/nfs/dbraw/zinc/23/50/41/377235041.db2.gz	PPZSRKFLPPMLKX-AATRIKPKSA-N	1	0	254.374	1.523	50	0		CDAARO
C[NH+]1CCC(CNC(=O)COc2ccc(F)cc2)CC1	ZINC000023013828	378724239	/nfs/dbraw/zinc/72/42/39/378724239.db2.gz	OBCBKSBILRTJGF-UHFFFAOYSA-N	1	0	280.343	1.663	50	0		CDAARO
OCCO[C@@H]1CCC[N@@H+]([C@H]2Cc3ccccc3[C@@H]2O)C1	ZINC000245652372	378809543	/nfs/dbraw/zinc/80/95/43/378809543.db2.gz	HUNUDVAKSCQCDI-KBMXLJTQSA-N	1	0	277.364	1.118	50	0		CDAARO
COc1cccc(OC[C@@H](O)C[NH+]2CCCCC2)c1	ZINC000000250513	169587517	/nfs/dbraw/zinc/58/75/17/169587517.db2.gz	SATJSPFNHMXELY-ZDUSSCGKSA-N	1	0	265.353	1.921	50	0		CDAARO
O=C1CC[C@@H]2C[N@H+](C[C@@H]3CCOC3)CC[C@H]2N1C1CC1	ZINC000343555443	296326588	/nfs/dbraw/zinc/32/65/88/296326588.db2.gz	XLWKOTKFGILDGQ-GZBFAFLISA-N	1	0	278.396	1.498	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1CCC[C@H](C(C)(C)C(=O)OC)C1	ZINC000093298006	184661256	/nfs/dbraw/zinc/66/12/56/184661256.db2.gz	YIVYIIJBQIDVHB-NWDGAFQWSA-N	1	0	257.374	1.669	50	0		CDAARO
C[C@@H]1CCCN(S(=O)(=O)N2CCC[C@H](C)[C@H]2C[NH3+])C1	ZINC000252156694	296394519	/nfs/dbraw/zinc/39/45/19/296394519.db2.gz	NKBJUSUOLVHEKB-FRRDWIJNSA-N	1	0	289.445	1.022	50	0		CDAARO
O=c1c2ccccc2ncn1CC[NH+]1CCCCC1	ZINC000005739625	285212568	/nfs/dbraw/zinc/21/25/68/285212568.db2.gz	ASCJEWULDAPEFO-UHFFFAOYSA-N	1	0	257.337	1.882	50	0		CDAARO
Cc1cc(CNc2cc(C3CC([NH3+])C3)ncn2)no1	ZINC000223015498	256892020	/nfs/dbraw/zinc/89/20/20/256892020.db2.gz	BWNPRSBNZIMMNL-UHFFFAOYSA-N	1	0	259.313	1.590	50	0		CDAARO
Cc1cc(=O)[nH]c2c1c(=O)[nH]n2[C@@H]1C[C@@H](C)[N@@H+](C)C[C@H]1C	ZINC000013739182	390249267	/nfs/dbraw/zinc/24/92/67/390249267.db2.gz	MVFIEUFRENOXDE-GMTAPVOTSA-N	1	0	290.367	1.640	50	0		CDAARO
CCC[N@H+](C)C[C@@H]1CCN(S(=O)(=O)c2cccnc2)C1	ZINC000096428709	390518283	/nfs/dbraw/zinc/51/82/83/390518283.db2.gz	RYGYTDQWCKYRRL-ZDUSSCGKSA-N	1	0	297.424	1.434	50	0		CDAARO
Cc1cccnc1[C@@H]([NH2+]C[C@@H](O)Cn1cccn1)C(C)C	ZINC000096424384	390515896	/nfs/dbraw/zinc/51/58/96/390515896.db2.gz	PGUJKMLEIZPVBJ-CABCVRRESA-N	1	0	288.395	1.934	50	0		CDAARO
C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)N1C(=O)[C@H]1CC[NH2+]C1	ZINC000299739578	288394138	/nfs/dbraw/zinc/39/41/38/288394138.db2.gz	QHYBCUIODLFKTP-VDERGJSUSA-N	1	0	288.391	1.973	50	0		CDAARO
COc1ccc(OC)c([C@@H](O)C[NH2+]Cc2c[nH]nc2C)c1	ZINC000097159528	390801035	/nfs/dbraw/zinc/80/10/35/390801035.db2.gz	FRYWZXHOYMZINW-AWEZNQCLSA-N	1	0	291.351	1.559	50	0		CDAARO
Cc1cc(C[N@@H+]2CCCN(c3cccnn3)CC2)ccn1	ZINC000527531587	391032739	/nfs/dbraw/zinc/03/27/39/391032739.db2.gz	ACKQRHIKBOCAEF-UHFFFAOYSA-N	1	0	283.379	1.892	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@H](CNc2ncncc2Cl)C1	ZINC000189583919	391197652	/nfs/dbraw/zinc/19/76/52/391197652.db2.gz	DAKDZWKRNIJCPO-LLVKDONJSA-N	1	0	284.791	1.899	50	0		CDAARO
CCOC[C@H](O)C[N@@H+]1C[C@H](O)C[C@H]1c1cccc(F)c1	ZINC000281939393	391430902	/nfs/dbraw/zinc/43/09/02/391430902.db2.gz	TWBVNBWULSYDPO-KFWWJZLASA-N	1	0	283.343	1.331	50	0		CDAARO
Cc1cc(F)c(C(=O)N2CC[NH2+]C[C@@H]2C)cc1F	ZINC000125434404	391465917	/nfs/dbraw/zinc/46/59/17/391465917.db2.gz	AJNAEPRPGXPSDB-VIFPVBQESA-N	1	0	254.280	1.707	50	0		CDAARO
[NH3+]C[C@H]1CN(Cc2cccc3cnccc32)CCO1	ZINC000426535469	391566805	/nfs/dbraw/zinc/56/68/05/391566805.db2.gz	LWJYAGPOVBBZHQ-AWEZNQCLSA-N	1	0	257.337	1.394	50	0		CDAARO
CN1CCN(C(=O)[C@@H]2CCOC2)[C@H](c2ccccc2)C1	ZINC000071832964	391889577	/nfs/dbraw/zinc/88/95/77/391889577.db2.gz	NXUQKZXOXDCOQK-CABCVRRESA-N	1	0	274.364	1.538	50	0		CDAARO
[NH2+]=C1Nc2nc3ccccc3n2[C@@]2(CCSC2)N1	ZINC000007738383	393002886	/nfs/dbraw/zinc/00/28/86/393002886.db2.gz	LQXPHTULLHSHCI-GFCCVEGCSA-N	1	0	259.338	1.375	50	0		CDAARO
COC(=O)CCC[N@@H+]1C[C@@H](O)C[C@@H]1c1cccc(F)c1	ZINC000281894684	393161792	/nfs/dbraw/zinc/16/17/92/393161792.db2.gz	QFRCSYHMLNCSRO-UONOGXRCSA-N	1	0	281.327	1.887	50	0		CDAARO
CC[C@@](C)(O)C[NH2+][C@@H]1CCN(c2ccccc2)C(=O)C1	ZINC000193093663	393220731	/nfs/dbraw/zinc/22/07/31/393220731.db2.gz	BVQQAERQFDZAPU-CZUORRHYSA-N	1	0	276.380	1.933	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N1CC[C@H](C)C[C@H](C)C1	ZINC000195554726	393294589	/nfs/dbraw/zinc/29/45/89/393294589.db2.gz	ZNIDWQFCRZJEFR-SRVKXCTJSA-N	1	0	258.431	1.961	50	0		CDAARO
CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000195575881	393304537	/nfs/dbraw/zinc/30/45/37/393304537.db2.gz	LVHKJWZGIVLNCW-MJBXVCDLSA-N	1	0	286.441	1.602	50	0		CDAARO
C[C@H](OC[C@@H]1CCCCO1)C(=O)N1CCC[C@H](C)[C@H]1C[NH3+]	ZINC000247331827	397900902	/nfs/dbraw/zinc/90/09/02/397900902.db2.gz	VEETYBIGFIDZMU-ZQDZILKHSA-N	1	0	298.427	1.546	50	0		CDAARO
C[C@@H]1C[C@@H](C)C[NH+](CCn2nc3ccccn3c2=O)C1	ZINC000036392947	398007472	/nfs/dbraw/zinc/00/74/72/398007472.db2.gz	MHNQUYCOAOGCKT-CHWSQXEVSA-N	1	0	274.368	1.474	50	0		CDAARO
COc1c2c(cc3c1[C@H](C[C@@H](C)O)[N@H+](C)CC3)OCO2	ZINC000000485912	286188620	/nfs/dbraw/zinc/18/86/20/286188620.db2.gz	QLEBYGRJDONRLS-KOLCDFICSA-N	1	0	279.336	1.724	50	0	biogenic	CDAARO
CCO[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CCC[C@H]2[NH3+])C1(C)C	ZINC000299738575	286325754	/nfs/dbraw/zinc/32/57/54/286325754.db2.gz	CIIPPJDFQMVVIA-FVCCEPFGSA-N	1	0	268.401	1.776	50	0		CDAARO
C[NH+](C)CCC1CCN(C(=O)C[C@H]2CCOC2)CC1	ZINC000351974376	154871078	/nfs/dbraw/zinc/87/10/78/154871078.db2.gz	HJEHLTZKUKIIKX-CQSZACIVSA-N	1	0	268.401	1.603	50	0		CDAARO
C[C@@H](O)C[NH+]1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000072319659	287087040	/nfs/dbraw/zinc/08/70/40/287087040.db2.gz	RILCRPPNPSBVRQ-SNVBAGLBSA-N	1	0	258.362	1.356	50	0		CDAARO
Cc1cc(C)c(S(=O)(=O)NCC[NH+](C)C)c(C)c1	ZINC000006703852	170230748	/nfs/dbraw/zinc/23/07/48/170230748.db2.gz	DYGQVDUPKYPXFU-UHFFFAOYSA-N	1	0	270.398	1.452	50	0		CDAARO
C[NH+](C)CCNS(=O)(=O)c1ccccc1C(F)(F)F	ZINC000007612654	170293576	/nfs/dbraw/zinc/29/35/76/170293576.db2.gz	MDSUMXVSVNTUDU-UHFFFAOYSA-N	1	0	296.314	1.545	50	0		CDAARO
[NH3+]C[C@@H](c1ccco1)S(=O)(=O)c1ccccc1	ZINC000007997079	170313108	/nfs/dbraw/zinc/31/31/08/170313108.db2.gz	HZWJQBNSBQWWQO-LBPRGKRZSA-N	1	0	251.307	1.753	50	0		CDAARO
NC(=O)C1CC[NH+](CCOc2cccc(Cl)c2)CC1	ZINC000009484600	170378965	/nfs/dbraw/zinc/37/89/65/170378965.db2.gz	KATWCHOYZZQOAU-UHFFFAOYSA-N	1	0	282.771	1.916	50	0		CDAARO
Cc1cccc(CS(=O)(=O)NCCC[NH+](C)C)c1	ZINC000010111486	170397774	/nfs/dbraw/zinc/39/77/74/170397774.db2.gz	CWXPRNIGGNTVSR-UHFFFAOYSA-N	1	0	270.398	1.366	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C[NH3+])c(C)c1	ZINC000020182654	171046102	/nfs/dbraw/zinc/04/61/02/171046102.db2.gz	NNZXZYPCNWCOHI-LBPRGKRZSA-N	1	0	268.382	1.415	50	0		CDAARO
O=S(=O)(NC1CC[NH2+]CC1)c1ccc(Cl)cc1	ZINC000020272012	171126918	/nfs/dbraw/zinc/12/69/18/171126918.db2.gz	YXMIPZNANMYUNP-UHFFFAOYSA-N	1	0	274.773	1.370	50	0		CDAARO
Cc1cc(CN2CCC([C@H](C)[NH+]3CCOCC3)CC2)no1	ZINC000020820147	171273481	/nfs/dbraw/zinc/27/34/81/171273481.db2.gz	LXFOKBXGURQZEA-AWEZNQCLSA-N	1	0	293.411	1.916	50	0		CDAARO
COc1ccc(CN2CC[N@H+](C)[C@@H](C)C2)c(OC)c1OC	ZINC000020878258	171277823	/nfs/dbraw/zinc/27/78/23/171277823.db2.gz	JRMAVMWXWVBGDH-LBPRGKRZSA-N	1	0	294.395	1.848	50	0		CDAARO
COc1cc2nc(N(C)CCC[NH3+])nc(N)c2cc1OC	ZINC000022048332	171350675	/nfs/dbraw/zinc/35/06/75/171350675.db2.gz	HVTJQTPDNHTWGI-UHFFFAOYSA-N	1	0	291.355	1.014	50	0	in-vitro	CDAARO
CC[NH+]1CCN(Cc2cn3c(cccc3C)n2)CC1	ZINC000022779075	171398955	/nfs/dbraw/zinc/39/89/55/171398955.db2.gz	WTOUEFJQPJPFTB-UHFFFAOYSA-N	1	0	258.369	1.780	50	0		CDAARO
Cc1ccccc1OCC(=O)NCC1CC[NH+](C)CC1	ZINC000023013809	171406440	/nfs/dbraw/zinc/40/64/40/171406440.db2.gz	XNUMKWDPVQSGFX-UHFFFAOYSA-N	1	0	276.380	1.832	50	0		CDAARO
O=C(Nc1ccc(F)cc1Cl)[C@@H]1C[NH2+]CCO1	ZINC000043707909	175100863	/nfs/dbraw/zinc/10/08/63/175100863.db2.gz	JZGWFMJSHFOHCU-JTQLQIEISA-N	1	0	258.680	1.406	50	0		CDAARO
COCC1(C(=O)NCC[C@H]2CCC[N@H+](C)C2)CCC1	ZINC000067432950	175774115	/nfs/dbraw/zinc/77/41/15/175774115.db2.gz	ZBOWUFHWBFRXKZ-CYBMUJFWSA-N	1	0	268.401	1.651	50	0		CDAARO
O=C(NCc1cccs1)[C@H]1CC12CC[NH2+]CC2	ZINC000070252270	175884186	/nfs/dbraw/zinc/88/41/86/175884186.db2.gz	RNABDQUSTABCOM-LLVKDONJSA-N	1	0	250.367	1.754	50	0		CDAARO
C[NH2+]CC(=O)N1CCC[C@H]1c1nc(C(C)C)no1	ZINC000071422204	176160853	/nfs/dbraw/zinc/16/08/53/176160853.db2.gz	NORHUULJDVFFCY-VIFPVBQESA-N	1	0	252.318	1.076	50	0		CDAARO
COCCc1noc(C[N@H+]2C[C@@H]3CC=CC[C@@H]3C2)n1	ZINC000072173917	176333506	/nfs/dbraw/zinc/33/35/06/176333506.db2.gz	UTGVNFLJYGSBPE-TXEJJXNPSA-N	1	0	263.341	1.657	50	0		CDAARO
Cc1cc(CCC(=O)N(C)C)nc([C@H]2CCC[NH2+]C2)n1	ZINC000072344291	176373199	/nfs/dbraw/zinc/37/31/99/176373199.db2.gz	JMFDOODMQOYDTQ-LBPRGKRZSA-N	1	0	276.384	1.273	50	0		CDAARO
Cc1noc(C)c1Cn1ccnc1-c1cc2n(n1)CC[NH2+]C2	ZINC000072407019	176398003	/nfs/dbraw/zinc/39/80/03/176398003.db2.gz	VMHOLZJGBWWMMP-UHFFFAOYSA-N	1	0	298.350	1.503	50	0		CDAARO
O=C(C[NH+]1CCCC1)N1CCCC[C@H]1CCn1ccnc1	ZINC000077456196	177271418	/nfs/dbraw/zinc/27/14/18/177271418.db2.gz	GTWQSTIVQCENSY-HNNXBMFYSA-N	1	0	290.411	1.750	50	0		CDAARO
C[C@@H]1CCCN(C(=O)[C@H]2CSCCS2)[C@H]1C[NH3+]	ZINC000247447908	287337936	/nfs/dbraw/zinc/33/79/36/287337936.db2.gz	YPTNKOUPVBBDQH-OUAUKWLOSA-N	1	0	274.455	1.421	50	0		CDAARO
C[C@@H]1CCC[N@H+](CC(=O)NC(=O)NC2CCCCC2)C1	ZINC000003564886	287346143	/nfs/dbraw/zinc/34/61/43/287346143.db2.gz	NTLKBOLVSKXUTR-GFCCVEGCSA-N	1	0	281.400	1.877	50	0		CDAARO
Cc1ccsc1CN(C)c1cc(NCCO)nc(N)n1	ZINC000065427085	260243089	/nfs/dbraw/zinc/24/30/89/260243089.db2.gz	VPOFYKZBTQIHCQ-UHFFFAOYSA-N	1	0	293.396	1.469	50	0		CDAARO
OC[C@@H]1C[NH+](Cc2cccc3[nH]ccc32)C[C@H]1CO	ZINC000529638524	271010613	/nfs/dbraw/zinc/01/06/13/271010613.db2.gz	IRYUHAPYIWPKCJ-STQMWFEESA-N	1	0	260.337	1.201	50	0		CDAARO
CC(C)(C)OC(=O)N1CCCN(C2CC[NH2+]CC2)C1=O	ZINC000071289228	275518566	/nfs/dbraw/zinc/51/85/66/275518566.db2.gz	DTMLLADDVZPADM-UHFFFAOYSA-N	1	0	283.372	1.801	50	0		CDAARO
CCOCCN1CC[N@H+](C[C@H]2CCCCO2)C[C@@H]1C	ZINC000247034495	276322884	/nfs/dbraw/zinc/32/28/84/276322884.db2.gz	DIMNYQCJPCYKAR-LSDHHAIUSA-N	1	0	270.417	1.598	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC([NH+]2CCC(O)CC2)CC1	ZINC000033976821	277181033	/nfs/dbraw/zinc/18/10/33/277181033.db2.gz	NHZHORRSIJNTSZ-UHFFFAOYSA-N	1	0	284.400	1.843	50	0		CDAARO
C[C@H](O)CN1CC[N@H+](CC2(O)CCCCC2)C[C@@H]1C	ZINC000106844068	278294356	/nfs/dbraw/zinc/29/43/56/278294356.db2.gz	HFLFXXDKFZNQQM-KBPBESRZSA-N	1	0	270.417	1.069	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(CN)([NH2+]C2CC2)CC1	ZINC000032628283	278381814	/nfs/dbraw/zinc/38/18/14/278381814.db2.gz	FBYGCVIKKILWIR-UHFFFAOYSA-N	1	0	269.389	1.467	50	0		CDAARO
C[C@H]1Cc2cc(S(=O)(=O)NC(C)(C)C[NH3+])ccc2O1	ZINC000123731432	278503378	/nfs/dbraw/zinc/50/33/78/278503378.db2.gz	HQRXSAHWYTUQJQ-VIFPVBQESA-N	1	0	284.381	1.026	50	0		CDAARO
C[C@@H]1CN(C(=O)C[NH2+][C@H]2CCCC2(C)C)C[C@H](C)O1	ZINC000195577943	278645892	/nfs/dbraw/zinc/64/58/92/278645892.db2.gz	GOZRDELVDNYOGS-XQQFMLRXSA-N	1	0	268.401	1.791	50	0		CDAARO
C[C@H](Cn1cncn1)[NH2+][C@H](C)c1ccc2c(c1)OCCO2	ZINC000095421184	279389410	/nfs/dbraw/zinc/38/94/10/279389410.db2.gz	JHBWOEMLFHMZSK-VXGBXAGGSA-N	1	0	288.351	1.789	50	0		CDAARO
O=S(=O)(N[C@@H]1CCC[NH2+]C1)c1cc(F)ccc1Cl	ZINC000097896804	280338085	/nfs/dbraw/zinc/33/80/85/280338085.db2.gz	JLYRRNNXHNCWMY-SECBINFHSA-N	1	0	292.763	1.509	50	0		CDAARO
CCc1ccc([C@H]2C[NH2+]CCN2C(=O)c2cn(C)cn2)cc1	ZINC000285897395	281431143	/nfs/dbraw/zinc/43/11/43/281431143.db2.gz	CSEZKYKDNAHDAG-MRXNPFEDSA-N	1	0	298.390	1.769	50	0		CDAARO
C[N@@H+]1C[C@H]2CCC[C@H](O)[C@@H]2[C@]2(CCCCC2=O)C1	ZINC000036550948	290310067	/nfs/dbraw/zinc/31/00/67/290310067.db2.gz	FYBWQOYLTXRONY-AYRXBEOTSA-N	1	0	251.370	1.839	50	0		CDAARO
C[C@H](C(=O)NC(=O)NC(C)(C)C)[NH+]1CCCCCC1	ZINC000008119234	298119234	/nfs/dbraw/zinc/11/92/34/298119234.db2.gz	HBGKMQYCARYEOY-LLVKDONJSA-N	1	0	269.389	1.875	50	0		CDAARO
Cc1c(F)cccc1S(=O)(=O)N[C@H]1CCC[C@H]1C[NH3+]	ZINC000095432108	300971261	/nfs/dbraw/zinc/97/12/61/300971261.db2.gz	DEDJRXGHXFHHGX-JQWIXIFHSA-N	1	0	286.372	1.540	50	0		CDAARO
O=C1CC[C@@H]([NH2+]CCc2ncc[nH]2)CCN1CC1CC1	ZINC000534581867	328312024	/nfs/dbraw/zinc/31/20/24/328312024.db2.gz	ZCXMNLFPFNATLG-CYBMUJFWSA-N	1	0	276.384	1.333	50	0		CDAARO
CC(C)c1nc(N2CCC[C@@]3(CC[NH2+]C3)C2)no1	ZINC000534592702	328318592	/nfs/dbraw/zinc/31/85/92/328318592.db2.gz	GWFVNFPEDKEGKH-ZDUSSCGKSA-N	1	0	250.346	1.773	50	0		CDAARO
C[C@H](CCC(=O)NCC1(CO)CCCC1)[NH+]1CCOCC1	ZINC000534652287	328337822	/nfs/dbraw/zinc/33/78/22/328337822.db2.gz	UNOLVEBLWKHPBV-CQSZACIVSA-N	1	0	298.427	1.156	50	0		CDAARO
C[C@@H](CN1CCCCCC1)[NH2+]CCn1cncn1	ZINC000534653114	328338319	/nfs/dbraw/zinc/33/83/19/328338319.db2.gz	DANZYGWVTUPUCY-ZDUSSCGKSA-N	1	0	251.378	1.132	50	0		CDAARO
Cc1ncn(C)c1C(=O)NC[C@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534665428	328344939	/nfs/dbraw/zinc/34/49/39/328344939.db2.gz	NOKFYRXZVRFBMN-CYBMUJFWSA-N	1	0	290.411	1.723	50	0		CDAARO
NC(=O)c1ccc(NC[C@@H]2CC[N@@H+](C3CCCC3)C2)nc1	ZINC000534670886	328347255	/nfs/dbraw/zinc/34/72/55/328347255.db2.gz	VRTLWEJPRGFRES-LBPRGKRZSA-N	1	0	288.395	1.279	50	0		CDAARO
CC(C)[C@H](CNC(=O)CCc1nc(Cl)n[nH]1)[NH+](C)C	ZINC000534673089	328348528	/nfs/dbraw/zinc/34/85/28/328348528.db2.gz	IMZLSPCQNKJNBG-VIFPVBQESA-N	1	0	287.795	1.093	50	0		CDAARO
CN(C(=O)[C@@H]([NH3+])Cc1ccccc1)[C@H]1CCSC1	ZINC000037175089	326918284	/nfs/dbraw/zinc/91/82/84/326918284.db2.gz	BNICCPVXWWLLNN-STQMWFEESA-N	1	0	264.394	1.520	50	0		CDAARO
Cc1nc([C@@H]2CCC[N@H+](CCO)C2)cc(N2CCCC2)n1	ZINC000072438459	327110630	/nfs/dbraw/zinc/11/06/30/327110630.db2.gz	ZVEIPVONXBJCDA-CQSZACIVSA-N	1	0	290.411	1.557	50	0		CDAARO
C[NH2+]C[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000032104982	330381216	/nfs/dbraw/zinc/38/12/16/330381216.db2.gz	XVUQUTDOVKEXAH-VIFPVBQESA-N	1	0	250.125	1.953	50	0		CDAARO
CC[NH+]1CCN(c2nc(C(C)C)nc3c2cnn3C)CC1	ZINC000072141649	482451438	/nfs/dbraw/zinc/45/14/38/482451438.db2.gz	SKRDJIZPAYASKI-UHFFFAOYSA-N	1	0	288.399	1.629	50	0		CDAARO
Cc1cc2n(n1)CCN(C[C@@H]1Cc3c(nc(C)nc3C)O1)C2	ZINC000670450060	483010901	/nfs/dbraw/zinc/01/09/01/483010901.db2.gz	DCHZKAQAXBMAGL-AWEZNQCLSA-N	1	0	299.378	1.418	50	0		CDAARO
CNC(=O)C[C@H]1CC[N@H+](CCCOc2ccccc2)C1	ZINC000670459178	483041089	/nfs/dbraw/zinc/04/10/89/483041089.db2.gz	IJYFQMRQPFBFCC-CQSZACIVSA-N	1	0	276.380	1.914	50	0		CDAARO
Cc1ncc(C(C)C)c(NCC2(O)CC[NH+](C)CC2)n1	ZINC000670467125	483057687	/nfs/dbraw/zinc/05/76/87/483057687.db2.gz	VWHRLTNEDPFWEB-UHFFFAOYSA-N	1	0	278.400	1.777	50	0		CDAARO
c1n[nH]cc1CC[NH2+][C@H]1CCN(c2ccccc2)C1	ZINC000685627567	483192133	/nfs/dbraw/zinc/19/21/33/483192133.db2.gz	QJFBXYBQKLUCQA-AWEZNQCLSA-N	1	0	256.353	1.821	50	0		CDAARO
Cc1cc([C@H]2CCC[N@H+](CCn3cncn3)C2)[nH]n1	ZINC000084111278	483247887	/nfs/dbraw/zinc/24/78/87/483247887.db2.gz	GNIUKKHTIWZFDJ-LBPRGKRZSA-N	1	0	260.345	1.189	50	0		CDAARO
CC(=O)N(Cc1noc(C)n1)[C@@H]1CC[N@@H+](C(C)C)C1	ZINC000084281102	483270522	/nfs/dbraw/zinc/27/05/22/483270522.db2.gz	XZADMPFIXCXFTJ-GFCCVEGCSA-N	1	0	266.345	1.209	50	0		CDAARO
O=C([C@@H](O)c1ccc(F)cc1)N1CC([NH+]2CCCCC2)C1	ZINC000223063500	534573670	/nfs/dbraw/zinc/57/36/70/534573670.db2.gz	HPIVWLPUEVHKRR-HNNXBMFYSA-N	1	0	292.354	1.556	50	0		CDAARO
CCc1cc(N[C@H]2CC[C@@H]([NH3+])CC2)n2nccc2n1	ZINC000244773925	523824649	/nfs/dbraw/zinc/82/46/49/523824649.db2.gz	PIUVCNPPZGBNER-KLPPZKSPSA-N	1	0	259.357	1.974	50	0		CDAARO
CCCCOC[C@H](O)C[NH+]1CCC(C2OCCO2)CC1	ZINC000195174406	528621584	/nfs/dbraw/zinc/62/15/84/528621584.db2.gz	WBORHAGVBIEDGK-CQSZACIVSA-N	1	0	287.400	1.249	50	0		CDAARO
CCn1c(CN(C)C)nnc1C1CC[NH+](C)CC1	ZINC000077438207	537706512	/nfs/dbraw/zinc/70/65/12/537706512.db2.gz	NGDJTWJKMWKYRX-UHFFFAOYSA-N	1	0	251.378	1.169	50	0		CDAARO
Cc1cc(Cl)ccc1OCCOCC[N@H+](C)CCO	ZINC000002974996	538149370	/nfs/dbraw/zinc/14/93/70/538149370.db2.gz	WYSSOVVGVDDKRU-UHFFFAOYSA-N	1	0	287.787	1.968	50	0		CDAARO
Cc1ncc(C[N@@H+](C)CC2(O)CCOCC2)s1	ZINC000123176590	538380084	/nfs/dbraw/zinc/38/00/84/538380084.db2.gz	HNHUSODDKOCQIY-UHFFFAOYSA-N	1	0	256.371	1.425	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@@H]1c1ccc(NS(C)(=O)=O)cc1	ZINC000757207497	577035802	/nfs/dbraw/zinc/03/58/02/577035802.db2.gz	BJGHMSCCGWMMEG-GWCFXTLKSA-N	1	0	268.382	1.771	50	0		CDAARO
CC1(C)CC(CC(=O)N2CC[C@H](CO)C2)CC(C)(C)[NH2+]1	ZINC000952972712	614517230	/nfs/dbraw/zinc/51/72/30/614517230.db2.gz	UOOVVOWDFIUBLO-LBPRGKRZSA-N	1	0	282.428	1.774	50	0		CDAARO
CCS(=O)(=O)N(C)CCC[NH+]1CCCCCC1	ZINC000952969582	615335780	/nfs/dbraw/zinc/33/57/80/615335780.db2.gz	OHUJJAMWEYCNEF-UHFFFAOYSA-N	1	0	262.419	1.534	50	0		CDAARO
C[C@@H]1[C@H](C)[NH2+]CCN1C(=O)C[C@@H](O)c1ccccc1	ZINC000888096874	617760330	/nfs/dbraw/zinc/76/03/30/617760330.db2.gz	UXQMATVNQFZIBY-OUCADQQQSA-N	1	0	262.353	1.319	50	0		CDAARO
Cc1nccnc1N1CC[N@@H+](CC(C)C)[C@H](CCO)C1	ZINC001772703600	1159438122	/nfs/dbraw/zinc/43/81/22/1159438122.db2.gz	YKAYNNQEVKMNCX-CQSZACIVSA-N	1	0	278.400	1.314	50	0		CDAARO
Cc1ncc(Cl)c(N2CCC[C@](O)(C[NH+](C)C)C2)n1	ZINC001772709380	1159443146	/nfs/dbraw/zinc/44/31/46/1159443146.db2.gz	GTVKGWBKYOJBFV-ZDUSSCGKSA-N	1	0	284.791	1.331	50	0		CDAARO
CC(=O)c1cnc(NCC[N@@H+]2CCCC[C@@H]2CO)nc1C	ZINC001704335988	1177692643	/nfs/dbraw/zinc/69/26/43/1177692643.db2.gz	RXSDPZRJCWHACB-CYBMUJFWSA-N	1	0	292.383	1.246	50	0		CDAARO
C[N@H+](CCO)CCOCCOc1ccccc1F	ZINC000002981172	897096321	/nfs/dbraw/zinc/09/63/21/897096321.db2.gz	MPXVDRSNLRFHKT-UHFFFAOYSA-N	1	0	257.305	1.145	50	0		CDAARO
CS(=O)(=O)Nc1ccc(C2CC[NH2+]CC2)cc1	ZINC000258575394	900880642	/nfs/dbraw/zinc/88/06/42/900880642.db2.gz	IHUGMDMVSGFWEU-UHFFFAOYSA-N	1	0	254.355	1.525	50	0		CDAARO
Cc1c[nH]c(CN(C)C(=O)CC[C@H](C)[NH+]2CCCC2)n1	ZINC000426589872	902652812	/nfs/dbraw/zinc/65/28/12/902652812.db2.gz	ZUWUBXLFIWRRKJ-ZDUSSCGKSA-N	1	0	278.400	1.941	50	0		CDAARO
NS(=O)(=O)CCC[N@@H+]1CCC[C@H](c2ccncc2)CC1	ZINC000952879632	910438940	/nfs/dbraw/zinc/43/89/40/910438940.db2.gz	FYUXMSPZTOMRDL-ZDUSSCGKSA-N	1	0	297.424	1.330	50	0		CDAARO
Nc1nc2c(c(NCCCNc3cccnc3)n1)CC[NH2+]C2	ZINC000067490581	936618609	/nfs/dbraw/zinc/61/86/09/936618609.db2.gz	JKGHKFNEVHIDRH-UHFFFAOYSA-N	1	0	299.382	1.014	50	0		CDAARO
CC(C)c1nc(-c2cccc3c2O[C@H](C[NH3+])C3)n[nH]1	ZINC000067834110	936620435	/nfs/dbraw/zinc/62/04/35/936620435.db2.gz	QOHXSMLAPNQSNE-JTQLQIEISA-N	1	0	258.325	1.857	50	0		CDAARO
CC(C)(CN1CC[C@@]([NH3+])(C(=O)[O-])C1)C[NH+]1CCCCCC1	ZINC000067955752	936620801	/nfs/dbraw/zinc/62/08/01/936620801.db2.gz	RTFSQEVYUXQMPM-INIZCTEOSA-N	1	0	297.443	1.376	50	0		CDAARO
CC(C)[NH+]1CCN(c2ccc(Br)nn2)CC1	ZINC000702031055	922462272	/nfs/dbraw/zinc/46/22/72/922462272.db2.gz	XCPLMMJYEIIEMS-UHFFFAOYSA-N	1	0	285.189	1.770	50	0		CDAARO
C[C@@H](C[NH+]1CCCC1)c1nc(CC(N)=O)nn1C(C)(C)C	ZINC000822276831	925615001	/nfs/dbraw/zinc/61/50/01/925615001.db2.gz	SBWYTSMFCUMMMJ-NSHDSACASA-N	1	0	293.415	1.260	50	0		CDAARO
CN(Cc1cnc(N(C)C)nc1)C[C@H]1CC[N@H+](C)C1(C)C	ZINC000823690446	925721564	/nfs/dbraw/zinc/72/15/64/925721564.db2.gz	YBRDPBBZIVRXTC-CQSZACIVSA-N	1	0	291.443	1.705	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CN(C)c2ncc(F)c(OC)n2)C1	ZINC000824412500	925820250	/nfs/dbraw/zinc/82/02/50/925820250.db2.gz	YUKRYCVOPOYLFJ-LLVKDONJSA-N	1	0	298.362	1.029	50	0		CDAARO
COc1ncc(C[N@H+](C)CC2CCOCC2)cn1	ZINC000824851783	925839777	/nfs/dbraw/zinc/83/97/77/925839777.db2.gz	GURRAPWSYWPKAJ-UHFFFAOYSA-N	1	0	251.330	1.344	50	0		CDAARO
CC(C)(CN1CCOCC1)C[N@@H+]1CC[C@@H](O)CC(C)(C)C1	ZINC000828630088	926153067	/nfs/dbraw/zinc/15/30/67/926153067.db2.gz	YEDFEVZBEYMHIL-OAHLLOKOSA-N	1	0	298.471	1.828	50	0		CDAARO
C[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)N(CC(N)=O)[C@H]1C	ZINC000585116131	930966601	/nfs/dbraw/zinc/96/66/01/930966601.db2.gz	ICRCBPNGRCYHQT-WOPDTQHZSA-N	1	0	299.415	1.485	50	0		CDAARO
Cn1cccc1C(=O)N[C@H]1C[C@H]([NH+](C)C)C12CCC2	ZINC000585131561	931024586	/nfs/dbraw/zinc/02/45/86/931024586.db2.gz	ZJAMOXIKXNHAAF-STQMWFEESA-N	1	0	261.369	1.628	50	0		CDAARO
Cc1cccc(C[C@H](C)NC(=O)C[NH+]2CCCC2)n1	ZINC000240824947	937476256	/nfs/dbraw/zinc/47/62/56/937476256.db2.gz	QMNYMWSYEXJPSJ-ZDUSSCGKSA-N	1	0	261.369	1.533	50	0		CDAARO
O=c1ccncn1CC1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1	ZINC000585636800	932835110	/nfs/dbraw/zinc/83/51/10/932835110.db2.gz	NIDHMZWSMMDAKM-CABCVRRESA-N	1	0	291.395	1.259	50	0		CDAARO
COCC[C@]1(CO)CCC[N@H+](Cc2cc(OC)ccn2)C1	ZINC000091644326	934872184	/nfs/dbraw/zinc/87/21/84/934872184.db2.gz	RRDVEKKGZYCPNO-MRXNPFEDSA-N	1	0	294.395	1.701	50	0		CDAARO
Cc1cnc(N2CCC([N@@H+]3CCC[C@H](CO)C3)CC2)nc1	ZINC000095360455	934972045	/nfs/dbraw/zinc/97/20/45/934972045.db2.gz	ZOGFDULKLQOTJR-AWEZNQCLSA-N	1	0	290.411	1.458	50	0		CDAARO
Cc1ccc(C(=O)CCC[N@@H+]2CC[C@@H](O)[C@@H](CO)C2)cc1	ZINC001529120830	968986957	/nfs/dbraw/zinc/98/69/57/968986957.db2.gz	NJURQHXALGDYJP-NVXWUHKLSA-N	1	0	291.391	1.633	50	0		CDAARO
CC(C)[C@H]1CN(C(=O)C[NH3+])C[C@@H](c2ccccc2)O1	ZINC001529134142	968990098	/nfs/dbraw/zinc/99/00/98/968990098.db2.gz	YWTDCNCGCUFNEM-KGLIPLIRSA-N	1	0	262.353	1.570	50	0		CDAARO
O[C@@H]1C[N@H+](CC2CCCCC2)C[C@H]1Cc1cnccn1	ZINC001529151165	968995152	/nfs/dbraw/zinc/99/51/52/968995152.db2.gz	GWYQYCBFVUFNER-GDBMZVCRSA-N	1	0	275.396	1.892	50	0		CDAARO
CSCC[NH+]1CCN(c2nc(C)cnc2C)CC1	ZINC001506398299	975148133	/nfs/dbraw/zinc/14/81/33/975148133.db2.gz	AEULCTXFOKUROU-UHFFFAOYSA-N	1	0	266.414	1.578	50	0		CDAARO
O[C@H]1CN(c2cc[nH+]c3ccccc32)C[C@@H]1N1CCOCC1	ZINC001506406602	975151755	/nfs/dbraw/zinc/15/17/55/975151755.db2.gz	LYUODQQMGGJVAR-IRXDYDNUSA-N	1	0	299.374	1.117	50	0		CDAARO
COCC(C)(C)CNC(=O)C[NH+]1CCCCCC1	ZINC001506420184	975158229	/nfs/dbraw/zinc/15/82/29/975158229.db2.gz	XKFHQBNGXIUZPA-UHFFFAOYSA-N	1	0	256.390	1.651	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCCNC(=O)c2csnn2)C[C@H](C)O1	ZINC000096461212	230377877	/nfs/dbraw/zinc/37/78/77/230377877.db2.gz	GUTHTLHFECRGQZ-PHIMTYICSA-N	1	0	298.412	1.157	50	0		CDAARO
Nc1ncnc2nc(SCC[NH+]3CCCCC3)[nH]c21	ZINC000000280705	230365925	/nfs/dbraw/zinc/36/59/25/230365925.db2.gz	BDZSCAJEZBGNHK-UHFFFAOYSA-N	1	0	278.385	1.513	50	0		CDAARO
CN(C[C@@H]1CCCC[N@@H+]1C)C(=O)[C@H]1CC[C@@H](O)CC1	ZINC000584903015	341986626	/nfs/dbraw/zinc/98/66/26/341986626.db2.gz	JWWGODPYEVNWTM-MELADBBJSA-N	1	0	268.401	1.480	50	0		CDAARO
CN(C)S(=O)(=O)CCC[N@@H+]1CCC[C@H]1c1ccco1	ZINC000116287543	230394119	/nfs/dbraw/zinc/39/41/19/230394119.db2.gz	URENUZGVRGXZFI-LBPRGKRZSA-N	1	0	286.397	1.698	50	0		CDAARO
O=C(N[C@@H]1CC[NH2+]C1)c1csc(-c2ccsc2)n1	ZINC000126974123	342005526	/nfs/dbraw/zinc/00/55/26/342005526.db2.gz	GOKODVUNVVAZSG-SECBINFHSA-N	1	0	279.390	1.963	50	0		CDAARO
C[C@@H](Oc1ccccc1Cl)C(=O)N1CC[NH2+]C[C@H]1C	ZINC000124648214	187147285	/nfs/dbraw/zinc/14/72/85/187147285.db2.gz	YMKZAHPEWDCTOY-GHMZBOCLSA-N	1	0	282.771	1.928	50	0		CDAARO
O=C(Nc1nc(-c2ccsc2)ns1)[C@H]1CCC[NH2+]1	ZINC000095959415	185043211	/nfs/dbraw/zinc/04/32/11/185043211.db2.gz	PKYAYLHRCSHJPN-MRVPVSSYSA-N	1	0	280.378	1.957	50	0		CDAARO
CCCS(=O)(=O)N[C@H](C)C[N@@H+]1CCC[C@H](C)C1	ZINC000189151111	365578146	/nfs/dbraw/zinc/57/81/46/365578146.db2.gz	RARGNOWWILPFCH-NWDGAFQWSA-N	1	0	262.419	1.436	50	0		CDAARO
COC(=O)N1CCC[C@H]([NH2+][C@H](C)c2ccccn2)C1	ZINC000095980733	185052910	/nfs/dbraw/zinc/05/29/10/185052910.db2.gz	MIHWMBXPSKWOOP-NEPJUHHUSA-N	1	0	263.341	1.963	50	0		CDAARO
CN(CCc1cccc2ccccc21)C(=O)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000239722532	361746392	/nfs/dbraw/zinc/74/63/92/361746392.db2.gz	CDDYEFDSBDEFEM-NVXWUHKLSA-N	1	0	298.386	1.564	50	0		CDAARO
C[C@@H]1CCC[C@H]2CCC[N@H+](CCN3CCNC3=O)[C@@H]12	ZINC000242100105	361754925	/nfs/dbraw/zinc/75/49/25/361754925.db2.gz	WEIVKEJJXIIWAS-RDBSUJKOSA-N	1	0	265.401	1.912	50	0		CDAARO
C[C@H]1[C@H](Cc2ccccc2)CC[N@@H+]1CCC(=O)NC(N)=O	ZINC000242288034	361755723	/nfs/dbraw/zinc/75/57/23/361755723.db2.gz	YKNNNHLOOXBZQG-JSGCOSHPSA-N	1	0	289.379	1.525	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2cnoc2C)CC1	ZINC000096098340	185096903	/nfs/dbraw/zinc/09/69/03/185096903.db2.gz	RICYXJGMHAYEDS-UHFFFAOYSA-N	1	0	281.356	1.071	50	0		CDAARO
CNC(=O)CC1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1	ZINC000089907621	539087665	/nfs/dbraw/zinc/08/76/65/539087665.db2.gz	CFGNGTQDDKPSCG-OLZOCXBDSA-N	1	0	254.374	1.138	50	0		CDAARO
Cc1cc(C(=O)N2CC[NH2+]C[C@H]2C)nn1C(C)(C)C	ZINC000125216214	187174632	/nfs/dbraw/zinc/17/46/32/187174632.db2.gz	XHMMRBPYDPCFTK-LLVKDONJSA-N	1	0	264.373	1.380	50	0		CDAARO
CCCN(C(=O)Cc1csc(C)n1)C1CC[NH2+]CC1	ZINC000195543747	342626591	/nfs/dbraw/zinc/62/65/91/342626591.db2.gz	WGVFGRNEIQOQFV-UHFFFAOYSA-N	1	0	281.425	1.985	50	0		CDAARO
[NH3+][C@H](CC(=O)N1CCCC1)c1c(F)cccc1F	ZINC000096663735	185109718	/nfs/dbraw/zinc/10/97/18/185109718.db2.gz	ZZCYDNRGTCYQIR-LLVKDONJSA-N	1	0	254.280	1.977	50	0		CDAARO
CNC(=O)[C@H]1CCCC[N@@H+]1CCCc1cccnc1	ZINC000243893659	361829238	/nfs/dbraw/zinc/82/92/38/361829238.db2.gz	ATAZIMHVSZQALD-CQSZACIVSA-N	1	0	261.369	1.615	50	0		CDAARO
Cc1nc(C(=O)NCC2([NH+](C)C)CCOCC2)cs1	ZINC000244626535	361853749	/nfs/dbraw/zinc/85/37/49/361853749.db2.gz	FNNHKRHMXQCRFU-UHFFFAOYSA-N	1	0	283.397	1.292	50	0		CDAARO
COc1ccc(CC(=O)N2CC[NH2+]C[C@@H]2C)c(Cl)c1	ZINC000125426789	187183945	/nfs/dbraw/zinc/18/39/45/187183945.db2.gz	SXMBWOCKCAPCHZ-JTQLQIEISA-N	1	0	282.771	1.711	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@H](C)c1ccc(F)cc1F	ZINC000097032982	185156114	/nfs/dbraw/zinc/15/61/14/185156114.db2.gz	KXPRBJXQTPHGMA-SECBINFHSA-N	1	0	292.351	1.555	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@@H]1NC(=O)C[C@H](O)c1cccc(F)c1	ZINC000585136913	342216222	/nfs/dbraw/zinc/21/62/22/342216222.db2.gz	YLIFJFXVUZISMR-TWINXVHLSA-N	1	0	294.370	1.752	50	0		CDAARO
Cc1nnc([C@H]2OCC[C@H]2CNc2cc[nH+]c(C)c2)[nH]1	ZINC000685940070	539045849	/nfs/dbraw/zinc/04/58/49/539045849.db2.gz	JVAJYLHBJJGONN-AAEUAGOBSA-N	1	0	273.340	1.428	50	0		CDAARO
CC(C)c1noc(-c2ccn3c(c2)nnc3C[NH3+])n1	ZINC000409444229	539071814	/nfs/dbraw/zinc/07/18/14/539071814.db2.gz	RRGSOOVNWGJUEG-UHFFFAOYSA-N	1	0	258.285	1.361	50	0		CDAARO
O=C(Cc1cccs1)N1CC[NH+]([C@H]2CCC[C@@H]2O)CC1	ZINC000084442207	342262921	/nfs/dbraw/zinc/26/29/21/342262921.db2.gz	QMXDIABSLMXMQG-KBPBESRZSA-N	1	0	294.420	1.348	50	0		CDAARO
CC(C)(C)OC(=O)NC1CCC2(CC1)C[NH2+]CCO2	ZINC000685939328	539116238	/nfs/dbraw/zinc/11/62/38/539116238.db2.gz	MQEADEBXAKDRLT-UHFFFAOYSA-N	1	0	270.373	1.812	50	0		CDAARO
C[N@H+](CCc1ccccc1)CC(=O)NCc1nccs1	ZINC000585121316	362040133	/nfs/dbraw/zinc/04/01/33/362040133.db2.gz	LUSHAYLHGHISLD-UHFFFAOYSA-N	1	0	289.404	1.934	50	0		CDAARO
Cn1ncc2c1ncnc2NCc1ccc(NC(N)=O)cc1	ZINC000036397384	362063942	/nfs/dbraw/zinc/06/39/42/362063942.db2.gz	PKVXOKMBPRYGTJ-UHFFFAOYSA-N	1	0	297.322	1.466	50	0		CDAARO
C[N@H+](C[C@@H]1CCCO1)CC(C)(C)CN1CCOCC1	ZINC000200581611	342438014	/nfs/dbraw/zinc/43/80/14/342438014.db2.gz	SBBHGFAITOYOCC-AWEZNQCLSA-N	1	0	270.417	1.456	50	0		CDAARO
C[C@@H](C(=O)N1CC[C@H](C[NH3+])C1)c1ccccc1F	ZINC000178581274	362246992	/nfs/dbraw/zinc/24/69/92/362246992.db2.gz	HKPLZQSDMFZEHQ-GHMZBOCLSA-N	1	0	250.317	1.736	50	0		CDAARO
C[NH+](C)C1(CNC(=O)CCc2ccncc2)CCOCC1	ZINC000073132149	343576427	/nfs/dbraw/zinc/57/64/27/343576427.db2.gz	JYJQLMPPONMMKS-UHFFFAOYSA-N	1	0	291.395	1.241	50	0		CDAARO
C[C@@H]1CN(C(=O)CCc2cscn2)C[C@@H](C)[NH2+]1	ZINC000179152155	362252448	/nfs/dbraw/zinc/25/24/48/362252448.db2.gz	ZPOWYLHMXAWQJX-NXEZZACHSA-N	1	0	253.371	1.285	50	0		CDAARO
C[C@@H]1C[NH+](CCCCNC(=O)c2ccn[nH]2)C[C@@H](C)O1	ZINC000084706194	362273803	/nfs/dbraw/zinc/27/38/03/362273803.db2.gz	IVQKBGMYEMEXRC-VXGBXAGGSA-N	1	0	280.372	1.029	50	0		CDAARO
CN(Cc1cc(Cl)cn1C)C(=O)NCC[N@H+](C)C1CC1	ZINC000096462937	529978144	/nfs/dbraw/zinc/97/81/44/529978144.db2.gz	CZMDSQNXHXJZLO-UHFFFAOYSA-N	1	0	298.818	1.914	50	0		CDAARO
CCOC(=O)[C@H]1C[N@H+](C)C[C@@H]1C(=O)c1ccccc1	ZINC000052530352	362539381	/nfs/dbraw/zinc/53/93/81/362539381.db2.gz	WQKWIFSBDCEQNX-STQMWFEESA-N	1	0	261.321	1.610	50	0		CDAARO
O=C(CCc1cccc(F)c1)NC[C@H]1CCC[NH2+]C1	ZINC000129730558	345998639	/nfs/dbraw/zinc/99/86/39/345998639.db2.gz	XUMPQSLVJPYUTN-ZDUSSCGKSA-N	1	0	264.344	1.874	50	0		CDAARO
O=C(Cc1ccccc1)N1CC[NH+](C[C@@H](O)C2CC2)CC1	ZINC000085436654	179063134	/nfs/dbraw/zinc/06/31/34/179063134.db2.gz	DDJKGYYLWJAEQL-MRXNPFEDSA-N	1	0	288.391	1.144	50	0		CDAARO
COc1cc(CN2CC[NH+](C[C@H](C)O)CC2)cc(OC)c1	ZINC000085436923	179063633	/nfs/dbraw/zinc/06/36/33/179063633.db2.gz	DGDSTLFFWIZXNP-ZDUSSCGKSA-N	1	0	294.395	1.202	50	0		CDAARO
COc1ccc(CCN2C(=O)CC[C@@H]3C[NH2+]CC[C@@H]32)cc1	ZINC000128856798	187395490	/nfs/dbraw/zinc/39/54/90/187395490.db2.gz	LZNYZCNSRVEMOL-ZBFHGGJFSA-N	1	0	288.391	1.838	50	0		CDAARO
COc1ccccc1C[NH2+]C[C@H]1CCCS1(=O)=O	ZINC000089473749	179799574	/nfs/dbraw/zinc/79/95/74/179799574.db2.gz	MMZUGNXGENTVDC-GFCCVEGCSA-N	1	0	269.366	1.362	50	0		CDAARO
COCC1(CNC(=O)[C@@H]2CCC[NH2+]C2)CCCC1	ZINC000584886363	349344950	/nfs/dbraw/zinc/34/49/50/349344950.db2.gz	KYNGYSCTCFCAJQ-GFCCVEGCSA-N	1	0	254.374	1.309	50	0		CDAARO
OCc1ccc2c(c1)C[N@H+]([C@H]1CCCOC1)CCO2	ZINC000584886653	349344986	/nfs/dbraw/zinc/34/49/86/349344986.db2.gz	RXROTVFQFFHWQK-AWEZNQCLSA-N	1	0	263.337	1.552	50	0		CDAARO
CCc1ccc2ncn(C[C@H]3CC[N@H+](C)C3)c(=O)c2c1	ZINC000584889379	349348065	/nfs/dbraw/zinc/34/80/65/349348065.db2.gz	SBMKKXWXLHVLFU-ZDUSSCGKSA-N	1	0	271.364	1.911	50	0		CDAARO
CCC[C@H](Cn1cnc2cnccc2c1=O)[NH+](C)C	ZINC000584891615	349350905	/nfs/dbraw/zinc/35/09/05/349350905.db2.gz	PNGSSLNUOUYDRR-LLVKDONJSA-N	1	0	260.341	1.522	50	0		CDAARO
CC(C)CC[N@@H+]1CCN(Cc2ccccn2)C[C@H]1CCO	ZINC000104431999	186000348	/nfs/dbraw/zinc/00/03/48/186000348.db2.gz	RHZFGOSSOSMYKS-QGZVFWFLSA-N	1	0	291.439	1.996	50	0		CDAARO
O=c1ccc(C[C@H]2CC[N@@H+](C3CCOCC3)C2)c[nH]1	ZINC000091364887	180142420	/nfs/dbraw/zinc/14/24/20/180142420.db2.gz	YICBWYSSMWFUAQ-CYBMUJFWSA-N	1	0	262.353	1.418	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1N[C@H](C)c1nnc(C)[nH]1	ZINC000091526314	180178943	/nfs/dbraw/zinc/17/89/43/180178943.db2.gz	NRBHYGWGYCMJEN-SSDOTTSWSA-N	1	0	261.333	1.529	50	0		CDAARO
COc1cccc(C(=O)[C@H]2CCC[N@H+](CCC(N)=O)C2)c1	ZINC000091663708	180221196	/nfs/dbraw/zinc/22/11/96/180221196.db2.gz	OLMOYPZYRWHIAB-ZDUSSCGKSA-N	1	0	290.363	1.465	50	0		CDAARO
OC[C@H]1CN(Cc2ccccn2)C[C@H]1C[NH+]1CCCC1	ZINC000091694014	180228748	/nfs/dbraw/zinc/22/87/48/180228748.db2.gz	LKASZRDHYJUQPE-HUUCEWRRSA-N	1	0	275.396	1.218	50	0		CDAARO
Cc1n[nH]c(C)c1CCC(=O)N1C[C@H]([NH3+])[C@@H](C2CC2)C1	ZINC000091738423	180243651	/nfs/dbraw/zinc/24/36/51/180243651.db2.gz	VFDCQWRWAUHACB-KGLIPLIRSA-N	1	0	276.384	1.155	50	0		CDAARO
CN1CC[NH+](C2(CNc3ncccn3)CCCC2)CC1	ZINC000091746889	180245461	/nfs/dbraw/zinc/24/54/61/180245461.db2.gz	NNIXRGXNBCFDIH-UHFFFAOYSA-N	1	0	275.400	1.449	50	0		CDAARO
C[C@H](CNC(=O)COCC1CC1)[N@@H+]1CCC[C@@H](C)C1	ZINC000106078835	186101469	/nfs/dbraw/zinc/10/14/69/186101469.db2.gz	ZQTCIXAXUGJTRP-CHWSQXEVSA-N	1	0	268.401	1.650	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H]1CNC(=O)C[C@@H]1C=CCC1	ZINC000106652706	186129740	/nfs/dbraw/zinc/12/97/40/186129740.db2.gz	YAYDUKWCZJSCJF-ZIAGYGMSSA-N	1	0	266.385	1.570	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1ccc2c(c1)C[C@@H](C)O2	ZINC000124919594	351385766	/nfs/dbraw/zinc/38/57/66/351385766.db2.gz	OTGLZHXRWPQFTE-PWSUYJOCSA-N	1	0	298.408	1.416	50	0		CDAARO
COC(=O)[C@H]1CCCCC[C@H]1[NH2+]Cc1nnc(C)n1C	ZINC000097099589	351600430	/nfs/dbraw/zinc/60/04/30/351600430.db2.gz	LNZDVKWXQHOOQY-NWDGAFQWSA-N	1	0	280.372	1.335	50	0		CDAARO
COc1cc(F)c([C@H](C)[NH2+]C2COCCOC2)cc1OC	ZINC000644553640	366183422	/nfs/dbraw/zinc/18/34/22/366183422.db2.gz	XREGLPFWFZDMJF-JTQLQIEISA-N	1	0	299.342	1.909	50	0		CDAARO
CCOC1CC[NH+](CC[C@H]2CCS(=O)(=O)C2)CC1	ZINC000677678343	482746678	/nfs/dbraw/zinc/74/66/78/482746678.db2.gz	HNNRTOZCDGYZQJ-LBPRGKRZSA-N	1	0	275.414	1.312	50	0		CDAARO
COc1ccc(OC)c(C[NH2+]C[C@@H]2CCCO2)c1	ZINC000000784593	355921351	/nfs/dbraw/zinc/92/13/51/355921351.db2.gz	VBIAHDCHALWQCZ-ZDUSSCGKSA-N	1	0	251.326	1.972	50	0		CDAARO
C[C@H](O)C[NH+](Cc1cccc(Cl)c1)C[C@H](C)O	ZINC000000042120	355881284	/nfs/dbraw/zinc/88/12/84/355881284.db2.gz	FRGASYAUZXLUDE-QWRGUYRKSA-N	1	0	257.761	1.904	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1cccc(OC)c1	ZINC000002180643	355962163	/nfs/dbraw/zinc/96/21/63/355962163.db2.gz	FODGBESNNVNCJX-UHFFFAOYSA-N	1	0	250.342	1.767	50	0		CDAARO
CCOc1ccc(C(=O)NCC[NH+]2CCCC2)cc1	ZINC000004454500	356030425	/nfs/dbraw/zinc/03/04/25/356030425.db2.gz	GMNIEFDZHGGZTP-UHFFFAOYSA-N	1	0	262.353	1.911	50	0		CDAARO
Cc1c(Cl)cccc1OCC(=O)N1CC[C@H]([NH3+])C1	ZINC000299739459	356270025	/nfs/dbraw/zinc/27/00/25/356270025.db2.gz	ORZUSHRJCDGRSV-JTQLQIEISA-N	1	0	268.744	1.587	50	0		CDAARO
Cc1ccc(-c2ccc(N3CC[NH2+]CC3)nn2)cc1	ZINC000011567977	356275607	/nfs/dbraw/zinc/27/56/07/356275607.db2.gz	QORSPTWXNHEJGA-UHFFFAOYSA-N	1	0	254.337	1.862	50	0		CDAARO
C[C@@H]1C[C@H](C)C[N@@H+](CC(=O)NCc2ccco2)C1	ZINC000014194571	356378906	/nfs/dbraw/zinc/37/89/06/356378906.db2.gz	FNBHEMCKPFVINB-TXEJJXNPSA-N	1	0	250.342	1.874	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC2CC[NH+](C)CC2)cc1	ZINC000014252161	356382309	/nfs/dbraw/zinc/38/23/09/356382309.db2.gz	SGQASUMXPUSQJA-UHFFFAOYSA-N	1	0	268.382	1.368	50	0		CDAARO
C[C@H]1C[C@@H](N(C)Cc2ccc3c(c2)OCO3)C(=O)O1	ZINC000032860211	356398026	/nfs/dbraw/zinc/39/80/26/356398026.db2.gz	PPMUJXFSSJKPAP-GXSJLCMTSA-N	1	0	263.293	1.551	50	0		CDAARO
COc1ccc(OC)c(CNCCC[NH+](C)C)c1	ZINC000019737217	356498878	/nfs/dbraw/zinc/49/88/78/356498878.db2.gz	ONGQSFWKBSVVEB-UHFFFAOYSA-N	1	0	252.358	1.745	50	0		CDAARO
CC(C)c1cccc(OCCOCCNCC[NH3+])c1	ZINC000019772358	356501070	/nfs/dbraw/zinc/50/10/70/356501070.db2.gz	KBRZULQMFIPCLI-UHFFFAOYSA-N	1	0	266.385	1.754	50	0		CDAARO
C[C@@H]1C[C@@H](OC[C@H](O)C[NH+]2CCN(C)CC2)CC(C)(C)C1	ZINC000022588903	356617267	/nfs/dbraw/zinc/61/72/67/356617267.db2.gz	YVAWMZJIRZQCSS-BZUAXINKSA-N	1	0	298.471	1.826	50	0		CDAARO
CN(C)C(=O)CN1CCN(Cc2cccc(F)c2)CC1	ZINC000022877450	356623064	/nfs/dbraw/zinc/62/30/64/356623064.db2.gz	WVLQIERIFXYHIZ-UHFFFAOYSA-N	1	0	279.359	1.032	50	0		CDAARO
O=C(c1cc(C2CC2)n[nH]1)N1CC[NH+](C2CCCC2)CC1	ZINC000032788003	356672015	/nfs/dbraw/zinc/67/20/15/356672015.db2.gz	HUBOFTJJOFLSOG-UHFFFAOYSA-N	1	0	288.395	1.988	50	0		CDAARO
CN(Cc1nc2ccccc2[nH]1)c1ncnc2c1cnn2C	ZINC000025494017	356676286	/nfs/dbraw/zinc/67/62/86/356676286.db2.gz	GHGVBLYQXWDNTR-UHFFFAOYSA-N	1	0	293.334	1.876	50	0		CDAARO
COc1cccc(/C(C)=C\C(=O)N2CC[C@H](C[NH3+])C2)c1	ZINC000255496323	356702394	/nfs/dbraw/zinc/70/23/94/356702394.db2.gz	HQMCXAKDXGOQTC-LLBKUYECSA-N	1	0	274.364	1.906	50	0		CDAARO
COc1cccc([C@@H](O)C[NH2+]Cc2cccnc2)c1	ZINC000032110629	356775281	/nfs/dbraw/zinc/77/52/81/356775281.db2.gz	ZBONKMQPIAVUFD-HNNXBMFYSA-N	1	0	258.321	1.913	50	0		CDAARO
C[C@H]([NH2+]C[C@@H]1CCN(S(C)(=O)=O)C1)c1ccsc1	ZINC000090797586	356831575	/nfs/dbraw/zinc/83/15/75/356831575.db2.gz	DXKNFBOZLPELMJ-QWRGUYRKSA-N	1	0	288.438	1.680	50	0		CDAARO
CC(C)S(=O)(=O)c1ccc(N2CC[NH2+]CC2)cc1	ZINC000039320841	356972657	/nfs/dbraw/zinc/97/26/57/356972657.db2.gz	ZLUCBCOJCIZPEX-UHFFFAOYSA-N	1	0	268.382	1.278	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)NC2(C[NH3+])CCCC2)c1	ZINC000095394520	357111970	/nfs/dbraw/zinc/11/19/70/357111970.db2.gz	ZXQMOXHCRKUDQT-UHFFFAOYSA-N	1	0	286.372	1.684	50	0		CDAARO
CC[C@@H]1CN(CCOCC(F)(F)F)CC[N@@H+]1C[C@H](C)O	ZINC000106906892	357283070	/nfs/dbraw/zinc/28/30/70/357283070.db2.gz	RFJVCGJXFWMMMM-NWDGAFQWSA-N	1	0	298.349	1.342	50	0		CDAARO
CCC1(CC)[C@H](OC)C[C@H]1[N@H+](C)CCC(=O)NC	ZINC000095424702	357349352	/nfs/dbraw/zinc/34/93/52/357349352.db2.gz	BDCJDKAZBMTGPU-VXGBXAGGSA-N	1	0	256.390	1.648	50	0		CDAARO
[NH3+]C[C@@H](NS(=O)(=O)c1cc(F)c(F)cc1F)C1CC1	ZINC000095432130	357515176	/nfs/dbraw/zinc/51/51/76/357515176.db2.gz	OJPMPNLEUYBORW-SNVBAGLBSA-N	1	0	294.298	1.120	50	0		CDAARO
CCSCC[NH2+]CC(=O)Nc1ccccc1NC(C)=O	ZINC000065394359	357535360	/nfs/dbraw/zinc/53/53/60/357535360.db2.gz	WADIMYLGFOQQJY-UHFFFAOYSA-N	1	0	295.408	1.926	50	0		CDAARO
Cc1ccc(Cl)cc1-n1c(CC[NH3+])n[nH]c1=O	ZINC000065398001	357536330	/nfs/dbraw/zinc/53/63/30/357536330.db2.gz	RZAZQNUERPJXCM-UHFFFAOYSA-N	1	0	252.705	1.024	50	0		CDAARO
Cn1cc(CN(Cc2ccc(CO)o2)C2CC2)cn1	ZINC000065423959	357540571	/nfs/dbraw/zinc/54/05/71/357540571.db2.gz	OKCNZRHCSPGQIY-UHFFFAOYSA-N	1	0	261.325	1.670	50	0		CDAARO
CCOCC[N@@H+]1CCC=C([C@H](C)N(C)C(C)=O)C1	ZINC000065460099	357542164	/nfs/dbraw/zinc/54/21/64/357542164.db2.gz	HZEWZJSMXZJECA-LBPRGKRZSA-N	1	0	254.374	1.522	50	0		CDAARO
O=C(C[NH2+]Cc1cccnc1)NCCc1ccc(F)cc1	ZINC000065525507	357546613	/nfs/dbraw/zinc/54/66/13/357546613.db2.gz	BRSYERFLTIHUOI-UHFFFAOYSA-N	1	0	287.338	1.669	50	0		CDAARO
Cc1cc(F)ccc1NC(=O)C[NH2+][C@H](C)Cn1ccnc1	ZINC000067818672	357628442	/nfs/dbraw/zinc/62/84/42/357628442.db2.gz	PTNXDMAQRXCVMG-GFCCVEGCSA-N	1	0	290.342	1.947	50	0		CDAARO
CC[N@@H+]1CCO[C@H](CCNC(=O)c2sccc2C)C1	ZINC000067432646	357607882	/nfs/dbraw/zinc/60/78/82/357607882.db2.gz	XPENADUKKMQLEB-GFCCVEGCSA-N	1	0	282.409	1.897	50	0		CDAARO
Cc1nccn1C[C@H](C)[NH2+]CCn1c(C)cc(C)nc1=O	ZINC000067819230	357630506	/nfs/dbraw/zinc/63/05/06/357630506.db2.gz	FONPFQPZMHPHGC-LBPRGKRZSA-N	1	0	289.383	1.043	50	0		CDAARO
CC(C)C[N@@H+]1CCC[C@H](CNC(=O)c2ncccc2O)C1	ZINC000067934109	357638443	/nfs/dbraw/zinc/63/84/43/357638443.db2.gz	BLYGGDYJHTUKJS-CYBMUJFWSA-N	1	0	291.395	1.885	50	0		CDAARO
COc1ccc(F)cc1C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188475869	357694276	/nfs/dbraw/zinc/69/42/76/357694276.db2.gz	LILGELNVMFEYFO-SECBINFHSA-N	1	0	252.289	1.268	50	0		CDAARO
Cn1ncc2c1CCC[C@H]2NC(=O)C[C@@H]1CSCC[NH2+]1	ZINC000091135232	357709500	/nfs/dbraw/zinc/70/95/00/357709500.db2.gz	ZCEBYVVGTFDTTN-ZYHUDNBSSA-N	1	0	294.424	1.009	50	0		CDAARO
c1cn(C[C@H]2CCCO2)c(-c2cc3n(n2)CCC[NH2+]C3)n1	ZINC000072423069	357833744	/nfs/dbraw/zinc/83/37/44/357833744.db2.gz	YVKVHCWNAYHFJP-CYBMUJFWSA-N	1	0	287.367	1.419	50	0		CDAARO
CC(C)Cc1cc(C(=O)N(C)CC[NH+](C)C)n(C)n1	ZINC000072430337	357835164	/nfs/dbraw/zinc/83/51/64/357835164.db2.gz	TYYPGKDCMKRAGX-UHFFFAOYSA-N	1	0	266.389	1.252	50	0		CDAARO
c1cn(C[C@H]2CCCO2)c(-c2cc3n(n2)CC[NH2+]C3)n1	ZINC000072459122	357837112	/nfs/dbraw/zinc/83/71/12/357837112.db2.gz	TVXFISJMCXUQFX-GFCCVEGCSA-N	1	0	273.340	1.029	50	0		CDAARO
COC(=O)[C@]12CCC[C@H]1C[N@H+](CC(=O)N1CCCCC1)C2	ZINC000097082978	357945481	/nfs/dbraw/zinc/94/54/81/357945481.db2.gz	HYCDTQQMPGYENK-BBRMVZONSA-N	1	0	294.395	1.274	50	0		CDAARO
Cc1cccnc1N1CCN(C[C@@H]2CC[NH2+]C2)CC1	ZINC000077424970	358018722	/nfs/dbraw/zinc/01/87/22/358018722.db2.gz	IOVFIGUIYYLEES-CQSZACIVSA-N	1	0	260.385	1.122	50	0		CDAARO
Cc1ccccc1[C@@H](C)[NH2+]CCNC(=O)c1ccn[nH]1	ZINC000097236303	358048927	/nfs/dbraw/zinc/04/89/27/358048927.db2.gz	KPEMUFPJPCWGID-GFCCVEGCSA-N	1	0	272.352	1.799	50	0		CDAARO
Cc1c[nH+]ccc1N1CCCN(C(=O)[C@H]2CCOC2)CC1	ZINC000082107315	358147198	/nfs/dbraw/zinc/14/71/98/358147198.db2.gz	DNXHWEBWEYUAIA-AWEZNQCLSA-N	1	0	289.379	1.465	50	0		CDAARO
Cn1ccnc1[C@H]1CCCN(C(=O)Cc2ccccn2)C1	ZINC000082146685	358149608	/nfs/dbraw/zinc/14/96/08/358149608.db2.gz	ZFUVAYCVAFYGIY-ZDUSSCGKSA-N	1	0	284.363	1.764	50	0		CDAARO
NC(=O)[C@H]([NH2+][C@H]1CCCSC1)c1ccccc1	ZINC000097084459	358183982	/nfs/dbraw/zinc/18/39/82/358183982.db2.gz	LVMRZUFBZDGSGW-NWDGAFQWSA-N	1	0	250.367	1.698	50	0		CDAARO
Cc1nc(CCNC(=O)N2CCC[N@@H+](C)CC2)cs1	ZINC000089709097	358429864	/nfs/dbraw/zinc/42/98/64/358429864.db2.gz	UCHPWUINKGIFLD-UHFFFAOYSA-N	1	0	282.413	1.341	50	0		CDAARO
CO[C@@H]1CCN(C(=O)Cc2cc(F)ccc2F)[C@H](C[NH3+])C1	ZINC000195557543	358560970	/nfs/dbraw/zinc/56/09/70/358560970.db2.gz	GDFHQBJBSVXZII-QWHCGFSZSA-N	1	0	298.333	1.472	50	0		CDAARO
CCCS(=O)(=O)N[C@H](C)C[N@@H+]1CCC[C@@H](C)C1	ZINC000195574185	358567233	/nfs/dbraw/zinc/56/72/33/358567233.db2.gz	RARGNOWWILPFCH-VXGBXAGGSA-N	1	0	262.419	1.436	50	0		CDAARO
CN1CC[C@@]2(CN(Cc3ccoc3)CC[N@@H+]2C)CCC1=O	ZINC000095382705	358690589	/nfs/dbraw/zinc/69/05/89/358690589.db2.gz	YTDJSUSPBDHEQN-MRXNPFEDSA-N	1	0	291.395	1.408	50	0		CDAARO
CNC(=O)CCCNc1cc(C(C)C)[nH+]c(N)n1	ZINC000095391983	358692938	/nfs/dbraw/zinc/69/29/38/358692938.db2.gz	GTVAWGWFIKTCPF-UHFFFAOYSA-N	1	0	251.334	1.120	50	0		CDAARO
CC[NH+](CC)[C@@H]1CCN(C(=O)c2cnc(C)nc2)C1	ZINC000097370472	358771277	/nfs/dbraw/zinc/77/12/77/358771277.db2.gz	LLHQGLGBSNHHNM-CYBMUJFWSA-N	1	0	262.357	1.341	50	0		CDAARO
C[C@@]1(C(=O)NCCSc2ccccn2)CCC[NH2+]C1	ZINC000096153301	358710186	/nfs/dbraw/zinc/71/01/86/358710186.db2.gz	ZVQOPXITENPVOG-CQSZACIVSA-N	1	0	279.409	1.680	50	0		CDAARO
O=C(C[C@@H]1NC(=O)c2ccccc21)N1CCc2[nH]cnc2C1	ZINC000096165254	358711781	/nfs/dbraw/zinc/71/17/81/358711781.db2.gz	WJHYPFDYWDXXIB-ZDUSSCGKSA-N	1	0	296.330	1.169	50	0		CDAARO
CCc1nc(C)c(C(=O)NCC[NH+]2CCCC2)o1	ZINC000097480413	358780267	/nfs/dbraw/zinc/78/02/67/358780267.db2.gz	IDASICJTKRULHO-UHFFFAOYSA-N	1	0	251.330	1.371	50	0		CDAARO
O=C1N[C@H]2CCC[C@@H]1C[N@H+](Cc1ccsc1)C2	ZINC000097729681	358794657	/nfs/dbraw/zinc/79/46/57/358794657.db2.gz	RCDRTYFZXHRZSL-NEPJUHHUSA-N	1	0	250.367	1.849	50	0		CDAARO
OC[C@@]1(O)CCC[N@H+](Cc2cccc3cc[nH]c32)CC1	ZINC000214966142	358866352	/nfs/dbraw/zinc/86/63/52/358866352.db2.gz	NZWCSFZMUGVOND-MRXNPFEDSA-N	1	0	274.364	1.877	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccccc2C(F)(F)F)C[C@@H]1CO	ZINC000215065468	358872676	/nfs/dbraw/zinc/87/26/76/358872676.db2.gz	ILQKVDRJXPZOOJ-GFCCVEGCSA-N	1	0	288.313	1.814	50	0		CDAARO
CN1Cc2cccn2C[C@@H]1CNC(=O)c1ccccc1F	ZINC000257176309	359069658	/nfs/dbraw/zinc/06/96/58/359069658.db2.gz	CGJTYWMXFACXRF-ZDUSSCGKSA-N	1	0	287.338	1.871	50	0		CDAARO
COC[C@@H]1C[N@@H+](C2CCCC2)C[C@H]1c1nc(C)no1	ZINC000257190788	359536111	/nfs/dbraw/zinc/53/61/11/359536111.db2.gz	PADYOVTYGDPMET-WCQYABFASA-N	1	0	265.357	1.982	50	0		CDAARO
C[N@@H+]1CCC[C@H](OC(=O)c2ccc3c(c2)OCCO3)C1	ZINC000000375759	359635630	/nfs/dbraw/zinc/63/56/30/359635630.db2.gz	UTULJXQFQBJKBN-LBPRGKRZSA-N	1	0	277.320	1.709	50	0		CDAARO
CN(C)c1ncc(C[N@H+](C)C[C@@H]2CCCCO2)cn1	ZINC000118944371	359825363	/nfs/dbraw/zinc/82/53/63/359825363.db2.gz	MGSCHJYBJNYDSH-ZDUSSCGKSA-N	1	0	264.373	1.544	50	0		CDAARO
Cc1ccc(C[NH2+]C[C@H]2CCCS2(=O)=O)s1	ZINC000087970524	363685615	/nfs/dbraw/zinc/68/56/15/363685615.db2.gz	YIGKTRYFVTYXKU-LLVKDONJSA-N	1	0	259.396	1.723	50	0		CDAARO
Cn1cc([C@H]2CCCC[N@@H+]2CCC2OCCO2)cn1	ZINC000408516276	359899546	/nfs/dbraw/zinc/89/95/46/359899546.db2.gz	HDJRLDQXULROGS-CYBMUJFWSA-N	1	0	265.357	1.710	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1Cc1cccc(C(=O)N(C)C)c1	ZINC000089939290	360198005	/nfs/dbraw/zinc/19/80/05/360198005.db2.gz	CIGHVXSKRNMBPQ-CYBMUJFWSA-N	1	0	275.396	1.524	50	0		CDAARO
Cc1cc(C[NH2+]C2CC2)cc(S(N)(=O)=O)c1C	ZINC000088983892	360162890	/nfs/dbraw/zinc/16/28/90/360162890.db2.gz	LKDOBARDFIFTES-UHFFFAOYSA-N	1	0	254.355	1.203	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@H]1CCN(C(=O)c2ccn(C)n2)C1	ZINC000409421145	360230388	/nfs/dbraw/zinc/23/03/88/360230388.db2.gz	OQNOAQLGMMLDMO-LBPRGKRZSA-N	1	0	273.340	1.321	50	0		CDAARO
Cc1c(C(=O)N2CC[C@H](C[NH3+])C2)cnn1C(C)(C)C	ZINC000178516987	189123467	/nfs/dbraw/zinc/12/34/67/189123467.db2.gz	DCQUXJPWHDUDMD-LLVKDONJSA-N	1	0	264.373	1.367	50	0		CDAARO
Cc1cc(-c2ccc(CN3CC[NH+](C)CC3)cn2)n[nH]1	ZINC000426409583	360665965	/nfs/dbraw/zinc/66/59/65/360665965.db2.gz	ZATMRISNLZFTFH-UHFFFAOYSA-N	1	0	271.368	1.528	50	0		CDAARO
Cc1nc(CSc2nnc([C@H]3CCC[NH2+]C3)n2C)co1	ZINC000426668233	360694757	/nfs/dbraw/zinc/69/47/57/360694757.db2.gz	FDNZKMHESAUCOI-JTQLQIEISA-N	1	0	293.396	1.871	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)CCOc2ccccc2Cl)C1	ZINC000178538354	189125674	/nfs/dbraw/zinc/12/56/74/189125674.db2.gz	IITTUKXVNOAOEP-NSHDSACASA-N	1	0	282.771	1.916	50	0		CDAARO
COc1ccccc1/C(C)=C/C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178571546	189127594	/nfs/dbraw/zinc/12/75/94/189127594.db2.gz	PNFYAMCHDYOILI-CNELAYHGSA-N	1	0	274.364	1.906	50	0		CDAARO
C[C@@H](Cc1ccccc1F)C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178582118	189128733	/nfs/dbraw/zinc/12/87/33/189128733.db2.gz	DTCIBEQBEKYTLQ-NWDGAFQWSA-N	1	0	264.344	1.812	50	0		CDAARO
Cc1c(F)cccc1S(=O)(=O)NCC[C@H](C)[NH3+]	ZINC000178909758	189153921	/nfs/dbraw/zinc/15/39/21/189153921.db2.gz	AWGKXEYXQSZONK-QMMMGPOBSA-N	1	0	260.334	1.150	50	0		CDAARO
C[C@H]([NH3+])CCNS(=O)(=O)c1cccc2cccnc21	ZINC000178909619	189153999	/nfs/dbraw/zinc/15/39/99/189153999.db2.gz	FMCZLSHIYAOHPZ-JTQLQIEISA-N	1	0	279.365	1.250	50	0		CDAARO
O=C(C[C@@H]1CC[NH2+]C1)NCCCc1nc2ccccc2[nH]1	ZINC000130346680	360944423	/nfs/dbraw/zinc/94/44/23/360944423.db2.gz	BLAHCLXIOALUFZ-LBPRGKRZSA-N	1	0	286.379	1.611	50	0		CDAARO
O=C(c1cccnc1)N1CCC(C[NH+]2CCOCC2)CC1	ZINC000036103473	360922806	/nfs/dbraw/zinc/92/28/06/360922806.db2.gz	LQBCLQFISWOIMF-UHFFFAOYSA-N	1	0	289.379	1.266	50	0		CDAARO
CC[NH+]1CCN(CC(=O)NC(C)(C)C(C)(C)C)CC1	ZINC000350786464	361168509	/nfs/dbraw/zinc/16/85/09/361168509.db2.gz	MCGCNDAGLPBQJL-UHFFFAOYSA-N	1	0	269.433	1.565	50	0		CDAARO
CC[C@H]1CN(C(=O)[C@@H]([NH3+])C(C)C)CCN1CC(F)F	ZINC000182909325	189339498	/nfs/dbraw/zinc/33/94/98/189339498.db2.gz	ULFHNPKEQAPIGZ-JQWIXIFHSA-N	1	0	277.359	1.158	50	0		CDAARO
Cc1cc(C)nc(NC(=[NH2+])NCCCn2ccnc2)n1	ZINC000003765658	370773231	/nfs/dbraw/zinc/77/32/31/370773231.db2.gz	CHHZVWUPROCBKC-UHFFFAOYSA-N	1	0	273.344	1.317	50	0		CDAARO
CCNC(=O)C[NH2+]Cc1cc2cccc(OC)c2o1	ZINC000035010476	364625556	/nfs/dbraw/zinc/62/55/56/364625556.db2.gz	KAPVMTVPXXRRGW-UHFFFAOYSA-N	1	0	262.309	1.667	50	0		CDAARO
NC(=O)c1ccc(C[N@@H+]2CCC[C@@H](c3ccncn3)C2)cc1	ZINC000089787660	366933545	/nfs/dbraw/zinc/93/35/45/366933545.db2.gz	MMKMKQZLEIBMPN-OAHLLOKOSA-N	1	0	296.374	1.955	50	0		CDAARO
CC[C@@H]1CN(C(=O)C2CC2)CC[C@@H]1[NH2+]Cc1ncc[nH]1	ZINC000089948775	366976202	/nfs/dbraw/zinc/97/62/02/366976202.db2.gz	JIXUYFVYDWFVOF-YPMHNXCESA-N	1	0	276.384	1.536	50	0		CDAARO
CCCCOCC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@H]21	ZINC000089954805	366981880	/nfs/dbraw/zinc/98/18/80/366981880.db2.gz	RTYOFXOCISMPOK-ZIAGYGMSSA-N	1	0	268.401	1.746	50	0		CDAARO
CCCCOCC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@@H]21	ZINC000089954803	366982228	/nfs/dbraw/zinc/98/22/28/366982228.db2.gz	RTYOFXOCISMPOK-KGLIPLIRSA-N	1	0	268.401	1.746	50	0		CDAARO
CCCC[NH2+][C@H]1CS(=O)(=O)C[C@H]1N1CCCCC1	ZINC000089954771	366982411	/nfs/dbraw/zinc/98/24/11/366982411.db2.gz	BQAZSENWMDYWCG-QWHCGFSZSA-N	1	0	274.430	1.028	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CC[NH2+]C[C@@H]2C)cc1C	ZINC000094345757	367521941	/nfs/dbraw/zinc/52/19/41/367521941.db2.gz	LPKFTHHJNNUUHS-GXTWGEPZSA-N	1	0	282.409	1.580	50	0		CDAARO
CCc1ccc(CN2CC[N@H+](C[C@@H](C)O)C[C@H]2C)o1	ZINC000252537672	367801735	/nfs/dbraw/zinc/80/17/35/367801735.db2.gz	MAIUAAOVLDGJSY-CHWSQXEVSA-N	1	0	266.385	1.729	50	0		CDAARO
CC[N@@H+]1CC[C@H](NS(=O)(=O)Cc2cccc(C)c2)C1	ZINC000359939269	368036274	/nfs/dbraw/zinc/03/62/74/368036274.db2.gz	NRSHWVZUGFFTKA-AWEZNQCLSA-N	1	0	282.409	1.509	50	0		CDAARO
CCCS(=O)(=O)N1CC[C@@H](Cn2c(C)c[nH+]c2C)C1	ZINC000575557776	369134700	/nfs/dbraw/zinc/13/47/00/369134700.db2.gz	JISHUDZSYMIAET-CYBMUJFWSA-N	1	0	285.413	1.562	50	0		CDAARO
CCOCC(=O)N1CCC[C@H](Oc2ccncc2)C1	ZINC000575608132	370624607	/nfs/dbraw/zinc/62/46/07/370624607.db2.gz	WPKGGMLDICWCLW-ZDUSSCGKSA-N	1	0	264.325	1.488	50	0		CDAARO
Cc1nnc([C@@H](C)NC[C@]2(O)CCC[N@@H+]3CCCC[C@@H]32)[nH]1	ZINC000063884842	371048871	/nfs/dbraw/zinc/04/88/71/371048871.db2.gz	JAFYYKKDPZOQEN-UXIGCNINSA-N	1	0	293.415	1.143	50	0		CDAARO
CCCOc1cncc(NC(=O)[C@@H]([NH3+])C2CCOCC2)c1	ZINC000638583978	371306760	/nfs/dbraw/zinc/30/67/60/371306760.db2.gz	PNXWTGQVFVMAIA-AWEZNQCLSA-N	1	0	293.367	1.563	50	0		CDAARO
C[C@H](CC(=O)N1CC[NH+]([C@H]2CCC[C@H]2O)CC1)C1CC1	ZINC000252673354	371684135	/nfs/dbraw/zinc/68/41/35/371684135.db2.gz	RBQKEXFETBDUKI-VHDGCEQUSA-N	1	0	280.412	1.480	50	0		CDAARO
[NH3+]C[C@@H](NC(=O)c1ccc2c(c1)OCCCO2)C1CC1	ZINC000178170445	372167049	/nfs/dbraw/zinc/16/70/49/372167049.db2.gz	IRQINUWJOPZAKK-GFCCVEGCSA-N	1	0	276.336	1.315	50	0		CDAARO
Cc1cccc(C[N@@H+]2CC[C@H]3OCc4cnnn4[C@H]3C2)n1	ZINC000299791237	372764943	/nfs/dbraw/zinc/76/49/43/372764943.db2.gz	DMLFFAKWJBTYFA-LSDHHAIUSA-N	1	0	285.351	1.327	50	0		CDAARO
COC(=O)c1ccc(-c2cccc3c2O[C@@H](C[NH3+])C3)nc1	ZINC000299801948	372773535	/nfs/dbraw/zinc/77/35/35/372773535.db2.gz	ZEUBQAZTYVKHJM-GFCCVEGCSA-N	1	0	284.315	1.797	50	0		CDAARO
Cc1noc(C)c1CN(C)C(=O)[C@H]1CCCC[NH2+]1	ZINC000037819125	373418076	/nfs/dbraw/zinc/41/80/76/373418076.db2.gz	RTFCUTQDAWWTEG-GFCCVEGCSA-N	1	0	251.330	1.392	50	0		CDAARO
C[C@H](C(=O)NCc1ccc(=O)[nH]c1)[NH+]1[C@H](C)CC[C@H]1C	ZINC000253370874	373680140	/nfs/dbraw/zinc/68/01/40/373680140.db2.gz	XLBGFCDFMSQSGK-IJLUTSLNSA-N	1	0	277.368	1.665	50	0		CDAARO
Cc1nc([C@@H]2CN(c3cc[nH+]c(C)c3)CCO2)no1	ZINC000253419379	373727828	/nfs/dbraw/zinc/72/78/28/373727828.db2.gz	RCWSMYHBXHWRLC-LBPRGKRZSA-N	1	0	260.297	1.659	50	0		CDAARO
Cc1nc(Cc2noc([C@H]3CC[N@H+](C)[C@@H](C)C3)n2)no1	ZINC000253427914	373734049	/nfs/dbraw/zinc/73/40/49/373734049.db2.gz	BHJKHBPCFMGIRW-WPRPVWTQSA-N	1	0	277.328	1.550	50	0		CDAARO
O=S(=O)(NCCC[NH+]1CCCCC1)c1ccccc1	ZINC000010279120	373778214	/nfs/dbraw/zinc/77/82/14/373778214.db2.gz	YJJWPIZCCBELLX-UHFFFAOYSA-N	1	0	282.409	1.841	50	0		CDAARO
Cc1cc(N2CC[C@@H](N(C)Cc3cccnc3)C2=O)n(C)n1	ZINC000104335963	374284236	/nfs/dbraw/zinc/28/42/36/374284236.db2.gz	HLBJMELPSGXYKK-CQSZACIVSA-N	1	0	299.378	1.361	50	0		CDAARO
CN(Cc1cccnc1)[C@H]1CCN(c2cnn(C)c2)C1=O	ZINC000104335979	374284479	/nfs/dbraw/zinc/28/44/79/374284479.db2.gz	KCFHCCSXQRBEFS-AWEZNQCLSA-N	1	0	285.351	1.052	50	0		CDAARO
COc1ccc(NC(=O)Cn2ccc(=[NH2+])cc2)cc1	ZINC000334157171	206120746	/nfs/dbraw/zinc/12/07/46/206120746.db2.gz	SYGKADVEZYWROT-UHFFFAOYSA-N	1	0	257.293	1.615	50	0		CDAARO
CCNC(=O)CN1C[C@@H]2C[N@H+](C)[C@@H](c3ccccc3)[C@@H]2C1	ZINC000108323220	412825035	/nfs/dbraw/zinc/82/50/35/412825035.db2.gz	BXXHIUKYTMFACF-UXLLHSPISA-N	1	0	287.407	1.357	50	0		CDAARO
CC(C)(C[NH3+])NS(=O)(=O)c1cc(F)c(F)c(F)c1	ZINC000123738961	374697738	/nfs/dbraw/zinc/69/77/38/374697738.db2.gz	ZWMLNGPNTRDRPW-UHFFFAOYSA-N	1	0	282.287	1.120	50	0		CDAARO
C[C@@H]1C[N@@H+]2CCCC[C@@H]2CN1C(=O)COCC1CC1	ZINC000095398123	374902437	/nfs/dbraw/zinc/90/24/37/374902437.db2.gz	QLQPAYDDKVQPOX-TZMCWYRMSA-N	1	0	266.385	1.498	50	0		CDAARO
COCCOc1ccc(C[NH2+][C@@H]2C[C@H](C)N(C)C2)cn1	ZINC000095420410	374923570	/nfs/dbraw/zinc/92/35/70/374923570.db2.gz	MEFLVUJUMLGTMG-GXTWGEPZSA-N	1	0	279.384	1.289	50	0		CDAARO
CC[NH+](CC)CCCN(C)c1ccc2nccn2n1	ZINC000095431650	374932497	/nfs/dbraw/zinc/93/24/97/374932497.db2.gz	SVKTYMLBCXRKLK-UHFFFAOYSA-N	1	0	261.373	1.897	50	0		CDAARO
CCCc1nccn1C[C@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000095438669	374939013	/nfs/dbraw/zinc/93/90/13/374939013.db2.gz	RTOIJHSTFSBJHW-HZSPNIEDSA-N	1	0	281.400	1.306	50	0		CDAARO
COC(=O)CN1CCC[N@@H+]([C@@H](C)Cc2ccsc2)CC1	ZINC000097084305	375144923	/nfs/dbraw/zinc/14/49/23/375144923.db2.gz	FOYYKPUSROVCKR-ZDUSSCGKSA-N	1	0	296.436	1.860	50	0		CDAARO
COC(=O)N1CCC[C@@H]([NH2+][C@@H]2CCCSC2)C1	ZINC000097084521	375145804	/nfs/dbraw/zinc/14/58/04/375145804.db2.gz	IFAHXWCEDTWEFE-GHMZBOCLSA-N	1	0	258.387	1.702	50	0		CDAARO
O=C(NC[C@@H](O)c1ccccc1Cl)[C@H]1CCCC[NH2+]1	ZINC000299738870	375199063	/nfs/dbraw/zinc/19/90/63/375199063.db2.gz	HMLSDTNZZCDABP-CHWSQXEVSA-N	1	0	282.771	1.632	50	0		CDAARO
COc1ccc(CN(C)C(=O)[C@@]2(F)CC[NH2+]C2)cc1F	ZINC000299740410	375201770	/nfs/dbraw/zinc/20/17/70/375201770.db2.gz	ZJHPHGNIMUBDSN-CQSZACIVSA-N	1	0	284.306	1.494	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CN(C)Cc2cnc(N)s2)C1	ZINC000670466649	483056501	/nfs/dbraw/zinc/05/65/01/483056501.db2.gz	VTRXNYZEMBHRGK-LLVKDONJSA-N	1	0	284.429	1.125	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CCC[NH2+]CC2)cc1F	ZINC000606441032	375822003	/nfs/dbraw/zinc/82/20/03/375822003.db2.gz	MICHVBQYIVRKNJ-XQRVVYSFSA-N	1	0	278.327	1.669	50	0		CDAARO
C[C@@H]1CCC[NH2+][C@H]1CNC(=O)[C@@H]1CSCCS1	ZINC000390834517	375874801	/nfs/dbraw/zinc/87/48/01/375874801.db2.gz	ABLJBANTDMZQNJ-VWYCJHECSA-N	1	0	274.455	1.339	50	0		CDAARO
CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CCN2C(=O)NC(=O)[C@H]2C1	ZINC000239762572	376017436	/nfs/dbraw/zinc/01/74/36/376017436.db2.gz	CMEJHLVQROTNKY-RWMBFGLXSA-N	1	0	277.368	1.215	50	0		CDAARO
CCS[C@@H]1CCC[C@@H](NC(=O)[C@H]2CCC[NH2+]2)C1	ZINC000242155958	376020946	/nfs/dbraw/zinc/02/09/46/376020946.db2.gz	WURXYQOTIRSJAY-IJLUTSLNSA-N	1	0	256.415	1.919	50	0		CDAARO
O=C1CCC2(CC[NH+](CCn3cc(Cl)cn3)CC2)N1	ZINC000243892344	376913989	/nfs/dbraw/zinc/91/39/89/376913989.db2.gz	AGNVOIXGIPGJFV-UHFFFAOYSA-N	1	0	282.775	1.281	50	0		CDAARO
C[N@@H+]1CCN2CCN(Cc3ccc(O)c(Cl)c3)C[C@H]2C1	ZINC000247963644	377185638	/nfs/dbraw/zinc/18/56/38/377185638.db2.gz	GPALUSRVRSSZJH-CYBMUJFWSA-N	1	0	295.814	1.477	50	0		CDAARO
COC[C@H](C)n1ccc(NC(=O)NC2CC[NH+](C)CC2)n1	ZINC000189930315	377479108	/nfs/dbraw/zinc/47/91/08/377479108.db2.gz	RTXHDKPOMNVDBA-NSHDSACASA-N	1	0	295.387	1.306	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C1CCN(c2ncccn2)CC1	ZINC000036932505	390201481	/nfs/dbraw/zinc/20/14/81/390201481.db2.gz	JQDPEWZPSZMMTO-UHFFFAOYSA-N	1	0	286.383	1.575	50	0		CDAARO
CC12CN3CC(c4ccccc4)(C[N@H+](C1)CC3)C2=O	ZINC000019370324	390227146	/nfs/dbraw/zinc/22/71/46/390227146.db2.gz	MAUSSGMNMJIGOZ-UHFFFAOYSA-N	1	0	256.349	1.145	50	0		CDAARO
Cc1ccc(O)c(C[N@@H+]2CCCC[C@H]2C2OCCO2)n1	ZINC000092936876	390510374	/nfs/dbraw/zinc/51/03/74/390510374.db2.gz	VNTBVMBUXPGEGM-ZDUSSCGKSA-N	1	0	278.352	1.823	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](CNc2nc(C)cc(C)n2)C1	ZINC000065382305	390550382	/nfs/dbraw/zinc/55/03/82/390550382.db2.gz	NHZSDBUWNHSRHG-AWEZNQCLSA-N	1	0	278.400	1.864	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)c1ncncc1Cl	ZINC000408513547	390846754	/nfs/dbraw/zinc/84/67/54/390846754.db2.gz	BVTXNIORWPXLEB-PSASIEDQSA-N	1	0	268.748	1.472	50	0		CDAARO
CC(C)c1cc(C(=O)N2CC[N@@H+]3CCC[C@H]3C2)nc(N)n1	ZINC000216947905	391016431	/nfs/dbraw/zinc/01/64/31/391016431.db2.gz	IUQZNGHXYLZFEG-NSHDSACASA-N	1	0	289.383	1.102	50	0		CDAARO
COc1cccc(CNc2cc(C3CC([NH3+])C3)nc(N)n2)c1	ZINC000223887512	533518319	/nfs/dbraw/zinc/51/83/19/533518319.db2.gz	XTQYULZWCHSZDY-UHFFFAOYSA-N	1	0	299.378	1.884	50	0		CDAARO
CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CCN(CCO)[C@@H](C)C1	ZINC000249083425	391495987	/nfs/dbraw/zinc/49/59/87/391495987.db2.gz	MCBRYWMFVAXSKK-HRCADAONSA-N	1	0	266.429	1.977	50	0		CDAARO
CC(C)N1CC[C@@H]([N@H+](C)C[C@H]2CCCOC2)C1=O	ZINC000245339169	391979632	/nfs/dbraw/zinc/97/96/32/391979632.db2.gz	QZQVVSPQQYPQHH-CHWSQXEVSA-N	1	0	254.374	1.354	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@@H]2CC[NH2+]C2)C[C@H](c2ccsc2)O1	ZINC000262614931	131241974	/nfs/dbraw/zinc/24/19/74/131241974.db2.gz	CTGMZQJQAYGQDW-NQBHXWOUSA-N	1	0	280.393	1.646	50	0		CDAARO
CONC(=O)NCc1ccc(F)c(C[NH+](C)C)c1	ZINC000096406889	393180232	/nfs/dbraw/zinc/18/02/32/393180232.db2.gz	LWWLGQUUGWWBAW-UHFFFAOYSA-N	1	0	255.293	1.248	50	0		CDAARO
Cc1cccc(S(=O)(=O)NCC[NH2+]C2CC2)c1F	ZINC000193258674	393286973	/nfs/dbraw/zinc/28/69/73/393286973.db2.gz	BPKDZXXJYKQDKO-UHFFFAOYSA-N	1	0	272.345	1.164	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@@](C)(O)c1cccs1	ZINC000195533959	393273327	/nfs/dbraw/zinc/27/33/27/393273327.db2.gz	JGBWQIIYDUQEED-IUODEOHRSA-N	1	0	296.436	1.946	50	0		CDAARO
COCCCC[NH+]1CCN(c2ccncn2)CC1	ZINC000092046095	135075131	/nfs/dbraw/zinc/07/51/31/135075131.db2.gz	ANPIOLFUBPODQL-UHFFFAOYSA-N	1	0	250.346	1.025	50	0		CDAARO
COC[C@]1(C(=O)N2CCc3ccccc32)CC[NH2+]C1	ZINC000261592564	140359015	/nfs/dbraw/zinc/35/90/15/140359015.db2.gz	MKJGCAGBTFZCBE-HNNXBMFYSA-N	1	0	260.337	1.202	50	0		CDAARO
C[C@H](CN1CCOCC1)OC(=O)c1ccn2c[nH+]cc2c1	ZINC000097107139	397605252	/nfs/dbraw/zinc/60/52/52/397605252.db2.gz	IASRCMGFDBMWAX-GFCCVEGCSA-N	1	0	289.335	1.212	50	0		CDAARO
Cc1n[nH]cc1CCCNC(=O)[C@H]1CCC[NH2+][C@@H]1C	ZINC000384239297	397926106	/nfs/dbraw/zinc/92/61/06/397926106.db2.gz	IODIJLYYWVUYRL-YPMHNXCESA-N	1	0	264.373	1.155	50	0		CDAARO
C[C@H]1COCCN1C(=O)N[C@@H]1CC[N@@H+](C2CCCC2)C1	ZINC000098012579	398004223	/nfs/dbraw/zinc/00/42/23/398004223.db2.gz	GYLVUZDOUYTMPK-QWHCGFSZSA-N	1	0	281.400	1.434	50	0		CDAARO
COc1cccc(CN2CC[NH2+][C@@H](C)[C@@H]2C)c1OC	ZINC000097162670	397981360	/nfs/dbraw/zinc/98/13/60/397981360.db2.gz	CMDFEYASUYJHCK-RYUDHWBXSA-N	1	0	264.369	1.886	50	0		CDAARO
O=C(c1ccnc(OC2CCC2)c1)N1CC[NH2+]CC1	ZINC000181351386	148192178	/nfs/dbraw/zinc/19/21/78/148192178.db2.gz	CBOALYWKNFGKLH-UHFFFAOYSA-N	1	0	261.325	1.058	50	0		CDAARO
Cc1c(C)n(C[C@@H](O)C[NH2+]CCO)c2ccccc12	ZINC000002268588	169783829	/nfs/dbraw/zinc/78/38/29/169783829.db2.gz	LAXQLMTYVIIFCX-ZDUSSCGKSA-N	1	0	262.353	1.201	50	0		CDAARO
Cc1c(C(=O)NCC[NH+](C)C)cnn1-c1ccccc1	ZINC000006869741	170251368	/nfs/dbraw/zinc/25/13/68/170251368.db2.gz	KEFJFKVHPITRJE-UHFFFAOYSA-N	1	0	272.352	1.472	50	0		CDAARO
COc1ccc(C)cc1C[NH+]1CCC(C(N)=O)CC1	ZINC000008317201	170330612	/nfs/dbraw/zinc/33/06/12/170330612.db2.gz	IDTAMHBKCJCVSV-UHFFFAOYSA-N	1	0	262.353	1.701	50	0		CDAARO
CCC(=O)c1ccc(OCC[NH2+]CCN(C)C)cc1	ZINC000020418805	171183949	/nfs/dbraw/zinc/18/39/49/171183949.db2.gz	SVGAOHNHLRODSE-UHFFFAOYSA-N	1	0	264.369	1.809	50	0		CDAARO
O=C(CCC1CCCCC1)N1CCN(CCO)CC1	ZINC000020653238	171268870	/nfs/dbraw/zinc/26/88/70/171268870.db2.gz	GFLHEADEHKBSLZ-UHFFFAOYSA-N	1	0	268.401	1.483	50	0		CDAARO
C[N@H+](CCCNC(=O)c1nccnc1N)Cc1ccccc1	ZINC000022276631	171383400	/nfs/dbraw/zinc/38/34/00/171383400.db2.gz	DCVGXKLYNMKNGC-UHFFFAOYSA-N	1	0	299.378	1.311	50	0		CDAARO
NC(=O)C[NH+]1CCC(CCc2ccc(O)cc2)CC1	ZINC000024829406	171441799	/nfs/dbraw/zinc/44/17/99/171441799.db2.gz	XTXGBUIVPBTNCC-UHFFFAOYSA-N	1	0	262.353	1.522	50	0		CDAARO
CC1CC[NH+](CCCN[C@H](C(N)=O)c2ccccc2)CC1	ZINC000026226192	171476229	/nfs/dbraw/zinc/47/62/29/171476229.db2.gz	MAWJUTSZKDCCCO-INIZCTEOSA-N	1	0	289.423	1.925	50	0		CDAARO
CS(=O)(=O)N1CCC([NH2+]Cc2cccs2)CC1	ZINC000030656546	171620328	/nfs/dbraw/zinc/62/03/28/171620328.db2.gz	GDKKGCOSGWLLPL-UHFFFAOYSA-N	1	0	274.411	1.262	50	0		CDAARO
Cn1nnnc1SCCC[NH2+]C/C=C\c1ccccc1	ZINC000035539919	172246002	/nfs/dbraw/zinc/24/60/02/172246002.db2.gz	ZPNBSWCRUOSNGT-UITAMQMPSA-N	1	0	289.408	1.995	50	0		CDAARO
CCC[C@@H]([NH3+])C(=O)N1CCN(Cc2ccccc2)CC1	ZINC000035686536	172354495	/nfs/dbraw/zinc/35/44/95/172354495.db2.gz	AUUXFJKBQQASPH-OAHLLOKOSA-N	1	0	275.396	1.458	50	0		CDAARO
CCOC(=O)C1CC[NH+](C[C@H](O)c2ccccc2)CC1	ZINC000037485776	173229459	/nfs/dbraw/zinc/22/94/59/173229459.db2.gz	XBVUKHLIAZYGGU-HNNXBMFYSA-N	1	0	277.364	1.995	50	0		CDAARO
COc1ccccc1CN(C)C(=O)[C@H]1CCCC[NH2+]1	ZINC000038059144	174069633	/nfs/dbraw/zinc/06/96/33/174069633.db2.gz	SECUNQHOBQNXFQ-CYBMUJFWSA-N	1	0	262.353	1.796	50	0		CDAARO
OC[C@H](c1ccc(Br)cc1)N1CC[NH2+]CC1	ZINC000038120815	174128542	/nfs/dbraw/zinc/12/85/42/174128542.db2.gz	QUJIMOZKQNYZDZ-GFCCVEGCSA-N	1	0	285.185	1.388	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)Cc1cccc(Cl)c1	ZINC000054369454	175558368	/nfs/dbraw/zinc/55/83/68/175558368.db2.gz	SKRBQEQCQQJECC-SNVBAGLBSA-N	1	0	252.745	1.703	50	0		CDAARO
[NH3+]CCc1nncn1-c1ccccc1C(F)(F)F	ZINC000067688588	175783840	/nfs/dbraw/zinc/78/38/40/175783840.db2.gz	CQQBCDDEYOBICV-UHFFFAOYSA-N	1	0	256.231	1.787	50	0		CDAARO
O=c1n(CC2CC2)nc([C@H]2CCC[NH2+]C2)n1-c1ccccc1	ZINC000071747917	176259042	/nfs/dbraw/zinc/25/90/42/176259042.db2.gz	RRNTXSPVLYFUMR-AWEZNQCLSA-N	1	0	298.390	1.911	50	0		CDAARO
FC(F)(F)C1CCN(Cc2cc3n(n2)CC[NH2+]C3)CC1	ZINC000072169486	176332602	/nfs/dbraw/zinc/33/26/02/176332602.db2.gz	RVXHWCSQPSXDQD-UHFFFAOYSA-N	1	0	288.317	1.761	50	0		CDAARO
COC(=O)[C@H](C[NH3+])Oc1ccc(Br)cc1	ZINC000076420153	177023265	/nfs/dbraw/zinc/02/32/65/177023265.db2.gz	AVUHNQLIRTYAKN-VIFPVBQESA-N	1	0	274.114	1.328	50	0		CDAARO
Oc1cccc(CN2CC[C@@](O)(C[NH+]3CCCCC3)C2)c1	ZINC000077392943	177262947	/nfs/dbraw/zinc/26/29/47/177262947.db2.gz	XBDRDYYWYPCPLL-QGZVFWFLSA-N	1	0	290.407	1.815	50	0		CDAARO
C([C@@H]1CCCCO1)N1CC[NH+]([C@H]2CCSC2)CC1	ZINC000097014616	275396473	/nfs/dbraw/zinc/39/64/73/275396473.db2.gz	JCZCSGBMCFDWEO-KBPBESRZSA-N	1	0	270.442	1.679	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)Cn1c(C)ccc1C	ZINC000170622902	276185060	/nfs/dbraw/zinc/18/50/60/276185060.db2.gz	VJAZXWAPERFILZ-AWEZNQCLSA-N	1	0	263.385	1.705	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1C(=O)N1CCC2(CC1)OC[C@H](C)O2	ZINC000089977241	276360980	/nfs/dbraw/zinc/36/09/80/276360980.db2.gz	LCUKTFFHMNITAY-UONOGXRCSA-N	1	0	296.411	1.615	50	0		CDAARO
CC(C)(C)[NH2+]C[C@H](O)c1ccc(O)c(NC(N)=O)c1	ZINC000002009481	277173239	/nfs/dbraw/zinc/17/32/39/277173239.db2.gz	KEMXXQOFIRIICG-NSHDSACASA-N	1	0	267.329	1.304	50	0	in-man	CDAARO
C[C@@H](C(=O)N1C[C@H](C)C[C@@H](C)C1)[NH+]1CCC(O)CC1	ZINC000249305485	277546776	/nfs/dbraw/zinc/54/67/76/277546776.db2.gz	JERNGNIEVLLHNX-UPJWGTAASA-N	1	0	268.401	1.336	50	0		CDAARO
CC(C)c1cc(N(C)CC[NH+](C)C)n2nccc2n1	ZINC000072475053	278018484	/nfs/dbraw/zinc/01/84/84/278018484.db2.gz	PLDZOYDYOBFVLC-UHFFFAOYSA-N	1	0	261.373	1.851	50	0		CDAARO
C[C@@H](O)C[N@@H+](Cc1ccccc1Cl)C[C@H](C)O	ZINC000000214570	278394627	/nfs/dbraw/zinc/39/46/27/278394627.db2.gz	LPFZHQQEAZUCTP-PHIMTYICSA-N	1	0	257.761	1.904	50	0		CDAARO
C[C@H]1CN(C)c2ccccc2CN1C(=O)[C@H]1CC[NH2+]C1	ZINC000299738457	278425075	/nfs/dbraw/zinc/42/50/75/278425075.db2.gz	BACNUXLKWWPVLG-STQMWFEESA-N	1	0	273.380	1.463	50	0		CDAARO
C[N@@H+]1CC[C@H](CNC(=O)c2cccc3c2OCO3)C1	ZINC000109849380	279312702	/nfs/dbraw/zinc/31/27/02/279312702.db2.gz	AVWHPQJOOHTQCA-SNVBAGLBSA-N	1	0	262.309	1.097	50	0		CDAARO
[NH3+]Cc1ccccc1CS(=O)(=O)N1CCCC1	ZINC000021788374	279659564	/nfs/dbraw/zinc/65/95/64/279659564.db2.gz	UXIOIHCIUYPRGY-UHFFFAOYSA-N	1	0	254.355	1.071	50	0		CDAARO
CCS(=O)(=O)N1CC[NH+](C2CCCCCC2)CC1	ZINC000004703363	280014348	/nfs/dbraw/zinc/01/43/48/280014348.db2.gz	GJVPMLPLKNDBOO-UHFFFAOYSA-N	1	0	274.430	1.677	50	0		CDAARO
OC1CC[NH+](CCCNc2nccc3ccccc32)CC1	ZINC000527851565	281205962	/nfs/dbraw/zinc/20/59/62/281205962.db2.gz	KZCDUQYZZSLWDT-UHFFFAOYSA-N	1	0	285.391	1.915	50	0		CDAARO
CC1(C)C[C@@H]([NH2+]CC2CCS(=O)(=O)CC2)C(C)(C)O1	ZINC000090882490	281317042	/nfs/dbraw/zinc/31/70/42/281317042.db2.gz	MYAUUEXDWSTWKG-GFCCVEGCSA-N	1	0	289.441	1.747	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1nc(OC)cc(OC)n1	ZINC000574474771	295006404	/nfs/dbraw/zinc/00/64/04/295006404.db2.gz	XWGZYQHEOCQHGA-NSHDSACASA-N	1	0	280.372	1.202	50	0		CDAARO
COc1ccccc1N1C(=N)NC(=[NH2+])NC12CCCC2	ZINC000000146412	295368287	/nfs/dbraw/zinc/36/82/87/295368287.db2.gz	JDKOMUBFZLLEMD-UHFFFAOYSA-N	1	0	273.340	1.415	50	0		CDAARO
CC(C)c1cc(C[NH2+][C@@H]2CCNC(=O)CC2)no1	ZINC000534580409	328311530	/nfs/dbraw/zinc/31/15/30/328311530.db2.gz	HZFZUTFRLOGEIU-JTQLQIEISA-N	1	0	251.330	1.556	50	0		CDAARO
CCCc1nc(N2CCC[C@]3(CC[NH2+]C3)C2)no1	ZINC000534587813	328316207	/nfs/dbraw/zinc/31/62/07/328316207.db2.gz	WWSIXGJBUWILHM-CYBMUJFWSA-N	1	0	250.346	1.602	50	0		CDAARO
CNc1nc(C(=O)NCC2(Cn3ccnc3)CC2)cs1	ZINC000534593382	328318915	/nfs/dbraw/zinc/31/89/15/328318915.db2.gz	YAXWQMIOUAJPQI-UHFFFAOYSA-N	1	0	291.380	1.013	50	0		CDAARO
O=C(NC[C@H]1CC[N@@H+](C2CCCCC2)C1)c1cn[nH]n1	ZINC000534633016	328332224	/nfs/dbraw/zinc/33/22/24/328332224.db2.gz	YSSMJBPPOSDOQH-LLVKDONJSA-N	1	0	277.372	1.189	50	0		CDAARO
O=C(NCCN1CCCc2ccccc21)[C@@H]1C=CC[NH2+]1	ZINC000534637900	328334580	/nfs/dbraw/zinc/33/45/80/328334580.db2.gz	NVSPGLKYXIHWKP-AWEZNQCLSA-N	1	0	271.364	1.083	50	0		CDAARO
Cc1cc(C(F)(F)F)cc(N2CCO[C@H](CC[NH3+])C2)n1	ZINC000534647829	328342944	/nfs/dbraw/zinc/34/29/44/328342944.db2.gz	QOOYHBCLTPRAPJ-LLVKDONJSA-N	1	0	289.301	1.963	50	0		CDAARO
COCCc1nc([C@@H]2C[NH2+]CCO2)n(C2CCCCC2)n1	ZINC000096150048	327203965	/nfs/dbraw/zinc/20/39/65/327203965.db2.gz	KTBBOEWHDXLWEN-ZDUSSCGKSA-N	1	0	294.399	1.633	50	0		CDAARO
Cc1ccc(OCCNc2nnc(CC[NH3+])o2)cc1C	ZINC001772710174	1159445422	/nfs/dbraw/zinc/44/54/22/1159445422.db2.gz	VUIOWYNVUZHQDY-UHFFFAOYSA-N	1	0	276.340	1.679	50	0		CDAARO
CO[C@H]1C[N@H+](CCCCOc2ccccc2)C[C@@H]1O	ZINC000670445167	482995964	/nfs/dbraw/zinc/99/59/64/482995964.db2.gz	ZJOOCSDQKAERNY-GJZGRUSLSA-N	1	0	265.353	1.537	50	0		CDAARO
Cc1cccc(N2CCC(NC(=O)[C@@H]3CC[NH2+]3)CC2)c1	ZINC000670451866	483014607	/nfs/dbraw/zinc/01/46/07/483014607.db2.gz	VKVSUTUJZKDCMD-HNNXBMFYSA-N	1	0	273.380	1.442	50	0		CDAARO
C[C@H](NC(=O)CCC[NH+]1CCCCCC1)c1ncnn1C	ZINC000670453652	483028055	/nfs/dbraw/zinc/02/80/55/483028055.db2.gz	KWOCNCJBXCYVQI-ZDUSSCGKSA-N	1	0	293.415	1.649	50	0		CDAARO
Cc1ncnc(C)c1C(=O)N[C@@H]1CCC[C@H]1[NH+](C)C	ZINC000670454408	483031070	/nfs/dbraw/zinc/03/10/70/483031070.db2.gz	YVYTWVTZXFPYLO-VXGBXAGGSA-N	1	0	262.357	1.306	50	0		CDAARO
Cc1cc(=O)c(C(=O)N2[C@@H]3CC[C@H]2C[N@H+](C)CC3)cn1C	ZINC000670470845	483073420	/nfs/dbraw/zinc/07/34/20/483073420.db2.gz	YHPMJWSTDHTWRC-OLZOCXBDSA-N	1	0	289.379	1.002	50	0		CDAARO
CCn1c(C)nnc1CN(C)[C@@H]1CC[N@H+](CC2CCC2)C1	ZINC000083836838	483202764	/nfs/dbraw/zinc/20/27/64/483202764.db2.gz	QQJSYMKWVMADDR-OAHLLOKOSA-N	1	0	291.443	1.913	50	0		CDAARO
COC(=O)c1cccc(C[NH2+]CCC(=O)N(C)C)c1	ZINC000083844058	483206825	/nfs/dbraw/zinc/20/68/25/483206825.db2.gz	OGIKVIRFRZCGQO-UHFFFAOYSA-N	1	0	264.325	1.041	50	0		CDAARO
COC(=O)c1ccoc1CN1CC[C@@H]([NH+]2CCCC2)C1	ZINC000083897520	483219256	/nfs/dbraw/zinc/21/92/56/483219256.db2.gz	VZCXXNWGUJZKQQ-GFCCVEGCSA-N	1	0	278.352	1.736	50	0		CDAARO
CC(C)N1C(=O)C2(CCCCC2)[C@H]1C(=O)NCC[NH+](C)C	ZINC000581821565	1161981702	/nfs/dbraw/zinc/98/17/02/1161981702.db2.gz	GYFMCSVJCYDNJU-CYBMUJFWSA-N	1	0	295.427	1.234	50	0		CDAARO
CCC(CC)(C[NH3+])C(=O)NC[C@H](O)c1ccccc1C	ZINC000236680003	521424054	/nfs/dbraw/zinc/42/40/54/521424054.db2.gz	HLBBJSFCSZBAGT-AWEZNQCLSA-N	1	0	278.396	1.910	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)NCc2cnc3ccccc3c2)C1	ZINC000426651470	534690466	/nfs/dbraw/zinc/69/04/66/534690466.db2.gz	ZSHQLPMIVOKDQN-GFCCVEGCSA-N	1	0	284.363	1.725	50	0		CDAARO
Cc1nn(C)cc1[C@@H](C)NC(=O)[C@@H]1CCCC[NH2+]1	ZINC000096481198	534839720	/nfs/dbraw/zinc/83/97/20/534839720.db2.gz	SASKUWYYGOHGHE-SKDRFNHKSA-N	1	0	250.346	1.048	50	0		CDAARO
CC(C)OCC[NH+]1CCC(Nc2ncccn2)CC1	ZINC000096447480	527955847	/nfs/dbraw/zinc/95/58/47/527955847.db2.gz	MDSXWRWRFPZVCU-UHFFFAOYSA-N	1	0	264.373	1.778	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(CC1)OCC[C@H]2[NH3+]	ZINC000110915348	538155637	/nfs/dbraw/zinc/15/56/37/538155637.db2.gz	GUJCTKQTCXPTIV-SNVBAGLBSA-N	1	0	256.346	1.504	50	0		CDAARO
C[C@@H](c1cccnc1)N1CC[NH+](CCC2OCCO2)CC1	ZINC000097161647	538438477	/nfs/dbraw/zinc/43/84/77/538438477.db2.gz	JKVGFGAHHMHYST-AWEZNQCLSA-N	1	0	291.395	1.523	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@H]([NH3+])c2ccccc2)C1	ZINC000958528572	613973448	/nfs/dbraw/zinc/97/34/48/613973448.db2.gz	QTIVACPRABCKEF-GFCCVEGCSA-N	1	0	278.352	1.668	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](NC(=O)/C=C/c2cnc(N)nc2)C1	ZINC000952965009	614676517	/nfs/dbraw/zinc/67/65/17/614676517.db2.gz	PQPWBWQFBVCREG-GFUIURDCSA-N	1	0	289.383	1.063	50	0		CDAARO
CC(C)[C@@H]([NH2+]CCCOCC(F)F)c1nncn1C	ZINC000888096046	617757401	/nfs/dbraw/zinc/75/74/01/617757401.db2.gz	IPFRWUOUYJOJQO-LLVKDONJSA-N	1	0	276.331	1.774	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CN(C)c2cncc(C)n2)C1	ZINC001772700432	1159436320	/nfs/dbraw/zinc/43/63/20/1159436320.db2.gz	DTXFBBGIPFYUPJ-ZDUSSCGKSA-N	1	0	264.373	1.190	50	0		CDAARO
Cc1nc(CNc2nnc(C(C)(C)[NH3+])o2)sc1C	ZINC001772704245	1159439691	/nfs/dbraw/zinc/43/96/91/1159439691.db2.gz	PWHQGVXQMPSSPQ-UHFFFAOYSA-N	1	0	267.358	1.949	50	0		CDAARO
CC1(C[N@@H+]2CCC[C@@H](c3nnc[nH]3)C2)CCOCC1	ZINC000822307024	1161927912	/nfs/dbraw/zinc/92/79/12/1161927912.db2.gz	WHLCWFSBCNYMDA-GFCCVEGCSA-N	1	0	264.373	1.801	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3c(C)noc3C)C[C@H]2O)[nH]n1	ZINC001704304365	1177682028	/nfs/dbraw/zinc/68/20/28/1177682028.db2.gz	QNFXLLCHPBAXRA-IUODEOHRSA-N	1	0	290.367	1.358	50	0		CDAARO
CO[C@@H]1CCC[C@@]12CCC[N@H+](Cc1cnc(N)nc1)C2	ZINC001704340321	1177694809	/nfs/dbraw/zinc/69/48/09/1177694809.db2.gz	GBZMGDPLVOFYMN-HIFRSBDPSA-N	1	0	276.384	1.840	50	0		CDAARO
COc1cnc(N2CCC([C@@H](C)[NH+](C)C)CC2)nc1	ZINC000077356338	785302236	/nfs/dbraw/zinc/30/22/36/785302236.db2.gz	SHDDPCCXVYAZTH-LLVKDONJSA-N	1	0	264.373	1.652	50	0		CDAARO
Cc1ncc(CN2CC[N@@H+](C(C)C)[C@@H](CCO)C2)s1	ZINC000022932613	785359048	/nfs/dbraw/zinc/35/90/48/785359048.db2.gz	GKNMZCGSFJKCIY-ZDUSSCGKSA-N	1	0	283.441	1.729	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)N[C@H](CO)c1ccc(F)cc1	ZINC000952965105	785523812	/nfs/dbraw/zinc/52/38/12/785523812.db2.gz	BRGFIWFCINBKAG-OAHLLOKOSA-N	1	0	294.370	1.851	50	0		CDAARO
CC[NH+]1CCN(CC(=O)N2C[C@@H]3CC=CC[C@@H]3C2)CC1	ZINC000073990726	785866761	/nfs/dbraw/zinc/86/67/61/785866761.db2.gz	YNTFCWJIXBHXAH-GASCZTMLSA-N	1	0	277.412	1.049	50	0		CDAARO
C[C@@H](CCc1ccc(O)cc1)NN1CCOCC1	ZINC000023283043	786617513	/nfs/dbraw/zinc/61/75/13/786617513.db2.gz	CIDCQGRAIHKQEO-LBPRGKRZSA-N	1	0	250.342	1.550	50	0		CDAARO
[NH3+][C@H](C1CCCC1)C1(O)CCC2(CC1)OCCO2	ZINC000958528764	789735119	/nfs/dbraw/zinc/73/51/19/789735119.db2.gz	UNZCJNOIBVYWSB-GFCCVEGCSA-N	1	0	255.358	1.552	50	0		CDAARO
Cc1[nH+]cc2ccc(C(=O)N[C@H](C)Cn3cncn3)cn21	ZINC000952845161	910400682	/nfs/dbraw/zinc/40/06/82/910400682.db2.gz	DEPIHJLXUMXCDF-SNVBAGLBSA-N	1	0	284.323	1.053	50	0		CDAARO
CCNC(=O)CN(C)C[C@H]1COC2(CCCCC2)O1	ZINC000952884015	910459193	/nfs/dbraw/zinc/45/91/93/910459193.db2.gz	RIWBIODBFKTDRS-LBPRGKRZSA-N	1	0	270.373	1.130	50	0		CDAARO
C[C@H](O)c1nc2cc(NC(=O)C3([NH3+])CCCC3)ccc2[nH]1	ZINC000952977930	910527243	/nfs/dbraw/zinc/52/72/43/910527243.db2.gz	CSTMYVWNRWRFLC-VIFPVBQESA-N	1	0	288.351	1.826	50	0		CDAARO
CC(C)S(=O)(=O)NC[C@@H]1CC[N@@H+](C2CCCCC2)C1	ZINC000822034341	925604976	/nfs/dbraw/zinc/60/49/76/925604976.db2.gz	DNWWYFBBJBUQKB-ZDUSSCGKSA-N	1	0	288.457	1.969	50	0		CDAARO
Cc1c[nH+]ccc1NCCNS(=O)(=O)CC1CCCC1	ZINC000825253731	925857177	/nfs/dbraw/zinc/85/71/77/925857177.db2.gz	VUKPQMGGQBMGLG-UHFFFAOYSA-N	1	0	297.424	1.333	50	0		CDAARO
CC(C)CC1(CNC(=O)[C@@H]([NH3+])Cc2cnc[nH]2)CCC1	ZINC000827530303	925944228	/nfs/dbraw/zinc/94/42/28/925944228.db2.gz	GBQDGTAADUVLFG-ZDUSSCGKSA-N	1	0	278.400	1.612	50	0		CDAARO
CN(C)C(=O)CNC(=O)CC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000827801836	925968914	/nfs/dbraw/zinc/96/89/14/925968914.db2.gz	MUTJMCLYMROBQO-UHFFFAOYSA-N	1	0	283.416	1.138	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)CCc1cccnc1	ZINC000827822473	925970403	/nfs/dbraw/zinc/97/04/03/925970403.db2.gz	TVSVTMCSAVUZRP-UHFFFAOYSA-N	1	0	284.363	1.368	50	0		CDAARO
CC(C)N1CCC[N@@H+]([C@H]2CCNC(=O)CC2)CC1	ZINC000828305657	926098044	/nfs/dbraw/zinc/09/80/44/926098044.db2.gz	RDRNRRMGKXQTCH-CYBMUJFWSA-N	1	0	253.390	1.071	50	0		CDAARO
CC(C)(C)n1nc(-c2ccccc2)nc1[C@H]([NH3+])CO	ZINC000828799089	926196175	/nfs/dbraw/zinc/19/61/75/926196175.db2.gz	DMWMJSGMMIGODO-LLVKDONJSA-N	1	0	260.341	1.692	50	0		CDAARO
O=C1NCCC[C@]12CC[N@H+](Cc1cncn1C1CC1)C2	ZINC000219568833	930880368	/nfs/dbraw/zinc/88/03/68/930880368.db2.gz	BAIVRPWQNXUQPD-OAHLLOKOSA-N	1	0	274.368	1.320	50	0		CDAARO
O=C(NCCc1ccccn1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21	ZINC000585122385	930988652	/nfs/dbraw/zinc/98/86/52/930988652.db2.gz	ZCCFDUNEFGKILK-GJZGRUSLSA-N	1	0	273.380	1.757	50	0		CDAARO
C[C@H]1COC[C@H]1[NH2+]CCN(C)C(=O)OC(C)(C)C	ZINC000688049555	934527902	/nfs/dbraw/zinc/52/79/02/934527902.db2.gz	RBWOHHXEFWJESD-WDEREUQCSA-N	1	0	258.362	1.478	50	0		CDAARO
COCCn1ccnc1C[N@H+](C)[C@@H]1C[C@@H]2C[C@H](O)C[C@@H]2C1	ZINC001529185378	969006176	/nfs/dbraw/zinc/00/61/76/969006176.db2.gz	MBNHQYSQOFNRCK-NMWPEEMBSA-N	1	0	293.411	1.511	50	0		CDAARO
CC[N@H+](C[C@@H]1CCCCO1)C1CCN(C(C)=O)CC1	ZINC001506397753	975147955	/nfs/dbraw/zinc/14/79/55/975147955.db2.gz	WYSVDTLTYBYOLC-HNNXBMFYSA-N	1	0	268.401	1.888	50	0		CDAARO
Cc1nncn1CC[N@@H+](C)C[C@@H](O)c1ccccc1	ZINC001506415382	975155351	/nfs/dbraw/zinc/15/53/51/975155351.db2.gz	XGSDYWNFQGNZMN-CQSZACIVSA-N	1	0	260.341	1.252	50	0		CDAARO
C[C@H](CCN(C)C(=O)c1cncn1C)[NH+]1CCCC1	ZINC001506420163	975158025	/nfs/dbraw/zinc/15/80/25/975158025.db2.gz	WOOLEYXCOPOHTD-GFCCVEGCSA-N	1	0	264.373	1.367	50	0		CDAARO
CC[N@@H+]1CCC[C@H](CN(C)C(=O)c2cc(O)ccc2N)C1	ZINC001506420583	975158185	/nfs/dbraw/zinc/15/81/85/975158185.db2.gz	KHYLTACREILFOL-GFCCVEGCSA-N	1	0	291.395	1.778	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CC(=O)N2CCCC2)n1	ZINC001506429350	975161741	/nfs/dbraw/zinc/16/17/41/975161741.db2.gz	TZWDSAFRSGPPOG-GFCCVEGCSA-N	1	0	264.373	1.100	50	0		CDAARO
Cn1nccc1C[NH2+]Cc1ccc(N2CCOC2=O)cc1	ZINC000096501563	230385031	/nfs/dbraw/zinc/38/50/31/230385031.db2.gz	JPACHUABFJPNJS-UHFFFAOYSA-N	1	0	286.335	1.667	50	0		CDAARO
c1ccc2[nH]c(C3C[NH+](C[C@@H]4CCOC4)C3)nc2c1	ZINC000097742701	230387005	/nfs/dbraw/zinc/38/70/05/230387005.db2.gz	BXAQXGHAKKPOPJ-NSHDSACASA-N	1	0	257.337	1.999	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1c1nc(-c2ccc(C)nn2)no1	ZINC000095519324	185002370	/nfs/dbraw/zinc/00/23/70/185002370.db2.gz	KUTHMSJYUHBUHV-NSHDSACASA-N	1	0	259.313	1.992	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)NCC[C@@H]1CC[NH2+]C1	ZINC000110797226	230394103	/nfs/dbraw/zinc/39/41/03/230394103.db2.gz	HFHNZZZUVDOJDY-NSHDSACASA-N	1	0	286.372	1.412	50	0		CDAARO
CC(C)CCO[C@H]1CC[N@@H+]([C@H](C)C(=O)N(C)C)C1	ZINC000107359827	398140692	/nfs/dbraw/zinc/14/06/92/398140692.db2.gz	UTRSMERQSHLDPN-OLZOCXBDSA-N	1	0	256.390	1.600	50	0		CDAARO
Cc1csc(N2CC[N@@H+](CCCCO)C[C@H]2C)n1	ZINC000106786557	349489789	/nfs/dbraw/zinc/48/97/89/349489789.db2.gz	VOCZBUYGWGTATF-GFCCVEGCSA-N	1	0	269.414	1.735	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(C(=O)NCc2cccnc2)C1	ZINC000095959748	185043138	/nfs/dbraw/zinc/04/31/38/185043138.db2.gz	VRUYDJBQPWGTTN-ZDUSSCGKSA-N	1	0	262.357	1.175	50	0		CDAARO
C[NH+](C)C[C@H]1CCN(C(=O)NCc2cccnc2)C1	ZINC000095959749	185043745	/nfs/dbraw/zinc/04/37/45/185043745.db2.gz	VRUYDJBQPWGTTN-CYBMUJFWSA-N	1	0	262.357	1.175	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1NC(=O)c1ccoc1	ZINC000223367895	398223446	/nfs/dbraw/zinc/22/34/46/398223446.db2.gz	UXKREEKJMRJLMJ-RYUDHWBXSA-N	1	0	252.314	1.117	50	0		CDAARO
CCC1(CC)[C@H](NC(=O)[C@H]2C[C@H](OC)C[NH2+]2)[C@H](C)[C@H]1OC	ZINC000240423832	361748334	/nfs/dbraw/zinc/74/83/34/361748334.db2.gz	FRHDUIZGECCWHC-ODXJTPSBSA-N	1	0	298.427	1.319	50	0		CDAARO
COC(=O)CNC(=O)[C@H](C)[N@@H+]1CC[C@@H](C)C[C@H](C)C1	ZINC000241684888	361753455	/nfs/dbraw/zinc/75/34/55/361753455.db2.gz	QGCGQDCTDKFIJT-WOPDTQHZSA-N	1	0	270.373	1.032	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)C[C@H](C)c1ccc(F)cc1F	ZINC000195554032	342625793	/nfs/dbraw/zinc/62/57/93/342625793.db2.gz	VIWZOWWZOAMBLT-FZZIBODNSA-N	1	0	298.333	1.561	50	0		CDAARO
COc1ccccc1C[NH2+][C@@H](C(N)=O)C(C)(C)C	ZINC000195573587	342628768	/nfs/dbraw/zinc/62/87/68/342628768.db2.gz	KMGZLENAIDDBJP-LBPRGKRZSA-N	1	0	250.342	1.685	50	0		CDAARO
C[NH+]1CCC(C(=O)NC[C@@](C)(O)C2CCCCC2)CC1	ZINC000252494807	361846570	/nfs/dbraw/zinc/84/65/70/361846570.db2.gz	OFLABKCVLITNCM-MRXNPFEDSA-N	1	0	282.428	1.776	50	0		CDAARO
CCc1nc2c(s1)[C@H]([NH2+][C@@H]1CCCNC1=O)CCC2	ZINC000095967542	539088162	/nfs/dbraw/zinc/08/81/62/539088162.db2.gz	QSNUHXOQZRKHBP-MWLCHTKSSA-N	1	0	279.409	1.951	50	0		CDAARO
c1cnc(N2CCC[N@@H+](C[C@@H]3CCCOC3)CC2)nc1	ZINC000244742154	361861722	/nfs/dbraw/zinc/86/17/22/361861722.db2.gz	OCSGRUQIFBNIME-AWEZNQCLSA-N	1	0	276.384	1.415	50	0		CDAARO
Cc1n[nH]c(C)c1C[N@H+](C)CCC(=O)NC(C)(C)C	ZINC000244884203	361869563	/nfs/dbraw/zinc/86/95/63/361869563.db2.gz	YHHPBPNEHLMSQW-UHFFFAOYSA-N	1	0	266.389	1.763	50	0		CDAARO
CCC1(CC)[C@H](NC(=O)[C@H]2C[C@H](OC)C[NH2+]2)[C@@H](C)[C@@H]1OC	ZINC000189319639	361911897	/nfs/dbraw/zinc/91/18/97/361911897.db2.gz	FRHDUIZGECCWHC-ITGHMWBKSA-N	1	0	298.427	1.319	50	0		CDAARO
CC(C)OC[C@@H](O)C[N@H+](C)CCOc1ccccc1F	ZINC000096967985	185143319	/nfs/dbraw/zinc/14/33/19/185143319.db2.gz	XMAFXQNYCVOKHY-ZDUSSCGKSA-N	1	0	285.359	1.922	50	0		CDAARO
CC[C@@H]1CN(C(=O)C(C)C)CC[C@H]1[NH2+]Cc1nccn1C	ZINC000084736436	342268403	/nfs/dbraw/zinc/26/84/03/342268403.db2.gz	ZMDKRWSUUYPQTA-ZIAGYGMSSA-N	1	0	292.427	1.793	50	0		CDAARO
[NH2+]=C1c2c3c(sc2N[C@H]2CCCCCN12)CCCC3	ZINC000000280797	342289844	/nfs/dbraw/zinc/28/98/44/342289844.db2.gz	ZRQFHFYNZCLUPJ-GFCCVEGCSA-N	1	0	275.421	1.487	50	0		CDAARO
CC(C)c1noc2ncc(C(=O)N3CC[C@@H](C[NH3+])C3)cc21	ZINC000178576572	362247032	/nfs/dbraw/zinc/24/70/32/362247032.db2.gz	MQUUDFSHQCSRAO-JTQLQIEISA-N	1	0	288.351	1.767	50	0		CDAARO
CCc1nccn1CCCNC(=O)C[N@H+](C)C1CCCC1	ZINC000219926888	529759689	/nfs/dbraw/zinc/75/96/89/529759689.db2.gz	ZCZVQMPYPRAIKC-UHFFFAOYSA-N	1	0	292.427	1.826	50	0		CDAARO
CC[C@H](C)[N@H+](C)CCNC(=O)N(C)CC(F)F	ZINC000084721826	362269988	/nfs/dbraw/zinc/26/99/88/362269988.db2.gz	MEGNKMCHELTBEF-VIFPVBQESA-N	1	0	251.321	1.623	50	0		CDAARO
CC(=O)NC[C@@H]1C[N@H+](C[C@H]2C(C)=CCC[C@H]2C)CCO1	ZINC000191073417	362399286	/nfs/dbraw/zinc/39/92/86/362399286.db2.gz	NECLUUSXMKWBHS-BMFZPTHFSA-N	1	0	280.412	1.816	50	0		CDAARO
[NH3+]Cc1ccc(OC2CCC3(CC2)OCCO3)nc1	ZINC000390825955	344885523	/nfs/dbraw/zinc/88/55/23/344885523.db2.gz	TWKZDICIPZMTSZ-UHFFFAOYSA-N	1	0	264.325	1.605	50	0		CDAARO
Cc1noc(C)c1[C@H](C)NC(=O)N1CC[C@@H](C[NH+](C)C)C1	ZINC000130001534	346179437	/nfs/dbraw/zinc/17/94/37/346179437.db2.gz	IYJCPMQSJPDURL-GWCFXTLKSA-N	1	0	294.399	1.946	50	0		CDAARO
CC[C@](C)(O)C[NH2+][C@H]1CCN(c2ccccc2)C(=O)C1	ZINC000193093674	136579868	/nfs/dbraw/zinc/57/98/68/136579868.db2.gz	BVQQAERQFDZAPU-BBRMVZONSA-N	1	0	276.380	1.933	50	0		CDAARO
Clc1nc2c(c(NC3CC[NH2+]CC3)n1)CCC2	ZINC000116993746	282548421	/nfs/dbraw/zinc/54/84/21/282548421.db2.gz	XVGHVWUPFQXPBC-UHFFFAOYSA-N	1	0	252.749	1.783	50	0		CDAARO
COc1ccnc(N2CC[NH+](C[C@H]3CCCO3)CC2)c1	ZINC000104719989	348727975	/nfs/dbraw/zinc/72/79/75/348727975.db2.gz	LEJDIVVJKCPEIB-CQSZACIVSA-N	1	0	277.368	1.391	50	0		CDAARO
O=C(CCC(F)(F)F)NCCC[N@H+]1CCC[C@H](O)C1	ZINC000584887042	349345580	/nfs/dbraw/zinc/34/55/80/349345580.db2.gz	QIYDTUFDQLKLRI-JTQLQIEISA-N	1	0	282.306	1.292	50	0		CDAARO
Cc1cc(NCCn2cncn2)c2cc3c(cc2[nH+]1)OCO3	ZINC000584888927	349346930	/nfs/dbraw/zinc/34/69/30/349346930.db2.gz	BCHJBTZUUDTKQK-UHFFFAOYSA-N	1	0	297.318	1.397	50	0		CDAARO
O=C(C[C@H]1CCOC1)N1CC[NH+](CC2CCC2)CC1	ZINC000584888574	349346986	/nfs/dbraw/zinc/34/69/86/349346986.db2.gz	UFMTVUHIFAXDEW-CQSZACIVSA-N	1	0	266.385	1.357	50	0		CDAARO
CN(Cc1ccccc1C[NH+]1CCCC1)C(=O)c1cn[nH]n1	ZINC000584891088	349350140	/nfs/dbraw/zinc/35/01/40/349350140.db2.gz	GQXRGNTZDHAGIY-UHFFFAOYSA-N	1	0	299.378	1.673	50	0		CDAARO
C[C@H]([NH2+]C[C@@H]1CN2CCN1CC2)c1ccc2c(c1)OCO2	ZINC000090649271	180018057	/nfs/dbraw/zinc/01/80/57/180018057.db2.gz	LIRPGXFIBQLNJG-GXTWGEPZSA-N	1	0	289.379	1.066	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC000091496691	180172524	/nfs/dbraw/zinc/17/25/24/180172524.db2.gz	PUUVSVOPWBUDRQ-CPCISQLKSA-N	1	0	272.270	1.974	50	0		CDAARO
CC(C)=CCC[N@H+]1CCN(C)[C@@]2(C1)CCC(=O)N(C)CC2	ZINC000091586247	180199502	/nfs/dbraw/zinc/19/95/02/180199502.db2.gz	ATPKKUMHDHLRDZ-KRWDZBQOSA-N	1	0	293.455	1.971	50	0		CDAARO
COc1ccc(CN2C[C@H](CO)[C@H](C[NH+](C)C)C2)c(C)c1	ZINC000091604036	180203593	/nfs/dbraw/zinc/20/35/93/180203593.db2.gz	GAJCNPRMBNPMQU-HZPDHXFCSA-N	1	0	292.423	1.606	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1N[C@@H](C)c1nnc(C)[nH]1	ZINC000091526313	180178788	/nfs/dbraw/zinc/17/87/88/180178788.db2.gz	NRBHYGWGYCMJEN-ZETCQYMHSA-N	1	0	261.333	1.529	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2cccc(COC)n2)C[C@@H]1[NH3+]	ZINC000091664917	180220700	/nfs/dbraw/zinc/22/07/00/180220700.db2.gz	GCONTDAZXKVODB-AAEUAGOBSA-N	1	0	277.368	1.427	50	0		CDAARO
OC[C@H]1CN(Cc2c[nH]cn2)C[C@H]1C[NH+]1CCCCCC1	ZINC000091665152	180221237	/nfs/dbraw/zinc/22/12/37/180221237.db2.gz	PAOWGMVNXPBOSH-HUUCEWRRSA-N	1	0	292.427	1.326	50	0		CDAARO
C[N@@H+]1C[C@H]2CC[C@@H]1CN(S(=O)(=O)c1ccccc1)C2	ZINC000091664071	180221293	/nfs/dbraw/zinc/22/12/93/180221293.db2.gz	VOAYRPKOMOKWFD-CHWSQXEVSA-N	1	0	280.393	1.401	50	0		CDAARO
C[C@@H]1C[N@H+](CCN2CCCC2=O)C[C@@]1(O)C1CCC1	ZINC000091757581	180247469	/nfs/dbraw/zinc/24/74/69/180247469.db2.gz	GRZUKDIXUSEXPC-DOMZBBRYSA-N	1	0	266.385	1.092	50	0		CDAARO
Cc1cccc(S(=O)(=O)N2C[C@@H]3CC[C@H](C2)[N@H+](C)C3)c1	ZINC000091808436	180260460	/nfs/dbraw/zinc/26/04/60/180260460.db2.gz	HNRIZSITSULJFS-ZIAGYGMSSA-N	1	0	294.420	1.710	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2c[nH]nc2-c2ccccc2)C[C@@H]1C1CC1	ZINC000091997263	180303193	/nfs/dbraw/zinc/30/31/93/180303193.db2.gz	VQBDJDCODPEEMB-CABCVRRESA-N	1	0	296.374	1.886	50	0		CDAARO
C[N@@H+]1C[C@@H]2CC[C@H](C1)N(Cc1ccc(OCCO)cc1)C2	ZINC000092037556	180310079	/nfs/dbraw/zinc/31/00/79/180310079.db2.gz	RZYIXOFWCHKFDC-JKSUJKDBSA-N	1	0	290.407	1.584	50	0		CDAARO
CC[C@@H]1CN(Cc2noc(C3CC3)n2)CC[N@@H+]1C[C@H](C)O	ZINC000106906904	186150144	/nfs/dbraw/zinc/15/01/44/186150144.db2.gz	BHMXSIJYMGAYRN-WCQYABFASA-N	1	0	294.399	1.224	50	0		CDAARO
CC[C@H]1CN(CCc2ccccn2)CC[N@@H+]1C[C@H](C)O	ZINC000106844388	186140426	/nfs/dbraw/zinc/14/04/26/186140426.db2.gz	UIFJEDQIUJIQGO-HOCLYGCPSA-N	1	0	277.412	1.401	50	0		CDAARO
C[NH+](C)CCSc1ccc(NC(=O)C2CC2)nn1	ZINC000013702016	365961982	/nfs/dbraw/zinc/96/19/82/365961982.db2.gz	HYYLDXYTSCKMTL-UHFFFAOYSA-N	1	0	266.370	1.479	50	0		CDAARO
CNC(=O)CN1CCC([NH2+]Cc2cccc(F)c2F)CC1	ZINC000107038160	186156876	/nfs/dbraw/zinc/15/68/76/186156876.db2.gz	QTVMRNVXLHMQFD-UHFFFAOYSA-N	1	0	297.349	1.265	50	0		CDAARO
COC(=O)Cn1cc(C[NH2+][C@@H]2CCC[C@H](C)[C@@H]2C)nn1	ZINC000108465359	186218860	/nfs/dbraw/zinc/21/88/60/186218860.db2.gz	ZLVQHAVNPPONMD-GMXVVIOVSA-N	1	0	280.372	1.365	50	0		CDAARO
Cc1nc(CN(C)CC(C)(C)C[NH+]2CCOCC2)[nH]c1C	ZINC000583651313	366009739	/nfs/dbraw/zinc/00/97/39/366009739.db2.gz	KTKFPJISFWWLFL-UHFFFAOYSA-N	1	0	294.443	1.817	50	0		CDAARO
O=C(c1ncc(F)cc1F)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000065429631	363239871	/nfs/dbraw/zinc/23/98/71/363239871.db2.gz	KRNOFTKLOVSSLD-ZJUUUORDSA-N	1	0	267.279	1.326	50	0		CDAARO
CCOC[C@H](O)C[N@@H+]1CC[C@@H](Oc2ccccc2)C1	ZINC000195530315	363454697	/nfs/dbraw/zinc/45/46/97/363454697.db2.gz	WBIUPXVTPZEVTL-UKRRQHHQSA-N	1	0	265.353	1.537	50	0		CDAARO
O=C1C[C@@H]([NH2+]CC2CC2)CN1Cc1cccc(F)c1	ZINC000012763600	356323385	/nfs/dbraw/zinc/32/33/85/356323385.db2.gz	RAAOLDYXYFUHCG-CQSZACIVSA-N	1	0	262.328	1.926	50	0		CDAARO
[NH3+]CCS(=O)(=O)c1ccc(Br)cc1	ZINC000011896395	356283214	/nfs/dbraw/zinc/28/32/14/356283214.db2.gz	UJBDHNFPJMRHII-UHFFFAOYSA-N	1	0	264.144	1.182	50	0		CDAARO
C[C@H](C(=O)NCc1ccc2c(c1)OCO2)[NH+]1CCCCC1	ZINC000015375976	356414579	/nfs/dbraw/zinc/41/45/79/356414579.db2.gz	QYAZVOWDOWYPED-GFCCVEGCSA-N	1	0	290.363	1.906	50	0		CDAARO
Cc1cc(S(C)(=O)=O)ccc1N1CC[NH2+][C@H](C)C1	ZINC000015443246	356416323	/nfs/dbraw/zinc/41/63/23/356416323.db2.gz	BWDYUGMPCHGURQ-LLVKDONJSA-N	1	0	268.382	1.197	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)Cc1noc2ccccc12	ZINC000015674985	356421896	/nfs/dbraw/zinc/42/18/96/356421896.db2.gz	DTSSLERZULPJSJ-LBPRGKRZSA-N	1	0	287.363	1.971	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COc2cccc(OC)c2)CC1	ZINC000019363163	356483293	/nfs/dbraw/zinc/48/32/93/356483293.db2.gz	QQWBSPJJCODTEG-CQSZACIVSA-N	1	0	294.395	1.072	50	0		CDAARO
O=C(NCC[N@@H+]1CCc2ccccc2C1)c1ccc(=O)oc1	ZINC000019222506	356477178	/nfs/dbraw/zinc/47/71/78/356477178.db2.gz	BQRWGBDXDXFIJN-UHFFFAOYSA-N	1	0	298.342	1.428	50	0		CDAARO
C[NH+]1CCN(CCOc2cccc(Cl)c2)CC1	ZINC000019590048	356493352	/nfs/dbraw/zinc/49/33/52/356493352.db2.gz	WJXJUTQPXNUQEP-UHFFFAOYSA-N	1	0	254.761	1.966	50	0		CDAARO
CC(C)(C)OC(=O)NCCC[C@@H]([NH3+])[C@@H](O)C(F)(F)F	ZINC000034537889	363531334	/nfs/dbraw/zinc/53/13/34/363531334.db2.gz	UHEFDJGMLCIEND-HTQZYQBOSA-N	1	0	286.294	1.542	50	0		CDAARO
CC(C)(C)C[N@@H+]1CCN(Cc2cc[nH]n2)C[C@@H]1CCO	ZINC000022851531	356622137	/nfs/dbraw/zinc/62/21/37/356622137.db2.gz	STIIZHREYPQGQT-AWEZNQCLSA-N	1	0	280.416	1.324	50	0		CDAARO
COc1ccc(C[C@H](C)[NH+]2CCN(CCO)CC2)cc1	ZINC000023283107	356639281	/nfs/dbraw/zinc/63/92/81/356639281.db2.gz	ZMAIFPQBFJMZHM-AWEZNQCLSA-N	1	0	278.396	1.236	50	0		CDAARO
CC1(C)NC(=O)N(CCN2CCc3sccc3C2)C1=O	ZINC000026913329	356701178	/nfs/dbraw/zinc/70/11/78/356701178.db2.gz	CFHKYOVXRAAVOM-UHFFFAOYSA-N	1	0	293.392	1.437	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCCC[C@@H]2[NH3+])cc1	ZINC000031892842	356771432	/nfs/dbraw/zinc/77/14/32/356771432.db2.gz	VVOFSHARRCJLLA-STQMWFEESA-N	1	0	268.382	1.543	50	0		CDAARO
COc1cccc([C@@H](O)C[NH2+]Cc2ccccn2)c1	ZINC000032110627	356775301	/nfs/dbraw/zinc/77/53/01/356775301.db2.gz	ACNFLRAIRKXFGE-HNNXBMFYSA-N	1	0	258.321	1.913	50	0		CDAARO
C[NH2+]CC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000000209318	356812731	/nfs/dbraw/zinc/81/27/31/356812731.db2.gz	BCYLMWGLBAKEBZ-JTQLQIEISA-N	1	0	278.352	1.369	50	0		CDAARO
NC(=O)[C@H]1CCC[N@H+](Cc2ccc(F)c(F)c2)C1	ZINC000000757470	356813937	/nfs/dbraw/zinc/81/39/37/356813937.db2.gz	BTJBAKJVJRLSPU-JTQLQIEISA-N	1	0	254.280	1.662	50	0		CDAARO
Cc1cccc(NC(=O)c2n[nH]c3c2C[NH2+]CC3)c1	ZINC000042784026	357080323	/nfs/dbraw/zinc/08/03/23/357080323.db2.gz	IFLDHRGKDIGYKJ-UHFFFAOYSA-N	1	0	256.309	1.616	50	0		CDAARO
C[C@H](CCn1cncn1)[NH2+]C[C@H]1COc2ccccc2O1	ZINC000095419263	357320611	/nfs/dbraw/zinc/32/06/11/357320611.db2.gz	UOIJTRKIQGUMGO-OLZOCXBDSA-N	1	0	288.351	1.486	50	0		CDAARO
O=C(CC[NH+]1CCCCCCC1)N1CCCOCC1	ZINC000055308694	357332213	/nfs/dbraw/zinc/33/22/13/357332213.db2.gz	QPZVZIFDMPWKIU-UHFFFAOYSA-N	1	0	268.401	1.892	50	0		CDAARO
CC[NH+]1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000058873934	357415407	/nfs/dbraw/zinc/41/54/07/357415407.db2.gz	NKBVABXSYYUPCC-UHFFFAOYSA-N	1	0	287.407	1.603	50	0		CDAARO
COC[C@@H](C)[NH+]1CCN(c2cccc(F)n2)CC1	ZINC000096429404	357471152	/nfs/dbraw/zinc/47/11/52/357471152.db2.gz	SMBWSRWXJSPYLV-LLVKDONJSA-N	1	0	253.321	1.378	50	0		CDAARO
C[C@H](CCn1cccn1)NC(=O)C[NH+]1CCCCCC1	ZINC000065435345	357541615	/nfs/dbraw/zinc/54/16/15/357541615.db2.gz	PYHAUFRVZHMOSE-CQSZACIVSA-N	1	0	278.400	1.654	50	0		CDAARO
C[C@@H]([NH2+]CC(C)(C)CO)C(=O)Nc1nccs1	ZINC000065505117	357545794	/nfs/dbraw/zinc/54/57/94/357545794.db2.gz	MATKARQTHKQGKJ-MRVPVSSYSA-N	1	0	257.359	1.078	50	0		CDAARO
Cc1nccn1C[C@H](C)[NH2+]CC1(CO)CCCC1	ZINC000067756199	357625512	/nfs/dbraw/zinc/62/55/12/357625512.db2.gz	XQVAEHPIHBUKGM-LBPRGKRZSA-N	1	0	251.374	1.722	50	0		CDAARO
CC[NH+](CC)CCn1cc(-c2cccc(O)c2)nn1	ZINC000067713039	357620439	/nfs/dbraw/zinc/62/04/39/357620439.db2.gz	ATEHGBMGBXSUAY-UHFFFAOYSA-N	1	0	260.341	1.993	50	0		CDAARO
CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)c2ncccc2O)C1	ZINC000067934110	357638983	/nfs/dbraw/zinc/63/89/83/357638983.db2.gz	BLYGGDYJHTUKJS-ZDUSSCGKSA-N	1	0	291.395	1.885	50	0		CDAARO
C[NH+]1CCC2(CN(CCOc3ccccc3)C(=O)O2)CC1	ZINC000072469031	357838136	/nfs/dbraw/zinc/83/81/36/357838136.db2.gz	FXWYCLFSXAFXHJ-UHFFFAOYSA-N	1	0	290.363	1.982	50	0		CDAARO
COCCOC[C@@H]1CCN(c2cccc(C)n2)C1	ZINC000097096509	357953490	/nfs/dbraw/zinc/95/34/90/357953490.db2.gz	QQXSZRMOJWALHR-CYBMUJFWSA-N	1	0	250.342	1.879	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNS(=O)(=O)c1cc(C)oc1C	ZINC000097102327	357972117	/nfs/dbraw/zinc/97/21/17/357972117.db2.gz	BGNXFZDHPXTXSD-LBPRGKRZSA-N	1	0	286.397	1.659	50	0		CDAARO
Cc1ccc(C)c(OC[C@H](O)CN2CC[NH+](C)CC2)c1	ZINC000019790778	358141898	/nfs/dbraw/zinc/14/18/98/358141898.db2.gz	OXAYFJBTRHHFMY-OAHLLOKOSA-N	1	0	278.396	1.291	50	0		CDAARO
CCC[C@H]([NH3+])C(=O)N(C)Cc1cccc(N(C)C)c1	ZINC000195554518	358556829	/nfs/dbraw/zinc/55/68/29/358556829.db2.gz	GUMBAMQGTGWRMM-AWEZNQCLSA-N	1	0	263.385	1.838	50	0		CDAARO
C[C@@H](Cn1cncn1)Nc1cc(N2CCCCC2)ncn1	ZINC000195575123	358567154	/nfs/dbraw/zinc/56/71/54/358567154.db2.gz	BYEQGLZDWHARSX-LBPRGKRZSA-N	1	0	287.371	1.559	50	0		CDAARO
CCn1cnnc1[C@@H](C)NC(=O)CC1CC[NH+](CC)CC1	ZINC000095377914	358689273	/nfs/dbraw/zinc/68/92/73/358689273.db2.gz	YRFFDOHCJWSMPP-GFCCVEGCSA-N	1	0	293.415	1.597	50	0		CDAARO
CCCc1nnc(N2CC[C@@H]([NH+](CC)CC)C2)o1	ZINC000095376539	358689297	/nfs/dbraw/zinc/68/92/97/358689297.db2.gz	HGVFCJDYMNZDRL-LLVKDONJSA-N	1	0	252.362	1.943	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)N[C@@H](C)Cc2cnccn2)CC1	ZINC000095387006	358691306	/nfs/dbraw/zinc/69/13/06/358691306.db2.gz	ZPVDHBVJIJKIEK-ZDUSSCGKSA-N	1	0	290.411	1.644	50	0		CDAARO
CC(C)c1ccnc(N2CC[C@@]3(O)CC[NH2+]C[C@H]3C2)n1	ZINC000095386499	358691323	/nfs/dbraw/zinc/69/13/23/358691323.db2.gz	UAKISUYMICDWPD-WFASDCNBSA-N	1	0	276.384	1.151	50	0		CDAARO
C[C@H](NC(=O)C1(O)CC[NH+](C)CC1)c1cc(F)cc(F)c1	ZINC000097475063	358779123	/nfs/dbraw/zinc/77/91/23/358779123.db2.gz	RBPSMCLMVAONRD-JTQLQIEISA-N	1	0	298.333	1.599	50	0		CDAARO
C[NH2+]Cc1nc([C@H]2CCOC2)nn1-c1cccc2c1CCC2	ZINC000097505921	358781363	/nfs/dbraw/zinc/78/13/63/358781363.db2.gz	HZVCALGSUBLRLI-ZDUSSCGKSA-N	1	0	298.390	1.979	50	0		CDAARO
Cc1n[nH]c(CN2CCC[C@]3(CC[NH2+]C3)C2)c1Cl	ZINC000097532344	358782367	/nfs/dbraw/zinc/78/23/67/358782367.db2.gz	GKJVDHFCFQKPNB-CYBMUJFWSA-N	1	0	268.792	1.947	50	0		CDAARO
CCn1nc(C)c(CCNC(=O)C[C@@H]2CCC[N@@H+]2C)c1C	ZINC000097744591	358795955	/nfs/dbraw/zinc/79/59/55/358795955.db2.gz	HLZKOLATUGTLNR-AWEZNQCLSA-N	1	0	292.427	1.663	50	0		CDAARO
COC(=O)CC1(NCc2cccc(O)c2)CC[NH+](C)CC1	ZINC000088744431	366495301	/nfs/dbraw/zinc/49/53/01/366495301.db2.gz	ASDWOWRUKSVXRZ-UHFFFAOYSA-N	1	0	292.379	1.509	50	0		CDAARO
CCc1ccc(CCNC(=O)C[C@@H]2C[NH2+]CCO2)cc1	ZINC000216010183	358916907	/nfs/dbraw/zinc/91/69/07/358916907.db2.gz	KXRWYIBZAZEQRP-OAHLLOKOSA-N	1	0	276.380	1.286	50	0		CDAARO
COC[C@H]1CCCC[N@@H+]1Cc1c(C)nn(CCO)c1C	ZINC000216057581	358920966	/nfs/dbraw/zinc/92/09/66/358920966.db2.gz	HPCJCDVLMODZRF-CQSZACIVSA-N	1	0	281.400	1.493	50	0		CDAARO
CCn1ncnc1CN1CCC[C@H](C[NH+]2CCCCC2)C1	ZINC000216199593	358931162	/nfs/dbraw/zinc/93/11/62/358931162.db2.gz	LZZNIWXQRWOCNR-OAHLLOKOSA-N	1	0	291.443	1.996	50	0		CDAARO
C[N@H+](CCCNc1ccc2nnnn2n1)Cc1ccccc1	ZINC000014018812	366527460	/nfs/dbraw/zinc/52/74/60/366527460.db2.gz	NIBPRIJLMLMQLB-UHFFFAOYSA-N	1	0	297.366	1.453	50	0		CDAARO
COc1ccccc1C[NH2+]C[C@H](OC)[C@H]1CCOC1	ZINC000585093633	482828926	/nfs/dbraw/zinc/82/89/26/482828926.db2.gz	PZNCWJCCKHDIAI-ZFWWWQNUSA-N	1	0	265.353	1.836	50	0		CDAARO
COC(=O)C[C@H]1CN(Cc2cccc(N)c2)CCO1	ZINC000408519027	359911956	/nfs/dbraw/zinc/91/19/56/359911956.db2.gz	SSVSHNMPKLWXSX-ZDUSSCGKSA-N	1	0	264.325	1.033	50	0		CDAARO
COCCCN1CCC(CO)([NH2+]CC(C)C)CC1	ZINC000408524835	359934695	/nfs/dbraw/zinc/93/46/95/359934695.db2.gz	ZUBVCOKNHZPIFK-UHFFFAOYSA-N	1	0	258.406	1.095	50	0		CDAARO
Cc1noc([C@@H](C)N2CCC[C@H]2Cn2nc(C)nc2C)n1	ZINC000257365640	359946171	/nfs/dbraw/zinc/94/61/71/359946171.db2.gz	CQKRHFUPSHRJJF-RNCFNFMXSA-N	1	0	290.371	1.812	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@H]1CCN(C(=O)c2ccnn2C)C1	ZINC000409421063	360230072	/nfs/dbraw/zinc/23/00/72/360230072.db2.gz	BPVPTFNDMPGALG-LBPRGKRZSA-N	1	0	273.340	1.321	50	0		CDAARO
C[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)c1cccnc1	ZINC000248163471	360428068	/nfs/dbraw/zinc/42/80/68/360428068.db2.gz	YTBXLWJGFMCOJD-UONOGXRCSA-N	1	0	259.353	1.780	50	0		CDAARO
CC[C@H](O)CSc1nnc(C[NH3+])n1-c1ccc(F)cc1	ZINC000426563082	360683971	/nfs/dbraw/zinc/68/39/71/360683971.db2.gz	AZGZXQYPHAMXND-NSHDSACASA-N	1	0	296.371	1.728	50	0		CDAARO
CC(C)c1nc(CCN(C)C(=O)[C@@H](C)[NH+](C)C)no1	ZINC000426361091	360659853	/nfs/dbraw/zinc/65/98/53/360659853.db2.gz	AKMFVWJQTAAQSP-SNVBAGLBSA-N	1	0	268.361	1.144	50	0		CDAARO
Cc1ccc2cccc(C(=O)N3CC[C@H](C[NH3+])C3)c2n1	ZINC000178520573	189123401	/nfs/dbraw/zinc/12/34/01/189123401.db2.gz	MXFBTXADRSQTSC-GFCCVEGCSA-N	1	0	269.348	1.964	50	0		CDAARO
CC(C)(C(=O)NCCc1nc(C2CC2)no1)[NH+]1CCCC1	ZINC000426420753	360667648	/nfs/dbraw/zinc/66/76/48/360667648.db2.gz	PDKAQFBTUKDHOW-UHFFFAOYSA-N	1	0	292.383	1.480	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)c2cncn2-c2ccc(F)cc2)C1	ZINC000178526670	189124601	/nfs/dbraw/zinc/12/46/01/189124601.db2.gz	XKHFHVBUYDUHLN-LLVKDONJSA-N	1	0	288.326	1.432	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cc(F)cc3nc[nH]c32)C1	ZINC000178961678	189157807	/nfs/dbraw/zinc/15/78/07/189157807.db2.gz	MLASRKWAKPVZGM-VIFPVBQESA-N	1	0	276.315	1.384	50	0		CDAARO
Cn1ncc(Cl)c1C[NH2+]CCCN1CCCC1=O	ZINC000130298364	360939342	/nfs/dbraw/zinc/93/93/42/360939342.db2.gz	GMJCGJYMXIURAT-UHFFFAOYSA-N	1	0	270.764	1.176	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)[C@H]2COc3ccc(Cl)cc3C2)C1	ZINC000195115072	283625243	/nfs/dbraw/zinc/62/52/43/283625243.db2.gz	QPHJJVDCHBTVBD-YPMHNXCESA-N	1	0	294.782	1.841	50	0		CDAARO
O=C(NC[C@@]1(O)CC[NH2+]C1)Nc1ccccc1Cl	ZINC000299800339	200880561	/nfs/dbraw/zinc/88/05/61/200880561.db2.gz	WYUMPJUHFYVRGK-GFCCVEGCSA-N	1	0	269.732	1.186	50	0		CDAARO
COCCN1CCCN(Cc2ccc(C)o2)CC1=O	ZINC000191706423	361266284	/nfs/dbraw/zinc/26/62/84/361266284.db2.gz	BHXDDNBKWNVJFS-UHFFFAOYSA-N	1	0	266.341	1.269	50	0		CDAARO
COc1ccccc1CN1CC[N@H+](C(C)C)[C@H](CCO)C1	ZINC000104296166	361586763	/nfs/dbraw/zinc/58/67/63/361586763.db2.gz	FEJLAKCEEGOXHH-MRXNPFEDSA-N	1	0	292.423	1.972	50	0		CDAARO
CSc1cccc(CN2CC[N@H+](C)[C@H](CCO)C2)c1	ZINC000104383867	361587233	/nfs/dbraw/zinc/58/72/33/361587233.db2.gz	OUOIVQCFBYONIT-CQSZACIVSA-N	1	0	280.437	1.907	50	0		CDAARO
C[NH+](C)CCN(Cc1ccco1)C(=O)[C@@H]1CCOC1	ZINC000088230476	364560862	/nfs/dbraw/zinc/56/08/62/364560862.db2.gz	DPEOLIKDLAIVIH-GFCCVEGCSA-N	1	0	266.341	1.206	50	0		CDAARO
c1csc(N2CC[NH+](CC[C@H]3CCCO3)CC2)n1	ZINC000188653876	365328901	/nfs/dbraw/zinc/32/89/01/365328901.db2.gz	BWMVDTLSHWKEBH-GFCCVEGCSA-N	1	0	267.398	1.834	50	0		CDAARO
COc1ccccc1C/C(C)=C\C(=O)N1CC[C@H]([NH3+])C1	ZINC000606442123	366880389	/nfs/dbraw/zinc/88/03/89/366880389.db2.gz	WBSXXBXSWBGVMB-HCYCVZQXSA-N	1	0	274.364	1.744	50	0		CDAARO
Cc1nccn1C[C@H](C)C[NH+]1CCC2(CC1)OCCO2	ZINC000089735537	366923172	/nfs/dbraw/zinc/92/31/72/366923172.db2.gz	CGIBOHIAVXHNFO-CYBMUJFWSA-N	1	0	279.384	1.667	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)CCC(F)(F)F)C1	ZINC000088834047	367328013	/nfs/dbraw/zinc/32/80/13/367328013.db2.gz	FKWBPMRPVHPMAB-SECBINFHSA-N	1	0	252.280	1.787	50	0		CDAARO
C[C@H]1C[N@H+](C)CC[C@H]1NS(=O)(=O)Cc1ccccc1	ZINC000252463451	367474001	/nfs/dbraw/zinc/47/40/01/367474001.db2.gz	SNMCPLULFXHMFL-GXTWGEPZSA-N	1	0	282.409	1.446	50	0		CDAARO
CC(=O)N(C)C1CC[NH+](C[C@@H](C)C(=O)OC(C)(C)C)CC1	ZINC000252482791	367567090	/nfs/dbraw/zinc/56/70/90/367567090.db2.gz	DNXMXTQBDDVLDI-GFCCVEGCSA-N	1	0	298.427	1.907	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCCN(C(=O)Nc2cccc(F)c2)C1	ZINC000630093247	367733105	/nfs/dbraw/zinc/73/31/05/367733105.db2.gz	JLGJURUORSEDJA-HNNXBMFYSA-N	1	0	295.358	1.746	50	0		CDAARO
CC[N@@H+]1CC[C@@H](CNCc2c(C)nn(C)c2C)C1	ZINC000037644232	369506126	/nfs/dbraw/zinc/50/61/26/369506126.db2.gz	PUCNFKACUQJDOF-ZDUSSCGKSA-N	1	0	250.390	1.468	50	0		CDAARO
C[C@@H]([NH3+])CC(=O)N1CCC(Oc2ccccc2)CC1	ZINC000037650906	369675880	/nfs/dbraw/zinc/67/58/80/369675880.db2.gz	OTYJGGDMBFVLIU-GFCCVEGCSA-N	1	0	262.353	1.794	50	0		CDAARO
Cc1nc(Oc2ccccc2)cc(N2CC[NH2+]CC2)n1	ZINC000026478781	370638647	/nfs/dbraw/zinc/63/86/47/370638647.db2.gz	UHJKDNARJCVJIM-UHFFFAOYSA-N	1	0	270.336	1.987	50	0		CDAARO
CCc1ocnc1C(=O)NCc1cncn1CCOC	ZINC000299777733	372755518	/nfs/dbraw/zinc/75/55/18/372755518.db2.gz	OCUKHHPOJISJHL-UHFFFAOYSA-N	1	0	278.312	1.010	50	0		CDAARO
Cc1nccn1CC1CC[NH+]([C@@H](C)C(=O)N(C)C)CC1	ZINC000299779820	372757015	/nfs/dbraw/zinc/75/70/15/372757015.db2.gz	RTCCQBRMWCDXII-LBPRGKRZSA-N	1	0	278.400	1.380	50	0		CDAARO
[NH3+]Cc1cccc(NC(=O)NCC2(Cn3cccn3)CC2)c1	ZINC000299785336	372758981	/nfs/dbraw/zinc/75/89/81/372758981.db2.gz	YFYYSGCDBDKWPT-UHFFFAOYSA-N	1	0	299.378	1.944	50	0		CDAARO
CN(C[C@H]1CC[N@H+](C)C1(C)C)C(=O)CCc1cn[nH]c1	ZINC000299797023	372769793	/nfs/dbraw/zinc/76/97/93/372769793.db2.gz	PEUMSQARNVWZCW-CYBMUJFWSA-N	1	0	278.400	1.531	50	0		CDAARO
O=C1CCC2(CC[NH+](CCn3cccn3)CC2)CCN1	ZINC000299796186	372769837	/nfs/dbraw/zinc/76/98/37/372769837.db2.gz	OFGFLGAKJBHNLQ-UHFFFAOYSA-N	1	0	276.384	1.265	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N(C)Cc1cc(C(C)C)on1	ZINC000299799217	372771152	/nfs/dbraw/zinc/77/11/52/372771152.db2.gz	RLANXRFQZSFTAV-NSHDSACASA-N	1	0	285.413	1.837	50	0		CDAARO
Cn1cnc(C(=O)N[C@@H]2CCC[N@@H+](C3CCCC3)C2)c1	ZINC000299800261	372771354	/nfs/dbraw/zinc/77/13/54/372771354.db2.gz	XLGIBIKTFXABFP-GFCCVEGCSA-N	1	0	276.384	1.557	50	0		CDAARO
COC[C@@H]1C[N@H+](Cc2ccncc2F)C[C@H]1C(=O)N(C)C	ZINC000253397958	373686454	/nfs/dbraw/zinc/68/64/54/373686454.db2.gz	BTYIXDSOIGCSOX-QWHCGFSZSA-N	1	0	295.358	1.003	50	0		CDAARO
Cc1cc([C@H]2CCCN2CC(=O)NC[C@H]2CCOC2)on1	ZINC000108182575	412814122	/nfs/dbraw/zinc/81/41/22/412814122.db2.gz	JGXRIWCDWYIRFD-CHWSQXEVSA-N	1	0	293.367	1.273	50	0		CDAARO
OC[C@H](O)C[N@H+](Cc1cccnc1)C1CCCCCC1	ZINC000055054667	373783959	/nfs/dbraw/zinc/78/39/59/373783959.db2.gz	BPQMTKUPRRBRAH-MRXNPFEDSA-N	1	0	278.396	1.960	50	0		CDAARO
Cc1ccc(C(=O)N2CCC[N@@H+](C(C)(C)C)CC2)c(=O)[nH]1	ZINC000065531266	374274090	/nfs/dbraw/zinc/27/40/90/374274090.db2.gz	JYHITOIGTRZHLE-UHFFFAOYSA-N	1	0	291.395	1.630	50	0		CDAARO
COc1cccc(CN(C)CC[NH+](C)C)c1OC	ZINC000019606716	374761240	/nfs/dbraw/zinc/76/12/40/374761240.db2.gz	IUVZCTFULWKEIB-UHFFFAOYSA-N	1	0	252.358	1.697	50	0		CDAARO
CCOc1ccccc1N1CC[NH+]([C@H](C)[C@@H](C)O)CC1	ZINC000095964816	375043579	/nfs/dbraw/zinc/04/35/79/375043579.db2.gz	VGSSTNKXKXDXKU-ZIAGYGMSSA-N	1	0	278.396	1.977	50	0		CDAARO
NC(=O)[C@H]1CCC[N@@H+]1C1CCN(c2ncccc2F)CC1	ZINC000095981618	375046808	/nfs/dbraw/zinc/04/68/08/375046808.db2.gz	NBEYJSXUOUSGNN-CYBMUJFWSA-N	1	0	292.358	1.139	50	0		CDAARO
CC(C)N(C[C@@H](C)O)C(=O)[C@@H](C)N1CCSCC1	ZINC000095979385	375047065	/nfs/dbraw/zinc/04/70/65/375047065.db2.gz	YEEGYMSVTMRODX-VXGBXAGGSA-N	1	0	274.430	1.042	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCN(C(=O)COc2cccc(F)c2)C1	ZINC000299740344	375201910	/nfs/dbraw/zinc/20/19/10/375201910.db2.gz	YQPZBWGYRSSJEO-NWDGAFQWSA-N	1	0	280.343	1.790	50	0		CDAARO
C[NH+](C)CCCNS(=O)(=O)c1ccc(Cl)s1	ZINC000002636462	375279835	/nfs/dbraw/zinc/27/98/35/375279835.db2.gz	OJHFGKDKULFUGX-UHFFFAOYSA-N	1	0	282.818	1.632	50	0		CDAARO
COc1ccc(C)cc1/C=C\C(=O)N1CCC[C@@H]([NH3+])C1	ZINC000493553884	375462692	/nfs/dbraw/zinc/46/26/92/375462692.db2.gz	PQYSSNYESPZRID-IQCBXXCUSA-N	1	0	274.364	1.967	50	0		CDAARO
C[N@@H+]1CC[C@](O)(c2ccco2)[C@H]([C@@H](O)c2ccco2)C1	ZINC000230093435	375511100	/nfs/dbraw/zinc/51/11/00/375511100.db2.gz	SVKRQFXAPDYWAG-NILFDRSVSA-N	1	0	277.320	1.746	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)/C=C\c2ccc(OC)c(F)c2)C1	ZINC000606441870	375823349	/nfs/dbraw/zinc/82/33/49/375823349.db2.gz	PQZMACIGUCGCAS-AGLBCWCQSA-N	1	0	292.354	1.915	50	0		CDAARO
c1cn(CC[NH2+]C2CCN(CCc3ccccc3)CC2)nn1	ZINC000123675093	375825552	/nfs/dbraw/zinc/82/55/52/375825552.db2.gz	DFSKCBXKHRAWLR-UHFFFAOYSA-N	1	0	299.422	1.575	50	0		CDAARO
C[C@@H]1CCC[NH2+][C@H]1CNC(=O)[C@H]1CSCCS1	ZINC000390834516	375874485	/nfs/dbraw/zinc/87/44/85/375874485.db2.gz	ABLJBANTDMZQNJ-OUAUKWLOSA-N	1	0	274.455	1.339	50	0		CDAARO
CC(C)COC[C@H](O)C[N@@H+]1CC[C@@]2(O)CCCC[C@H]2C1	ZINC000241338527	376018751	/nfs/dbraw/zinc/01/87/51/376018751.db2.gz	MBLHMTWGCQWAGG-XHSDSOJGSA-N	1	0	285.428	1.647	50	0		CDAARO
C[NH+]1CCC2(CC1)CN(c1ncnc3[nH]ccc31)CCO2	ZINC000645384339	377196190	/nfs/dbraw/zinc/19/61/90/377196190.db2.gz	AQJKCALAAXFSPH-UHFFFAOYSA-N	1	0	287.367	1.259	50	0		CDAARO
CCc1csc(C[NH2+][C@H](C)Cn2cncn2)n1	ZINC000067713997	377230960	/nfs/dbraw/zinc/23/09/60/377230960.db2.gz	KAWPQQXPMZSIGU-SECBINFHSA-N	1	0	251.359	1.475	50	0		CDAARO
Cc1nc(CC[NH3+])cc(NCc2[nH]nc3c2CCC3)n1	ZINC000067785136	377237966	/nfs/dbraw/zinc/23/79/66/377237966.db2.gz	NKPCIVXJEFQKJK-UHFFFAOYSA-N	1	0	272.356	1.110	50	0		CDAARO
O[C@@H](CN1CCOCC1)C[N@@H+]1CCC[C@H]1c1ccccc1	ZINC000245237335	377967250	/nfs/dbraw/zinc/96/72/50/377967250.db2.gz	JYIQSMZPACXSFW-IRXDYDNUSA-N	1	0	290.407	1.517	50	0		CDAARO
CNC(=O)c1cccc(CC[NH2+][C@@H]2CCOC[C@@H]2C)c1	ZINC000192593871	378207590	/nfs/dbraw/zinc/20/75/90/378207590.db2.gz	PVROWHDGBXUMMR-SWLSCSKDSA-N	1	0	276.380	1.603	50	0		CDAARO
Cn1c(C[C@@H](O)C[NH2+]C(C)(C)C)nc2ccccc21	ZINC000071771739	184575599	/nfs/dbraw/zinc/57/55/99/184575599.db2.gz	AAZHCJWCFHZEQI-LLVKDONJSA-N	1	0	261.369	1.865	50	0		CDAARO
COCC[C@@H]1CCCC[N@H+](CCN2CCO[C@H](C)C2)C1	ZINC000253397108	285143822	/nfs/dbraw/zinc/14/38/22/285143822.db2.gz	IHHVZVKZMZKQBQ-CVEARBPZSA-N	1	0	284.444	1.846	50	0		CDAARO
CCSCC[N@@H+]1CCCC[C@H]1CNS(C)(=O)=O	ZINC000096424145	256788986	/nfs/dbraw/zinc/78/89/86/256788986.db2.gz	DDEQDZSQBBGADL-NSHDSACASA-N	1	0	280.459	1.143	50	0		CDAARO
C[NH+](C)CCCNC(=O)[C@]1(C)CC(c2ccccc2)=NO1	ZINC000096192708	256792836	/nfs/dbraw/zinc/79/28/36/256792836.db2.gz	UXVIEGQMOZJQRN-INIZCTEOSA-N	1	0	289.379	1.638	50	0		CDAARO
Cn1cc(CCC(=O)N[C@H]2CCC[C@@H]([NH+](C)C)C2)cn1	ZINC000095408064	184969715	/nfs/dbraw/zinc/96/97/15/184969715.db2.gz	RKRZSQPCVFPRGG-UONOGXRCSA-N	1	0	278.400	1.342	50	0		CDAARO
COCC[N@@H+]1CC[C@H](NC(=O)NCc2ccccc2C)C1	ZINC000096413338	390510235	/nfs/dbraw/zinc/51/02/35/390510235.db2.gz	SDGSGDXLKCYARP-HNNXBMFYSA-N	1	0	291.395	1.515	50	0		CDAARO
C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)c1cn[nH]n1	ZINC000096419358	390513211	/nfs/dbraw/zinc/51/32/11/390513211.db2.gz	XLAJFVVFGVHGFN-CYBMUJFWSA-N	1	0	299.378	1.541	50	0		CDAARO
Cc1cccnc1[C@H]([NH2+]CCNS(C)(=O)=O)C(C)C	ZINC000096424375	390516116	/nfs/dbraw/zinc/51/61/16/390516116.db2.gz	KWRPDVSVLYAZKJ-GFCCVEGCSA-N	1	0	285.413	1.226	50	0		CDAARO
CCOc1cccc(OCC[N@@H+]2CC[C@H](C(=O)NC)C2)c1	ZINC000065532558	390552509	/nfs/dbraw/zinc/55/25/09/390552509.db2.gz	ZBSZKEGQNGBHTA-ZDUSSCGKSA-N	1	0	292.379	1.532	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(=O)[C@@]2(CC[NH2+]C2)C1	ZINC000096958696	390915559	/nfs/dbraw/zinc/91/55/59/390915559.db2.gz	OTVWZPBRDNHFQV-CYBMUJFWSA-N	1	0	254.330	1.176	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)CSC(F)(F)F)C1	ZINC000178973399	390926908	/nfs/dbraw/zinc/92/69/08/390926908.db2.gz	RZZNBFGBSBIALA-ZETCQYMHSA-N	1	0	256.293	1.307	50	0		CDAARO
COC(=O)[C@@H]1CC12CC[NH+](C[C@@](C)(O)C(F)(F)F)CC2	ZINC000241171037	391332902	/nfs/dbraw/zinc/33/29/02/391332902.db2.gz	KDULBBBZOYIWAJ-GXSJLCMTSA-N	1	0	295.301	1.575	50	0		CDAARO
Cc1c[nH]c(C(=O)N2CCC[N@@H+](C3CCCC3)CC2)n1	ZINC000244866540	391343705	/nfs/dbraw/zinc/34/37/05/391343705.db2.gz	VXYNQZXVPGIZDX-UHFFFAOYSA-N	1	0	276.384	1.809	50	0		CDAARO
Cc1csc(NC(=O)[C@H](C)[N@H+](C)C2CCOCC2)n1	ZINC000244678569	391343976	/nfs/dbraw/zinc/34/39/76/391343976.db2.gz	IFZIWLKZDBPIBK-JTQLQIEISA-N	1	0	283.397	1.889	50	0		CDAARO
O=C(NC[C@@H](O)c1ccccc1F)[C@@H]1CCCC[NH2+]1	ZINC000269099513	132111880	/nfs/dbraw/zinc/11/18/80/132111880.db2.gz	QLQQXJQCQMSLLA-QWHCGFSZSA-N	1	0	266.316	1.117	50	0		CDAARO
Cc1ccc(OC[C@@H](O)CN2CC[NH+](C)CC2)cc1C	ZINC000021487181	393169708	/nfs/dbraw/zinc/16/97/08/393169708.db2.gz	QMRUCCSMFYERRP-HNNXBMFYSA-N	1	0	278.396	1.291	50	0		CDAARO
COC(=O)CCC[N@@H+]1C[C@H](O)C[C@H]1c1cccc(F)c1	ZINC000281894680	393161614	/nfs/dbraw/zinc/16/16/14/393161614.db2.gz	QFRCSYHMLNCSRO-KGLIPLIRSA-N	1	0	281.327	1.887	50	0		CDAARO
CCC[C@]1(CO)CCCN(c2ccc(C[NH3+])cn2)C1	ZINC000091724432	135073139	/nfs/dbraw/zinc/07/31/39/135073139.db2.gz	BPMQKRDDWKAMDG-HNNXBMFYSA-N	1	0	263.385	1.919	50	0		CDAARO
Cc1ccc(C[NH2+][C@H](CN2CCOCC2)C(C)C)nc1	ZINC000095416711	292106378	/nfs/dbraw/zinc/10/63/78/292106378.db2.gz	XAOBWAYTTXRYSO-MRXNPFEDSA-N	1	0	277.412	1.836	50	0		CDAARO
CC1CCC(NC(=O)C[N@@H+]2C[C@@H](C(N)=O)CC[C@H]2C)CC1	ZINC000245833266	397665669	/nfs/dbraw/zinc/66/56/69/397665669.db2.gz	BHLLDWWRNAHJDI-DKNRTOFZSA-N	1	0	295.427	1.267	50	0		CDAARO
CSCC[C@H](C)NC(=O)N1CC[C@H]([NH+]2CC=CC2)C1	ZINC000101388690	397791812	/nfs/dbraw/zinc/79/18/12/397791812.db2.gz	MKBPMRSHANKTJG-STQMWFEESA-N	1	0	283.441	1.784	50	0		CDAARO
CCO[C@@H]1C[C@@H](O)C12CC[NH+](C[C@@H](O)CC)CC2	ZINC000195530806	286295704	/nfs/dbraw/zinc/29/57/04/286295704.db2.gz	OEOHHUKMKDUVPJ-YNEHKIRRSA-N	1	0	257.374	1.009	50	0		CDAARO
CN1C(=O)[C@@H]2[C@@H](C1=O)[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@H]21	ZINC000004722479	170005474	/nfs/dbraw/zinc/00/54/74/170005474.db2.gz	QZZNCEYZNMCPSB-XJFOESAGSA-N	1	0	288.322	1.576	50	0		CDAARO
O[C@H](COCc1ccc2c(c1)OCO2)C[NH+]1CCCCC1	ZINC000005029699	170058123	/nfs/dbraw/zinc/05/81/23/170058123.db2.gz	LRBZBYUWANWFAX-AWEZNQCLSA-N	1	0	293.363	1.779	50	0		CDAARO
CC[NH+](CC)CCn1ncc(Cl)c(Cl)c1=O	ZINC000005848252	170146942	/nfs/dbraw/zinc/14/69/42/170146942.db2.gz	FQLCBPGVJBJNJW-UHFFFAOYSA-N	1	0	264.156	1.892	50	0		CDAARO
CCCC[NH2+]Cc1cccc(OC)c1OCC(N)=O	ZINC000006747296	170239597	/nfs/dbraw/zinc/23/95/97/170239597.db2.gz	FKLCSYXEYPIOOW-UHFFFAOYSA-N	1	0	266.341	1.449	50	0		CDAARO
Cc1nc2c3c(C)c(C)n(CCC[NH+](C)C)c3ncn2n1	ZINC000006759119	170241438	/nfs/dbraw/zinc/24/14/38/170241438.db2.gz	OWZBJXAFGPSKLV-UHFFFAOYSA-N	1	0	286.383	1.956	50	0		CDAARO
CNC(=O)NC(=O)[C@@H](C)[NH2+][C@H](c1ccccc1)C(C)C	ZINC000008002960	170313286	/nfs/dbraw/zinc/31/32/86/170313286.db2.gz	MAZKPHBZWATHRH-YPMHNXCESA-N	1	0	277.368	1.817	50	0		CDAARO
COc1ccc(OCC[NH+]2CCC(C(N)=O)CC2)cc1	ZINC000008317270	170330677	/nfs/dbraw/zinc/33/06/77/170330677.db2.gz	MBHSLTGJAVIGRF-UHFFFAOYSA-N	1	0	278.352	1.271	50	0		CDAARO
O=C1NCCCC[C@H]1[NH2+][C@H]1CCc2ccccc2C1	ZINC000008556086	170340182	/nfs/dbraw/zinc/34/01/82/170340182.db2.gz	IIXXQBNVBPXGSJ-LSDHHAIUSA-N	1	0	258.365	1.802	50	0		CDAARO
Cc1ccc(C(C)C)c(OC[C@@H](O)C[NH2+]CCO)c1	ZINC000009970645	170392293	/nfs/dbraw/zinc/39/22/93/170392293.db2.gz	DBHXHWYFZNYLNE-ZDUSSCGKSA-N	1	0	267.369	1.440	50	0		CDAARO
Brc1cnc(O[C@H]2CCC[NH2+]C2)nc1	ZINC000016678708	170708696	/nfs/dbraw/zinc/70/86/96/170708696.db2.gz	HBAYDUMSWQKSEP-QMMMGPOBSA-N	1	0	258.119	1.370	50	0		CDAARO
Cc1nnc(NCC[C@@H](C)N2CC[NH+](C)CC2)s1	ZINC000534664747	411828701	/nfs/dbraw/zinc/82/87/01/411828701.db2.gz	DOQINULUMWAXQW-SNVBAGLBSA-N	1	0	269.418	1.284	50	0		CDAARO
CC(=O)c1ccc(OCCN2CC[NH+](C)CC2)cc1	ZINC000020326513	171151109	/nfs/dbraw/zinc/15/11/09/171151109.db2.gz	XKYMLPOBFUXLIT-UHFFFAOYSA-N	1	0	262.353	1.515	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2cc(C)cc(C)c2)CC1	ZINC000020608819	171267646	/nfs/dbraw/zinc/26/76/46/171267646.db2.gz	ZQVYNPUDZSXBKY-UHFFFAOYSA-N	1	0	275.396	1.879	50	0		CDAARO
COc1ccc(CN(C)CC[NH+](C)C)cc1OC	ZINC000022585260	171392776	/nfs/dbraw/zinc/39/27/76/171392776.db2.gz	QKRUQAAUPSYDTE-UHFFFAOYSA-N	1	0	252.358	1.697	50	0		CDAARO
O=C(C[NH2+]Cc1csc(Br)c1)NC1CC1	ZINC000035251529	172081495	/nfs/dbraw/zinc/08/14/95/172081495.db2.gz	XJDYFWZFKFBYDB-UHFFFAOYSA-N	1	0	289.198	1.879	50	0		CDAARO
[NH3+][C@@H](Cc1ccccc1)C(=O)NCc1ccncc1	ZINC000057332503	175592613	/nfs/dbraw/zinc/59/26/13/175592613.db2.gz	HDEOFZSPKFJXQI-AWEZNQCLSA-N	1	0	255.321	1.268	50	0		CDAARO
C[C@@H]1CCCN(C(=O)CC[NH2+]CC(C)(C)CO)C1	ZINC000065374411	175724018	/nfs/dbraw/zinc/72/40/18/175724018.db2.gz	GMOFLJHUCCBHJG-GFCCVEGCSA-N	1	0	256.390	1.243	50	0		CDAARO
COC[C@@H](C)Nc1nc(-c2cccnc2)nc2c1CC[NH2+]C2	ZINC000071682148	176245657	/nfs/dbraw/zinc/24/56/57/176245657.db2.gz	ZCKTYGRHFWEHPE-LLVKDONJSA-N	1	0	299.378	1.631	50	0		CDAARO
[NH3+]CC[C@@H]1CCCN(C(=O)c2c(O)cccc2O)C1	ZINC000071755507	176260870	/nfs/dbraw/zinc/26/08/70/176260870.db2.gz	RJFKEWAIEGWVHV-JTQLQIEISA-N	1	0	264.325	1.299	50	0		CDAARO
COc1cccc(CN2CCC[C@]3(CC[NH2+]C3)C2=O)c1	ZINC000072129071	176321356	/nfs/dbraw/zinc/32/13/56/176321356.db2.gz	VTPTWGWEHMYESO-MRXNPFEDSA-N	1	0	274.364	1.797	50	0		CDAARO
CN(CC[NH+](C)C)C(=O)c1cn(CC2CCCCC2)nn1	ZINC000072162727	176330589	/nfs/dbraw/zinc/33/05/89/176330589.db2.gz	RKFRGQIBDBNYSW-UHFFFAOYSA-N	1	0	293.415	1.492	50	0		CDAARO
O=c1ccc(-c2cccs2)nn1C[C@H]1CCC[NH2+]C1	ZINC000072343592	176372158	/nfs/dbraw/zinc/37/21/58/176372158.db2.gz	MGIRFKATVIWBQY-NSHDSACASA-N	1	0	275.377	1.971	50	0		CDAARO
CSCc1nc(CNC[C@]2(O)CCC[NH2+]C2)cs1	ZINC000072428448	176402354	/nfs/dbraw/zinc/40/23/54/176402354.db2.gz	KEJKDUUDNHQKLQ-LBPRGKRZSA-N	1	0	287.454	1.210	50	0		CDAARO
CSCCC(=O)N1CCC[C@@H](c2ncc[nH]2)C1	ZINC000077343667	177254463	/nfs/dbraw/zinc/25/44/63/177254463.db2.gz	HQFYFOOIPQMYEI-SNVBAGLBSA-N	1	0	253.371	1.869	50	0		CDAARO
Cc1csc(N2CCC([NH+]3CCC(O)CC3)CC2)n1	ZINC000077391255	177262843	/nfs/dbraw/zinc/26/28/43/177262843.db2.gz	FOFIPMIIDWTMLX-UHFFFAOYSA-N	1	0	281.425	1.877	50	0		CDAARO
COCC[N@H+](C)CCC(=O)N[C@H]1CC[C@@H]2CCC[C@@H]21	ZINC000077519303	177277838	/nfs/dbraw/zinc/27/78/38/177277838.db2.gz	DYNPZVWRMFBPFL-IHRRRGAJSA-N	1	0	268.401	1.650	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNS(=O)(=O)c1cc(N)ccc1C	ZINC000019991404	260115463	/nfs/dbraw/zinc/11/54/63/260115463.db2.gz	XBKLKOJPFCOWFW-CYBMUJFWSA-N	1	0	297.424	1.340	50	0		CDAARO
c1ccc(CN2CCO[C@@H](C[NH+]3CCCC3)C2)cc1	ZINC000071619122	260273369	/nfs/dbraw/zinc/27/33/69/260273369.db2.gz	ZMCFQWJMHRVTFS-INIZCTEOSA-N	1	0	260.381	1.983	50	0		CDAARO
C[NH+](C)C[C@H](O)c1ccccc1I	ZINC000000339088	273800478	/nfs/dbraw/zinc/80/04/78/273800478.db2.gz	VACUCMZTAGLMKC-JTQLQIEISA-N	1	0	291.132	1.886	50	0		CDAARO
C[C@@H]1CC[NH2+][C@@H](C(=O)N[C@H]2COc3ccccc32)C1	ZINC000253149980	274308692	/nfs/dbraw/zinc/30/86/92/274308692.db2.gz	DKYQLPWUCFUVGM-RTXFEEFZSA-N	1	0	260.337	1.624	50	0		CDAARO
CC1(C)C[C@H]([NH2+]CC2CCS(=O)(=O)CC2)C(C)(C)O1	ZINC000090882489	276148508	/nfs/dbraw/zinc/14/85/08/276148508.db2.gz	MYAUUEXDWSTWKG-LBPRGKRZSA-N	1	0	289.441	1.747	50	0		CDAARO
CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CCN2C(=O)NC(=O)[C@@H]2C1	ZINC000097164474	276181248	/nfs/dbraw/zinc/18/12/48/276181248.db2.gz	CMEJHLVQROTNKY-AVGNSLFASA-N	1	0	277.368	1.215	50	0		CDAARO
CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1[NH2+]Cc1ncc[nH]1	ZINC000089948776	276616959	/nfs/dbraw/zinc/61/69/59/276616959.db2.gz	JIXUYFVYDWFVOF-AAEUAGOBSA-N	1	0	276.384	1.536	50	0		CDAARO
CNC(=O)[C@H](CC(C)C)[NH2+][C@H]1CN(C(C)C)C[C@H]1C	ZINC000095421151	277011872	/nfs/dbraw/zinc/01/18/72/277011872.db2.gz	DZSZXGKBDDXOQF-RDBSUJKOSA-N	1	0	269.433	1.465	50	0		CDAARO
CC(C)CC[N@@H+]1CCN2C(=O)[C@@H](CC(C)C)NC(=O)[C@H]2C1	ZINC000014530300	277354442	/nfs/dbraw/zinc/35/44/42/277354442.db2.gz	FXFSYSCEXJFKIM-ZIAGYGMSSA-N	1	0	295.427	1.090	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1Nc1cc(C)nc2c(C)c(C)nn21	ZINC000072433046	277751418	/nfs/dbraw/zinc/75/14/18/277751418.db2.gz	AWKSLVQIUTXYIK-RYUDHWBXSA-N	1	0	275.356	1.053	50	0		CDAARO
C[C@H]([NH3+])C(=O)N1[C@H](C)CO[C@@H](c2ccccc2)[C@H]1C	ZINC000246467013	278223776	/nfs/dbraw/zinc/22/37/76/278223776.db2.gz	COFJXYQBTCAEFS-GFQSEFKGSA-N	1	0	262.353	1.711	50	0		CDAARO
CC(C)(C)CN1CCC[C@@](O)(C[NH+]2CCCCC2)C1=O	ZINC000012302526	278324552	/nfs/dbraw/zinc/32/45/52/278324552.db2.gz	JCRYOGPGGVULMQ-MRXNPFEDSA-N	1	0	282.428	1.872	50	0		CDAARO
Cn1cc(CN2CC[N@H+](C)C[C@H]2c2ccccc2)cn1	ZINC000248401868	280355152	/nfs/dbraw/zinc/35/51/52/280355152.db2.gz	MFFADHOVKMSGLC-INIZCTEOSA-N	1	0	270.380	1.909	50	0		CDAARO
CC1(C)C[C@@H]([NH2+]CC2(CS(C)(=O)=O)CC2)C(C)(C)O1	ZINC000090183073	281317266	/nfs/dbraw/zinc/31/72/66/281317266.db2.gz	MMUNAMYKZLFTPU-LLVKDONJSA-N	1	0	289.441	1.747	50	0		CDAARO
OC[C@H]1CCCN1c1cc(NCC[C@H]2CCCO2)ncn1	ZINC000257365195	289391373	/nfs/dbraw/zinc/39/13/73/289391373.db2.gz	HFIBCFSPSGJWCT-CHWSQXEVSA-N	1	0	292.383	1.419	50	0		CDAARO
[NH3+][C@@H]1CCC[C@@H](C(=O)N2CCC[C@H](Cn3cncn3)C2)C1	ZINC000299738834	295303452	/nfs/dbraw/zinc/30/34/52/295303452.db2.gz	HBKFEHZCYSWXLP-BFHYXJOUSA-N	1	0	291.399	1.034	50	0		CDAARO
C[C@H]1COC[C@H](C)N1C(=O)c1ccc2c(c1)CC[NH2+]CC2	ZINC000276719680	300362298	/nfs/dbraw/zinc/36/22/98/300362298.db2.gz	PRINLSXHUWTNAV-STQMWFEESA-N	1	0	288.391	1.624	50	0		CDAARO
O=C1NCCN1CC[NH+]1CCC(C(F)(F)F)CC1	ZINC000071788970	304674106	/nfs/dbraw/zinc/67/41/06/304674106.db2.gz	NQBIMHIJXJNAFK-UHFFFAOYSA-N	1	0	265.279	1.286	50	0		CDAARO
C[C@H](CCC(=O)NCc1cscn1)[NH+]1CCN(C)CC1	ZINC000534581095	328311641	/nfs/dbraw/zinc/31/16/41/328311641.db2.gz	HBDAYBKWYYYLFS-GFCCVEGCSA-N	1	0	296.440	1.175	50	0		CDAARO
C[NH+](C)C1(CNC(=O)CCCN2CCCC2=O)CCCC1	ZINC000534582468	328312336	/nfs/dbraw/zinc/31/23/36/328312336.db2.gz	PZICXDUMBOYPPR-UHFFFAOYSA-N	1	0	295.427	1.380	50	0		CDAARO
Cc1cc(C)n(CCCC(=O)NC[C@@H](C(C)C)[NH+](C)C)n1	ZINC000534630508	328331030	/nfs/dbraw/zinc/33/10/30/328331030.db2.gz	PQRHKMRRTVXQKK-HNNXBMFYSA-N	1	0	294.443	1.983	50	0		CDAARO
C[NH+](C)C(C)(C)CNC(=O)N1Cc2ccccc2[C@@H](O)C1	ZINC000534640202	328336134	/nfs/dbraw/zinc/33/61/34/328336134.db2.gz	RSRCYYRAOBRFTI-AWEZNQCLSA-N	1	0	291.395	1.585	50	0		CDAARO
O=C(NC[C@]1(O)CCC[NH2+]C1)C1CCCCCC1	ZINC000534649944	328336374	/nfs/dbraw/zinc/33/63/74/328336374.db2.gz	SFUNURBKXRGYGY-AWEZNQCLSA-N	1	0	254.374	1.188	50	0		CDAARO
O=C(NCCc1nccc(-c2ccccc2)n1)[C@@H]1C=CC[NH2+]1	ZINC000534667752	328346227	/nfs/dbraw/zinc/34/62/27/328346227.db2.gz	IDZHJSXQTJIJHZ-HNNXBMFYSA-N	1	0	294.358	1.330	50	0		CDAARO
Cc1ccccc1[C@@H](CNC(=O)Cn1cccn1)[NH+](C)C	ZINC000534663984	328351418	/nfs/dbraw/zinc/35/14/18/328351418.db2.gz	KYRLURUGLCAMKH-OAHLLOKOSA-N	1	0	286.379	1.611	50	0		CDAARO
O=C(NCc1ccc2nonc2c1)[C@@H]1CCC[NH2+]CC1	ZINC000534663964	328351571	/nfs/dbraw/zinc/35/15/71/328351571.db2.gz	ZNPKMDWGTSMXSE-LLVKDONJSA-N	1	0	274.324	1.229	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCO[C@@H](c2ccc(F)c(C)c2)C1	ZINC000097234119	323207541	/nfs/dbraw/zinc/20/75/41/323207541.db2.gz	IWAIFQVRZCAJFF-ZIAGYGMSSA-N	1	0	280.343	1.771	50	0		CDAARO
O=C(c1c[nH]nc1C1CCCCC1)N1CC[C@H]2C[NH2+]C[C@H]21	ZINC000077422326	327132234	/nfs/dbraw/zinc/13/22/34/327132234.db2.gz	PSNMEYXYOQFZOP-GXTWGEPZSA-N	1	0	288.395	1.891	50	0		CDAARO
CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)NC[C@@H]1CCCCO1	ZINC000096436226	329526194	/nfs/dbraw/zinc/52/61/94/329526194.db2.gz	CEJJGMRBYNDVFF-GJZGRUSLSA-N	1	0	298.427	1.465	50	0		CDAARO
OC[C@@]12C[N@H+](CCOc3ccc(F)cc3)C[C@@H]1COCC2	ZINC001772704749	1159438817	/nfs/dbraw/zinc/43/88/17/1159438817.db2.gz	DWBMUMDZHVNWQZ-CZUORRHYSA-N	1	0	295.354	1.535	50	0		CDAARO
CN1C[C@@]2(CC[N@H+](CC3=CCCCC3)C2)OCC1=O	ZINC000670428822	482959632	/nfs/dbraw/zinc/95/96/32/482959632.db2.gz	AYGLBVKZUOIAHR-OAHLLOKOSA-N	1	0	264.369	1.420	50	0		CDAARO
C[N@@H+](Cc1ccc(OCC(N)=O)cc1)C[C@H]1CCOC1	ZINC000670437503	482980067	/nfs/dbraw/zinc/98/00/67/482980067.db2.gz	ORRDTFWGELZUCI-CYBMUJFWSA-N	1	0	278.352	1.019	50	0		CDAARO
CCCc1cnc(N2CCC[C@](CO)(C[NH+](C)C)C2)nc1	ZINC000670442965	482990381	/nfs/dbraw/zinc/99/03/81/482990381.db2.gz	DNYNZCSOCQJRMX-INIZCTEOSA-N	1	0	292.427	1.570	50	0		CDAARO
COC[C@H](C)NC(=O)C1CC[NH+](Cc2cc(C)n[nH]2)CC1	ZINC000670460447	483043956	/nfs/dbraw/zinc/04/39/56/483043956.db2.gz	RLLKHADSRCAWNR-LBPRGKRZSA-N	1	0	294.399	1.081	50	0		CDAARO
CCCc1cnc(C)nc1NCCC[NH+]1CCC(O)CC1	ZINC000670460778	483046247	/nfs/dbraw/zinc/04/62/47/483046247.db2.gz	VJEJOQOXURHTEL-UHFFFAOYSA-N	1	0	292.427	1.996	50	0		CDAARO
Cc1c[nH+]ccc1N1CCN(Cc2cnc(C)nc2)CC1	ZINC000670469367	483063361	/nfs/dbraw/zinc/06/33/61/483063361.db2.gz	KTXXYUILYVPBAK-UHFFFAOYSA-N	1	0	283.379	1.811	50	0		CDAARO
CCNc1ncc(C[N@H+](C)C[C@H]2CCOC2)cn1	ZINC000670469185	483063393	/nfs/dbraw/zinc/06/33/93/483063393.db2.gz	SMYLGBPJERVIJO-LLVKDONJSA-N	1	0	250.346	1.377	50	0		CDAARO
C[C@@H](CN1CCN(C)CC1)[N@@H+]1CCC2(CCCC2)C1	ZINC000670471042	483073506	/nfs/dbraw/zinc/07/35/06/483073506.db2.gz	HDHQZPCYPJBNBZ-HNNXBMFYSA-N	1	0	265.445	1.888	50	0		CDAARO
O=c1c2c(Cl)cccc2ncn1C[C@@]1(O)CCC[NH2+]C1	ZINC000670471433	483074612	/nfs/dbraw/zinc/07/46/12/483074612.db2.gz	LUTUTCGEPLHZOP-CQSZACIVSA-N	1	0	293.754	1.164	50	0		CDAARO
O=C(C[C@H]1CCOC1)NC1CC[NH+](C2CCOCC2)CC1	ZINC000670472382	483081222	/nfs/dbraw/zinc/08/12/22/483081222.db2.gz	FQBAHXZBEAMUGK-CYBMUJFWSA-N	1	0	296.411	1.173	50	0		CDAARO
Cc1ccsc1[C@@H](C)[NH2+]C[C@@H]1CN2CCN1CC2	ZINC000090648929	483281941	/nfs/dbraw/zinc/28/19/41/483281941.db2.gz	PUANHGYPGMECAR-CHWSQXEVSA-N	1	0	265.426	1.707	50	0		CDAARO
Cc1cc(N2CCC(c3ncc[nH]3)CC2)nc(N)[nH+]1	ZINC000077486970	483506033	/nfs/dbraw/zinc/50/60/33/483506033.db2.gz	XBRGOISXZJROFP-UHFFFAOYSA-N	1	0	258.329	1.474	50	0		CDAARO
CCO[C@@H]1C[C@](CO)([NH2+]Cc2ncc[nH]2)C1(C)C	ZINC000186583603	535534073	/nfs/dbraw/zinc/53/40/73/535534073.db2.gz	XJKFTNOEEXPJMY-ZWNOBZJWSA-N	1	0	253.346	1.065	50	0		CDAARO
CN(CCOc1ccccc1F)C(=O)[C@@H]1CCC[C@@H]1[NH3+]	ZINC000085367421	522921097	/nfs/dbraw/zinc/92/10/97/522921097.db2.gz	QHSQBPARLJLTJJ-YPMHNXCESA-N	1	0	280.343	1.790	50	0		CDAARO
CC1CC[NH+](C[C@H](O)CNC(=O)OC(C)(C)C)CC1	ZINC000096483492	528252743	/nfs/dbraw/zinc/25/27/43/528252743.db2.gz	JNDRGQDLZDTDQZ-GFCCVEGCSA-N	1	0	272.389	1.604	50	0		CDAARO
CC(C)c1ncncc1C(=O)N1CCC[C@H]([C@@H](C)[NH3+])C1	ZINC000269297198	534921704	/nfs/dbraw/zinc/92/17/04/534921704.db2.gz	WHURRLBBLNNPOI-NEPJUHHUSA-N	1	0	276.384	1.799	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCN(S(C)(=O)=O)C2)C[C@@H]1C	ZINC000097146748	567904811	/nfs/dbraw/zinc/90/48/11/567904811.db2.gz	QKFKGEZVYFDTDN-RFGFWPKPSA-N	1	0	288.457	1.682	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@@](O)([C@@H]([NH3+])C2CCC2)C1	ZINC000958528663	613975143	/nfs/dbraw/zinc/97/51/43/613975143.db2.gz	YMVHQUHSTJPBGY-WFASDCNBSA-N	1	0	284.400	1.876	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@](O)([C@H]([NH3+])C(C)(C)C)C1	ZINC000958528548	613980886	/nfs/dbraw/zinc/98/08/86/613980886.db2.gz	QFGDSVRKXYGAKX-QMTHXVAHSA-N	1	0	272.389	1.732	50	0		CDAARO
COCC(C)(C)C(=O)N1CC[C@@]2(CCC[N@@H+]2C)C1	ZINC000952994948	616706775	/nfs/dbraw/zinc/70/67/75/616706775.db2.gz	XKUIHSQXAFQECP-AWEZNQCLSA-N	1	0	254.374	1.356	50	0		CDAARO
CC1([NH3+])CN(C(=O)/C=C/c2cnn(-c3ccccc3)c2)C1	ZINC000888096776	617759282	/nfs/dbraw/zinc/75/92/82/617759282.db2.gz	QHILHPFKSLENGE-BQYQJAHWSA-N	1	0	282.347	1.445	50	0		CDAARO
OC[C@@H](O)C1CC[NH+](C2Cc3ccccc3C2)CC1	ZINC001772701066	1159437040	/nfs/dbraw/zinc/43/70/40/1159437040.db2.gz	BIMFHRFUCBOOJG-MRXNPFEDSA-N	1	0	261.365	1.219	50	0		CDAARO
[NH3+]CCc1nc2ccccc2c(N2CCC[C@@H]2CO)n1	ZINC000065371082	1161970088	/nfs/dbraw/zinc/97/00/88/1161970088.db2.gz	QCQWLCVDCYSYNJ-LLVKDONJSA-N	1	0	272.352	1.092	50	0		CDAARO
C[NH+](C)CCN(Cc1c[nH]cn1)C(=O)C1(C)CCCC1	ZINC001704313237	1177686569	/nfs/dbraw/zinc/68/65/69/1177686569.db2.gz	HJTLNWUUCVVZHH-UHFFFAOYSA-N	1	0	278.400	1.880	50	0		CDAARO
Cc1noc(C)c1CN(C)C(=O)[C@@H](C)[NH+]1CCCC1	ZINC001704349994	1177697915	/nfs/dbraw/zinc/69/79/15/1177697915.db2.gz	JMBWDRUKQQHLRU-LLVKDONJSA-N	1	0	265.357	1.734	50	0		CDAARO
O=C(NCC1CCOCC1)[C@@H]1[NH2+]CC12CCCC2	ZINC000852800987	790370883	/nfs/dbraw/zinc/37/08/83/790370883.db2.gz	VMVYFYAQJAKWNH-LBPRGKRZSA-N	1	0	252.358	1.061	50	0		CDAARO
Cc1n[nH]c(C)c1CNC(=O)[C@H](C)n1ccnc1C	ZINC000426442071	791202500	/nfs/dbraw/zinc/20/25/00/791202500.db2.gz	WSPUJTXRTJTWRI-JTQLQIEISA-N	1	0	261.329	1.409	50	0		CDAARO
CC(C)n1cncc1CSc1nnc(CC[NH3+])n1C	ZINC000720990868	792426474	/nfs/dbraw/zinc/42/64/74/792426474.db2.gz	YYYKGVMDLPMQQN-UHFFFAOYSA-N	1	0	280.401	1.386	50	0		CDAARO
Cc1nccn1Cc1ccccc1NC(=O)[C@H]1C=CC[NH2+]1	ZINC000952969099	793130384	/nfs/dbraw/zinc/13/03/84/793130384.db2.gz	PQUBDNRLALOWLS-OAHLLOKOSA-N	1	0	282.347	1.706	50	0		CDAARO
CCOC(=O)N1CCC([NH+]2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000023282400	793560515	/nfs/dbraw/zinc/56/05/15/793560515.db2.gz	HLABMGJVARLIJR-RYUDHWBXSA-N	1	0	270.373	1.717	50	0		CDAARO
C[NH+](C)[C@H]1C[C@H](Nc2ccc3nccnc3n2)C12CCC2	ZINC000857760847	795806344	/nfs/dbraw/zinc/80/63/44/795806344.db2.gz	RDDXGZJSTNKEGO-STQMWFEESA-N	1	0	283.379	1.683	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CCN(C)S(=O)(=O)N1CCCC1	ZINC000952962190	795889075	/nfs/dbraw/zinc/88/90/75/795889075.db2.gz	BSEFEVZYKCEHEI-ZDUSSCGKSA-N	1	0	289.445	1.133	50	0		CDAARO
C[NH+](C)[C@H]1C[C@@H](Nc2ccc3nccnc3n2)C12CCC2	ZINC000857760845	796044541	/nfs/dbraw/zinc/04/45/41/796044541.db2.gz	RDDXGZJSTNKEGO-OLZOCXBDSA-N	1	0	283.379	1.683	50	0		CDAARO
C[C@@H](NC(=O)C[NH+]1CCC(C(N)=O)CC1)C1=CCCCC1	ZINC000091695839	796058899	/nfs/dbraw/zinc/05/88/99/796058899.db2.gz	MRJGEUYATVKJMN-GFCCVEGCSA-N	1	0	293.411	1.189	50	0		CDAARO
CC(C)[N@@H+]1CCN(C(=O)Nc2nncs2)C[C@@H]1C	ZINC000055342439	796224376	/nfs/dbraw/zinc/22/43/76/796224376.db2.gz	YZHNKHFNXQFZKP-VIFPVBQESA-N	1	0	269.374	1.485	50	0		CDAARO
NC(=O)[C@@H]([NH2+]C1CSCCSC1)c1ccccc1	ZINC001506405773	908927991	/nfs/dbraw/zinc/92/79/91/908927991.db2.gz	WVHVTDYGZRLZNX-LBPRGKRZSA-N	1	0	282.434	1.651	50	0		CDAARO
CCCO[C@@H]1CCC[N@H+](Cc2c(CO)cnc(C)c2O)C1	ZINC000952860332	910413178	/nfs/dbraw/zinc/41/31/78/910413178.db2.gz	MKVZBHMHZBFOLA-CQSZACIVSA-N	1	0	294.395	1.979	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1ccc(OCCO)cc1	ZINC000952884887	910458634	/nfs/dbraw/zinc/45/86/34/910458634.db2.gz	OTDLDEAFNLYKHH-QWHCGFSZSA-N	1	0	292.379	1.222	50	0		CDAARO
CCNS(=O)(=O)[C@H]1CC[N@H+](Cc2cccc(C)c2C)C1	ZINC000181558578	916371066	/nfs/dbraw/zinc/37/10/66/916371066.db2.gz	IVBHUTRSSQDJOB-HNNXBMFYSA-N	1	0	296.436	1.817	50	0		CDAARO
CCN(CC[NH+](CC)CC)C(=O)c1cnc(C)nc1	ZINC000823060607	925665025	/nfs/dbraw/zinc/66/50/25/925665025.db2.gz	DSGBBFUKLGCVCK-UHFFFAOYSA-N	1	0	264.373	1.589	50	0		CDAARO
C[NH+]1CCC(O)(c2nc(-c3c[nH]c4ccccc34)n[nH]2)CC1	ZINC000823761069	925724707	/nfs/dbraw/zinc/72/47/07/925724707.db2.gz	DMGNYIMONWNHIN-UHFFFAOYSA-N	1	0	297.362	1.866	50	0		CDAARO
COCCn1ccnc1C[NH+]1CCC2(COC(=O)O2)CC1	ZINC000824466644	925823349	/nfs/dbraw/zinc/82/33/49/925823349.db2.gz	ZURBGCOOHJTXRJ-UHFFFAOYSA-N	1	0	295.339	1.031	50	0		CDAARO
COc1nccnc1NC[C@H]1Cc2ccccc2C[N@@H+]1C	ZINC000824853280	925840720	/nfs/dbraw/zinc/84/07/20/925840720.db2.gz	PFDMXNVNIZWLRJ-CQSZACIVSA-N	1	0	284.363	1.954	50	0		CDAARO
O=C(N1CCCCC1)N1CCC([NH2+][C@H]2CCCOC2)CC1	ZINC000827937588	926004577	/nfs/dbraw/zinc/00/45/77/926004577.db2.gz	JYCWTENYFDGJID-HNNXBMFYSA-N	1	0	295.427	1.825	50	0		CDAARO
O=C1CC[C@@H]([NH+]2CCC(Cn3ccnc3)CC2)CCN1	ZINC000828305666	926098130	/nfs/dbraw/zinc/09/81/30/926098130.db2.gz	RXRDGARDZUUREH-CQSZACIVSA-N	1	0	276.384	1.264	50	0		CDAARO
O=C1OC[C@@H]2C[N@@H+](C3Cc4ccccc4C3)CCN12	ZINC000828322834	926110987	/nfs/dbraw/zinc/11/09/87/926110987.db2.gz	KHWXTUIIFPDQRZ-AWEZNQCLSA-N	1	0	258.321	1.290	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)N(CCO)Cc1ccccc1	ZINC000828754078	926184397	/nfs/dbraw/zinc/18/43/97/926184397.db2.gz	YKBYFFUPHKNLQU-UHFFFAOYSA-N	1	0	290.407	1.884	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)Cc1ncc(Cl)s1	ZINC000585139483	931033238	/nfs/dbraw/zinc/03/32/38/931033238.db2.gz	AFFGZJUKSCWQMF-DTWKUNHWSA-N	1	0	287.816	1.890	50	0		CDAARO
CC(C)=CCC[N@@H+](C)C[C@@H]1CCCN(CCO)C1	ZINC001529173102	969001208	/nfs/dbraw/zinc/00/12/08/969001208.db2.gz	MIPHUECICBOAQU-HNNXBMFYSA-N	1	0	254.418	1.979	50	0		CDAARO
Cc1nncn1CC[N@H+](CC1CC1)C[C@H]1CCCO1	ZINC001506397342	975148203	/nfs/dbraw/zinc/14/82/03/975148203.db2.gz	RVWBFXJCRLRONE-CQSZACIVSA-N	1	0	264.373	1.478	50	0		CDAARO
Cc1nc(C[NH2+][C@H]2CCN(c3ccccc3)C2)cc(=O)[nH]1	ZINC001506399677	975149019	/nfs/dbraw/zinc/14/90/19/975149019.db2.gz	PQSYVROOIMHFHK-ZDUSSCGKSA-N	1	0	284.363	1.859	50	0		CDAARO
CCc1nn(C)c(NC(=O)[C@@H]2CCC[N@H+](C)C2)c1CC	ZINC001506400270	975149465	/nfs/dbraw/zinc/14/94/65/975149465.db2.gz	CKMQJYALXPPLBX-LLVKDONJSA-N	1	0	278.400	1.825	50	0		CDAARO
Cc1cccnc1N1CC[C@@H](N2CC[NH+](C)CC2)C1	ZINC001506403520	975150422	/nfs/dbraw/zinc/15/04/22/975150422.db2.gz	SPRKLPUNSKDBEO-CQSZACIVSA-N	1	0	260.385	1.216	50	0		CDAARO
Cc1nc(N)nc(N2CCC[C@H]([NH+](C)C)C2)c1Cl	ZINC001506411151	975153932	/nfs/dbraw/zinc/15/39/32/975153932.db2.gz	WZXWXAXQEZLION-VIFPVBQESA-N	1	0	269.780	1.551	50	0		CDAARO
CC(C)[C@H](CNc1cc(C(N)=O)ccn1)[NH+]1CCCC1	ZINC001506426342	975160464	/nfs/dbraw/zinc/16/04/64/975160464.db2.gz	GPOMYGRWIDRIDP-ZDUSSCGKSA-N	1	0	276.384	1.713	50	0		CDAARO
CC(C)Cc1cc(C(=O)N2CC[C@H](C[NH3+])C2)n(C)n1	ZINC000082091337	177919761	/nfs/dbraw/zinc/91/97/61/177919761.db2.gz	RXVPLMFOYBQTFB-LLVKDONJSA-N	1	0	264.373	1.039	50	0		CDAARO
Cc1nccn1CCC[N@@H+]1CCC[C@@H](C2OCCO2)C1	ZINC000096485955	230381411	/nfs/dbraw/zinc/38/14/11/230381411.db2.gz	ITJWYANNOVRAHR-CQSZACIVSA-N	1	0	279.384	1.667	50	0		CDAARO
CCN(CC[NH+](C)C)C(=O)Nc1ccc2n[nH]nc2c1	ZINC000095504343	185000368	/nfs/dbraw/zinc/00/03/68/185000368.db2.gz	UKPWQUBDZXXNSF-UHFFFAOYSA-N	1	0	276.344	1.373	50	0		CDAARO
CCO[C@H](CC)CNC(=O)c1cccc(C[NH3+])c1	ZINC000584903030	341986567	/nfs/dbraw/zinc/98/65/67/341986567.db2.gz	MMMTWASJDKVNJH-CYBMUJFWSA-N	1	0	250.342	1.690	50	0		CDAARO
Cc1ccc2[nH]c(Cn3cnc4nccnc4c3=O)nc2c1	ZINC000584903837	341994030	/nfs/dbraw/zinc/99/40/30/341994030.db2.gz	JNNNWKYFLLBCKS-UHFFFAOYSA-N	1	0	292.302	1.420	50	0		CDAARO
CCNC(=O)NC(=O)[C@@H](C)[N@H+](C)[C@H](C)Cc1ccsc1	ZINC000107531115	398152499	/nfs/dbraw/zinc/15/24/99/398152499.db2.gz	PVLMFJZZDGRMOY-GHMZBOCLSA-N	1	0	297.424	1.845	50	0		CDAARO
O=C(NC[C@@H]1C[N@@H+]2CCC[C@@H]2CO1)N1C[C@H]2CCC[C@@H]2C1	ZINC000084137091	539086097	/nfs/dbraw/zinc/08/60/97/539086097.db2.gz	PBLKBKWJSOBAIQ-KBUPBQIOSA-N	1	0	293.411	1.291	50	0		CDAARO
COc1cccc(/C(C)=C/C(=O)N2CC[NH2+]C[C@H]2C)c1	ZINC000124598320	187144854	/nfs/dbraw/zinc/14/48/54/187144854.db2.gz	BUNCVYBLLOPZKN-CNELAYHGSA-N	1	0	274.364	1.919	50	0		CDAARO
O=C(N[C@H]1CC[NH2+]C1)c1cccc(-c2noc(C3CC3)n2)c1	ZINC000126923185	342004406	/nfs/dbraw/zinc/00/44/06/342004406.db2.gz	BUVBHDWWZHLWCT-ZDUSSCGKSA-N	1	0	298.346	1.706	50	0		CDAARO
C[C@@H](CC(=O)N1CCCCCC1)[NH2+][C@@H]1CCCCNC1=O	ZINC000095967268	185046626	/nfs/dbraw/zinc/04/66/26/185046626.db2.gz	GXAJYDHZPVDVKV-UONOGXRCSA-N	1	0	295.427	1.426	50	0		CDAARO
CCOC(=O)N1CCC[N@H+](CCCn2ccnc2C)CC1	ZINC000095977646	185052000	/nfs/dbraw/zinc/05/20/00/185052000.db2.gz	MRAFAFFZVYYSSF-UHFFFAOYSA-N	1	0	294.399	1.746	50	0		CDAARO
CCCC[C@H](NC1CC[NH+](CCOC)CC1)C(=O)OC	ZINC000095977470	185052375	/nfs/dbraw/zinc/05/23/75/185052375.db2.gz	WAQHSLYBXNLZSK-AWEZNQCLSA-N	1	0	286.416	1.419	50	0		CDAARO
CN(CCC[NH+](C)C)C(=O)NCc1ccc2c(c1)OCO2	ZINC000095986858	185056768	/nfs/dbraw/zinc/05/67/68/185056768.db2.gz	PZOOHSVHQLSKAR-UHFFFAOYSA-N	1	0	293.367	1.508	50	0		CDAARO
Cn1cc([C@@H]2CC[N@@H+]([C@H]3Cc4ccccc4[C@@H]3O)C2)cn1	ZINC000242242308	361754418	/nfs/dbraw/zinc/75/44/18/361754418.db2.gz	XTSVZHDLTIFBIO-COXVUDFISA-N	1	0	283.375	1.868	50	0		CDAARO
CCN(CC)CC[N@@H+]1CCCC[C@@H]1[C@@H]1CNC(=O)C1	ZINC000195555788	342626415	/nfs/dbraw/zinc/62/64/15/342626415.db2.gz	QMOSCNVCYPKZRJ-UONOGXRCSA-N	1	0	267.417	1.319	50	0		CDAARO
CC(C)(C)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[NH2+]CCO1	ZINC000195543491	342626690	/nfs/dbraw/zinc/62/66/90/342626690.db2.gz	BZEKFIQWLNOSJM-LSDHHAIUSA-N	1	0	290.407	1.748	50	0		CDAARO
CC[N@@H+]1C[C@H](NC(=O)c2ccc(C)nc2C)[C@@H](OC)C1	ZINC000243893358	361829069	/nfs/dbraw/zinc/82/90/69/361829069.db2.gz	AQFNGSOPEGMABR-KBPBESRZSA-N	1	0	277.368	1.147	50	0		CDAARO
CCCn1ncnc1[C@@H](C)NC(=O)C[N@H+](C)C1CCCC1	ZINC000244594105	361853899	/nfs/dbraw/zinc/85/38/99/361853899.db2.gz	DGLBRKZNLGWROE-GFCCVEGCSA-N	1	0	293.415	1.740	50	0		CDAARO
CSCc1noc(CN2CCC[C@@H]([NH+](C)C)CC2)n1	ZINC000244659661	361855104	/nfs/dbraw/zinc/85/51/04/361855104.db2.gz	HGQHZABKEVLMCG-LLVKDONJSA-N	1	0	284.429	1.849	50	0		CDAARO
Cc1cnn(CCCN2CC[NH+](C(C)C)CC2)c1	ZINC000244707825	361856488	/nfs/dbraw/zinc/85/64/88/361856488.db2.gz	KIHWXGPXNMZTJR-UHFFFAOYSA-N	1	0	250.390	1.608	50	0		CDAARO
c1coc(-c2nc([C@H]3C[N@@H+]4CCC[C@H]4CO3)no2)c1	ZINC000252537421	361859713	/nfs/dbraw/zinc/85/97/13/361859713.db2.gz	LDJMKGFQWLSYNA-GXSJLCMTSA-N	1	0	261.281	1.865	50	0		CDAARO
CCn1c(Cn2cnc3c2CCC3)nnc1[C@H]1C[C@@H]([NH3+])C1	ZINC000244734995	361859839	/nfs/dbraw/zinc/85/98/39/361859839.db2.gz	NRDFKGJIIRHJBY-PHIMTYICSA-N	1	0	286.383	1.236	50	0		CDAARO
Cc1ccccc1[C@]1(O)CC[N@H+](CCc2cn[nH]c2)C1	ZINC000244787846	361863521	/nfs/dbraw/zinc/86/35/21/361863521.db2.gz	QESALAZKQZERLX-INIZCTEOSA-N	1	0	271.364	1.854	50	0		CDAARO
Cc1nc(NCc2ccccn2)cc([C@H]2C[C@@H]([NH3+])C2)n1	ZINC000244874666	361867377	/nfs/dbraw/zinc/86/73/77/361867377.db2.gz	XFINHKCQFDBCQR-TXEJJXNPSA-N	1	0	269.352	1.997	50	0		CDAARO
C[NH+](C)[C@@H]1CCN(Cc2cc(-c3ccncc3)no2)C1	ZINC000244723805	361858536	/nfs/dbraw/zinc/85/85/36/361858536.db2.gz	MHQYJNHTUISLNT-CYBMUJFWSA-N	1	0	272.352	1.873	50	0		CDAARO
O=C1NCCN1C1CC[NH+](CCc2ccncc2)CC1	ZINC000065624518	361929122	/nfs/dbraw/zinc/92/91/22/361929122.db2.gz	HPOUPHZDTJRBQZ-UHFFFAOYSA-N	1	0	274.368	1.114	50	0		CDAARO
CC(C)Oc1cccc([C@@H](C)[NH2+][C@@H](C)C(N)=O)c1	ZINC000097033091	185155939	/nfs/dbraw/zinc/15/59/39/185155939.db2.gz	RCTDPMPWLMYCBW-MNOVXSKESA-N	1	0	250.342	1.998	50	0		CDAARO
C[N@H+]1C[C@H]2CC[C@@H](C1)N2c1cnc2ccccc2n1	ZINC000585135101	342215900	/nfs/dbraw/zinc/21/59/00/342215900.db2.gz	XPVKCRMJXFMNBG-TXEJJXNPSA-N	1	0	254.337	1.913	50	0		CDAARO
CC[C@H](O)C[NH+]1CCC(N(C)CC(F)F)CC1	ZINC000096473679	529697007	/nfs/dbraw/zinc/69/70/07/529697007.db2.gz	OKBOGWADLJBTMB-NSHDSACASA-N	1	0	250.333	1.419	50	0		CDAARO
Cn1ccc(NC(=O)C[N@H+](C)CCC[C@H]2CCCO2)n1	ZINC000252494895	362388336	/nfs/dbraw/zinc/38/83/36/362388336.db2.gz	OHOIZBDHGWEJCS-LBPRGKRZSA-N	1	0	280.372	1.250	50	0		CDAARO
CCn1c(CN(C)CCSC)nnc1[C@H]1C[C@@H]([NH3+])C1	ZINC000253378475	362425525	/nfs/dbraw/zinc/42/55/25/362425525.db2.gz	GJQKLOOMOWVREN-PHIMTYICSA-N	1	0	283.445	1.298	50	0		CDAARO
C[NH+](C)C[C@H]1CCN(C(=O)NCC[C@H]2CCCO2)C1	ZINC000129430525	345576620	/nfs/dbraw/zinc/57/66/20/345576620.db2.gz	DFOWEIOKSNEEQC-CHWSQXEVSA-N	1	0	269.389	1.149	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)COc2ccccc2)CC1	ZINC000085467948	179073368	/nfs/dbraw/zinc/07/33/68/179073368.db2.gz	BFNQIZNYNANNRA-UHFFFAOYSA-N	1	0	292.379	1.292	50	0		CDAARO
Cc1cnc(CN2CCC[C@H]2C[N@@H+]2CCC[C@@H]2CO)o1	ZINC000085855727	179189456	/nfs/dbraw/zinc/18/94/56/179189456.db2.gz	AKFSWRSOWGLADH-UONOGXRCSA-N	1	0	279.384	1.404	50	0		CDAARO
CCNc1cc(NCCNC(=O)CC)nc(C)[nH+]1	ZINC000036708068	362836052	/nfs/dbraw/zinc/83/60/52/362836052.db2.gz	GGMGUWLSGKDYNJ-UHFFFAOYSA-N	1	0	251.334	1.155	50	0		CDAARO
COC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H](C)C1=O	ZINC000100748674	348749880	/nfs/dbraw/zinc/74/98/80/348749880.db2.gz	IVBZCMSOGWPACW-WCQYABFASA-N	1	0	261.321	1.497	50	0		CDAARO
CC[C@H](NC(=O)CN1CCC[N@H+](C)CC1)c1nccs1	ZINC000230577476	348756532	/nfs/dbraw/zinc/75/65/32/348756532.db2.gz	YOAGDEWBHSZMDW-LBPRGKRZSA-N	1	0	296.440	1.348	50	0		CDAARO
c1ccc(Cc2noc(CC[NH2+][C@@H]3CCOC3)n2)cc1	ZINC000584894515	349354207	/nfs/dbraw/zinc/35/42/07/349354207.db2.gz	ZGEBCBIUWSIGGX-CYBMUJFWSA-N	1	0	273.336	1.581	50	0		CDAARO
CCc1noc(CCNC(=O)C[NH+]2CCCCCCC2)n1	ZINC000584895178	349355735	/nfs/dbraw/zinc/35/57/35/349355735.db2.gz	CKJGONUIJHVLNZ-UHFFFAOYSA-N	1	0	294.399	1.557	50	0		CDAARO
CC(C)c1csc(CN2CCN3CC[N@H+](C)C[C@@H]3C2)n1	ZINC000065366123	362946033	/nfs/dbraw/zinc/94/60/33/362946033.db2.gz	LLYOKIDUYCIFMN-CYBMUJFWSA-N	1	0	294.468	1.698	50	0		CDAARO
O=C(C[C@H]1C[NH2+]CCO1)NCc1ccc(Cl)s1	ZINC000091312554	180132869	/nfs/dbraw/zinc/13/28/69/180132869.db2.gz	SQMNFLXMZFZLTQ-QMMMGPOBSA-N	1	0	274.773	1.396	50	0		CDAARO
CN(CCOc1ccccc1F)C(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000091544111	180185153	/nfs/dbraw/zinc/18/51/53/180185153.db2.gz	MNRKJWFPKXXKOL-NWDGAFQWSA-N	1	0	280.343	1.790	50	0		CDAARO
CC(C)[C@H]1CN(S(=O)(=O)c2cccnc2)C[C@@H]1[NH+](C)C	ZINC000091625201	180209665	/nfs/dbraw/zinc/20/96/65/180209665.db2.gz	FBXCGGLGZDBELM-KGLIPLIRSA-N	1	0	297.424	1.288	50	0		CDAARO
CCCCS(=O)(=O)N1C[C@H]([NH3+])[C@@H](c2ccc(C)o2)C1	ZINC000091736767	180244094	/nfs/dbraw/zinc/24/40/94/180244094.db2.gz	NBNLHWXCDFERRC-RYUDHWBXSA-N	1	0	286.397	1.444	50	0		CDAARO
C[C@@H]1CN(C(=O)CC[NH+]2CCCC2)CC[C@@]1(O)C1CCC1	ZINC000092107311	180326852	/nfs/dbraw/zinc/32/68/52/180326852.db2.gz	OCILHDJTOXEUAY-PBHICJAKSA-N	1	0	294.439	1.872	50	0		CDAARO
COc1ccccc1OC[C@H](O)CN1CCC[N@H+](C)CC1	ZINC000106590776	186128393	/nfs/dbraw/zinc/12/83/93/186128393.db2.gz	VALINRZNAGOHRX-CQSZACIVSA-N	1	0	294.395	1.072	50	0		CDAARO
Cc1ccc(C[C@H](C[NH3+])CO)cc1Br	ZINC000107496825	186176752	/nfs/dbraw/zinc/17/67/52/186176752.db2.gz	FYWBDJKLELUPOO-SNVBAGLBSA-N	1	0	258.159	1.867	50	0		CDAARO
CS[C@@H]1CCC[C@@H]1[N@H+](C)CCC(=O)N1CCOCC1	ZINC000110642560	186308615	/nfs/dbraw/zinc/30/86/15/186308615.db2.gz	OOCBMNKWPYPHHR-QWHCGFSZSA-N	1	0	286.441	1.451	50	0		CDAARO
C[N@@H+]1C[C@@H](NCc2nncn2-c2ccccc2)CC1(C)C	ZINC000583651145	366009250	/nfs/dbraw/zinc/00/92/50/366009250.db2.gz	ICJZBDPLJGJVDX-ZDUSSCGKSA-N	1	0	285.395	1.840	50	0		CDAARO
CC[C@@H]1CCCC[C@@H]1C[NH+]1CCC2(CC1)NC(=O)NC2=O	ZINC000583650794	366007082	/nfs/dbraw/zinc/00/70/82/366007082.db2.gz	BIAFTEHYGYSCCT-CHWSQXEVSA-N	1	0	293.411	1.877	50	0		CDAARO
C[NH+](C)[C@H]1CCN(C(=O)c2cc(Br)no2)C1	ZINC000583652066	366019371	/nfs/dbraw/zinc/01/93/71/366019371.db2.gz	ZEIADSCQKZGJJO-ZETCQYMHSA-N	1	0	288.145	1.213	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@H]1NC(=O)c1ccc(F)c(F)c1F	ZINC000094184055	363241033	/nfs/dbraw/zinc/24/10/33/363241033.db2.gz	HSIKYTHLJKUCGT-OIBJUYFYSA-N	1	0	272.270	1.974	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]CCc1ccc2c(c1)OCCO2	ZINC000036901482	363289146	/nfs/dbraw/zinc/28/91/46/363289146.db2.gz	PQDNERQTKUOAOD-UHFFFAOYSA-N	1	0	273.336	1.822	50	0		CDAARO
C[C@H](CCC(=O)NCCc1cnn(C)c1)[NH+]1CCCC1	ZINC000426373625	358492496	/nfs/dbraw/zinc/49/24/96/358492496.db2.gz	NWYKNTXYVGKGMF-CYBMUJFWSA-N	1	0	278.400	1.343	50	0		CDAARO
Nc1cc(N)[nH+]c(SCC(=O)c2ccc(F)cc2)n1	ZINC000000617783	355920214	/nfs/dbraw/zinc/92/02/14/355920214.db2.gz	UHWYZYFFJSRCJM-UHFFFAOYSA-N	1	0	278.312	1.755	50	0		CDAARO
C[NH+](C)CCNC(=O)C(O)(c1ccccc1)c1ccccc1	ZINC000002228646	355964656	/nfs/dbraw/zinc/96/46/56/355964656.db2.gz	KCAHVQJFKHLCFY-UHFFFAOYSA-N	1	0	298.386	1.600	50	0		CDAARO
COc1cccc([C@]2(O)CC[S@](=O)C[C@@H]2C[NH+](C)C)c1	ZINC000004466995	356031864	/nfs/dbraw/zinc/03/18/64/356031864.db2.gz	SMRSCUYCLLYTCF-XBHMSOGKSA-N	1	0	297.420	1.213	50	0		CDAARO
COc1ccc(C(=O)O[C@H]2C[NH+]3CCC2CC3)cc1OC	ZINC000004664804	356039780	/nfs/dbraw/zinc/03/97/80/356039780.db2.gz	JFAJOGLBGXCMLX-HNNXBMFYSA-N	1	0	291.347	1.955	50	0		CDAARO
O=C(NCC[NH+]1CCCCC1)Nc1nc2ccccn2n1	ZINC000097376571	356101022	/nfs/dbraw/zinc/10/10/22/356101022.db2.gz	VCSHEBXJXCKPEI-UHFFFAOYSA-N	1	0	288.355	1.337	50	0		CDAARO
CCOC[C@@H]([NH2+]CC(=O)Nc1cc(C)on1)C(C)C	ZINC000286308218	356249189	/nfs/dbraw/zinc/24/91/89/356249189.db2.gz	VXLIUBRTXCRZNX-LLVKDONJSA-N	1	0	269.345	1.572	50	0		CDAARO
Cc1cccc(N2CCN(C(=O)[C@@H]3CCC[NH2+]3)CC2)c1C	ZINC000011754490	356278898	/nfs/dbraw/zinc/27/88/98/356278898.db2.gz	WFZKABCJVXEXBL-HNNXBMFYSA-N	1	0	287.407	1.704	50	0		CDAARO
COc1cc(OC)cc([C@@H]2[NH2+]CCc3nc[nH]c32)c1	ZINC000012243710	356291749	/nfs/dbraw/zinc/29/17/49/356291749.db2.gz	GKPQGYHEHZJQHQ-ZDUSSCGKSA-N	1	0	259.309	1.662	50	0	biogenic	CDAARO
CC[N@H+](C)C[C@]1(O)CCCN(Cc2cccc(C)c2)C1=O	ZINC000012574501	356309657	/nfs/dbraw/zinc/30/96/57/356309657.db2.gz	YQYQYTZWGDNVQU-QGZVFWFLSA-N	1	0	290.407	1.800	50	0		CDAARO
Cc1ccccc1O[C@@H](C)C(=O)NC1CC[NH+](C)CC1	ZINC000016603068	356442990	/nfs/dbraw/zinc/44/29/90/356442990.db2.gz	FBYVVYLPMJTPFG-ZDUSSCGKSA-N	1	0	276.380	1.973	50	0		CDAARO
[NH3+]Cc1ccc(N2CCN(c3ccccn3)CC2)nc1	ZINC000019276381	356478732	/nfs/dbraw/zinc/47/87/32/356478732.db2.gz	YPTGVBTULAQOKA-UHFFFAOYSA-N	1	0	269.352	1.262	50	0		CDAARO
c1n[nH]cc1CCC[NH+]1CCN(Cc2ccccn2)CC1	ZINC000019838611	356508869	/nfs/dbraw/zinc/50/88/69/356508869.db2.gz	XWNDSACVJXINMI-UHFFFAOYSA-N	1	0	285.395	1.555	50	0		CDAARO
Cc1ccccc1O[C@@H](C)C(=O)NCCC[NH+](C)C	ZINC000018217634	366275802	/nfs/dbraw/zinc/27/58/02/366275802.db2.gz	QUIZOTMEFXDADP-ZDUSSCGKSA-N	1	0	264.369	1.830	50	0		CDAARO
Fc1cc(Br)ccc1CN1CC[NH2+]CC1	ZINC000022913520	356623966	/nfs/dbraw/zinc/62/39/66/356623966.db2.gz	NRCBEINBLSTDHM-UHFFFAOYSA-N	1	0	273.149	1.993	50	0		CDAARO
CNC(=O)C1CC[NH+](Cc2c(C)noc2C)CC1	ZINC000025755019	356681743	/nfs/dbraw/zinc/68/17/43/356681743.db2.gz	YJPROXKTIWIXFP-UHFFFAOYSA-N	1	0	251.330	1.249	50	0		CDAARO
O=C([C@@H]1CC12CC[NH2+]CC2)N(CCO)C1CCCCC1	ZINC000070254055	356742538	/nfs/dbraw/zinc/74/25/38/356742538.db2.gz	QAAUOPYAPGHVKA-AWEZNQCLSA-N	1	0	280.412	1.530	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)C1	ZINC000269172513	356819409	/nfs/dbraw/zinc/81/94/09/356819409.db2.gz	JUTKEDZZCQGLRF-NILFDRSVSA-N	1	0	276.355	1.997	50	0		CDAARO
C[NH+]1CCC(CNC(=O)C[C@H]2CCCOC2)CC1	ZINC000193059306	356819975	/nfs/dbraw/zinc/81/99/75/356819975.db2.gz	CYSHVVHTUCAVAD-CYBMUJFWSA-N	1	0	254.374	1.261	50	0		CDAARO
CC[C@@H](Cc1ccc(C)cc1)[N@H+](C)CC(=O)NC(N)=O	ZINC000096441565	357473119	/nfs/dbraw/zinc/47/31/19/357473119.db2.gz	NIQWSNGPUHBRLV-ZDUSSCGKSA-N	1	0	277.368	1.443	50	0		CDAARO
CCn1nc(C)c(C[NH2+][C@H](C)Cn2cncn2)c1C	ZINC000065394548	357536001	/nfs/dbraw/zinc/53/60/01/357536001.db2.gz	JFKULWLHRMOCSP-SNVBAGLBSA-N	1	0	262.361	1.290	50	0		CDAARO
CCCc1cnc(N2CC[NH+](C3CCOCC3)CC2)nc1	ZINC000065398784	357537408	/nfs/dbraw/zinc/53/74/08/357537408.db2.gz	KHNLKUHKAIMIBK-UHFFFAOYSA-N	1	0	290.411	1.730	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(NCC[C@@H](C)CO)c1C	ZINC000065399398	357537541	/nfs/dbraw/zinc/53/75/41/357537541.db2.gz	PHWODLPEDQAIPY-SECBINFHSA-N	1	0	252.362	1.590	50	0		CDAARO
Cc1cc(C[C@@H](C)[NH2+]CCC(=O)Nc2cccnc2)[nH]n1	ZINC000065424493	357540577	/nfs/dbraw/zinc/54/05/77/357540577.db2.gz	JKRSYVQNPPZJTF-LLVKDONJSA-N	1	0	287.367	1.663	50	0		CDAARO
[NH3+]Cc1n[nH]c(=O)n1-c1ccc(Cl)c(C(F)(F)F)c1	ZINC000065428463	357541452	/nfs/dbraw/zinc/54/14/52/357541452.db2.gz	NPZAFMIHPCSAGO-UHFFFAOYSA-N	1	0	292.648	1.692	50	0		CDAARO
C[C@H](CO)[NH2+]CCC(=O)Nc1ccc(N(C)C)cc1	ZINC000065525839	357547229	/nfs/dbraw/zinc/54/72/29/357547229.db2.gz	RCRBMTIEGXHXIN-LLVKDONJSA-N	1	0	265.357	1.052	50	0		CDAARO
CCOC(=O)c1nn(Cc2ccncc2)c2c1C[NH2+]CC2	ZINC000067804763	357628953	/nfs/dbraw/zinc/62/89/53/357628953.db2.gz	ULNRDTLZKJSQML-UHFFFAOYSA-N	1	0	286.335	1.149	50	0		CDAARO
CSc1n[nH]c(-c2cc(F)cc3c2O[C@@H](C[NH3+])C3)n1	ZINC000067588727	357612775	/nfs/dbraw/zinc/61/27/75/357612775.db2.gz	QJTRWRHEMZIKLO-MRVPVSSYSA-N	1	0	280.328	1.595	50	0		CDAARO
C[NH+]1CCC(Cc2noc(COc3cccnc3)n2)CC1	ZINC000067562257	357613403	/nfs/dbraw/zinc/61/34/03/357613403.db2.gz	UAQYJWBPBFZWBF-UHFFFAOYSA-N	1	0	288.351	1.928	50	0		CDAARO
COc1cc(OC)cc(C(=O)NCC2CC[NH+](C)CC2)c1	ZINC000023013390	357646457	/nfs/dbraw/zinc/64/64/57/357646457.db2.gz	UGNAOOGHBBLBHX-UHFFFAOYSA-N	1	0	292.379	1.775	50	0		CDAARO
CCNC(=O)NC(=O)C[N@H+](CCC(C)C)C1CC1	ZINC000069420240	357672353	/nfs/dbraw/zinc/67/23/53/357672353.db2.gz	LPOQYAVMKNFTIO-UHFFFAOYSA-N	1	0	255.362	1.343	50	0		CDAARO
CNc1ccnc(-c2cccc3c2O[C@@H](C[NH3+])C3)n1	ZINC000067881758	357634883	/nfs/dbraw/zinc/63/48/83/357634883.db2.gz	XVMMUBCUITUTKT-SNVBAGLBSA-N	1	0	256.309	1.448	50	0		CDAARO
CCN(CC)C(=O)[C@@H]1C[C@H]([NH3+])CN1C(=O)CC1CCCC1	ZINC000067919764	357637420	/nfs/dbraw/zinc/63/74/20/357637420.db2.gz	KTWJWFXATSXLBG-KBPBESRZSA-N	1	0	295.427	1.363	50	0		CDAARO
COc1ccc(-c2n[nH]cc2C[NH2+][C@@H](C)CO)cc1	ZINC000067946236	357638930	/nfs/dbraw/zinc/63/89/30/357638930.db2.gz	IGFYNJGWZRIFOL-JTQLQIEISA-N	1	0	261.325	1.556	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H]1[C@H]2CCCO[C@H]2C1(C)C	ZINC000248482069	283281180	/nfs/dbraw/zinc/28/11/80/283281180.db2.gz	INYCXPNRCBDPPO-IJLUTSLNSA-N	1	0	268.401	1.552	50	0		CDAARO
CNc1cc(C)[nH+]c(N2CCO[C@@H](C(F)(F)F)C2)n1	ZINC000071715065	357772827	/nfs/dbraw/zinc/77/28/27/357772827.db2.gz	QIJKHFDJCZPYOQ-MRVPVSSYSA-N	1	0	276.262	1.594	50	0		CDAARO
C[C@@H](CCc1cccc(F)c1)[N@@H+]1CC[C@H](C(N)=O)C1	ZINC000097084219	357943972	/nfs/dbraw/zinc/94/39/72/357943972.db2.gz	QHXUXTKZJPFEHB-AAEUAGOBSA-N	1	0	264.344	1.954	50	0		CDAARO
Cc1cccc(N2CCC([N@@H+]3CCC[C@@H]3C(N)=O)CC2)n1	ZINC000097096585	357953994	/nfs/dbraw/zinc/95/39/94/357953994.db2.gz	RSMPATXQWGSWGC-CQSZACIVSA-N	1	0	288.395	1.309	50	0		CDAARO
Cc1cc(F)cc(S(=O)(=O)N[C@@H](C[NH3+])C2CC2)c1	ZINC000097229418	358043087	/nfs/dbraw/zinc/04/30/87/358043087.db2.gz	MWDAZELLFNVJGR-LBPRGKRZSA-N	1	0	272.345	1.150	50	0		CDAARO
O=C(NC[C@@H]1C[C@H](F)C[NH2+]1)c1ccc2ncsc2c1	ZINC000082120453	358148018	/nfs/dbraw/zinc/14/80/18/358148018.db2.gz	FAEZKSVZMZWSEG-UWVGGRQHSA-N	1	0	279.340	1.726	50	0		CDAARO
CN1CCc2ccc(NC(=O)N3CCC[N@H+](C)CC3)cc21	ZINC000097052368	358136688	/nfs/dbraw/zinc/13/66/88/358136688.db2.gz	PNARQMMDUDUESU-UHFFFAOYSA-N	1	0	288.395	1.848	50	0		CDAARO
C[C@H]1CN([C@H]2CCN(CC(F)(F)F)C2=O)CCS1	ZINC000247401176	358193082	/nfs/dbraw/zinc/19/30/82/358193082.db2.gz	BGRXJMQXZJVTPJ-IUCAKERBSA-N	1	0	282.331	1.587	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N[C@H]1CCC[NH2+][C@@H]1C	ZINC000193451000	358295571	/nfs/dbraw/zinc/29/55/71/358295571.db2.gz	AXVRYIMJJRHDGW-YPMHNXCESA-N	1	0	282.409	1.668	50	0		CDAARO
COC(=O)C[N@H+](C1CCOCC1)[C@H]1C=CCCC1	ZINC000089400885	358406764	/nfs/dbraw/zinc/40/67/64/358406764.db2.gz	HQAYNJOEBKKTNE-LBPRGKRZSA-N	1	0	253.342	1.749	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)C1	ZINC000195117035	358551484	/nfs/dbraw/zinc/55/14/84/358551484.db2.gz	BSVFJLWAJKHTJY-LBPRGKRZSA-N	1	0	288.326	1.779	50	0		CDAARO
CC(C)C(=O)NC[C@H](c1ccc2c(c1)OCO2)[NH+](C)C	ZINC000012196006	358552666	/nfs/dbraw/zinc/55/26/66/358552666.db2.gz	XZCDMHLZXOXNSN-GFCCVEGCSA-N	1	0	278.352	1.790	50	0	biogenic	CDAARO
Cc1cc(S(=O)(=O)N(C)CCC[NH3+])sc1C	ZINC000195555288	358557576	/nfs/dbraw/zinc/55/75/76/358557576.db2.gz	ZZIIHHXWEYLYRO-UHFFFAOYSA-N	1	0	262.400	1.334	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)c1sc(C)nc1C	ZINC000195544638	358559727	/nfs/dbraw/zinc/55/97/27/358559727.db2.gz	PVWWLZIWVUMOAY-UHFFFAOYSA-N	1	0	291.442	1.556	50	0		CDAARO
CN(C)[C@@H](C(=O)NCC[NH+]1CCCC1)c1cccc(F)c1	ZINC000095354260	358683934	/nfs/dbraw/zinc/68/39/34/358683934.db2.gz	WJCQBAQRZFLVBX-OAHLLOKOSA-N	1	0	293.386	1.640	50	0		CDAARO
Cc1ccc(N2CCC([C@@H](C)[NH+]3CCOCC3)CC2)nn1	ZINC000095354329	358684011	/nfs/dbraw/zinc/68/40/11/358684011.db2.gz	BBELKPBFZQCZPC-CQSZACIVSA-N	1	0	290.411	1.722	50	0		CDAARO
CCN(C)c1ccnc(N2C[C@H]([NH3+])[C@@H](C3CC3)C2)n1	ZINC000095358085	358684872	/nfs/dbraw/zinc/68/48/72/358684872.db2.gz	ZJDPKKZRVLZHRO-NEPJUHHUSA-N	1	0	261.373	1.106	50	0		CDAARO
CN(C)[C@H](C(=O)NCCC[NH+](C)C)c1cccc(F)c1	ZINC000095367302	358686408	/nfs/dbraw/zinc/68/64/08/358686408.db2.gz	WCUZDENHYIRYNR-AWEZNQCLSA-N	1	0	281.375	1.496	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)NCc1ccc(O)cc1	ZINC000095364600	358686791	/nfs/dbraw/zinc/68/67/91/358686791.db2.gz	DOJFTKBAJJZERH-AWEZNQCLSA-N	1	0	262.353	1.883	50	0		CDAARO
CC(C)C[N@@H+]1CCn2nc(CNc3ncccn3)cc2C1	ZINC000095373742	358688471	/nfs/dbraw/zinc/68/84/71/358688471.db2.gz	STVGRBYBKZJZEK-UHFFFAOYSA-N	1	0	286.383	1.757	50	0		CDAARO
CCc1cnc(N2CCC([NH+]3CCC(O)CC3)CC2)nc1	ZINC000095387380	358691218	/nfs/dbraw/zinc/69/12/18/358691218.db2.gz	HDDMQQQAVFDMDZ-UHFFFAOYSA-N	1	0	290.411	1.465	50	0		CDAARO
OCC[NH+]1CCN(Cc2cccc(Br)c2)CC1	ZINC000095402574	358693029	/nfs/dbraw/zinc/69/30/29/358693029.db2.gz	BAMYAEXJRNQESW-UHFFFAOYSA-N	1	0	299.212	1.559	50	0		CDAARO
COCC[NH+]1CCC(c2nc([C@H]3CCOC3)no2)CC1	ZINC000096180240	358713294	/nfs/dbraw/zinc/71/32/94/358713294.db2.gz	HOUPGLRPCQUFJC-LBPRGKRZSA-N	1	0	281.356	1.399	50	0		CDAARO
O[C@H](c1ccccn1)C1CCN(Cc2ncc[nH]2)CC1	ZINC000097568911	358785196	/nfs/dbraw/zinc/78/51/96/358785196.db2.gz	YSKSYCQTMXPYLF-HNNXBMFYSA-N	1	0	272.352	1.750	50	0		CDAARO
O=C(NCCc1c[nH]cn1)[C@@H]1CCc2ccccc21	ZINC000215966217	358912819	/nfs/dbraw/zinc/91/28/19/358912819.db2.gz	FJQCSZOUINBKQE-CQSZACIVSA-N	1	0	255.321	1.798	50	0		CDAARO
Cc1nn(CCO)c(C)c1C[N@H+](C)CCn1ccnc1C	ZINC000215287058	358882240	/nfs/dbraw/zinc/88/22/40/358882240.db2.gz	CHTZBXBBGVLYSA-UHFFFAOYSA-N	1	0	291.399	1.129	50	0		CDAARO
Cn1cncc1C[N@H+](C)C[C@H]1CC(=O)N(C(C)(C)C)C1	ZINC000215527226	358893460	/nfs/dbraw/zinc/89/34/60/358893460.db2.gz	ZORNBSFAJPKDHT-GFCCVEGCSA-N	1	0	278.400	1.499	50	0		CDAARO
Cc1c[nH]c(CN(C)C(=O)c2c(C)nn(C)c2C)n1	ZINC000216321642	358937141	/nfs/dbraw/zinc/93/71/41/358937141.db2.gz	FKJVMRMEGAGTBL-UHFFFAOYSA-N	1	0	261.329	1.341	50	0		CDAARO
COCC[NH+]1CCN(Cc2cc(C(C)(C)C)n[nH]2)CC1	ZINC000216437642	358944677	/nfs/dbraw/zinc/94/46/77/358944677.db2.gz	SCUJNHCWRUNQEH-UHFFFAOYSA-N	1	0	280.416	1.471	50	0		CDAARO
Cc1nc(CN2CCC(O)(C[NH+]3CCCC3)CC2)c[nH]1	ZINC000216460686	358946691	/nfs/dbraw/zinc/94/66/91/358946691.db2.gz	UMWGTODJRDCMOP-UHFFFAOYSA-N	1	0	278.400	1.141	50	0		CDAARO
Cc1nc(C)n(C[C@@H]2CCCN([C@H]3C[C@@H](C)OC3=O)C2)n1	ZINC000247860089	359154699	/nfs/dbraw/zinc/15/46/99/359154699.db2.gz	ZRTWGARUKFOGAE-HONMWMINSA-N	1	0	292.383	1.311	50	0		CDAARO
CCc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)NC(N)=O)cc1	ZINC000024990401	359332741	/nfs/dbraw/zinc/33/27/41/359332741.db2.gz	FQPAYLZJLFVBNR-UWVGGRQHSA-N	1	0	263.341	1.483	50	0		CDAARO
COCCCN(C)c1cc(C2CC([NH3+])C2)ncn1	ZINC000223377665	359420462	/nfs/dbraw/zinc/42/04/62/359420462.db2.gz	OTGPLWATAUBFHF-UHFFFAOYSA-N	1	0	250.346	1.154	50	0		CDAARO
C[C@H]1CCCN(C(=O)COc2cccc(F)c2)[C@H]1C[NH3+]	ZINC000408519272	359911905	/nfs/dbraw/zinc/91/19/05/359911905.db2.gz	YUGBOCYKIZGLCF-FZMZJTMJSA-N	1	0	280.343	1.790	50	0		CDAARO
[NH3+]C1(C(=O)NCc2nc3cc(F)ccc3[nH]2)CCCC1	ZINC000262680103	360135958	/nfs/dbraw/zinc/13/59/58/360135958.db2.gz	WTAJJIIPHYWUEM-UHFFFAOYSA-N	1	0	276.315	1.590	50	0		CDAARO
Cc1ccccc1C[C@@H](C)[NH2+]CCN1CCCS1(=O)=O	ZINC000089520023	360137548	/nfs/dbraw/zinc/13/75/48/360137548.db2.gz	YOIKQUPSUMWZSN-CQSZACIVSA-N	1	0	296.436	1.551	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@@H]1CCN(C(=O)c2cn(C)nc2C)C1	ZINC000409421106	360230703	/nfs/dbraw/zinc/23/07/03/360230703.db2.gz	IMIQUHIKCNKZBZ-CYBMUJFWSA-N	1	0	287.367	1.629	50	0		CDAARO
C[NH2+]Cc1nnc(SCC[C@@H]2CC2(F)F)n1C	ZINC000426518869	360679955	/nfs/dbraw/zinc/67/99/55/360679955.db2.gz	YJGMLQBZPWPTFJ-SSDOTTSWSA-N	1	0	262.329	1.672	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)CCCOc2ccc(F)cc2F)C1	ZINC000178519052	189122983	/nfs/dbraw/zinc/12/29/83/189122983.db2.gz	MWGBRBJTCBJKMS-LLVKDONJSA-N	1	0	298.333	1.931	50	0		CDAARO
Cn1c(SCCn2cccn2)nnc1C1CC[NH2+]CC1	ZINC000426728299	360699689	/nfs/dbraw/zinc/69/96/89/360699689.db2.gz	PXVSHVOCVLAACE-UHFFFAOYSA-N	1	0	292.412	1.271	50	0		CDAARO
COc1ccccc1OCCC(=O)N1CC[C@H](C[NH3+])C1	ZINC000178534864	189124747	/nfs/dbraw/zinc/12/47/47/189124747.db2.gz	XYNQOHBXGLSGEX-GFCCVEGCSA-N	1	0	278.352	1.271	50	0		CDAARO
CCOc1cccc(C(=O)N2CC[C@H](C[NH2+]C)C2)c1	ZINC000179006419	189160956	/nfs/dbraw/zinc/16/09/56/189160956.db2.gz	IEQLMXIBXQHKSY-GFCCVEGCSA-N	1	0	262.353	1.767	50	0		CDAARO
C[C@@H]([NH3+])CCNS(=O)(=O)c1cccc2cccnc21	ZINC000178909627	189154022	/nfs/dbraw/zinc/15/40/22/189154022.db2.gz	FMCZLSHIYAOHPZ-SNVBAGLBSA-N	1	0	279.365	1.250	50	0		CDAARO
CCO[C@H](C)CN(C)C(=O)c1cc(C)ccc1OCC[NH3+]	ZINC000426628868	360852221	/nfs/dbraw/zinc/85/22/21/360852221.db2.gz	VNIJVGAWLLNWSM-CYBMUJFWSA-N	1	0	294.395	1.830	50	0		CDAARO
CN(C(=O)c1c[nH]nc1-c1ccccc1F)[C@H]1CC[NH2+]C1	ZINC000179095461	189169151	/nfs/dbraw/zinc/16/91/51/189169151.db2.gz	HKZBVOJJCGVONW-JTQLQIEISA-N	1	0	288.326	1.650	50	0		CDAARO
CC[C@@H]1C[N@H+](C[C@@H]2CCC=CO2)C[C@]2(CCOC2)O1	ZINC000370210038	360975459	/nfs/dbraw/zinc/97/54/59/360975459.db2.gz	MZDBLLRGRBFFPK-ILXRZTDVSA-N	1	0	267.369	1.949	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)[C@H]2CSc3ccccc32)C1	ZINC000092239192	283624943	/nfs/dbraw/zinc/62/49/43/283624943.db2.gz	KLEBOJXWEVYRFZ-JQWIXIFHSA-N	1	0	262.378	1.826	50	0		CDAARO
NC(=O)[C@H](c1ccccc1)[N@@H+]1CCCC[C@H]1Cn1cccn1	ZINC000247707048	361168230	/nfs/dbraw/zinc/16/82/30/361168230.db2.gz	FTRHOVFPOKCKAD-HOTGVXAUSA-N	1	0	298.390	1.964	50	0		CDAARO
C[C@@H]1C[N@@H+](C[C@H](O)COC2CCCCC2)C[C@H](C)O1	ZINC000012414141	361229879	/nfs/dbraw/zinc/22/98/79/361229879.db2.gz	WRNHQEHAJUBKFK-MJBXVCDLSA-N	1	0	271.401	1.806	50	0		CDAARO
C[C@H](C(=O)NCc1ccc(-c2ncon2)cc1)[NH+](C)C	ZINC000426641337	361330479	/nfs/dbraw/zinc/33/04/79/361330479.db2.gz	GLLHQWUSTVVZPK-SNVBAGLBSA-N	1	0	274.324	1.303	50	0		CDAARO
Clc1cnn(CCN2CC[N@@H+]3CCC[C@H]3C2)c1	ZINC000335568709	361513544	/nfs/dbraw/zinc/51/35/44/361513544.db2.gz	YKRLUBGTHCWXNB-LBPRGKRZSA-N	1	0	254.765	1.317	50	0		CDAARO
C[NH+](C)CCn1nnc2c1c1ccccc1oc2=O	ZINC000000198778	361638600	/nfs/dbraw/zinc/63/86/00/361638600.db2.gz	WJSGYLVKBAPALB-UHFFFAOYSA-N	1	0	258.281	1.099	50	0		CDAARO
O=C(c1cncc(F)c1)N1CC[C@@H]([NH+]2CCCCC2)C1	ZINC000268272688	364022260	/nfs/dbraw/zinc/02/22/60/364022260.db2.gz	ODRBEYKTFPCUMV-CQSZACIVSA-N	1	0	277.343	1.921	50	0		CDAARO
CS[C@H](C)CNC(=O)C[C@H](C)[C@H]1CCC[NH2+]C1	ZINC000248729674	364370471	/nfs/dbraw/zinc/37/04/71/364370471.db2.gz	ODEQEDMBMIFSCU-TUAOUCFPSA-N	1	0	258.431	1.880	50	0		CDAARO
CS[C@H]1CN(C(=O)Nc2cc(C)no2)C[C@H]1[NH+](C)C	ZINC000089608792	366883895	/nfs/dbraw/zinc/88/38/95/366883895.db2.gz	OLGOISRCAPGDOP-ZJUUUORDSA-N	1	0	284.385	1.492	50	0		CDAARO
O=C([C@@H]1CC=CCC1)N1CC[NH+]([C@@H]2CCC[C@H]2O)CC1	ZINC000252506458	367653599	/nfs/dbraw/zinc/65/35/99/367653599.db2.gz	SZMNVPYDQGFHHK-RBSFLKMASA-N	1	0	278.396	1.400	50	0		CDAARO
CCOc1ccccc1CN1CC[N@H+](CCCO)[C@H](C)C1	ZINC000252540142	367813946	/nfs/dbraw/zinc/81/39/46/367813946.db2.gz	OTYLBINZFKSETJ-OAHLLOKOSA-N	1	0	292.423	1.974	50	0		CDAARO
C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)N1C(=O)CC[NH3+]	ZINC000377144654	367968041	/nfs/dbraw/zinc/96/80/41/367968041.db2.gz	HXKYDJLKEGFEEP-TYNCELHUSA-N	1	0	262.353	1.712	50	0		CDAARO
CC[C@H]1CCCN(C(=O)[C@H]2CN(C)CCO2)CC1	ZINC000081411107	369957660	/nfs/dbraw/zinc/95/76/60/369957660.db2.gz	IDPPPJSKYSJHDA-QWHCGFSZSA-N	1	0	254.374	1.356	50	0		CDAARO
CC(C)n1n[o+]c(NC(=O)c2ccccc2)c1C=O	ZINC000022864166	370504424	/nfs/dbraw/zinc/50/44/24/370504424.db2.gz	RQHHPPAADWZETL-UHFFFAOYSA-O	1	0	260.273	1.608	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@@H]([NH3+])CN1Cc1cccc2ccccc21	ZINC000299762363	372749091	/nfs/dbraw/zinc/74/90/91/372749091.db2.gz	VOTRCZXVFICJPM-WBVHZDCISA-N	1	0	297.402	1.878	50	0		CDAARO
Cc1nccn1CC1CC[NH+]([C@H](C)C(=O)N(C)C)CC1	ZINC000299779811	372757211	/nfs/dbraw/zinc/75/72/11/372757211.db2.gz	RTCCQBRMWCDXII-GFCCVEGCSA-N	1	0	278.400	1.380	50	0		CDAARO
O=C(NC[C@@H]1CCC[N@@H+](C2CCCC2)C1)c1cncnc1	ZINC000299779779	372757424	/nfs/dbraw/zinc/75/74/24/372757424.db2.gz	QJNQUSXFZSNLHV-ZDUSSCGKSA-N	1	0	288.395	1.861	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)c2ccc(F)cc2)CC1	ZINC000027441837	373507103	/nfs/dbraw/zinc/50/71/03/373507103.db2.gz	TXQUEZOULWGDLA-UHFFFAOYSA-N	1	0	280.343	1.666	50	0		CDAARO
C[NH+]1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1	ZINC000253408887	373713343	/nfs/dbraw/zinc/71/33/43/373713343.db2.gz	YWJDYHKUZAZBFV-UHFFFAOYSA-N	1	0	289.379	1.694	50	0		CDAARO
OC[C@@H]1C[N@H+](Cc2ccncc2F)C[C@H]1c1ccncc1	ZINC000253411410	373719014	/nfs/dbraw/zinc/71/90/14/373719014.db2.gz	OOMBRQPSWGYRMJ-GJZGRUSLSA-N	1	0	287.338	1.824	50	0		CDAARO
O[C@H]1CCN(CCOc2ccccc2Br)C1	ZINC000093789687	374783992	/nfs/dbraw/zinc/78/39/92/374783992.db2.gz	APANPWOQVYOHBR-JTQLQIEISA-N	1	0	286.169	1.895	50	0		CDAARO
[NH3+]CCN1CCN(c2nc3ccccc3s2)CC1	ZINC000020394262	374900020	/nfs/dbraw/zinc/90/00/20/374900020.db2.gz	ABLITCQTFDMCEE-UHFFFAOYSA-N	1	0	262.382	1.377	50	0		CDAARO
CC(=O)N1CCN(CC[NH2+][C@H](C)c2ccccc2C)CC1	ZINC000095420286	374921992	/nfs/dbraw/zinc/92/19/92/374921992.db2.gz	BJGVSEKWAZNOFT-OAHLLOKOSA-N	1	0	289.423	1.810	50	0		CDAARO
COc1ccc([C@@H](C)[C@@H](C)[NH2+]CCS(C)(=O)=O)cc1	ZINC000095421222	374923022	/nfs/dbraw/zinc/92/30/22/374923022.db2.gz	NJTVEEXVJZRKER-NWDGAFQWSA-N	1	0	285.409	1.821	50	0		CDAARO
CC(C)OC[C@@H](O)C[NH2+]C(C)(C)c1nccs1	ZINC000095426439	374926488	/nfs/dbraw/zinc/92/64/88/374926488.db2.gz	VSTWDBBWMNWTHO-JTQLQIEISA-N	1	0	258.387	1.754	50	0		CDAARO
CC[NH+](CC)CCN(CCOC)[C@@H]1CCSC1	ZINC000095442074	374935596	/nfs/dbraw/zinc/93/55/96/374935596.db2.gz	LNARSRUFSBXUIG-CYBMUJFWSA-N	1	0	260.447	1.782	50	0		CDAARO
CC[C@H](C)[C@@H]([NH2+]CC(=O)N(CC(C)C)C(C)C)C(N)=O	ZINC000095452693	374951464	/nfs/dbraw/zinc/95/14/64/374951464.db2.gz	VEEIXXWAZJAUDA-GXTWGEPZSA-N	1	0	285.432	1.369	50	0		CDAARO
c1cc(N2CCCC2)ncc1C[NH2+][C@@H]1CCCOC1	ZINC000095412237	374914982	/nfs/dbraw/zinc/91/49/82/374914982.db2.gz	FMVYQZJAZCTFHS-CQSZACIVSA-N	1	0	261.369	1.950	50	0		CDAARO
Cc1ccoc1C(=O)Nc1ccc(N2CC[NH2+]CC2)cn1	ZINC000095971573	375044432	/nfs/dbraw/zinc/04/44/32/375044432.db2.gz	WEPMUZUDLMTNSQ-UHFFFAOYSA-N	1	0	286.335	1.645	50	0		CDAARO
CN(Cc1csc2ccccc12)C(=O)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000299748506	375207448	/nfs/dbraw/zinc/20/74/48/375207448.db2.gz	HGSJVZJSUOUEAJ-AAEUAGOBSA-N	1	0	290.388	1.583	50	0		CDAARO
C[C@@H](NC(=O)C[NH+]1CCC(C(N)=O)CC1)c1ccccc1	ZINC000002643576	375284787	/nfs/dbraw/zinc/28/47/87/375284787.db2.gz	WRXDFCYUNTUIRM-GFCCVEGCSA-N	1	0	289.379	1.061	50	0		CDAARO
OC[C@@H]1CCC[C@H]([NH2+]C2CSCCSC2)C1	ZINC000670462906	483051429	/nfs/dbraw/zinc/05/14/29/483051429.db2.gz	MOSREXCTPQAFDG-MNOVXSKESA-N	1	0	261.456	1.976	50	0		CDAARO
O=C([C@H]1C=CC[NH2+]1)N1CCC2(CC1)C(=O)Nc1ccccc12	ZINC000299768135	284540983	/nfs/dbraw/zinc/54/09/83/284540983.db2.gz	JJDKUVZBDJVWPI-CQSZACIVSA-N	1	0	297.358	1.027	50	0		CDAARO
COc1ccc(C)cc1/C=C\C(=O)N1CC[C@H](C[NH3+])C1	ZINC000606441647	375823526	/nfs/dbraw/zinc/82/35/26/375823526.db2.gz	IIGQIOXOXQSWLK-RYWCDNDXSA-N	1	0	274.364	1.824	50	0		CDAARO
[NH3+][C@@H]1CCN(S(=O)(=O)c2ccc(F)cc2Cl)C1	ZINC000050242065	376057879	/nfs/dbraw/zinc/05/78/79/376057879.db2.gz	ZPYGTWZGQPKRPU-MRVPVSSYSA-N	1	0	278.736	1.201	50	0		CDAARO
CN(C[C@@H]1CCC[N@@H+]1C)S(=O)(=O)N1CCCCCC1	ZINC000420767205	376387348	/nfs/dbraw/zinc/38/73/48/376387348.db2.gz	NBFDRAQTDJXVJY-ZDUSSCGKSA-N	1	0	289.445	1.133	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)Nc2ncnc3c2CC[NH2+]C3)n1	ZINC000067804290	377240571	/nfs/dbraw/zinc/24/05/71/377240571.db2.gz	XMVWBYRSJRTATP-LLVKDONJSA-N	1	0	286.383	1.436	50	0		CDAARO
CCn1ncnc1CN1CCC2(CC[N@H+](C)C2)CC1	ZINC000067872853	377278049	/nfs/dbraw/zinc/27/80/49/377278049.db2.gz	LASSYMWYKGVLFF-UHFFFAOYSA-N	1	0	263.389	1.216	50	0		CDAARO
CCC1(CC)[C@H](NC(=O)Cn2ccnc2)[C@H](C)[C@H]1OC	ZINC000245289791	378047353	/nfs/dbraw/zinc/04/73/53/378047353.db2.gz	FEEMKSHXMUKGFH-IACUBPJLSA-N	1	0	279.384	1.839	50	0		CDAARO
C[C@@H]1C[C@@H]([NH3+])CCN1C(=O)/C=C\C1CCOCC1	ZINC000492995499	253342836	/nfs/dbraw/zinc/34/28/36/253342836.db2.gz	UTFKZWRPCSKAND-FIFDWTMUSA-N	1	0	252.358	1.307	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)/C=C\c1cnc(C)s1	ZINC000493778191	253553411	/nfs/dbraw/zinc/55/34/11/253553411.db2.gz	LZYJJYKWGVQIEN-ISALQUGTSA-N	1	0	265.382	1.675	50	0		CDAARO
CCN(Cc1ccc2c(c1)OCO2)C(=O)C[C@H]1CC[NH2+]C1	ZINC000089744010	256862937	/nfs/dbraw/zinc/86/29/37/256862937.db2.gz	NFDZJEQQIRUFQR-GFCCVEGCSA-N	1	0	290.363	1.763	50	0		CDAARO
COc1cc(C(=O)N[C@H]2CC[NH2+]C[C@H]2C)ccc1C	ZINC000094345030	184785207	/nfs/dbraw/zinc/78/52/07/184785207.db2.gz	ABCBDASMFUUMIT-YPMHNXCESA-N	1	0	262.353	1.731	50	0		CDAARO
COc1ccc2[nH]c3c(ncnc3N3CC[NH2+]CC3)c2c1	ZINC000009304035	390192280	/nfs/dbraw/zinc/19/22/80/390192280.db2.gz	YBNDUQHTMYVYHE-UHFFFAOYSA-N	1	0	283.335	1.529	50	0		CDAARO
CCOCC(=O)NCC1([NH+]2CCCCC2)CCN(C)CC1	ZINC000096425913	390517394	/nfs/dbraw/zinc/51/73/94/390517394.db2.gz	OMFUOUGAUWGSAD-UHFFFAOYSA-N	1	0	297.443	1.089	50	0		CDAARO
O=C1[C@@H]2CC(Cl)=CC[C@@H]2C(=O)N1CC[NH+]1CCCCC1	ZINC000100104595	390446131	/nfs/dbraw/zinc/44/61/31/390446131.db2.gz	SHZOHIJTDOCLRY-QWHCGFSZSA-N	1	0	296.798	1.990	50	0		CDAARO
Cc1c(CNC(=O)[C@H](C)[NH+]2[C@H](C)CC[C@H]2C)cnn1C	ZINC000252486334	131134953	/nfs/dbraw/zinc/13/49/53/131134953.db2.gz	IPKCOFQOZAPJSF-WZRBSPASSA-N	1	0	278.400	1.606	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2CCC[NH2+]2)C[C@H](c2ccc(F)cc2)O1	ZINC000261833451	131172282	/nfs/dbraw/zinc/17/22/82/131172282.db2.gz	YZBQTAMYLUTYLD-KCPJHIHWSA-N	1	0	292.354	1.866	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](C(=O)N2CCC3(CC2)OCCO3)C1	ZINC000089840150	392512149	/nfs/dbraw/zinc/51/21/49/392512149.db2.gz	IICFRMULQBGEEM-AWEZNQCLSA-N	1	0	296.411	1.330	50	0		CDAARO
Cc1ccccc1[C@@H]1CN(C(=O)[C@H]2CC[NH2+]C2)[C@H](C)CO1	ZINC000269216422	132133231	/nfs/dbraw/zinc/13/32/31/132133231.db2.gz	KOQDWGPXXAIPMI-YCPHGPKFSA-N	1	0	288.391	1.893	50	0		CDAARO
C[C@@H]1CCCN(c2cc(N3CCN(C)CC3)ncn2)C1	ZINC000089929840	135060879	/nfs/dbraw/zinc/06/08/79/135060879.db2.gz	WAHFVMYYARNGSH-CYBMUJFWSA-N	1	0	275.400	1.465	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)c1cccc(N)n1	ZINC000092674543	397902077	/nfs/dbraw/zinc/90/20/77/397902077.db2.gz	PKUXOGWXPXXKMO-LLVKDONJSA-N	1	0	262.357	1.220	50	0		CDAARO
C[C@@H]([NH3+])C(=O)N1CCC[C@@H]1Cc1cccc(F)c1	ZINC000095426453	147114250	/nfs/dbraw/zinc/11/42/50/147114250.db2.gz	MUUCVAJBYVIOTC-ZWNOBZJWSA-N	1	0	250.317	1.706	50	0		CDAARO
CCO[C@@H]1C[C@H](O)C12CCN(C(=O)C1([NH3+])CCCC1)CC2	ZINC000262477399	286407371	/nfs/dbraw/zinc/40/73/71/286407371.db2.gz	QKNQMCAIJVEOQQ-QWHCGFSZSA-N	1	0	296.411	1.036	50	0		CDAARO
Cc1nnc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)s1	ZINC000660691096	413376632	/nfs/dbraw/zinc/37/66/32/413376632.db2.gz	FWPVOWQPAXHOME-TUAOUCFPSA-N	1	0	267.398	1.972	50	0		CDAARO
C[C@@H]1C[C@@H]1N1C[C@H](Nc2ncnc(N)c2Cl)CC1=O	ZINC000372967597	160161565	/nfs/dbraw/zinc/16/15/65/160161565.db2.gz	OASGNRZBMIGLEO-PRJMDXOYSA-N	1	0	281.747	1.133	50	0		CDAARO
COc1ccc(OCC[NH2+]C[C@@H]2CCCO2)cc1	ZINC000003247033	169871687	/nfs/dbraw/zinc/87/16/87/169871687.db2.gz	WWNHKUSYSXLHAB-AWEZNQCLSA-N	1	0	251.326	1.843	50	0		CDAARO
CCS(=O)(=O)N1CCC([N@H+](C)Cc2ccccc2)CC1	ZINC000004744095	170009866	/nfs/dbraw/zinc/00/98/66/170009866.db2.gz	PJDYDXNBBVAKAF-UHFFFAOYSA-N	1	0	296.436	1.933	50	0		CDAARO
[NH2+]=C1S[C@@H]2CS(=O)(=O)C[C@@H]2N1Cc1ccccc1	ZINC000006010710	170168471	/nfs/dbraw/zinc/16/84/71/170168471.db2.gz	YWVLQFWRKMBPBJ-WDEREUQCSA-N	1	0	282.390	1.336	50	0		CDAARO
COc1ccc(S(=O)(=O)[C@H](C[NH3+])c2cccnc2)cc1	ZINC000008031101	170315344	/nfs/dbraw/zinc/31/53/44/170315344.db2.gz	KDESKLSRXACSPO-CQSZACIVSA-N	1	0	292.360	1.564	50	0		CDAARO
Cc1ccc(C2=CC[N@H+](CCC(=O)NC(N)=O)CC2)cc1	ZINC000009498014	170379070	/nfs/dbraw/zinc/37/90/70/170379070.db2.gz	XJLHGTVMYCZKHE-UHFFFAOYSA-N	1	0	287.363	1.669	50	0		CDAARO
C[NH+](C)Cc1ccccc1CNC(=O)c1nccnc1N	ZINC000010085718	170397347	/nfs/dbraw/zinc/39/73/47/170397347.db2.gz	WGUVOBPWTVKOPU-UHFFFAOYSA-N	1	0	285.351	1.050	50	0		CDAARO
OCC[C@H]1C[NH2+]CCN1Cc1c(F)cccc1Cl	ZINC000020219133	171081997	/nfs/dbraw/zinc/08/19/97/171081997.db2.gz	XEVOTRDYGJQNRJ-JTQLQIEISA-N	1	0	272.751	1.635	50	0		CDAARO
C[NH+](C)CCNC(=O)c1nc(-c2cccs2)no1	ZINC000020744540	171271262	/nfs/dbraw/zinc/27/12/62/171271262.db2.gz	SRFHQFMNAQTRIH-UHFFFAOYSA-N	1	0	266.326	1.090	50	0		CDAARO
CCC[C@](C)([NH3+])C(=O)Nc1ccc(-n2cncn2)nc1	ZINC000037622100	173573993	/nfs/dbraw/zinc/57/39/93/173573993.db2.gz	HGVMWSHEUQWOGN-ZDUSSCGKSA-N	1	0	274.328	1.118	50	0		CDAARO
CC[C@H]1CCCCN1C(=O)[C@H](C)[NH+]1CCC(O)CC1	ZINC000043302526	175002432	/nfs/dbraw/zinc/00/24/32/175002432.db2.gz	OHODJYRRCHOAHZ-STQMWFEESA-N	1	0	268.401	1.623	50	0		CDAARO
O=C(NC[C@@]1(O)CC[NH2+]C1)c1cccc2ccccc21	ZINC000072148405	176325781	/nfs/dbraw/zinc/32/57/81/176325781.db2.gz	LITFYYCNVUACIR-MRXNPFEDSA-N	1	0	270.332	1.294	50	0		CDAARO
C[C@@H](CCC(=O)N1CCn2cncc2C1)[NH+]1CCCC1	ZINC000072161682	176329805	/nfs/dbraw/zinc/32/98/05/176329805.db2.gz	GGSAGRUTVDYOOR-ZDUSSCGKSA-N	1	0	276.384	1.490	50	0		CDAARO
CN(Cc1nc2cc(F)ccc2[nH]1)C[C@@]1(O)CCC[NH2+]C1	ZINC000077322595	177252774	/nfs/dbraw/zinc/25/27/74/177252774.db2.gz	PAEXSTJWCYBDJZ-OAHLLOKOSA-N	1	0	292.358	1.248	50	0		CDAARO
Cc1ccsc1CCNC(=O)C[C@@H]1C[NH2+]CCO1	ZINC000258909429	270309782	/nfs/dbraw/zinc/30/97/82/270309782.db2.gz	JKNISMQBBFVZAM-LLVKDONJSA-N	1	0	268.382	1.094	50	0		CDAARO
C[C@@H]1CN(c2cc(-n3cccn3)nc(N)[nH+]2)C[C@H](C)S1	ZINC000092917611	274360777	/nfs/dbraw/zinc/36/07/77/274360777.db2.gz	HADOLUXIXBORNO-AOOOYVTPSA-N	1	0	290.396	1.575	50	0		CDAARO
O=C1Nc2cc(Cl)c(Cl)cc2N2CC[NH2+]C[C@@H]12	ZINC000000008760	275024748	/nfs/dbraw/zinc/02/47/48/275024748.db2.gz	PHGWDAICBXUJDU-JTQLQIEISA-N	1	0	272.135	1.724	50	0	in-vitro	CDAARO
c1cn2nc3c(c2c(N2CC[NH2+]CC2)n1)CCCC3	ZINC000098211121	275073306	/nfs/dbraw/zinc/07/33/06/275073306.db2.gz	PULOIKGWILSENF-UHFFFAOYSA-N	1	0	257.341	1.018	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(C[C@@H](C[NH3+])CO2)CC1	ZINC000091303569	278384397	/nfs/dbraw/zinc/38/43/97/278384397.db2.gz	RSXOKGBXILPBOM-NSHDSACASA-N	1	0	270.373	1.751	50	0		CDAARO
Cc1cc(C(=O)NC[C@@H]2CC[N@@H+](C)C2)nn1-c1ccccc1	ZINC000109847815	279312792	/nfs/dbraw/zinc/31/27/92/279312792.db2.gz	ATJOXEFLDXQUAF-AWEZNQCLSA-N	1	0	298.390	1.862	50	0		CDAARO
CC[N@@H+]1CCC[C@@]2(CCCN(C(=O)Cn3ccnn3)C2)C1	ZINC000299772062	279315549	/nfs/dbraw/zinc/31/55/49/279315549.db2.gz	XHWASUNCBYGWNH-OAHLLOKOSA-N	1	0	291.399	1.003	50	0		CDAARO
CC[C@H]1CN(CC[NH3+])Cc2cc(OC)ccc2O1	ZINC000299761683	281167707	/nfs/dbraw/zinc/16/77/07/281167707.db2.gz	YZGVYMDQHNCGTA-LBPRGKRZSA-N	1	0	250.342	1.627	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)/C=C\c2ccc3c(c2)CCO3)C1	ZINC000254968851	289347593	/nfs/dbraw/zinc/34/75/93/289347593.db2.gz	BHYPGSGXADFGHN-PKYBCLHXSA-N	1	0	286.375	1.845	50	0		CDAARO
Cc1nc(CCN(C)C(=O)[C@@H](C)[NH+]2CCCCCC2)no1	ZINC000553306046	290110426	/nfs/dbraw/zinc/11/04/26/290110426.db2.gz	SNRNHPXFNXGHFP-GFCCVEGCSA-N	1	0	294.399	1.643	50	0		CDAARO
[NH3+]CCCCCCNC1=NS(=O)(=O)c2ccccc21	ZINC000004535243	303375054	/nfs/dbraw/zinc/37/50/54/303375054.db2.gz	SGHGROAEXGVMQF-UHFFFAOYSA-N	1	0	281.381	1.244	50	0		CDAARO
C[C@@H](CCNC(=O)Cc1ccsc1)[NH+]1CCN(C)CC1	ZINC000534577284	328310508	/nfs/dbraw/zinc/31/05/08/328310508.db2.gz	SPGQYUSJYLOHQS-ZDUSSCGKSA-N	1	0	295.452	1.433	50	0		CDAARO
CC[N@H+](C)C1(CNC(=O)C[C@H]2CCOC2)CCCC1	ZINC000534631010	328331433	/nfs/dbraw/zinc/33/14/33/328331433.db2.gz	ALNJVDQFRRVYRA-CYBMUJFWSA-N	1	0	268.401	1.794	50	0		CDAARO
CC1=NO[C@](C)(C(=O)NCCCOC2CC[NH+](C)CC2)C1	ZINC000534661179	328349301	/nfs/dbraw/zinc/34/93/01/328349301.db2.gz	FFLPJVWLXAIZPL-HNNXBMFYSA-N	1	0	297.399	1.158	50	0		CDAARO
C[NH+](C)CCN1CC(=O)Nc2c(Cl)cccc2C1=O	ZINC000534669419	328346767	/nfs/dbraw/zinc/34/67/67/328346767.db2.gz	RMVSZUMFENQETO-UHFFFAOYSA-N	1	0	281.743	1.296	50	0		CDAARO
[NH3+][C@H]1[C@@H]2CC[C@H]1CN(C[C@@H]1COc3ccccc3O1)C2	ZINC000534670178	328347001	/nfs/dbraw/zinc/34/70/01/328347001.db2.gz	OXDBDOFROQXZPQ-IATRGZMQSA-N	1	0	274.364	1.496	50	0		CDAARO
CN(CC1(CO)CCCC1)C(=O)[C@@H]1CC12CC[NH2+]CC2	ZINC000534661162	328349139	/nfs/dbraw/zinc/34/91/39/328349139.db2.gz	XGLXDPMMKPNIJD-ZDUSSCGKSA-N	1	0	280.412	1.387	50	0		CDAARO
CCc1noc(C)c1NC(=O)C[C@H]1CSCC[NH2+]1	ZINC000125475288	323209655	/nfs/dbraw/zinc/20/96/55/323209655.db2.gz	OLTSASGWVJVCFI-VIFPVBQESA-N	1	0	269.370	1.579	50	0		CDAARO
FC(F)(F)[C@@]1(c2nc(-c3cccnc3)no2)CC[NH2+]C1	ZINC000111240726	330381711	/nfs/dbraw/zinc/38/17/11/330381711.db2.gz	ACRAXFFIQIOMOR-NSHDSACASA-N	1	0	284.241	1.925	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C[C@@H](C(C)C)N1CCOCC1	ZINC000097159210	482458994	/nfs/dbraw/zinc/45/89/94/482458994.db2.gz	OWAFPRJPLHXOST-HNNXBMFYSA-N	1	0	280.416	1.473	50	0		CDAARO
CC[C@@H]1CN(c2nc(C)c(C)cc2C(N)=O)CC[N@@H+]1C	ZINC000670473357	483083527	/nfs/dbraw/zinc/08/35/27/483083527.db2.gz	RRVIFEZTQLMDIS-GFCCVEGCSA-N	1	0	276.384	1.328	50	0		CDAARO
CC(C)CC[NH+]1CCC(CNS(C)(=O)=O)CC1	ZINC000096456765	527725370	/nfs/dbraw/zinc/72/53/70/527725370.db2.gz	HUWDMGBCUYABRN-UHFFFAOYSA-N	1	0	262.419	1.294	50	0		CDAARO
C[NH2+][C@H]1CCCN(Cc2cccc3c2OCCO3)C1	ZINC000261758984	536413116	/nfs/dbraw/zinc/41/31/16/536413116.db2.gz	MSRPQFZBJLAHKL-ZDUSSCGKSA-N	1	0	262.353	1.642	50	0		CDAARO
CC(=O)NC[C@H](c1ccc2c(c1)OCO2)[NH+]1CCCC1	ZINC000012197089	574466963	/nfs/dbraw/zinc/46/69/63/574466963.db2.gz	VTHYCOWIXUPBJT-CYBMUJFWSA-N	1	0	276.336	1.688	50	0		CDAARO
CC[C@H](C(=O)NCc1nnc(C2CCC2)n1C)[NH+](C)C	ZINC000097141935	567904830	/nfs/dbraw/zinc/90/48/30/567904830.db2.gz	GBTAMJPLQUYAMR-LLVKDONJSA-N	1	0	279.388	1.039	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@@H](C2=[NH+]CCN2)C1	ZINC000757073980	575930643	/nfs/dbraw/zinc/93/06/43/575930643.db2.gz	QBEXMMVPQIDOBG-SNVBAGLBSA-N	1	0	253.346	1.635	50	0		CDAARO
CC(C)[C@@H]([NH3+])[C@]1(O)CCCN(C(=O)OC(C)(C)C)C1	ZINC000958528200	614119434	/nfs/dbraw/zinc/11/94/34/614119434.db2.gz	NWVYDGZVAUNTTK-RISCZKNCSA-N	1	0	272.389	1.732	50	0		CDAARO
CCN(CCc1nc2c(cccc2C)[nH]1)C(=O)[C@H]1CC[NH2+]1	ZINC000952971851	615060640	/nfs/dbraw/zinc/06/06/40/615060640.db2.gz	YHKKYNMSTCTPPE-CYBMUJFWSA-N	1	0	286.379	1.624	50	0		CDAARO
CCNC(=O)C[N@H+](C)CC1([C@H]2CCCCO2)CCC1	ZINC000952994898	615465775	/nfs/dbraw/zinc/46/57/75/615465775.db2.gz	WGHLIBIWBXPAGJ-CYBMUJFWSA-N	1	0	268.401	1.794	50	0		CDAARO
C[N@H+](Cc1cc[nH]n1)[C@H]1CCC(=O)N(CC2CC2)CC1	ZINC000952983573	616165786	/nfs/dbraw/zinc/16/57/86/616165786.db2.gz	VWPZNLYNKMQRKO-AWEZNQCLSA-N	1	0	276.384	1.633	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CNC(=O)NCc2cccs2)C1	ZINC000952979868	616411393	/nfs/dbraw/zinc/41/13/93/616411393.db2.gz	UXCDVCBQAGLXHG-GFCCVEGCSA-N	1	0	297.424	1.516	50	0		CDAARO
CC1(C)[C@H]2CCC[C@H]2[C@@H]1[NH2+]CCS(=O)(=O)C1CC1	ZINC000850474805	632057694	/nfs/dbraw/zinc/05/76/94/632057694.db2.gz	QNMZRANDCYPSRH-AGIUHOORSA-N	1	0	271.426	1.978	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](CCCC(C)C)C[C@H]2O)[nH]n1	ZINC001704297201	1177678832	/nfs/dbraw/zinc/67/88/32/1177678832.db2.gz	NCGGTVXJMGKJBY-UKRRQHHQSA-N	1	0	265.401	1.990	50	0		CDAARO
Cc1cc(C)c(C[NH2+][C@H](C)CS(C)(=O)=O)cn1	ZINC000396978042	796538704	/nfs/dbraw/zinc/53/87/04/796538704.db2.gz	LMRDPQZWWDRBLC-LLVKDONJSA-N	1	0	256.371	1.221	50	0		CDAARO
C[NH+](C)[C@H]1CCN(c2nccs2)C[C@H]1CCCO	ZINC000091817958	796922507	/nfs/dbraw/zinc/92/25/07/796922507.db2.gz	OOABAZZTZFOBJX-NEPJUHHUSA-N	1	0	269.414	1.672	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1Cn1ncc(N2CCCCC2)cc1=O	ZINC000095358756	797019077	/nfs/dbraw/zinc/01/90/77/797019077.db2.gz	KUSNCYGJZBZIGC-AWEZNQCLSA-N	1	0	290.411	1.718	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2ncccc2C)CC1	ZINC001001292423	797339527	/nfs/dbraw/zinc/33/95/27/797339527.db2.gz	SDIJPJHQYJYUBN-UHFFFAOYSA-N	1	0	291.395	1.478	50	0		CDAARO
Cc1ccc(N2CCC([N@@H+]3CCC[C@H](O)C3)CC2)nn1	ZINC000032603569	913041539	/nfs/dbraw/zinc/04/15/39/913041539.db2.gz	HZUXOEJABVGSHK-AWEZNQCLSA-N	1	0	276.384	1.211	50	0		CDAARO
Cc1nc(-c2nc([C@@H]3CCC[NH2+]C3)cc(=O)[nH]2)cs1	ZINC000023192724	897192308	/nfs/dbraw/zinc/19/23/08/897192308.db2.gz	WTLUBTZAUXHNID-SECBINFHSA-N	1	0	276.365	1.669	50	0		CDAARO
Cc1cc(C[N@@H+]2C[C@@H](O)C[C@@]2(C)CO)ccc1F	ZINC000585117366	902277402	/nfs/dbraw/zinc/27/74/02/902277402.db2.gz	ZNIYZQSGGTYLFK-JSGCOSHPSA-N	1	0	253.317	1.452	50	0		CDAARO
CN1CCC[C@@](O)(C[NH2+]Cc2cccc3ccccc32)C1=O	ZINC000012198212	921431681	/nfs/dbraw/zinc/43/16/81/921431681.db2.gz	MMYGTFAURTYPGB-GOSISDBHSA-N	1	0	298.386	1.913	50	0		CDAARO
COc1cccc(-c2cn(CC[NH+]3CCCCC3)nn2)n1	ZINC000952880151	910440576	/nfs/dbraw/zinc/44/05/76/910440576.db2.gz	CMLFLBRVLURGNJ-UHFFFAOYSA-N	1	0	287.367	1.835	50	0		CDAARO
CC[C@@H](O)C[NH+]1CCC(CNC(=O)c2ccoc2)CC1	ZINC000952867541	910461866	/nfs/dbraw/zinc/46/18/66/910461866.db2.gz	OITQUMUNNHLJAZ-CQSZACIVSA-N	1	0	280.368	1.492	50	0		CDAARO
Cc1cc(N2Cc3cnc(CC(C)C)nc3C2)nc(N)[nH+]1	ZINC000067855390	915070134	/nfs/dbraw/zinc/07/01/34/915070134.db2.gz	IEAYHKFFVABOPD-UHFFFAOYSA-N	1	0	284.367	1.876	50	0		CDAARO
CNC(=O)c1ccnc(N2CCC3(C2)CC[NH2+]CC3)c1	ZINC000067563147	936618943	/nfs/dbraw/zinc/61/89/43/936618943.db2.gz	ZHJWMTCVOQQPIU-UHFFFAOYSA-N	1	0	274.368	1.021	50	0		CDAARO
COc1ccccc1C(=O)N1CCO[C@@H](CC[NH+](C)C)C1	ZINC000012439779	922088920	/nfs/dbraw/zinc/08/89/20/922088920.db2.gz	HXMIIMXZXMCCCB-ZDUSSCGKSA-N	1	0	292.379	1.488	50	0		CDAARO
CCCc1cnc(C)nc1NC[C@H]1CCC[N@H+](CCO)C1	ZINC000823012075	925661117	/nfs/dbraw/zinc/66/11/17/925661117.db2.gz	STQLQSWRQLSXRP-CQSZACIVSA-N	1	0	292.427	1.854	50	0		CDAARO
CCc1cc(N[C@@H]2CC(=O)N(C)C2)nc(N2CCCC2)[nH+]1	ZINC000823503696	925699477	/nfs/dbraw/zinc/69/94/77/925699477.db2.gz	ANJIIFATWQBAKN-GFCCVEGCSA-N	1	0	289.383	1.282	50	0		CDAARO
CCc1cc(N2CC[NH+](CCc3ncc[nH]3)CC2)ncn1	ZINC000823557528	925710195	/nfs/dbraw/zinc/71/01/95/925710195.db2.gz	SRKZRDQEDJMZGR-UHFFFAOYSA-N	1	0	286.383	1.127	50	0		CDAARO
Cc1nnc([C@H](C)[NH2+]C2CCN(C(=O)C3CC3)CC2)[nH]1	ZINC000827911264	925990034	/nfs/dbraw/zinc/99/00/34/925990034.db2.gz	QRJQWPXBVLBTTC-VIFPVBQESA-N	1	0	277.372	1.165	50	0		CDAARO
CCc1cc(N[C@@H]2CCNC2=O)nc(N2CCCCC2)[nH+]1	ZINC000065489143	928770492	/nfs/dbraw/zinc/77/04/92/928770492.db2.gz	SITFRTGUZYWUCV-GFCCVEGCSA-N	1	0	289.383	1.330	50	0		CDAARO
COc1ccc(/C=C/C(=O)N2CC[NH2+]C[C@H]2C)cc1F	ZINC000125250515	931898210	/nfs/dbraw/zinc/89/82/10/931898210.db2.gz	RHWUQWYODQKAFK-DUMNWFOQSA-N	1	0	278.327	1.668	50	0		CDAARO
COc1ccc(/C(C)=C/C(=O)N2CC[NH2+][C@H](C)C2)cc1	ZINC000188428460	934436049	/nfs/dbraw/zinc/43/60/49/934436049.db2.gz	JGARUMSFFBYLGH-RSKUSDAESA-N	1	0	274.364	1.919	50	0		CDAARO
Cc1ncc2c(c1-c1noc(CC(C)(C)O)n1)CC[NH2+]C2	ZINC000020109774	935727110	/nfs/dbraw/zinc/72/71/10/935727110.db2.gz	SYFZZSDWNLPWBG-UHFFFAOYSA-N	1	0	288.351	1.399	50	0		CDAARO
CCC[C@]1(CO)C[N@H+](Cc2cccnc2C)CC[C@@H]1O	ZINC001529158797	968997611	/nfs/dbraw/zinc/99/76/11/968997611.db2.gz	MGWKGVOIMIJQNP-JKSUJKDBSA-N	1	0	278.396	1.735	50	0		CDAARO
Cc1cc(N[C@H]2CCOC2)nc(N2CCCCC2)[nH+]1	ZINC001529186570	969007383	/nfs/dbraw/zinc/00/73/83/969007383.db2.gz	IEEWDXIQIVLKID-LBPRGKRZSA-N	1	0	262.357	1.976	50	0		CDAARO
CN(C)c1nc(NC[C@H]2CCCC[N@@H+]2C)ncc1F	ZINC001506403582	975150012	/nfs/dbraw/zinc/15/00/12/975150012.db2.gz	SURKZKKJSWYVFL-SNVBAGLBSA-N	1	0	267.352	1.578	50	0		CDAARO
O=c1cc(C[NH2+]C2CSCCSC2)nc[nH]1	ZINC001506420680	975158062	/nfs/dbraw/zinc/15/80/62/975158062.db2.gz	AJPQYCQYJIEVOH-UHFFFAOYSA-N	1	0	257.384	1.120	50	0		CDAARO
CC(C)(C)C[N@@H+]1CCN(C2CCOCC2)C[C@H]1CCO	ZINC000105626056	1163600739	/nfs/dbraw/zinc/60/07/39/1163600739.db2.gz	IAOFDBSFDXJGHE-OAHLLOKOSA-N	1	0	284.444	1.580	50	0		CDAARO
Cc1nn(C)c(C)c1C[NH2+][C@@H]1CCN(c2ccccn2)C1	ZINC000096494392	230383622	/nfs/dbraw/zinc/38/36/22/230383622.db2.gz	VLVLDTKBCYQVCL-CQSZACIVSA-N	1	0	285.395	1.800	50	0		CDAARO
C[C@H](CCc1ccccc1)NC(=O)CNCCC[NH+](C)C	ZINC000002632784	230367352	/nfs/dbraw/zinc/36/73/52/230367352.db2.gz	DLOHZKDIBOAONQ-OAHLLOKOSA-N	1	0	291.439	1.665	50	0		CDAARO
CCN1CCC(CNc2ncc(C)cn2)([NH+](C)C)CC1	ZINC000095505870	185000378	/nfs/dbraw/zinc/00/03/78/185000378.db2.gz	LLTYUZGTGYSECQ-UHFFFAOYSA-N	1	0	277.416	1.613	50	0		CDAARO
Cc1cc(CC(=O)N2C[C@@H](C(C)C)[C@H]([NH+](C)C)C2)on1	ZINC000095518680	185002949	/nfs/dbraw/zinc/00/29/49/185002949.db2.gz	CAQSCAJOCKFSPQ-UONOGXRCSA-N	1	0	279.384	1.570	50	0		CDAARO
Cc1cc(F)ccc1C(=O)N1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1	ZINC000186928459	230395875	/nfs/dbraw/zinc/39/58/75/230395875.db2.gz	JWVBMWDVCFRWJD-ZLKJLUDKSA-N	1	0	262.328	1.943	50	0		CDAARO
Cc1c[nH]c(C(=O)N2C[C@@H](C(C)C)[C@H]([NH+](C)C)C2)n1	ZINC000095528772	185004645	/nfs/dbraw/zinc/00/46/45/185004645.db2.gz	TZMPIXOXQFETMX-NWDGAFQWSA-N	1	0	264.373	1.376	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)CCCOc1ccc(F)cc1F	ZINC000124494845	187140224	/nfs/dbraw/zinc/14/02/24/187140224.db2.gz	FFBGQCALGMTZRV-LLVKDONJSA-N	1	0	298.333	1.944	50	0		CDAARO
COCCN(Cc1ccncc1)C(=O)C[C@@H]1CC[NH2+]C1	ZINC000215767817	398204523	/nfs/dbraw/zinc/20/45/23/398204523.db2.gz	AQYBUZHGYSMZTA-AWEZNQCLSA-N	1	0	277.368	1.056	50	0		CDAARO
C[C@@H]1CCCC[C@H]1[NH2+]Cc1nc(CS(C)(=O)=O)no1	ZINC000095941193	185036684	/nfs/dbraw/zinc/03/66/84/185036684.db2.gz	PRVSBVVGGMHJEF-NXEZZACHSA-N	1	0	287.385	1.283	50	0		CDAARO
CCCCN(C)S(=O)(=O)NC[C@@H]1CCC[N@H+](CC)C1	ZINC000095958220	185043271	/nfs/dbraw/zinc/04/32/71/185043271.db2.gz	ZXNIOTTXAKKHFG-ZDUSSCGKSA-N	1	0	291.461	1.285	50	0		CDAARO
Cc1cccc2c1ncnc2N1CCO[C@H]2CC[N@@H+](C)C[C@@H]21	ZINC000242263389	361754470	/nfs/dbraw/zinc/75/44/70/361754470.db2.gz	XYPKNWLFYIBACQ-GJZGRUSLSA-N	1	0	298.390	1.848	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@@H]1CC[N@H+](C[C@H]2CCC(=O)N2)C1	ZINC000242302334	361755947	/nfs/dbraw/zinc/75/59/47/361755947.db2.gz	YRMIXWNIPSHKPC-NWDGAFQWSA-N	1	0	297.399	1.112	50	0		CDAARO
COC(=O)c1cc(C[N@@H+]2CCC[C@H]([C@@H](C)O)C2)n(C)c1C	ZINC000242302206	361756020	/nfs/dbraw/zinc/75/60/20/361756020.db2.gz	YQMFSWGTFMJDKR-OLZOCXBDSA-N	1	0	294.395	1.713	50	0		CDAARO
O=C1CCCN1Cc1ccccc1C[NH2+][C@@H]1CCOC1	ZINC000088679426	342089605	/nfs/dbraw/zinc/08/96/05/342089605.db2.gz	NGHWIECMDLLNQY-OAHLLOKOSA-N	1	0	274.364	1.688	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1cc(-c2cccnc2)n[nH]1	ZINC000096118151	185101979	/nfs/dbraw/zinc/10/19/79/185101979.db2.gz	HTHXHFFUEJQITL-CYBMUJFWSA-N	1	0	299.378	1.686	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)CCCOc1ccccc1F	ZINC000125322321	187179480	/nfs/dbraw/zinc/17/94/80/187179480.db2.gz	YHCWKXOOZQWTNO-GFCCVEGCSA-N	1	0	280.343	1.805	50	0		CDAARO
CN(CCc1cnn(C)c1)CC[N@@H+]1C[C@H]2CC[C@@H]1C2	ZINC000243902142	361830363	/nfs/dbraw/zinc/83/03/63/361830363.db2.gz	BGUVKIYIBXQYDI-DZGCQCFKSA-N	1	0	262.401	1.379	50	0		CDAARO
CCn1cc(CNc2cc([C@H]3C[C@@H]([NH3+])C3)nc(N)n2)cn1	ZINC000244708092	361858362	/nfs/dbraw/zinc/85/83/62/361858362.db2.gz	KNJLWRKPCPMHIP-PHIMTYICSA-N	1	0	287.371	1.092	50	0		CDAARO
CCOC(=O)[C@@]1(COC)CCC[N@H+](Cc2cccnc2)C1	ZINC000252484204	361843136	/nfs/dbraw/zinc/84/31/36/361843136.db2.gz	FRIXJYSUEGTVNM-INIZCTEOSA-N	1	0	292.379	1.873	50	0		CDAARO
C[N@H+](CCCn1cnnn1)Cc1cnc2ccccc2n1	ZINC000244795682	361865323	/nfs/dbraw/zinc/86/53/23/361865323.db2.gz	RLQJPWCFNGCPHH-UHFFFAOYSA-N	1	0	283.339	1.138	50	0		CDAARO
Cc1ccsc1C[N@H+](CCO)CCN1CCCC1=O	ZINC000244852839	361866308	/nfs/dbraw/zinc/86/63/08/361866308.db2.gz	UZUHKSIIRXZGSS-UHFFFAOYSA-N	1	0	282.409	1.473	50	0		CDAARO
Cc1noc(C)c1CN(C)C(=O)[C@@H]1Cc2ccccc2C[NH2+]1	ZINC000095951320	539088214	/nfs/dbraw/zinc/08/82/14/539088214.db2.gz	SFYIOCFOBXDJTB-INIZCTEOSA-N	1	0	299.374	1.964	50	0		CDAARO
CO[C@@H](C[NH3+])CC(=O)N(C)Cc1cc2ccccc2o1	ZINC000262937716	361891058	/nfs/dbraw/zinc/89/10/58/361891058.db2.gz	UEBHXNXGLMQFEO-GFCCVEGCSA-N	1	0	276.336	1.755	50	0		CDAARO
C[N@H+]1C[C@H]2CC[C@@H](C1)N2CC(=O)NCC1CCCCC1	ZINC000585136815	342216037	/nfs/dbraw/zinc/21/60/37/342216037.db2.gz	UDIPFBIRFJBLDV-GASCZTMLSA-N	1	0	279.428	1.461	50	0		CDAARO
C[C@@H]([NH2+]CCCNc1ccccc1)c1cnnn1C	ZINC000585134582	342215646	/nfs/dbraw/zinc/21/56/46/342215646.db2.gz	AVEQMTWWRWWCLW-GFCCVEGCSA-N	1	0	259.357	1.968	50	0		CDAARO
Cc1c[nH+]cc(Br)c1N1CCC[C@@H](C(N)=O)C1	ZINC000585141783	342219204	/nfs/dbraw/zinc/21/92/04/342219204.db2.gz	FRYOWTSMKDYSCA-SECBINFHSA-N	1	0	298.184	1.854	50	0		CDAARO
Cc1cc([C@H]2CCC[N@@H+]([C@H]3CCN(C)C3=O)C2)[nH]n1	ZINC000685939593	539045719	/nfs/dbraw/zinc/04/57/19/539045719.db2.gz	WOQNZAFQRHURBK-AAEUAGOBSA-N	1	0	262.357	1.128	50	0		CDAARO
c1n[nH]cc1O[C@@H]1COC[C@@H]1[NH2+][C@@H]1CCc2ccccc2C1	ZINC000685941120	539045881	/nfs/dbraw/zinc/04/58/81/539045881.db2.gz	RSGGNOYTGINXRH-HYVNUMGLSA-N	1	0	299.374	1.703	50	0		CDAARO
COC1(OC)CCOC[C@@H]1[NH2+]CCc1ccncc1C	ZINC000685943206	539046032	/nfs/dbraw/zinc/04/60/32/539046032.db2.gz	GBFWSHGBCPXDCW-AWEZNQCLSA-N	1	0	280.368	1.300	50	0		CDAARO
COc1ccc2nc(C)cc(C(=O)N3CC[NH2+]C[C@@H]3C)c2c1	ZINC000126370941	187235252	/nfs/dbraw/zinc/23/52/52/187235252.db2.gz	SYVWNCYZTYKHEJ-LBPRGKRZSA-N	1	0	299.374	1.986	50	0		CDAARO
[NH3+][C@H](C(=O)N1CC[C@H]2OCCC[C@H]2C1)c1ccccc1	ZINC000252586074	342387259	/nfs/dbraw/zinc/38/72/59/342387259.db2.gz	NGQVWZPTWQUYRU-ZNMIVQPWSA-N	1	0	274.364	1.714	50	0		CDAARO
C[C@@H](Oc1ccccc1Cl)C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178546961	362246770	/nfs/dbraw/zinc/24/67/70/362246770.db2.gz	AHHAHBNKYVELPQ-GHMZBOCLSA-N	1	0	282.771	1.915	50	0		CDAARO
NC(=O)[C@H]1CCC[N@H+](Cc2ccc3c(c2)OCCO3)C1	ZINC000084459121	362265063	/nfs/dbraw/zinc/26/50/63/362265063.db2.gz	XFWSGVNCONYHED-LBPRGKRZSA-N	1	0	276.336	1.155	50	0		CDAARO
O=C1NCCN(C[C@@H]2CCCCO2)[C@H]1c1cccs1	ZINC000084437072	362263476	/nfs/dbraw/zinc/26/34/76/362263476.db2.gz	ZWDCLBOWWDHIPQ-AAEUAGOBSA-N	1	0	280.393	1.790	50	0		CDAARO
CCOC(=O)[C@@H](C)NC1CCN(C(=O)C(C)C)CC1	ZINC000084791185	362272110	/nfs/dbraw/zinc/27/21/10/362272110.db2.gz	OOPWGVBTRVVSPT-LLVKDONJSA-N	1	0	270.373	1.175	50	0		CDAARO
CNC(=O)C[C@@H](C)[N@H+](C)Cc1cncn1CC(C)C	ZINC000252479833	362383389	/nfs/dbraw/zinc/38/33/89/362383389.db2.gz	BNMLNRHYZASBMN-GFCCVEGCSA-N	1	0	266.389	1.496	50	0		CDAARO
Cc1ccn2ncc(C(=O)NC3(C[NH3+])CCCC3)c2n1	ZINC000097228959	185567421	/nfs/dbraw/zinc/56/74/21/185567421.db2.gz	QHRPOCKNBBCUNV-UHFFFAOYSA-N	1	0	273.340	1.039	50	0		CDAARO
CN(Cc1ccc2c(c1)OCO2)C(=O)[C@H]1CCC[C@H]1[NH3+]	ZINC000085367108	179037825	/nfs/dbraw/zinc/03/78/25/179037825.db2.gz	PJSQJAKAYULGMC-NWDGAFQWSA-N	1	0	276.336	1.501	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@H]1CCC[C@@H]1[NH3+]	ZINC000085375773	179043962	/nfs/dbraw/zinc/04/39/62/179043962.db2.gz	CNHBDSSILIVBOA-UWVGGRQHSA-N	1	0	253.371	1.537	50	0		CDAARO
CCOC(=O)[C@@]12C[NH2+]C[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000051943474	346372374	/nfs/dbraw/zinc/37/23/74/346372374.db2.gz	LWIRXZLYPPQKOS-IINYFYTJSA-N	1	0	284.356	1.006	50	0		CDAARO
CC[C@H](NC(=O)N1CC[C@@H](C[NH+](C)C)C1)c1noc(C)n1	ZINC000130234026	346646988	/nfs/dbraw/zinc/64/69/88/346646988.db2.gz	FCNQJRMTYWTAEI-RYUDHWBXSA-N	1	0	295.387	1.422	50	0		CDAARO
Cn1c(=O)c2ccccc2n(CC[NH+]2CCCCC2)c1=O	ZINC000071282897	282560136	/nfs/dbraw/zinc/56/01/36/282560136.db2.gz	CUDWDCOVHDZALL-UHFFFAOYSA-N	1	0	287.363	1.186	50	0		CDAARO
CCCC[C@H]([NH2+][C@@H]1CCN(C(C)=O)C[C@@H]1CC)C(N)=O	ZINC000089950131	282974791	/nfs/dbraw/zinc/97/47/91/282974791.db2.gz	BMPWBKARDJXSBE-MJBXVCDLSA-N	1	0	283.416	1.267	50	0		CDAARO
[NH3+]C1CCN(S(=O)(=O)c2ccc(F)cc2Cl)CC1	ZINC000036753777	362946083	/nfs/dbraw/zinc/94/60/83/362946083.db2.gz	QXGOVDXHFTWKGO-UHFFFAOYSA-N	1	0	292.763	1.591	50	0		CDAARO
CC(C)C[N@@H+]1CCCN(C(=O)C[C@@H]2CCCOC2)CC1	ZINC000584900181	349362189	/nfs/dbraw/zinc/36/21/89/349362189.db2.gz	RFXKONMUDRBAMV-HNNXBMFYSA-N	1	0	282.428	1.993	50	0		CDAARO
CC(C)[C@@H]1C[N@H+](Cc2ccncc2)C[C@H]1NC(=O)N(C)C	ZINC000091620211	180208423	/nfs/dbraw/zinc/20/84/23/180208423.db2.gz	GBUKCYCILQWPOT-LSDHHAIUSA-N	1	0	290.411	1.809	50	0		CDAARO
COc1ccccc1CCC(=O)N1C[C@H]([NH3+])[C@@H](C2CC2)C1	ZINC000091707099	180229964	/nfs/dbraw/zinc/22/99/64/180229964.db2.gz	YKBLSAAGJSICJH-CABCVRRESA-N	1	0	288.391	1.824	50	0		CDAARO
CC[N@H+](C)C[C@@H]1CN(C(=O)c2ccc(C)nc2)C[C@@H]1CO	ZINC000091860027	180275148	/nfs/dbraw/zinc/27/51/48/180275148.db2.gz	VNGAYPLRKGMGKA-HUUCEWRRSA-N	1	0	291.395	1.022	50	0		CDAARO
O=C(N[C@@H]1CC[NH2+]C1)c1c[nH]nc1-c1ccccc1	ZINC000091818871	180262765	/nfs/dbraw/zinc/26/27/65/180262765.db2.gz	BUHDFNLUUNFLBR-LLVKDONJSA-N	1	0	256.309	1.168	50	0		CDAARO
CN(C)c1ccc(C[N@@H+]2CC[C@]3(C2)CCCNC3=O)cn1	ZINC000092019765	180307320	/nfs/dbraw/zinc/30/73/20/180307320.db2.gz	PCMNPOGHGDRWGE-INIZCTEOSA-N	1	0	288.395	1.250	50	0		CDAARO
Fc1ccccc1C[NH2+]C[C@H]1CN(C2CC2)CCO1	ZINC000106380840	186112002	/nfs/dbraw/zinc/11/20/02/186112002.db2.gz	VFMYCXHGNCOCJK-AWEZNQCLSA-N	1	0	264.344	1.779	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(Cc2cccc(F)c2)C[C@@H]1C	ZINC000106840879	186140005	/nfs/dbraw/zinc/14/00/05/186140005.db2.gz	OKARWRQJPPENGS-STQMWFEESA-N	1	0	266.360	1.713	50	0		CDAARO
Cc1ccccc1CCNC(=O)[C@@H](C)[N@@H+]1CC[C@@H](CO)C1	ZINC000108123933	186205275	/nfs/dbraw/zinc/20/52/75/186205275.db2.gz	YNWBSXYNXQEFLQ-HUUCEWRRSA-N	1	0	290.407	1.356	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCN(S(=O)(=O)c2cccc(F)c2)C1	ZINC000109040348	186240608	/nfs/dbraw/zinc/24/06/08/186240608.db2.gz	HWSSQNNJGYUBKU-GHMZBOCLSA-N	1	0	286.372	1.574	50	0		CDAARO
O=C(C1CC1)N1CC(N2CCc3ccccc3C2)C1	ZINC000390825921	351371995	/nfs/dbraw/zinc/37/19/95/351371995.db2.gz	QFEMAWGYGUYYIC-UHFFFAOYSA-N	1	0	256.349	1.666	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCCN1C(=O)c1cccc(-n2cncn2)c1	ZINC000122217319	187021680	/nfs/dbraw/zinc/02/16/80/187021680.db2.gz	XZKPBWZSBCLWKJ-WFASDCNBSA-N	1	0	299.378	1.609	50	0		CDAARO
C[NH+](C)CCN(Cc1ccccn1)C(=O)[C@H]1CCCCO1	ZINC000122718577	187047609	/nfs/dbraw/zinc/04/76/09/187047609.db2.gz	NZHDMVKQVNSLKY-OAHLLOKOSA-N	1	0	291.395	1.541	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1nccc(OC)n1	ZINC000264860843	363173902	/nfs/dbraw/zinc/17/39/02/363173902.db2.gz	LWWLTVJMRWSINJ-NSHDSACASA-N	1	0	250.346	1.772	50	0		CDAARO
Cc1cc(C)nc(NCCC[N@@H+]2CCC[C@@H](O)C2)n1	ZINC000065431300	363246633	/nfs/dbraw/zinc/24/66/33/363246633.db2.gz	YQMNLKUAAXWZNL-CYBMUJFWSA-N	1	0	264.373	1.352	50	0		CDAARO
C[C@H](Nc1ncnc2c1cnn2C)c1ccncc1	ZINC000014215861	366132834	/nfs/dbraw/zinc/13/28/34/366132834.db2.gz	BGHGKBFEFDQPCH-VIFPVBQESA-N	1	0	254.297	1.931	50	0		CDAARO
O=C(C1CC[NH2+]CC1)N1CCC[N@@H+](C2CCC2)CC1	ZINC000090624519	358484314	/nfs/dbraw/zinc/48/43/14/358484314.db2.gz	JEDKFRUWDJYLCQ-UHFFFAOYSA-N	1	0	265.401	1.073	50	0		CDAARO
CC[C@H](O)C[N@@H+]1CCC[C@@H](c2nncn2C2CC2)C1	ZINC000195549426	363455176	/nfs/dbraw/zinc/45/51/76/363455176.db2.gz	JWIPMRAUTBYEJN-YPMHNXCESA-N	1	0	264.373	1.563	50	0		CDAARO
COc1ccc(OC(=O)N(C)C)c(C[NH+](C)C)c1	ZINC000000317594	355904354	/nfs/dbraw/zinc/90/43/54/355904354.db2.gz	AXHUPMKXGMVUKZ-UHFFFAOYSA-N	1	0	252.314	1.817	50	0		CDAARO
[NH3+]CCNC(=O)c1ncsc1-c1cccc(F)c1	ZINC000002555369	355974581	/nfs/dbraw/zinc/97/45/81/355974581.db2.gz	SCKBPXUWGMKLDM-UHFFFAOYSA-N	1	0	265.313	1.638	50	0		CDAARO
C[NH+](C)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000002903669	355987321	/nfs/dbraw/zinc/98/73/21/355987321.db2.gz	RODFIHMZMQWGCK-UHFFFAOYSA-N	1	0	260.334	1.056	50	0		CDAARO
CC(=O)Nc1ccc(C(=O)NCCC[NH+](C)C)cc1	ZINC000002931011	355988248	/nfs/dbraw/zinc/98/82/48/355988248.db2.gz	DQJMISBYHPSOCM-UHFFFAOYSA-N	1	0	263.341	1.327	50	0		CDAARO
COc1ccc(OC)c(C[NH2+]CCCN2CCOCC2)c1	ZINC000002424636	355969902	/nfs/dbraw/zinc/96/99/02/355969902.db2.gz	AXOPRUJNLCSVAJ-UHFFFAOYSA-N	1	0	294.395	1.516	50	0		CDAARO
C[NH+](C)CCn1ncc2cc(NC(N)=S)ccc21	ZINC000004050224	356015790	/nfs/dbraw/zinc/01/57/90/356015790.db2.gz	KXQVHYSJKQROLO-UHFFFAOYSA-N	1	0	263.370	1.253	50	0		CDAARO
CCOC(CC[NH2+]C[C@H](O)C(F)(F)F)OCC	ZINC000004092407	356018191	/nfs/dbraw/zinc/01/81/91/356018191.db2.gz	PUWYVRMSYNFZKC-QMMMGPOBSA-N	1	0	259.268	1.288	50	0		CDAARO
C[C@H]([NH2+][C@@H]1CCN(c2ccccc2)C1=O)[C@@H]1CCCO1	ZINC000097373177	356093648	/nfs/dbraw/zinc/09/36/48/356093648.db2.gz	IDYYTJXAGAFCHE-CFVMTHIKSA-N	1	0	274.364	1.949	50	0		CDAARO
C[C@H](Oc1ccc(F)cc1F)C(=O)NC1CC[NH+](C)CC1	ZINC000012380615	356296177	/nfs/dbraw/zinc/29/61/77/356296177.db2.gz	YWOKQPKOROPBFV-JTQLQIEISA-N	1	0	298.333	1.943	50	0		CDAARO
COc1cccc2cc(C(=O)NCC[NH+](C)C)oc21	ZINC000013675402	356352899	/nfs/dbraw/zinc/35/28/99/356352899.db2.gz	OISLGRNRYPUBQB-UHFFFAOYSA-N	1	0	262.309	1.733	50	0		CDAARO
CCOc1ccc(C[N@H+](C)CCC(N)=O)cc1OC	ZINC000016373057	356438046	/nfs/dbraw/zinc/43/80/46/356438046.db2.gz	ZSULRAIITQEIPR-UHFFFAOYSA-N	1	0	266.341	1.401	50	0		CDAARO
C[C@@H]1CN(C(=O)C[C@H]([NH3+])c2ccccc2)C[C@@H](C)O1	ZINC000019426038	356484841	/nfs/dbraw/zinc/48/48/41/356484841.db2.gz	CMVFCAPGNXSBNG-BZPMIXESSA-N	1	0	262.353	1.712	50	0		CDAARO
CC[NH+]1CCN(CCC(=O)Nc2ccc(OC)cc2)CC1	ZINC000019528183	356490284	/nfs/dbraw/zinc/49/02/84/356490284.db2.gz	CWSSMKLXUPUYNE-UHFFFAOYSA-N	1	0	291.395	1.661	50	0		CDAARO
OCCc1cn(CC2CC[NH+](Cc3ccoc3)CC2)nn1	ZINC000019745314	356499406	/nfs/dbraw/zinc/49/94/06/356499406.db2.gz	ZOHQTJSAICKURN-UHFFFAOYSA-N	1	0	290.367	1.318	50	0		CDAARO
CCC[N@H+](CC1CC1)[C@@H](C)C(=O)NC(=O)NCC	ZINC000096970310	283194895	/nfs/dbraw/zinc/19/48/95/283194895.db2.gz	BCFCTQJFJFOLAN-JTQLQIEISA-N	1	0	255.362	1.343	50	0		CDAARO
CC[NH+]1CCN(CCOc2ccc(C=O)cc2)CC1	ZINC000023094348	356627665	/nfs/dbraw/zinc/62/76/65/356627665.db2.gz	NKJUABQRXOGQKI-UHFFFAOYSA-N	1	0	262.353	1.515	50	0		CDAARO
CC[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(C(N)=O)cc1	ZINC000023991260	356650829	/nfs/dbraw/zinc/65/08/29/356650829.db2.gz	STQLPDZRQFBAED-CQSZACIVSA-N	1	0	289.379	1.989	50	0		CDAARO
OCC[NH2+]CCNCc1cccc(Br)c1	ZINC000023256562	356637823	/nfs/dbraw/zinc/63/78/23/356637823.db2.gz	ANVIRLPLCAWTGU-UHFFFAOYSA-N	1	0	273.174	1.121	50	0		CDAARO
Cc1ccsc1CN(C)Cc1nc(N)nc(N)n1	ZINC000024032005	356651776	/nfs/dbraw/zinc/65/17/76/356651776.db2.gz	NTSGREYYOFCQOT-UHFFFAOYSA-N	1	0	264.358	1.038	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)c1cnccn1)c1cccs1	ZINC000027676258	356711873	/nfs/dbraw/zinc/71/18/73/356711873.db2.gz	WXTJOXZIVPBIKO-LLVKDONJSA-N	1	0	276.365	1.571	50	0		CDAARO
C[C@H](C1CC1)[N@H+](C)CCOc1ccc(S(N)(=O)=O)cc1	ZINC000030971167	356758090	/nfs/dbraw/zinc/75/80/90/356758090.db2.gz	NTDQGGSMLKUEJS-LLVKDONJSA-N	1	0	298.408	1.443	50	0		CDAARO
COc1cc2c(cc1OC)C[N@H+](CCCO)CC2	ZINC000019785902	356804526	/nfs/dbraw/zinc/80/45/26/356804526.db2.gz	FRZFXAJJOUAIJV-UHFFFAOYSA-N	1	0	251.326	1.444	50	0		CDAARO
CC[C@@H](CO)[NH2+]C[C@H](O)COc1cc(C)ccc1C	ZINC000026781353	356823118	/nfs/dbraw/zinc/82/31/18/356823118.db2.gz	HYEIYIKEUWTZCS-KBPBESRZSA-N	1	0	267.369	1.404	50	0		CDAARO
COC(=O)[C@H](CCC[NH3+])NC(=O)OCc1ccccc1	ZINC000036407110	356873391	/nfs/dbraw/zinc/87/33/91/356873391.db2.gz	CGWOYYFSONWCPS-LBPRGKRZSA-N	1	0	280.324	1.193	50	0		CDAARO
CCCCC[NH+]1CCC(Cn2cc(CO)nn2)CC1	ZINC000055183247	357329938	/nfs/dbraw/zinc/32/99/38/357329938.db2.gz	SQVLYTQTKYRRQQ-UHFFFAOYSA-N	1	0	266.389	1.673	50	0		CDAARO
COc1ccc(C[C@@H](C[NH3+])CO)cc1Br	ZINC000063065247	357502685	/nfs/dbraw/zinc/50/26/85/357502685.db2.gz	KDOUUEQTPBNYQY-VIFPVBQESA-N	1	0	274.158	1.567	50	0		CDAARO
O=S(=O)([N-][C@@H]1CCC[NH2+]C1)c1c(F)cc(F)cc1F	ZINC000037908914	357508474	/nfs/dbraw/zinc/50/84/74/357508474.db2.gz	JISQAOSCYBREHC-MRVPVSSYSA-N	1	0	294.298	1.134	50	0		CDAARO
Cc1cccc(Cn2c(=O)[nH]nc2[C@@H]2CCC[N@@H+](C)C2)c1	ZINC000065397921	357536733	/nfs/dbraw/zinc/53/67/33/357536733.db2.gz	AAGKDWWBRNPFAD-CQSZACIVSA-N	1	0	286.379	1.737	50	0		CDAARO
CC(C)(C)n1cc(C2=CC[N@H+](CCCC(N)=O)CC2)cn1	ZINC000065493127	357544253	/nfs/dbraw/zinc/54/42/53/357544253.db2.gz	MNSBABUBVBNAJN-UHFFFAOYSA-N	1	0	290.411	1.993	50	0		CDAARO
C[NH2+]Cc1n[nH]c(=O)n1-c1ccc(C)c(Cl)c1	ZINC000065532575	357548208	/nfs/dbraw/zinc/54/82/08/357548208.db2.gz	ULACCYQWBMHHSX-UHFFFAOYSA-N	1	0	252.705	1.242	50	0		CDAARO
CC(C)CC[C@]1(C2CC[NH2+]CC2)NC(=O)NC1=O	ZINC000067784474	357625856	/nfs/dbraw/zinc/62/58/56/357625856.db2.gz	HGPNSJBULQTQDQ-CYBMUJFWSA-N	1	0	253.346	1.000	50	0		CDAARO
CC(C)(C)N1C[C@H]([NH2+]C2CCSCC2)CC1=O	ZINC000080234917	538862292	/nfs/dbraw/zinc/86/22/92/538862292.db2.gz	CTKAYQXGSCGHCZ-LLVKDONJSA-N	1	0	256.415	1.871	50	0		CDAARO
CCn1nc(C)c(C(=O)NCC[C@H]2CCC[N@H+](C)C2)c1C	ZINC000067847764	357631664	/nfs/dbraw/zinc/63/16/64/357631664.db2.gz	FGHCYDQKLBNICD-CQSZACIVSA-N	1	0	292.427	1.982	50	0		CDAARO
CCn1ccnc1CN1CC[C@H](CNC(=O)C=C(C)C)C1	ZINC000067885000	357635340	/nfs/dbraw/zinc/63/53/40/357635340.db2.gz	ODTZHXYZFGHZAY-CQSZACIVSA-N	1	0	290.411	1.807	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCN(C(=O)Cc2cccs2)C1	ZINC000070172263	357712495	/nfs/dbraw/zinc/71/24/95/357712495.db2.gz	CRYPLHDLLGYSBZ-WDEREUQCSA-N	1	0	252.383	1.876	50	0		CDAARO
COCC[N@H+](C)C[C@H]1CC[C@@H](Cc2cncc(OC)c2)O1	ZINC000072417802	357833983	/nfs/dbraw/zinc/83/39/83/357833983.db2.gz	PBWXUULVOOYRJC-LSDHHAIUSA-N	1	0	294.395	1.759	50	0		CDAARO
COC[C@@H]([NH3+])C(=O)N1CCC(Oc2cccc(C)c2)CC1	ZINC000082133879	358149076	/nfs/dbraw/zinc/14/90/76/358149076.db2.gz	QIXSCXSGVXIPDG-OAHLLOKOSA-N	1	0	292.379	1.339	50	0		CDAARO
O=C(CO)N1C[C@H]2CC[C@@H]1C[N@H+](Cc1ccc(F)cc1)C2	ZINC000092028379	358537104	/nfs/dbraw/zinc/53/71/04/358537104.db2.gz	GUVLRMIHNIASKY-DZGCQCFKSA-N	1	0	292.354	1.241	50	0		CDAARO
CN(CCCC[NH+]1CCOCC1)c1ccncn1	ZINC000095368145	358686924	/nfs/dbraw/zinc/68/69/24/358686924.db2.gz	AFMGMHFMEUEEDZ-UHFFFAOYSA-N	1	0	250.346	1.025	50	0		CDAARO
c1c(-c2ccnc3ccccc32)nnn1C[C@@H]1C[NH2+]CCO1	ZINC000095387150	358691116	/nfs/dbraw/zinc/69/11/16/358691116.db2.gz	CABAVMYMPKZESK-LBPRGKRZSA-N	1	0	295.346	1.482	50	0		CDAARO
COCC(=O)N1C[C@H]2CC[C@H](C[N@H+]2Cc2ccccc2)C1	ZINC000095391060	358691765	/nfs/dbraw/zinc/69/17/65/358691765.db2.gz	YMEYCJBMNMWGJT-HZPDHXFCSA-N	1	0	288.391	1.756	50	0		CDAARO
CS[C@@H](CO)[C@@H](C)NC(=O)C1CC[NH+](C(C)C)CC1	ZINC000095445644	358694171	/nfs/dbraw/zinc/69/41/71/358694171.db2.gz	FMWWRLULHVWRFJ-YPMHNXCESA-N	1	0	288.457	1.335	50	0		CDAARO
COc1cc(C)c(C(=O)N2CCC[NH2+]CC2)cc1OC	ZINC000098163566	358733955	/nfs/dbraw/zinc/73/39/55/358733955.db2.gz	SJJGYKXSQGXOBO-UHFFFAOYSA-N	1	0	278.352	1.448	50	0		CDAARO
C[NH+]1CCC(CCC(=O)N[C@H](CO)c2ccccc2)CC1	ZINC000097553156	358785207	/nfs/dbraw/zinc/78/52/07/358785207.db2.gz	ZUMXUXUARSSYGH-MRXNPFEDSA-N	1	0	290.407	1.958	50	0		CDAARO
CC(C)n1cncc1CN1CC[NH+](CCCCO)CC1	ZINC000097636638	358789339	/nfs/dbraw/zinc/78/93/39/358789339.db2.gz	NOMLPVCLUZGNBB-UHFFFAOYSA-N	1	0	280.416	1.354	50	0		CDAARO
Cc1nc(C)c(CC(=O)NCCc2c[nH]cn2)s1	ZINC000097679809	358793089	/nfs/dbraw/zinc/79/30/89/358793089.db2.gz	CPSYEJXDLJWGCG-UHFFFAOYSA-N	1	0	264.354	1.384	50	0		CDAARO
CS[C@H](C)CC[NH+]1CCN(c2cnccn2)CC1	ZINC000215543056	358894150	/nfs/dbraw/zinc/89/41/50/358894150.db2.gz	XLVZVMGFQUWEOW-GFCCVEGCSA-N	1	0	266.414	1.740	50	0		CDAARO
O=C(C[NH2+]C1CC1)N[C@H](c1cccnc1)C(F)(F)F	ZINC000215679626	358898411	/nfs/dbraw/zinc/89/84/11/358898411.db2.gz	ZDDLZUPEXUZXMW-LLVKDONJSA-N	1	0	273.258	1.553	50	0		CDAARO
COCCNC(=O)N(C)[C@H](C)C1CC[NH+](C)CC1	ZINC000095467192	358928883	/nfs/dbraw/zinc/92/88/83/358928883.db2.gz	UOQMYBRSQLQDQR-LLVKDONJSA-N	1	0	257.378	1.005	50	0		CDAARO
CCNC(=O)NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1C	ZINC000012775852	359000400	/nfs/dbraw/zinc/00/04/00/359000400.db2.gz	KEEOPGVHSKSFMK-VXGBXAGGSA-N	1	0	277.368	1.880	50	0		CDAARO
NC(=O)c1cccnc1N1CC[NH+](CC2CCC2)CC1	ZINC000032578234	359218144	/nfs/dbraw/zinc/21/81/44/359218144.db2.gz	BCGVESXMNJNXNP-UHFFFAOYSA-N	1	0	274.368	1.103	50	0		CDAARO
Cc1nc(N)ncc1C(=O)N[C@@H](c1nccn1C)C(C)C	ZINC000223512359	359430985	/nfs/dbraw/zinc/43/09/85/359430985.db2.gz	JDICHDXXHWIGNG-LLVKDONJSA-N	1	0	288.355	1.228	50	0		CDAARO
O[C@@H]1CN(c2noc(C3CC3)n2)CC[N@@H+](C2CCCC2)C1	ZINC000223957889	359478590	/nfs/dbraw/zinc/47/85/90/359478590.db2.gz	KSLZIBRJTFEERR-ZDUSSCGKSA-N	1	0	292.383	1.373	50	0		CDAARO
OC[C@@H]1C[N@@H+](C2CCC2)C[C@H]1c1nc(C2CC2)no1	ZINC000257194219	359603560	/nfs/dbraw/zinc/60/35/60/359603560.db2.gz	SVEUNVZOMBSHSJ-CMPLNLGQSA-N	1	0	263.341	1.507	50	0		CDAARO
CCOCC[N@H+](C)C[C@H]1CN(c2ccccc2)CCO1	ZINC000408522621	359928310	/nfs/dbraw/zinc/92/83/10/359928310.db2.gz	KQJHKGIUTDPICC-INIZCTEOSA-N	1	0	278.396	1.860	50	0		CDAARO
C[NH+](C)CCc1ccc(C(=O)NC[C@@H]2CCCOC2)cc1	ZINC000408524310	359933377	/nfs/dbraw/zinc/93/33/77/359933377.db2.gz	ZJOHBVXMJPFFAS-HNNXBMFYSA-N	1	0	290.407	1.947	50	0		CDAARO
CC[N@H+]1C[C@H](NS(=O)(=O)/C=C/c2ccccc2)[C@@H](C)C1	ZINC000257366151	359945092	/nfs/dbraw/zinc/94/50/92/359945092.db2.gz	LMYWPOXQFKEENR-IXLVIVEVSA-N	1	0	294.420	1.917	50	0		CDAARO
Cc1nc(CC[NH3+])cc(N(C)[C@H](C)c2ccncn2)n1	ZINC000067894171	360201983	/nfs/dbraw/zinc/20/19/83/360201983.db2.gz	XRICEXZCUUQFHY-SNVBAGLBSA-N	1	0	272.356	1.274	50	0		CDAARO
CN1Cc2cccn2C[C@H]1CNC(=O)c1cccc(F)c1	ZINC000409420309	360223117	/nfs/dbraw/zinc/22/31/17/360223117.db2.gz	FSAHNSALRMULLB-OAHLLOKOSA-N	1	0	287.338	1.871	50	0		CDAARO
Cc1cc(CNC(=O)CN2CC[N@@H+](C)C[C@@H]2C)ccc1F	ZINC000089587735	360500510	/nfs/dbraw/zinc/50/05/10/360500510.db2.gz	NZVAFSOAMYNJGL-ZDUSSCGKSA-N	1	0	293.386	1.386	50	0		CDAARO
CCn1ccc(CSc2nnc(C[NH2+]C)n2C)n1	ZINC000426575067	360685414	/nfs/dbraw/zinc/68/54/14/360685414.db2.gz	SKNHVWWWMNHWIK-UHFFFAOYSA-N	1	0	266.374	1.043	50	0		CDAARO
Cn1cncc1CSc1nnc([C@H]2CCC[NH2+]C2)n1C	ZINC000426387797	360662391	/nfs/dbraw/zinc/66/23/91/360662391.db2.gz	CZCOCPMYCLAFRZ-JTQLQIEISA-N	1	0	292.412	1.308	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)CCOc2ccccc2Cl)C1	ZINC000178538233	189125559	/nfs/dbraw/zinc/12/55/59/189125559.db2.gz	IITTUKXVNOAOEP-LLVKDONJSA-N	1	0	282.771	1.916	50	0		CDAARO
C1=CC[C@H](C[N@H+]2CC[C@@H](CN3CCOCC3)C2)CC1	ZINC000245745822	360747870	/nfs/dbraw/zinc/74/78/70/360747870.db2.gz	MSTSDPOUJXITSU-HOTGVXAUSA-N	1	0	264.413	1.997	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2ccc(N3CCCC3)nc2)C1	ZINC000178974465	189158846	/nfs/dbraw/zinc/15/88/46/189158846.db2.gz	LSJYCMGRKRHQAI-ZDUSSCGKSA-N	1	0	288.395	1.363	50	0		CDAARO
Cc1cc(C)c(OCC(=O)N(C)[C@H]2CC[NH2+]C2)c(C)c1	ZINC000179097092	189168855	/nfs/dbraw/zinc/16/88/55/189168855.db2.gz	VMFAQLWIKIPDKK-AWEZNQCLSA-N	1	0	276.380	1.811	50	0		CDAARO
COc1cccc([C@H](O)C[NH2+]Cc2cnn(C)c2)c1	ZINC000096481069	360862223	/nfs/dbraw/zinc/86/22/23/360862223.db2.gz	JIAFTBPSLOZTMD-CQSZACIVSA-N	1	0	261.325	1.252	50	0		CDAARO
CC(C)([NH3+])CNS(=O)(=O)c1ccc(F)c(Cl)c1	ZINC000129648683	361197538	/nfs/dbraw/zinc/19/75/38/361197538.db2.gz	GVABFYQWFBBWBH-UHFFFAOYSA-N	1	0	280.752	1.495	50	0		CDAARO
CCOc1cc2c(cc1C[NH2+]C[C@H](C)O)O[C@@H](C)C2	ZINC000035111537	361258154	/nfs/dbraw/zinc/25/81/54/361258154.db2.gz	DAOZUFSMWUNKFJ-QWRGUYRKSA-N	1	0	265.353	1.879	50	0		CDAARO
Cc1ccccc1[C@H](CN1CCOCC1)[NH2+]C[C@H](C)O	ZINC000183277803	189353360	/nfs/dbraw/zinc/35/33/60/189353360.db2.gz	ZUAQQTDNDIILLT-HOCLYGCPSA-N	1	0	278.396	1.339	50	0		CDAARO
CCc1nnc(C[NH2+][C@@H]2CC(C)(C)OC2(C)C)n1C	ZINC000189230678	361653823	/nfs/dbraw/zinc/65/38/23/361653823.db2.gz	ZDMMKNZYEPFLSX-SNVBAGLBSA-N	1	0	266.389	1.813	50	0		CDAARO
C[C@@H]1CN(C(=O)CCOc2ccc(F)cc2)CC[NH2+]1	ZINC000188404674	189501064	/nfs/dbraw/zinc/50/10/64/189501064.db2.gz	JIMGRJZZGVPZAQ-LLVKDONJSA-N	1	0	266.316	1.415	50	0		CDAARO
CCC[NH+]1CCC(NC[C@H](O)c2ccco2)CC1	ZINC000088264629	364648059	/nfs/dbraw/zinc/64/80/59/364648059.db2.gz	NFQWMNJWUHTNDK-ZDUSSCGKSA-N	1	0	252.358	1.777	50	0		CDAARO
CCC[NH+]1CCC(NC[C@@H](O)c2ccco2)CC1	ZINC000088264632	364648186	/nfs/dbraw/zinc/64/81/86/364648186.db2.gz	NFQWMNJWUHTNDK-CYBMUJFWSA-N	1	0	252.358	1.777	50	0		CDAARO
CN(CC[N@H+](C)C1CC1)C(=O)c1cccc2cn[nH]c21	ZINC000186783323	364651867	/nfs/dbraw/zinc/65/18/67/364651867.db2.gz	ZIVGWUCAFBCRSU-UHFFFAOYSA-N	1	0	272.352	1.729	50	0		CDAARO
C[N@H+](CCN1C(=O)c2ccccc2C1=O)[C@H]1CCSC1	ZINC000089935914	366971381	/nfs/dbraw/zinc/97/13/81/366971381.db2.gz	VVZDKJOYWFGOGT-NSHDSACASA-N	1	0	290.388	1.720	50	0		CDAARO
CC[C@@H](CO)[NH+]1CCN(Cc2ncc(C3CC3)o2)CC1	ZINC000089943516	366976006	/nfs/dbraw/zinc/97/60/06/366976006.db2.gz	QVICGJTYGRGOTA-ZDUSSCGKSA-N	1	0	279.384	1.441	50	0		CDAARO
OC[C@H]1C[C@@H](O)C[N@@H+]1CCSC1CCCCC1	ZINC000252488462	367577687	/nfs/dbraw/zinc/57/76/87/367577687.db2.gz	ISHPOYHPSRVTLM-VXGBXAGGSA-N	1	0	259.415	1.480	50	0		CDAARO
COC(=O)C(C)(C)CC[N@@H+]1CCO[C@H]([C@H]2CCCO2)C1	ZINC000252584463	368161695	/nfs/dbraw/zinc/16/16/95/368161695.db2.gz	AOOUKTDESNNFHA-OLZOCXBDSA-N	1	0	285.384	1.456	50	0		CDAARO
C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1C[C@H](O)CN1CCOCC1	ZINC000252581984	368161722	/nfs/dbraw/zinc/16/17/22/368161722.db2.gz	VMDZXINKFCTKOC-QKPAOTATSA-N	1	0	282.428	1.333	50	0		CDAARO
COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]([NH3+])CC(C)C	ZINC000001605754	369925613	/nfs/dbraw/zinc/92/56/13/369925613.db2.gz	DJBPSNXKZLENEZ-UONOGXRCSA-N	1	0	292.379	1.260	50	0	biogenic	CDAARO
COCC[N@H+]1[C@H](C)CN(Cc2ccnc(N)c2)C[C@@H]1C	ZINC000193446376	370493658	/nfs/dbraw/zinc/49/36/58/370493658.db2.gz	ZXCFLQMKDMIRQY-BETUJISGSA-N	1	0	278.400	1.205	50	0		CDAARO
O=C(CC1CC1)NCC1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000575609199	370635294	/nfs/dbraw/zinc/63/52/94/370635294.db2.gz	YKJNAFOCMSOSPY-CQSZACIVSA-N	1	0	266.385	1.404	50	0		CDAARO
C[NH+](C)C[C@H]1CN(Cc2ccc3c[nH]nc3c2)CCO1	ZINC000179220530	372259608	/nfs/dbraw/zinc/25/96/08/372259608.db2.gz	MHDDMZQKICUJFF-AWEZNQCLSA-N	1	0	274.368	1.325	50	0		CDAARO
CN1C(=O)N(Cc2ccccc2)C2(CC[NH2+]CC2)C1=O	ZINC000299786127	372762945	/nfs/dbraw/zinc/76/29/45/372762945.db2.gz	PIHLKEWWFVYCAA-UHFFFAOYSA-N	1	0	273.336	1.203	50	0		CDAARO
Nc1nc(C(=O)N[C@H]2CCC[N@@H+](C3CCCC3)C2)cs1	ZINC000299794466	372766751	/nfs/dbraw/zinc/76/67/51/372766751.db2.gz	KLCTZOUMNYEROO-JTQLQIEISA-N	1	0	294.424	1.862	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N(C)CCOc1cccc(Cl)c1	ZINC000037802285	373352875	/nfs/dbraw/zinc/35/28/75/373352875.db2.gz	PUWLZECGTYHQDD-LBPRGKRZSA-N	1	0	270.760	1.915	50	0		CDAARO
CN(C(=O)c1conc1C1CC1)[C@@H]1CCC[N@H+](C)C1	ZINC000253417693	373725709	/nfs/dbraw/zinc/72/57/09/373725709.db2.gz	DSKYJDAEURIVJS-LLVKDONJSA-N	1	0	263.341	1.718	50	0		CDAARO
CN1CC[C@@H]2CC[N@H+](C[C@@H](O)COC(C)(C)C)[C@H]2C1	ZINC000253417073	373726678	/nfs/dbraw/zinc/72/66/78/373726678.db2.gz	LENXEFFBRGIKCU-MCIONIFRSA-N	1	0	270.417	1.188	50	0		CDAARO
c1ccc(NC[C@H]2CC[N@H+](C[C@H]3CCOC3)C2)nc1	ZINC000225217987	373760388	/nfs/dbraw/zinc/76/03/88/373760388.db2.gz	SABUSLIXTPSIGI-ZIAGYGMSSA-N	1	0	261.369	1.852	50	0		CDAARO
COC[C@@](C)(CO)[NH2+]CCC(=O)Nc1cccc(F)c1	ZINC000639955871	373808568	/nfs/dbraw/zinc/80/85/68/373808568.db2.gz	SPIXGSZHZZUKBR-CQSZACIVSA-N	1	0	284.331	1.141	50	0		CDAARO
CCc1cccc(NC(=O)C[N@@H+]2CC[C@@H](CC(N)=O)C2)c1	ZINC000368575176	373844467	/nfs/dbraw/zinc/84/44/67/373844467.db2.gz	IOZDZNYKNSENCG-ZDUSSCGKSA-N	1	0	289.379	1.385	50	0		CDAARO
Cc1cc(CNC(=O)N[C@H](C)C(C)(C)C[NH+](C)C)n(C)n1	ZINC000252499121	189978492	/nfs/dbraw/zinc/97/84/92/189978492.db2.gz	RVTATHZFHXAWRH-GFCCVEGCSA-N	1	0	295.431	1.504	50	0		CDAARO
CCn1cc(CN(C)[C@H](C)C(=O)N2CCCCC2)cn1	ZINC000095430692	374932311	/nfs/dbraw/zinc/93/23/11/374932311.db2.gz	FPHUMWNLIOGQCM-CYBMUJFWSA-N	1	0	278.400	1.736	50	0		CDAARO
COc1ccc(OCC[N@@H+]2CCC[C@H]2CC(N)=O)cc1	ZINC000095466743	374961329	/nfs/dbraw/zinc/96/13/29/374961329.db2.gz	HAPYLJYZBRQQAG-LBPRGKRZSA-N	1	0	278.352	1.414	50	0		CDAARO
CN(C[C@H]1CCC[N@@H+]1CCOCCO)c1ccccc1	ZINC000095399801	374905914	/nfs/dbraw/zinc/90/59/14/374905914.db2.gz	AAXDATKAVSWBPZ-MRXNPFEDSA-N	1	0	278.396	1.596	50	0		CDAARO
COc1cccc(/C(C)=C\C(=O)N2CC[C@@H]([NH3+])C2)c1	ZINC000606441066	375822332	/nfs/dbraw/zinc/82/23/32/375822332.db2.gz	BWNDACKVUCVFJI-BIRHUZIMSA-N	1	0	260.337	1.658	50	0		CDAARO
C[NH+](C)C/C=C\C(=O)N1CCC2(CC1)OCC(C)(C)CO2	ZINC000606442797	375824582	/nfs/dbraw/zinc/82/45/82/375824582.db2.gz	FKKQOCNIFNFJFQ-WAYWQWQTSA-N	1	0	296.411	1.496	50	0		CDAARO
O=C(CN1CC[N@@H+]2CCC[C@H]2C1)Nc1ccc(F)cc1F	ZINC000239173769	376015313	/nfs/dbraw/zinc/01/53/13/376015313.db2.gz	OPYRJZYOMYNJQF-LBPRGKRZSA-N	1	0	295.333	1.683	50	0		CDAARO
C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1C[C@@H](O)CN1CCCC1=O	ZINC000241383270	376018663	/nfs/dbraw/zinc/01/86/63/376018663.db2.gz	MTUXCMHLUFKJEL-CBBWQLFWSA-N	1	0	280.412	1.623	50	0		CDAARO
Cc1ccc(F)c(NC(=O)NC[C@H]2C[N@@H+](C)CCN2C)c1	ZINC000264639230	190124557	/nfs/dbraw/zinc/12/45/57/190124557.db2.gz	MJIGDLCBEVWCLY-LBPRGKRZSA-N	1	0	294.374	1.501	50	0		CDAARO
CC(C)[NH+]1CCN(CCCSc2ncc[nH]2)CC1	ZINC000189477006	377296164	/nfs/dbraw/zinc/29/61/64/377296164.db2.gz	SGKXDPHQUIPKMJ-UHFFFAOYSA-N	1	0	268.430	1.918	50	0		CDAARO
CCNC(=O)N[C@@H]1CC[N@H+](Cc2cnc(C)s2)C[C@H]1C	ZINC000245316874	378069578	/nfs/dbraw/zinc/06/95/78/378069578.db2.gz	LACLLWAMJGFKJS-ZWNOBZJWSA-N	1	0	296.440	1.981	50	0		CDAARO
CC[NH+](CC)CCN1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000245343871	378073029	/nfs/dbraw/zinc/07/30/29/378073029.db2.gz	WFJBSCWGXITUQX-SOUVJXGZSA-N	1	0	270.417	1.597	50	0		CDAARO
O[C@@H](C[NH+]1CCN(Cc2cccc(F)c2)CC1)C1CC1	ZINC000085436857	285302969	/nfs/dbraw/zinc/30/29/69/285302969.db2.gz	SZZRDQFESYCAMM-INIZCTEOSA-N	1	0	278.371	1.714	50	0		CDAARO
CC(=O)c1cc(CSc2nnc(CC[NH3+])n2C)cs1	ZINC000426406043	256861623	/nfs/dbraw/zinc/86/16/23/256861623.db2.gz	GYAMLXJZCNAYAY-UHFFFAOYSA-N	1	0	296.421	1.873	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)Cc2ccc(F)cc2F)C1	ZINC000095067595	184930524	/nfs/dbraw/zinc/93/05/24/184930524.db2.gz	BCPUSQIRGLUDIJ-SECBINFHSA-N	1	0	254.280	1.315	50	0		CDAARO
NC(=O)C[C@@H]([NH2+]Cc1ccccc1)C1CCOCC1	ZINC000095452889	184990232	/nfs/dbraw/zinc/99/02/32/184990232.db2.gz	SIEJVPWPWOOEJE-CQSZACIVSA-N	1	0	262.353	1.447	50	0		CDAARO
CCCCC[N@@H+]1CCC[C@@H](Cn2cc(CO)nn2)C1	ZINC000055108876	390488961	/nfs/dbraw/zinc/48/89/61/390488961.db2.gz	FCQCNIPHIDAIJP-CYBMUJFWSA-N	1	0	266.389	1.673	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(OC2CC[NH2+]CC2)C1	ZINC000144962778	390551821	/nfs/dbraw/zinc/55/18/21/390551821.db2.gz	SJIOEXVHZCHRRZ-UHFFFAOYSA-N	1	0	256.346	1.374	50	0		CDAARO
[NH3+]CC(=O)N1CCc2onc(-c3ccc(F)c(F)c3)c2C1	ZINC000067769653	390575953	/nfs/dbraw/zinc/57/59/53/390575953.db2.gz	LBOLHWHRKMNALU-UHFFFAOYSA-N	1	0	293.273	1.463	50	0		CDAARO
CC(C)Cn1cncc1CN1CCC[C@](O)(C[NH+](C)C)C1	ZINC000072156523	390625388	/nfs/dbraw/zinc/62/53/88/390625388.db2.gz	XQFGVEHKSRKDIX-INIZCTEOSA-N	1	0	294.443	1.428	50	0		CDAARO
Cc1cc(N2CCO[C@@H](C(F)(F)F)C2)nc(N)[nH+]1	ZINC000072478115	390628967	/nfs/dbraw/zinc/62/89/67/390628967.db2.gz	PYWVZTKPCXUONH-SSDOTTSWSA-N	1	0	262.235	1.135	50	0		CDAARO
CS(=O)(=O)[C@@H]1CCC[C@@H]([NH2+]Cc2ccns2)C1	ZINC000404273478	390958808	/nfs/dbraw/zinc/95/88/08/390958808.db2.gz	MDWLWJHWGAYBSA-MWLCHTKSSA-N	1	0	274.411	1.589	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(C[C@H](C[NH3+])O2)CC1	ZINC000095630829	390911219	/nfs/dbraw/zinc/91/12/19/390911219.db2.gz	BXYHKGJGEWCZMB-SNVBAGLBSA-N	1	0	256.346	1.504	50	0		CDAARO
CC(C)[C@@H](O)C[NH2+][C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000123922855	390912532	/nfs/dbraw/zinc/91/25/32/390912532.db2.gz	PQFLYWSABRDLHG-WFASDCNBSA-N	1	0	274.368	1.935	50	0		CDAARO
CC(C)N(Cc1nccn1C)C(=O)[C@H]1CCCC[N@@H+]1C	ZINC000097619549	390917887	/nfs/dbraw/zinc/91/78/87/390917887.db2.gz	ZFYQNPVVVRSVDY-CYBMUJFWSA-N	1	0	278.400	1.641	50	0		CDAARO
C[C@H]([NH2+]CC1OCCO1)c1ccc(N2CCCC2=O)cc1	ZINC000180247550	390981706	/nfs/dbraw/zinc/98/17/06/390981706.db2.gz	HWUVTBHHCZUFBA-LBPRGKRZSA-N	1	0	290.363	1.837	50	0		CDAARO
CNc1nc(CN2CC[N@@H+]3CCC[C@H]3C2)cs1	ZINC000244708317	391042707	/nfs/dbraw/zinc/04/27/07/391042707.db2.gz	KRLIBPIJUNTOFY-NSHDSACASA-N	1	0	252.387	1.465	50	0		CDAARO
COC(=O)CCN1CCN(c2ncc(Cl)cn2)[C@H](C)C1	ZINC000089265502	391437728	/nfs/dbraw/zinc/43/77/28/391437728.db2.gz	CEJZNJTYSKLMJS-SNVBAGLBSA-N	1	0	298.774	1.204	50	0		CDAARO
C[N@H+](CCN1CCOC1=O)[C@H]1Cc2ccccc2[C@H]1O	ZINC000241590506	391680823	/nfs/dbraw/zinc/68/08/23/391680823.db2.gz	PFKVXLHPNBMHBA-UONOGXRCSA-N	1	0	276.336	1.029	50	0		CDAARO
CC(C)(C)c1ccc(C2=NC3(CC[NH2+]CC3)NC2=O)cc1	ZINC000006817129	392450212	/nfs/dbraw/zinc/45/02/12/392450212.db2.gz	LSQNQFDYKOMQDD-UHFFFAOYSA-N	1	0	285.391	1.983	50	0		CDAARO
CCCc1noc(CN2CCN(c3cc[nH+]cc3)CC2)n1	ZINC000089960517	135061793	/nfs/dbraw/zinc/06/17/93/135061793.db2.gz	RNTIEHIRJTUKDN-UHFFFAOYSA-N	1	0	287.367	1.739	50	0		CDAARO
Cc1cnc(N2CC([NH+]3CCCCC3)C2)nc1N(C)C	ZINC000065372054	292902889	/nfs/dbraw/zinc/90/28/89/292902889.db2.gz	TWNPDFYDJGIQGI-UHFFFAOYSA-N	1	0	275.400	1.526	50	0		CDAARO
COCCC1([NH2+]CCCS(C)(=O)=O)CCCC1	ZINC000095454718	292310075	/nfs/dbraw/zinc/31/00/75/292310075.db2.gz	NJIACHZKRMCELJ-UHFFFAOYSA-N	1	0	263.403	1.360	50	0		CDAARO
CCSCC[NH2+]C[C@]1(N2CCOCC2)CCSC1	ZINC000371939785	160063006	/nfs/dbraw/zinc/06/30/06/160063006.db2.gz	UJEWBKBJXILYGQ-CYBMUJFWSA-N	1	0	290.498	1.537	50	0		CDAARO
CCOC(=O)C[C@H]([NH3+])c1ccc(OC)c(OC)c1	ZINC000004990709	170050601	/nfs/dbraw/zinc/05/06/01/170050601.db2.gz	QJFIEJGVDLYEPY-JTQLQIEISA-N	1	0	253.298	1.657	50	0		CDAARO
Cc1ccsc1C[NH2+]CCSc1nnnn1C	ZINC000004998055	170052071	/nfs/dbraw/zinc/05/20/71/170052071.db2.gz	JJLOSXSPXLTEDI-UHFFFAOYSA-N	1	0	269.399	1.462	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](NC(=O)c2cc(N)ccc2OC)C1	ZINC000005509803	170105852	/nfs/dbraw/zinc/10/58/52/170105852.db2.gz	DLIRWCUMIAJQJA-GFCCVEGCSA-N	1	0	277.368	1.492	50	0		CDAARO
C[NH+](C)CC(C)(C)CNS(=O)(=O)c1ccccc1	ZINC000006085966	170174584	/nfs/dbraw/zinc/17/45/84/170174584.db2.gz	TZHFYUNAQRCQPB-UHFFFAOYSA-N	1	0	270.398	1.553	50	0		CDAARO
CC(C)Oc1cccc(C(=O)NCC[NH+](C)C)c1	ZINC000006702931	170230274	/nfs/dbraw/zinc/23/02/74/170230274.db2.gz	YOJUKRFICMXQSQ-UHFFFAOYSA-N	1	0	250.342	1.765	50	0		CDAARO
C[C@@H]1C[C@H](C)C[N@@H+](CC(=O)Nc2ccccc2C(N)=O)C1	ZINC000006725557	170232822	/nfs/dbraw/zinc/23/28/22/170232822.db2.gz	UEIASVUCIDAPRA-TXEJJXNPSA-N	1	0	289.379	1.702	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)COc2ccc(F)cc2F)CC1	ZINC000006729956	170234835	/nfs/dbraw/zinc/23/48/35/170234835.db2.gz	TVELZYLPSOUCOP-UHFFFAOYSA-N	1	0	284.306	1.508	50	0		CDAARO
C[C@H](C(=O)N1CCNC1=O)[N@H+](C)Cc1ccccc1	ZINC000007340146	170278140	/nfs/dbraw/zinc/27/81/40/170278140.db2.gz	MHLCSNXJJUANKQ-LLVKDONJSA-N	1	0	261.325	1.059	50	0		CDAARO
C[NH+](C)CCCNS(=O)(=O)c1cc(F)ccc1F	ZINC000008105316	170318824	/nfs/dbraw/zinc/31/88/24/170318824.db2.gz	BJAIUMSIZAQCTR-UHFFFAOYSA-N	1	0	278.324	1.195	50	0		CDAARO
Nc1cc(N)[nH+]c(SCc2nccn2C(F)F)n1	ZINC000008725489	170349794	/nfs/dbraw/zinc/34/97/94/170349794.db2.gz	IDXCJDCOVQYFKD-UHFFFAOYSA-N	1	0	272.284	1.525	50	0		CDAARO
C[C@H]1CCC[N@H+](CC(=O)NCc2ccc3c(c2)OCO3)C1	ZINC000010030155	170396248	/nfs/dbraw/zinc/39/62/48/170396248.db2.gz	OQXRYIFUPQIUCZ-LBPRGKRZSA-N	1	0	290.363	1.763	50	0		CDAARO
COc1cc(OC)c(OC)cc1CN1CC[NH+](C)CC1	ZINC000019536805	170826550	/nfs/dbraw/zinc/82/65/50/170826550.db2.gz	AMNKUVKQDIXCAS-UHFFFAOYSA-N	1	0	280.368	1.460	50	0		CDAARO
COc1ccc(CN2CC[N@H+](C)[C@@H](CCO)C2)cc1	ZINC000020998649	171284138	/nfs/dbraw/zinc/28/41/38/171284138.db2.gz	NHRPSWIXONYTTC-AWEZNQCLSA-N	1	0	264.369	1.194	50	0		CDAARO
CCN(CC)S(=O)(=O)Cc1ccc(C[NH3+])cc1	ZINC000021038660	171292658	/nfs/dbraw/zinc/29/26/58/171292658.db2.gz	BZXVBGYJXXZNOO-UHFFFAOYSA-N	1	0	256.371	1.317	50	0		CDAARO
COCC[NH2+]CC(=O)N[C@H]1CCCC[C@H]1C(C)(C)C	ZINC000092495310	292559522	/nfs/dbraw/zinc/55/95/22/292559522.db2.gz	GTUAQPFNRUCIQJ-OLZOCXBDSA-N	1	0	270.417	1.944	50	0		CDAARO
C[C@H](c1nc2ccccc2c(=O)[nH]1)N1CC[NH+](C)CC1	ZINC000022797735	171399447	/nfs/dbraw/zinc/39/94/47/171399447.db2.gz	DLPUDSAKNIYXMX-LLVKDONJSA-N	1	0	272.352	1.232	50	0		CDAARO
CN(Cc1ccco1)C(=O)[C@@H]([NH3+])Cc1ccccc1	ZINC000035702155	172369865	/nfs/dbraw/zinc/36/98/65/172369865.db2.gz	RGUQONDQHQUXNN-AWEZNQCLSA-N	1	0	258.321	1.808	50	0		CDAARO
[NH3+]C1CN(C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000039952173	174176978	/nfs/dbraw/zinc/17/69/78/174176978.db2.gz	IWHDHWNOKIWMGK-UHFFFAOYSA-N	1	0	289.379	1.431	50	0		CDAARO
C[C@H]1CCCN(C(=O)CC[NH2+]CC(C)(C)CO)C1	ZINC000065374412	175723990	/nfs/dbraw/zinc/72/39/90/175723990.db2.gz	GMOFLJHUCCBHJG-LBPRGKRZSA-N	1	0	256.390	1.243	50	0		CDAARO
Cc1ccsc1CN(C(=O)[C@@H]1C[NH2+]CCO1)C1CC1	ZINC000071662237	176242416	/nfs/dbraw/zinc/24/24/16/176242416.db2.gz	JGZFNZKGBOYLFU-LBPRGKRZSA-N	1	0	280.393	1.536	50	0		CDAARO
COc1ccc(CCN(C)[C@@H]2CCC[NH2+]C2)cc1OC	ZINC000071712044	176248978	/nfs/dbraw/zinc/24/89/78/176248978.db2.gz	CHIUWQICDAPELM-CQSZACIVSA-N	1	0	278.396	1.930	50	0		CDAARO
c1cc(-c2nc3c(c(NC4CC4)n2)C[NH2+]C3)ccn1	ZINC000072129547	176321343	/nfs/dbraw/zinc/32/13/43/176321343.db2.gz	ZLIYUGPKWVLASK-UHFFFAOYSA-N	1	0	253.309	1.716	50	0		CDAARO
Cc1c(CN2CC([N@H+]3CCCC[C@@H]3C)C2)cnn1C	ZINC000072140083	176323089	/nfs/dbraw/zinc/32/30/89/176323089.db2.gz	SIBJDFIPYPYKTK-LBPRGKRZSA-N	1	0	262.401	1.787	50	0		CDAARO
Fc1cccc(CN2CCN(C[C@H]3CC[NH2+]C3)CC2)c1	ZINC000072147149	176325953	/nfs/dbraw/zinc/32/59/53/176325953.db2.gz	CZXNNQRFPTYYRB-HNNXBMFYSA-N	1	0	277.387	1.553	50	0		CDAARO
Cc1nn(C)cc1NC(=O)C[N@H+]1C[C@@H]2[C@@H]3CC[C@@H](C3)[C@@H]2C1	ZINC000072154613	176328139	/nfs/dbraw/zinc/32/81/39/176328139.db2.gz	STYOBLUNZAFEPB-KPWCQOOUSA-N	1	0	288.395	1.645	50	0		CDAARO
O=C(C[C@@H]1COCC[NH2+]1)Nc1cccc2cccnc21	ZINC000072164155	176330726	/nfs/dbraw/zinc/33/07/26/176330726.db2.gz	ZNFLSARIGLYDTD-GFCCVEGCSA-N	1	0	271.320	1.552	50	0		CDAARO
Cc1cc(CNC(=O)[C@H]2C[NH2+]CCO2)c(C(F)(F)F)o1	ZINC000072426742	176402166	/nfs/dbraw/zinc/40/21/66/176402166.db2.gz	RBELPTFTZWOILN-SECBINFHSA-N	1	0	292.257	1.211	50	0		CDAARO
COCC(=O)N[C@H]1CC[C@H]1[NH2+]C1Cc2ccccc2C1	ZINC000072463498	176405747	/nfs/dbraw/zinc/40/57/47/176405747.db2.gz	KAJCRIXRWDCIEH-CABCVRRESA-N	1	0	274.364	1.037	50	0		CDAARO
Cc1cc(C(=O)N[C@@H]2CC[NH2+]C[C@H]2O)ccc1Cl	ZINC000077391061	177262931	/nfs/dbraw/zinc/26/29/31/177262931.db2.gz	ZAWFXFKCJMGILV-VXGBXAGGSA-N	1	0	268.744	1.101	50	0		CDAARO
C[NH+]1CCN(c2cc(Br)ccn2)CC1	ZINC000040456703	273899527	/nfs/dbraw/zinc/89/95/27/273899527.db2.gz	PCVKEOQZVDCNGO-UHFFFAOYSA-N	1	0	256.147	1.596	50	0		CDAARO
O[C@@H](C[N@@H+]1CCCN(c2ncccn2)CC1)c1ccccc1	ZINC000244758102	275051311	/nfs/dbraw/zinc/05/13/11/275051311.db2.gz	OSKPNSQTTVMOSD-INIZCTEOSA-N	1	0	298.390	1.722	50	0		CDAARO
C[NH+](C)C[C@@H](O)c1ccccc1I	ZINC000000339089	276795379	/nfs/dbraw/zinc/79/53/79/276795379.db2.gz	VACUCMZTAGLMKC-SNVBAGLBSA-N	1	0	291.132	1.886	50	0		CDAARO
C[N@@H+]1CCC[C@@H](c2nc3c([nH]2)C(=O)NCC(C)(C)C3)C1	ZINC000095381080	277055191	/nfs/dbraw/zinc/05/51/91/277055191.db2.gz	BSXOWMCZJHHKHH-SNVBAGLBSA-N	1	0	276.384	1.531	50	0		CDAARO
COC(=O)c1ccc(NC(=O)c2cc[n+](C)cc2)cc1	ZINC000003279948	277434857	/nfs/dbraw/zinc/43/48/57/277434857.db2.gz	CVXKMAQKTSNLMR-UHFFFAOYSA-O	1	0	271.296	1.550	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1ccc(N2CCCC2)c(F)c1	ZINC000124310242	288319235	/nfs/dbraw/zinc/31/92/35/288319235.db2.gz	GIWXXVDDYBSOLE-GFCCVEGCSA-N	1	0	291.370	1.860	50	0		CDAARO
CN1C[C@H]([NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCCC3)CCC1=O	ZINC000194049330	290309622	/nfs/dbraw/zinc/30/96/22/290309622.db2.gz	QCSIWJPUYBPFBG-QHSBEEBCSA-N	1	0	278.396	1.545	50	0		CDAARO
Cc1n[n+]2c(Br)c(C)[nH]n2c1Br	ZINC000012371995	293089294	/nfs/dbraw/zinc/08/92/94/293089294.db2.gz	ILLPCFQHGSROHD-UHFFFAOYSA-N	1	0	294.958	1.390	50	0		CDAARO
CO[C@H](C)C(=O)N1CC[N@H+](C)CC12CCCCC2	ZINC000098016489	294206073	/nfs/dbraw/zinc/20/60/73/294206073.db2.gz	ZAYOFAFSGFHPSQ-GFCCVEGCSA-N	1	0	254.374	1.498	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)NCCCC[C@H]1CCCO1	ZINC000534578283	328310889	/nfs/dbraw/zinc/31/08/89/328310889.db2.gz	XKDMQJPAXSGSRR-AWEZNQCLSA-N	1	0	268.401	1.842	50	0		CDAARO
COc1cc(NCC[C@H]2CCCOC2)nc(N)n1	ZINC000534579784	328311238	/nfs/dbraw/zinc/31/12/38/328311238.db2.gz	KIFPJVRRNLOEON-SECBINFHSA-N	1	0	252.318	1.126	50	0		CDAARO
C[NH+]1CCC(O)(C(=O)NC2(C3CCCCC3)CC2)CC1	ZINC000534590049	328317879	/nfs/dbraw/zinc/31/78/79/328317879.db2.gz	RXIRKCZBYIDIOZ-UHFFFAOYSA-N	1	0	280.412	1.672	50	0		CDAARO
O=C1NCC[C@@H]1[NH2+]C1CCN(c2ccccc2Cl)CC1	ZINC000534590838	328318164	/nfs/dbraw/zinc/31/81/64/328318164.db2.gz	GJLKCVRSWNXJEP-ZDUSSCGKSA-N	1	0	293.798	1.787	50	0		CDAARO
Cc1nn[nH]c1C(=O)N[C@@H](CC[NH+](C)C)c1ccccc1	ZINC000534644088	328329680	/nfs/dbraw/zinc/32/96/80/328329680.db2.gz	IVQVYICGTFATFH-ZDUSSCGKSA-N	1	0	287.367	1.536	50	0		CDAARO
C[C@@H](CCNC(=O)N1CC(Oc2ccccc2)C1)[NH+](C)C	ZINC000534646554	328330074	/nfs/dbraw/zinc/33/00/74/328330074.db2.gz	RFLOLHFXVDXTHR-ZDUSSCGKSA-N	1	0	291.395	1.799	50	0		CDAARO
O=C(NC[C@@]1(O)CCC[NH2+]C1)C1CCCCCC1	ZINC000534649945	328336239	/nfs/dbraw/zinc/33/62/39/328336239.db2.gz	SFUNURBKXRGYGY-CQSZACIVSA-N	1	0	254.374	1.188	50	0		CDAARO
[NH3+]C[C@@H]1CN(CCCCOCc2ccccc2)CCO1	ZINC000534673010	328348469	/nfs/dbraw/zinc/34/84/69/328348469.db2.gz	IPVLXRMPHYABLL-MRXNPFEDSA-N	1	0	278.396	1.643	50	0		CDAARO
C[C@@H](C(=O)NCCc1ncc[nH]1)[N@H+](C)C1CCCCC1	ZINC000534674668	328349795	/nfs/dbraw/zinc/34/97/95/328349795.db2.gz	RZYCXLQAHZFLMC-LBPRGKRZSA-N	1	0	278.400	1.721	50	0		CDAARO
COCc1nc2n(n1)C[C@H]([NH2+]CCC(C)(C)C)CC2	ZINC000097103960	323207733	/nfs/dbraw/zinc/20/77/33/323207733.db2.gz	QSIWHXFCYCTSBJ-LLVKDONJSA-N	1	0	266.389	1.765	50	0		CDAARO
C[C@@](O)(CCNC1=[NH+]CCCCN1)c1ccccc1	ZINC000521396922	326829884	/nfs/dbraw/zinc/82/98/84/326829884.db2.gz	GMVUSKSURKITHS-OAHLLOKOSA-N	1	0	261.369	1.613	50	0		CDAARO
CC(C)[C@H]1OCCC[C@H]1CNC1=[NH+]CCCCN1	ZINC000521396964	326830020	/nfs/dbraw/zinc/83/00/20/326830020.db2.gz	WVUSBDGPCVXKRL-QWHCGFSZSA-N	1	0	253.390	1.767	50	0		CDAARO
Cc1nc(C(=O)N2CCCC[C@@H]2[C@H](C)[NH3+])cs1	ZINC000087428993	330372980	/nfs/dbraw/zinc/37/29/80/330372980.db2.gz	ARQJCOWHKDSIHB-GZMMTYOYSA-N	1	0	253.371	1.793	50	0		CDAARO
Cc1cccc(C)c1NC(=O)N1C[C@@H]2C[NH2+]C[C@]2(CO)C1	ZINC001772702052	1159437072	/nfs/dbraw/zinc/43/70/72/1159437072.db2.gz	QHDSSKOELDLMFT-XJKSGUPXSA-N	1	0	289.379	1.349	50	0		CDAARO
CCOc1ccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)cc1OC	ZINC000084810548	482508101	/nfs/dbraw/zinc/50/81/01/482508101.db2.gz	PQCBLWJZJRMNGC-ZDUSSCGKSA-N	1	0	292.379	1.791	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@@H]1NC(=O)c1ccc(F)cc1F	ZINC000091496674	482567965	/nfs/dbraw/zinc/56/79/65/482567965.db2.gz	LMXCRDTVFHGTKO-PELKAZGASA-N	1	0	254.280	1.835	50	0		CDAARO
CN(CCOc1ccccc1F)C(=O)[C@@H]1CCC[C@H]1[NH3+]	ZINC000085367428	482577763	/nfs/dbraw/zinc/57/77/63/482577763.db2.gz	QHSQBPARLJLTJJ-DGCLKSJQSA-N	1	0	280.343	1.790	50	0		CDAARO
O=C1CC[C@H]([N@@H+]2CCCN(c3ccccc3)CC2)CCN1	ZINC000670434957	482971304	/nfs/dbraw/zinc/97/13/04/482971304.db2.gz	NQXKIVCHJDTBNW-INIZCTEOSA-N	1	0	287.407	1.867	50	0		CDAARO
Cc1cnc(C[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)cn1	ZINC000670440785	482985291	/nfs/dbraw/zinc/98/52/91/482985291.db2.gz	APPHXCVVJSQUER-GFCCVEGCSA-N	1	0	257.341	1.888	50	0		CDAARO
Cc1nc2c([nH]1)CN(Cc1noc([C@@H]3CCCO3)n1)CC2	ZINC000670450040	483011127	/nfs/dbraw/zinc/01/11/27/483011127.db2.gz	BJNBOBVIGSQASY-LBPRGKRZSA-N	1	0	289.339	1.511	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1ncc(F)c(OC)n1	ZINC000670458648	483039733	/nfs/dbraw/zinc/03/97/33/483039733.db2.gz	BINTVEGGDNPIMG-JTQLQIEISA-N	1	0	268.336	1.911	50	0		CDAARO
CO[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC(=O)N1C[C@@H](C)O[C@@H](C)C1	ZINC000670458661	483040637	/nfs/dbraw/zinc/04/06/37/483040637.db2.gz	IOPDLXJPYQYBIH-OYQDBORRSA-N	1	0	296.411	1.264	50	0		CDAARO
Cn1cc([C@H]2OCC[C@@H]2C[NH2+]Cc2ccc(CO)o2)cn1	ZINC000084317504	483272344	/nfs/dbraw/zinc/27/23/44/483272344.db2.gz	DWIFMEYFSMBMHX-ABAIWWIYSA-N	1	0	291.351	1.373	50	0		CDAARO
Cc1nc(CN2CCC(C[NH+]3CCOCC3)CC2)co1	ZINC000077521949	483510252	/nfs/dbraw/zinc/51/02/52/483510252.db2.gz	SOLNVOUTERDZPL-UHFFFAOYSA-N	1	0	279.384	1.527	50	0		CDAARO
COc1cc(C[NH2+]CC(C)(C)O)cc2c1OCCO2	ZINC000096480992	533870887	/nfs/dbraw/zinc/87/08/87/533870887.db2.gz	SPSOWJFIPYLJPH-UHFFFAOYSA-N	1	0	267.325	1.327	50	0		CDAARO
O=C(Nc1n[nH]c2c1cccc2Cl)[C@H]1CCC[NH2+]1	ZINC000182821221	527496976	/nfs/dbraw/zinc/49/69/76/527496976.db2.gz	ANVSNPTVLJOULF-SECBINFHSA-N	1	0	264.716	1.907	50	0		CDAARO
CC1(C)C[C@H]([NH2+]Cc2cccc(NS(C)(=O)=O)c2)CO1	ZINC000417851296	527744236	/nfs/dbraw/zinc/74/42/36/527744236.db2.gz	FUYXRKJXNCRZPD-ZDUSSCGKSA-N	1	0	298.408	1.715	50	0		CDAARO
CCOC(=O)[C@H]1C[NH2+]CCc2c3ccccc3[nH]c21	ZINC000071781440	567902300	/nfs/dbraw/zinc/90/23/00/567902300.db2.gz	CTOZCCZDPQNZFT-LBPRGKRZSA-N	1	0	258.321	1.960	50	0		CDAARO
CCCC1(NC(=O)CN2CC[NH+](CC)CC2)CC1	ZINC000952984535	614895895	/nfs/dbraw/zinc/89/58/95/614895895.db2.gz	VKVZRGJNYHNUTB-UHFFFAOYSA-N	1	0	253.390	1.073	50	0		CDAARO
CON(C)C(=O)CC[N@@H+]1CCCC[C@@H]1c1cc(C)n[nH]1	ZINC000952995020	617004728	/nfs/dbraw/zinc/00/47/28/617004728.db2.gz	AKAQWPXZLCCAMC-CYBMUJFWSA-N	1	0	280.372	1.655	50	0		CDAARO
CC(=O)N1CCC[C@@H](CNc2cc(C)[nH+]c(N)n2)C1	ZINC000032587053	631812463	/nfs/dbraw/zinc/81/24/63/631812463.db2.gz	CMGGRVFQHNMZRD-NSHDSACASA-N	1	0	263.345	1.038	50	0		CDAARO
Cc1ncc(Cl)c(N2CC[C@H](C[NH+](C)C)C2)n1	ZINC001772701995	1159437321	/nfs/dbraw/zinc/43/73/21/1159437321.db2.gz	CSWORCAUGYLADY-SNVBAGLBSA-N	1	0	254.765	1.826	50	0		CDAARO
CN(C)c1nc(N2[C@@H]3CC[C@H]2C[N@H+](C)CC3)ncc1F	ZINC001772711679	1159446170	/nfs/dbraw/zinc/44/61/70/1159446170.db2.gz	CRFZUSHDDUSWHM-MNOVXSKESA-N	1	0	279.363	1.355	50	0		CDAARO
[NH3+]CCC(=O)N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12	ZINC001704356558	1177700789	/nfs/dbraw/zinc/70/07/89/1177700789.db2.gz	ZCSCDPQGXBWZLK-CZUORRHYSA-N	1	0	299.374	1.257	50	0		CDAARO
CCCS(=O)(=O)NC[C@H](C(C)C)[NH+]1CCCC1	ZINC000049736708	814698853	/nfs/dbraw/zinc/69/88/53/814698853.db2.gz	QRZSJJAKDIUEKR-GFCCVEGCSA-N	1	0	262.419	1.436	50	0		CDAARO
Cc1nnc(CN2CCC[C@H](c3cc(=O)[nH]cn3)C2)s1	ZINC000299787735	811094522	/nfs/dbraw/zinc/09/45/22/811094522.db2.gz	XMTPUTAJCKCLHT-JTQLQIEISA-N	1	0	291.380	1.722	50	0		CDAARO
COc1cccc(OCCCCC[NH2+]CCO)c1	ZINC000002903529	811189539	/nfs/dbraw/zinc/18/95/39/811189539.db2.gz	VIXGODBYYSRSFO-UHFFFAOYSA-N	1	0	253.342	1.826	50	0		CDAARO
C[C@H](Cc1ccccc1F)[NH2+][C@H]1CS(=O)(=O)C1(C)C	ZINC000877871973	811869304	/nfs/dbraw/zinc/86/93/04/811869304.db2.gz	ZKXFGNHEYHOZPS-MFKMUULPSA-N	1	0	285.384	1.922	50	0		CDAARO
CC(C)NC(=O)C[NH2+][C@@H]1CCN(Cc2ccccc2)C1	ZINC000035133260	813848815	/nfs/dbraw/zinc/84/88/15/813848815.db2.gz	LYFXREMNPVAKFQ-OAHLLOKOSA-N	1	0	275.396	1.375	50	0		CDAARO
COc1ccc(N2CCC([NH+]3CCSCC3)CC2)nn1	ZINC000020255411	813879815	/nfs/dbraw/zinc/87/98/15/813879815.db2.gz	FEPNTDWXLFGMAN-UHFFFAOYSA-N	1	0	294.424	1.503	50	0		CDAARO
c1ccc(-c2ccc(NC[C@H]3C[NH2+]CCO3)nn2)cc1	ZINC000032598271	813946527	/nfs/dbraw/zinc/94/65/27/813946527.db2.gz	GJIHWFDLLWKXCV-CYBMUJFWSA-N	1	0	270.336	1.544	50	0		CDAARO
COCCCN(Cc1ncc[nH]1)C1CC[NH+](C)CC1	ZINC000072410648	816797239	/nfs/dbraw/zinc/79/72/39/816797239.db2.gz	JRMMUEIOQIYJDN-UHFFFAOYSA-N	1	0	266.389	1.342	50	0		CDAARO
Cc1n[nH]c(C)c1CCC[N@@H+](C)C[C@@H]1COCCO1	ZINC000252483472	816997067	/nfs/dbraw/zinc/99/70/67/816997067.db2.gz	FCEOBDAYPZRPRZ-CYBMUJFWSA-N	1	0	267.373	1.306	50	0		CDAARO
COc1ccc(-c2cccc(N3CC[NH2+]CC3)n2)cn1	ZINC000032513738	817094338	/nfs/dbraw/zinc/09/43/38/817094338.db2.gz	ZYHIYLVWMNXGQP-UHFFFAOYSA-N	1	0	270.336	1.562	50	0		CDAARO
COC(=O)N1CCN(Cc2cccc3c2NCCC3)CC1	ZINC000387096244	817153237	/nfs/dbraw/zinc/15/32/37/817153237.db2.gz	IIGUZJAWEGCDEA-UHFFFAOYSA-N	1	0	289.379	1.929	50	0		CDAARO
COc1ccc(C(=O)[C@@H]2CCC[N@H+](CCO)C2)cc1F	ZINC000011842757	817526014	/nfs/dbraw/zinc/52/60/14/817526014.db2.gz	QGODGHRYNRYDID-GFCCVEGCSA-N	1	0	281.327	1.721	50	0		CDAARO
Cc1nc[nH]c1C[N@@H+]1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2	ZINC000022023166	817885156	/nfs/dbraw/zinc/88/51/56/817885156.db2.gz	STFQNGYLPOKDOY-OLZOCXBDSA-N	1	0	284.363	1.499	50	0		CDAARO
O=C(NCc1nc[nH]n1)c1ccc([C@@H]2CCC[NH2+]2)s1	ZINC000019743246	899214313	/nfs/dbraw/zinc/21/43/13/899214313.db2.gz	GKQZADPGZAGARN-QMMMGPOBSA-N	1	0	277.353	1.221	50	0		CDAARO
C[C@@H]([NH2+][C@@H]1C(=O)NCC1(C)C)C1(Br)CC1	ZINC000952876867	910436158	/nfs/dbraw/zinc/43/61/58/910436158.db2.gz	GXRXZSWZCUYMLJ-HTQZYQBOSA-N	1	0	275.190	1.417	50	0		CDAARO
CC[C@H](C)C[NH+]1CCC(O)(c2ccnn2C)CC1	ZINC000952882503	910451574	/nfs/dbraw/zinc/45/15/74/910451574.db2.gz	RMZWHQLKYFISQZ-LBPRGKRZSA-N	1	0	251.374	1.750	50	0		CDAARO
[NH3+][C@H]1[C@H]2C=C[C@H](C2)[C@H]1C(=O)Nc1cccc(-n2cccn2)c1	ZINC000952985839	910550956	/nfs/dbraw/zinc/55/09/56/910550956.db2.gz	HRXQADDSBFSJBA-KOZAUXTDSA-N	1	0	294.358	1.960	50	0		CDAARO
C[N@H+](CCn1cnnc1)C[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000823684425	925720657	/nfs/dbraw/zinc/72/06/57/925720657.db2.gz	UGVSGDKETQHIQH-ZDUSSCGKSA-N	1	0	291.399	1.001	50	0		CDAARO
CC(C)[N@@H+]1CC[C@H](CN(C)Cc2ccnn2C)C1	ZINC000823715040	925721685	/nfs/dbraw/zinc/72/16/85/925721685.db2.gz	JTDXGNYLJUBPNF-CYBMUJFWSA-N	1	0	250.390	1.582	50	0		CDAARO
Cc1[nH]ccc1C(=O)NCC[C@H](C)[NH+]1CCN(C)CC1	ZINC000823789400	925732892	/nfs/dbraw/zinc/73/28/92/925732892.db2.gz	LPQFYOZBDNVDOY-LBPRGKRZSA-N	1	0	278.400	1.079	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CN(C)c2nc(C)cnc2C)C1	ZINC000824412339	925820770	/nfs/dbraw/zinc/82/07/70/925820770.db2.gz	GJPKDRRXJIIHIJ-CQSZACIVSA-N	1	0	278.400	1.498	50	0		CDAARO
CO[C@H]1CN(C2CC[NH+](C3CCCC3)CC2)C[C@@H]1O	ZINC000824504724	925828306	/nfs/dbraw/zinc/82/83/06/925828306.db2.gz	IHHXMWUDNQLZNW-GJZGRUSLSA-N	1	0	268.401	1.085	50	0		CDAARO
Cc1nccn1CC[C@@H](C)[NH2+]CCN1CCC(CO)CC1	ZINC000828719654	926166309	/nfs/dbraw/zinc/16/63/09/926166309.db2.gz	RXEJOYFUSGACBI-CQSZACIVSA-N	1	0	294.443	1.264	50	0		CDAARO
CS(=O)(=O)N1CC[C@@H](N2CCc3cccc(F)c3C2)C1	ZINC000585117385	930983811	/nfs/dbraw/zinc/98/38/11/930983811.db2.gz	ZWCNHWOUEAHNJX-GFCCVEGCSA-N	1	0	298.383	1.218	50	0		CDAARO
Cc1ncccc1CN(C)C[C@@H]1CCC[N@H+](CCO)C1	ZINC001529191359	969010453	/nfs/dbraw/zinc/01/04/53/969010453.db2.gz	XJAYMIQEUXRRMP-HNNXBMFYSA-N	1	0	277.412	1.526	50	0		CDAARO
CC[N@H+](C[C@H]1CCCCO1)C1CCN(C(C)=O)CC1	ZINC001506397760	975148090	/nfs/dbraw/zinc/14/80/90/975148090.db2.gz	WYSVDTLTYBYOLC-OAHLLOKOSA-N	1	0	268.401	1.888	50	0		CDAARO
O[C@@H]1CCC[N@@H+](C2CC[NH+](CCCn3ccnc3)CC2)C1	ZINC001506400618	975148841	/nfs/dbraw/zinc/14/88/41/975148841.db2.gz	FHVOBUZMMVUBJB-MRXNPFEDSA-N	1	0	292.427	1.194	50	0		CDAARO
OCC1CC[NH+]([C@@H]2CCN(c3ccccc3)C2)CC1	ZINC001506412506	975154527	/nfs/dbraw/zinc/15/45/27/975154527.db2.gz	ZHLDQLCMXUMVIE-MRXNPFEDSA-N	1	0	260.381	1.970	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](CN(C)Cc2ccnn2C)C1	ZINC001506425415	975159213	/nfs/dbraw/zinc/15/92/13/975159213.db2.gz	OMGKYDODQDTPPR-CQSZACIVSA-N	1	0	280.416	1.210	50	0		CDAARO
[NH3+][C@@H]1CCCCN(C(=O)CCN2CCc3ccccc32)C1	ZINC000082086680	177919223	/nfs/dbraw/zinc/91/92/23/177919223.db2.gz	YLDRSZFRPRSFKF-OAHLLOKOSA-N	1	0	287.407	1.779	50	0		CDAARO
C[C@@H]1C[C@H](NC(=O)CCC(=O)OC(C)(C)C)C[N@@H+]1C1CC1	ZINC000192395505	342467912	/nfs/dbraw/zinc/46/79/12/342467912.db2.gz	AYDFKXVWFGFBHU-NEPJUHHUSA-N	1	0	296.411	1.850	50	0		CDAARO
Cc1ccccc1CCNC(=O)N1CC[C@H](C[NH3+])C1	ZINC000416875914	230415301	/nfs/dbraw/zinc/41/53/01/230415301.db2.gz	VCFSTSQADXQHMB-CYBMUJFWSA-N	1	0	261.369	1.528	50	0		CDAARO
COC(=O)C1(C[NH2+]Cc2cccn2C)CCOCC1	ZINC000097372947	342002699	/nfs/dbraw/zinc/00/26/99/342002699.db2.gz	HRRFQAZUEXQLPJ-UHFFFAOYSA-N	1	0	266.341	1.085	50	0		CDAARO
c1ncn(Cc2cccc(C[NH2+][C@H]3CCSC3)c2)n1	ZINC000095967274	185047052	/nfs/dbraw/zinc/04/70/52/185047052.db2.gz	WZRISROARAACNY-AWEZNQCLSA-N	1	0	274.393	1.922	50	0		CDAARO
O=C1[C@H]([NH2+][C@@H]2CCOC2)CCN1CCCc1ccccc1	ZINC000095983711	185054098	/nfs/dbraw/zinc/05/40/98/185054098.db2.gz	RPSWKEMQYYHKNI-HZPDHXFCSA-N	1	0	288.391	1.599	50	0		CDAARO
Cc1cnc(C[NH2+][C@H]2CCC[C@@H](S(C)(=O)=O)C2)s1	ZINC000241121713	361751208	/nfs/dbraw/zinc/75/12/08/361751208.db2.gz	JDJDJMXLVRVYAV-WDEREUQCSA-N	1	0	288.438	1.897	50	0		CDAARO
CC(C)c1cc(C(=O)NCCC[NH+](C)C)nc(N(C)C)n1	ZINC000096101153	185097857	/nfs/dbraw/zinc/09/78/57/185097857.db2.gz	RNSIMJFMBSANKI-UHFFFAOYSA-N	1	0	293.415	1.348	50	0		CDAARO
CC[N@@H+]1CC[C@@H](N(C)C(=O)CNc2ccccc2)C1	ZINC000195543809	342626668	/nfs/dbraw/zinc/62/66/68/342626668.db2.gz	BOSYMBQFEBDRIW-CQSZACIVSA-N	1	0	261.369	1.651	50	0		CDAARO
CN(CCc1ccccc1)c1cc([C@H]2C[C@@H]([NH3+])C2)nc(N)n1	ZINC000244787557	361863697	/nfs/dbraw/zinc/86/36/97/361863697.db2.gz	PZIMXJJFQPQVDF-OKILXGFUSA-N	1	0	297.406	1.942	50	0		CDAARO
Cc1[nH]c2ccccc2c1CC(=O)NC[C@@H]1C[C@H](F)C[NH2+]1	ZINC000244873166	361866615	/nfs/dbraw/zinc/86/66/15/361866615.db2.gz	WLDXTYUIZYJUFZ-RYUDHWBXSA-N	1	0	289.354	1.835	50	0		CDAARO
C[N@H+](Cc1ccc(OCC2CC2)cc1)[C@@H]1COC[C@H]1O	ZINC000289901444	361891538	/nfs/dbraw/zinc/89/15/38/361891538.db2.gz	WUFSPGVFAMTJBU-HZPDHXFCSA-N	1	0	277.364	1.667	50	0		CDAARO
CCN(CC)C(=O)CN(C)C(=O)C[NH+]1CCC(C)CC1	ZINC000096954605	185140957	/nfs/dbraw/zinc/14/09/57/185140957.db2.gz	YDRYVEIVBKGPPQ-UHFFFAOYSA-N	1	0	283.416	1.045	50	0		CDAARO
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[NH2+]C[C@@H]2C)c1	ZINC000125445024	187185428	/nfs/dbraw/zinc/18/54/28/187185428.db2.gz	YNGHHRANQQACSL-TUKIKUTGSA-N	1	0	274.364	1.619	50	0		CDAARO
CCCC[C@H]([NH3+])C(=O)N(C)Cc1ncc(Cl)n1C	ZINC000097234155	342205478	/nfs/dbraw/zinc/20/54/78/342205478.db2.gz	UGPBNMPSDRKWJC-VIFPVBQESA-N	1	0	272.780	1.549	50	0		CDAARO
COC[C@H]([NH2+]CC(=O)N1CCCCC1)c1ccccc1	ZINC000097033211	185155720	/nfs/dbraw/zinc/15/57/20/185155720.db2.gz	FNRWFWPRGCLFJB-HNNXBMFYSA-N	1	0	276.380	1.976	50	0		CDAARO
O[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@@H+]2Cc1nc2cccnc2s1	ZINC000440943591	361952862	/nfs/dbraw/zinc/95/28/62/361952862.db2.gz	ZBGSUDQASNLVLX-HAOVPJPFSA-N	1	0	287.388	1.892	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1ccccc1S(N)(=O)=O	ZINC000585141923	342219180	/nfs/dbraw/zinc/21/91/80/342219180.db2.gz	INZRQACNOXQHEV-GFCCVEGCSA-N	1	0	297.424	1.620	50	0		CDAARO
CC(C)(C)C(=O)NCC1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000585149161	342225596	/nfs/dbraw/zinc/22/55/96/342225596.db2.gz	KBOXXWGSHAZSNZ-CYBMUJFWSA-N	1	0	268.401	1.650	50	0		CDAARO
COC(=O)C1CC2(C1)C[NH2+]C[C@@H]2C(=O)OC(C)(C)C	ZINC000585139543	539103364	/nfs/dbraw/zinc/10/33/64/539103364.db2.gz	WAIXTEHZHVQHLH-OPASDULOSA-N	1	0	269.341	1.117	50	0		CDAARO
O=C(c1ccc(C[N@H+]2CCC[C@@H](O)C2)cc1)N1CCCC1	ZINC000024957923	539132629	/nfs/dbraw/zinc/13/26/29/539132629.db2.gz	JIXUDWZSOJJRHH-MRXNPFEDSA-N	1	0	288.391	1.879	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)Cc1ccc(-n2cccn2)cc1	ZINC000125897380	187204260	/nfs/dbraw/zinc/20/42/60/187204260.db2.gz	UBVIIZFZGFKXLU-ZDUSSCGKSA-N	1	0	284.363	1.235	50	0		CDAARO
Cc1cc(C(=O)N2CC[NH2+]C[C@@H]2C)ccc1-n1cncn1	ZINC000126005682	187210777	/nfs/dbraw/zinc/21/07/77/187210777.db2.gz	VHMBVUXTHYDDQC-LBPRGKRZSA-N	1	0	285.351	1.010	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(C[NH3+])c2)C1	ZINC000381900525	365726808	/nfs/dbraw/zinc/72/68/08/365726808.db2.gz	WDMDCQRLSUZIMY-CYBMUJFWSA-N	1	0	293.367	1.929	50	0		CDAARO
Cc1ccc(O)c(C[NH2+][C@@H](CO)Cc2ccccc2)n1	ZINC000083662532	362252109	/nfs/dbraw/zinc/25/21/09/362252109.db2.gz	AWGMOEDRKWVTCK-CQSZACIVSA-N	1	0	272.348	1.789	50	0		CDAARO
CC[C@@H]1CN(CCc2ccncc2)CC[N@@H+]1C[C@@H](C)O	ZINC000084736472	362270239	/nfs/dbraw/zinc/27/02/39/362270239.db2.gz	ZXJBIFXMLOIXHL-GDBMZVCRSA-N	1	0	277.412	1.401	50	0		CDAARO
COC[C@@H](O)C[N@H+](C[C@H]1CCCO1)C1CCCC1	ZINC000182354524	362288817	/nfs/dbraw/zinc/28/88/17/362288817.db2.gz	ZUSQIOWQKLATDN-UONOGXRCSA-N	1	0	257.374	1.417	50	0		CDAARO
COC(=O)[C@H](N[C@H]1CCc2ccccc2C1)[C@@H](C)O	ZINC000249158659	362399806	/nfs/dbraw/zinc/39/98/06/362399806.db2.gz	ZIPAEWXPHPZZNY-DDTOSNHZSA-N	1	0	263.337	1.056	50	0		CDAARO
CC[C@H](N[C@@H]1CC[N@H+](CC2CCCC2)C1)C(=O)OC	ZINC000192853944	345997310	/nfs/dbraw/zinc/99/73/10/345997310.db2.gz	DNEFRJRNOPOUAD-KGLIPLIRSA-N	1	0	268.401	1.792	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN1C(=O)c1cc2ccccc2o1	ZINC000085470066	179075037	/nfs/dbraw/zinc/07/50/37/179075037.db2.gz	DYRKMEAYYSEGMX-CYBMUJFWSA-N	1	0	288.347	1.835	50	0		CDAARO
CS(=O)(=O)CCOCC[NH2+][C@@H]1CCCc2occc21	ZINC000193008068	362753296	/nfs/dbraw/zinc/75/32/96/362753296.db2.gz	FXFSOKMNKNVCKJ-GFCCVEGCSA-N	1	0	287.381	1.308	50	0		CDAARO
Cc1ccc([C@@H]2CN(CC[NH2+]C(C)C)CCO2)o1	ZINC000193479681	362922567	/nfs/dbraw/zinc/92/25/67/362922567.db2.gz	WISURLULJPGZMB-AWEZNQCLSA-N	1	0	252.358	1.959	50	0		CDAARO
C[C@@H](CN1CCOCC1)[NH2+]Cc1nc2ccccc2o1	ZINC000584889687	349348773	/nfs/dbraw/zinc/34/87/73/349348773.db2.gz	YBFNMHFIBDDCBK-LBPRGKRZSA-N	1	0	275.352	1.638	50	0		CDAARO
CC(C)[C@H](CNc1nccc(N(C)C)n1)[NH+](C)C	ZINC000584891545	349350456	/nfs/dbraw/zinc/35/04/56/349350456.db2.gz	JRQOTVKYXRPGJJ-NSHDSACASA-N	1	0	251.378	1.541	50	0		CDAARO
COc1ccc2[nH]c(C(=O)N3C[C@H]([NH3+])[C@@H](C4CC4)C3)cc2c1	ZINC000091350977	180137574	/nfs/dbraw/zinc/13/75/74/180137574.db2.gz	CPLLZPSHVLQHOM-KGLIPLIRSA-N	1	0	299.374	1.986	50	0		CDAARO
Cc1[nH+]c(N)nc(NCc2nc(C3CC3)no2)c1C	ZINC000091409970	180148311	/nfs/dbraw/zinc/14/83/11/180148311.db2.gz	AYPUEHPFXODELD-UHFFFAOYSA-N	1	0	260.301	1.548	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000091545651	180186396	/nfs/dbraw/zinc/18/63/96/180186396.db2.gz	CIFTZGGGJYRGNY-VHSXEESVSA-N	1	0	253.371	1.537	50	0		CDAARO
Cc1c[nH]c(C[N@@H+]2CC[C@](C)(O)[C@H](C)C2)c(C)c1=O	ZINC000091645812	180214925	/nfs/dbraw/zinc/21/49/25/180214925.db2.gz	XROFPXSRRJEPSU-ABAIWWIYSA-N	1	0	264.369	1.585	50	0		CDAARO
C[NH+]1CCC(c2nnc(Cn3cncn3)n2C2CC2)CC1	ZINC000091737481	180244042	/nfs/dbraw/zinc/24/40/42/180244042.db2.gz	ZGDQIVWSVMGXGW-UHFFFAOYSA-N	1	0	287.371	1.062	50	0		CDAARO
C[C@H](OC[C@@H]1CCCCO1)C(=O)N1C[C@H](C)[C@H]([NH+](C)C)C1	ZINC000107057365	186157904	/nfs/dbraw/zinc/15/79/04/186157904.db2.gz	VENIEMXADHKUCK-ZQDZILKHSA-N	1	0	298.427	1.369	50	0		CDAARO
COc1ccc(C[NH2+][C@@H]2CCC[C@@H]2O)c(OC)c1	ZINC000109554300	186262785	/nfs/dbraw/zinc/26/27/85/186262785.db2.gz	FRYKMYDSYUUBRI-OLZOCXBDSA-N	1	0	251.326	1.707	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCC[C@@H]2CC[NH2+]C2)c(C)c1	ZINC000110796794	186325814	/nfs/dbraw/zinc/32/58/14/186325814.db2.gz	LVGBWNFZDUUDSB-ZDUSSCGKSA-N	1	0	282.409	1.581	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)[C@H]2CCOc3ccccc32)C1	ZINC000111189059	186367907	/nfs/dbraw/zinc/36/79/07/186367907.db2.gz	MNBQZSURIZHWTP-JSGCOSHPSA-N	1	0	274.364	1.621	50	0		CDAARO
CC[N@@H+]1C[C@@H](C)[C@@H](NS(=O)(=O)c2ccccc2F)C1	ZINC000257365994	350964534	/nfs/dbraw/zinc/96/45/34/350964534.db2.gz	FKMHBESVYOFGRT-PWSUYJOCSA-N	1	0	286.372	1.444	50	0		CDAARO
CC[C@@H](C)CS(=O)(=O)NC[C@H]([NH3+])c1ccccc1	ZINC000123794753	351286765	/nfs/dbraw/zinc/28/67/65/351286765.db2.gz	RHFAFYFXLURTRJ-YPMHNXCESA-N	1	0	270.398	1.652	50	0		CDAARO
C[C@H](NC(=O)c1ccc2nccn2c1)[C@@H]1CCCC[NH2+]1	ZINC000583652116	366020082	/nfs/dbraw/zinc/02/00/82/366020082.db2.gz	YXWSPNOUHGWRTJ-AAEUAGOBSA-N	1	0	272.352	1.595	50	0		CDAARO
Cn1nccc1C(=O)NC[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000193840648	358499135	/nfs/dbraw/zinc/49/91/35/358499135.db2.gz	FXKSDANXEGTLRU-HNNXBMFYSA-N	1	0	298.390	1.672	50	0		CDAARO
CN(C)c1cc[n+](CN2C(=O)c3ccccc3C2=O)cc1	ZINC000000480195	355914121	/nfs/dbraw/zinc/91/41/21/355914121.db2.gz	JWGCPNXSXCFZCB-UHFFFAOYSA-N	1	0	282.323	1.294	50	0		CDAARO
O=C1C=CC(=O)N1C1CC[NH+](Cc2ccccc2)CC1	ZINC000000069744	355883060	/nfs/dbraw/zinc/88/30/60/355883060.db2.gz	DQBXVDRKIWDMGP-UHFFFAOYSA-N	1	0	270.332	1.576	50	0		CDAARO
COc1ccccc1NC(=O)NCC[NH+]1CCCC1	ZINC000001740972	355951038	/nfs/dbraw/zinc/95/10/38/355951038.db2.gz	KCWIUEWZXRZBHG-UHFFFAOYSA-N	1	0	263.341	1.913	50	0		CDAARO
C[N@@H+]1CCOC[C@@H](CNC(=O)c2ccncc2Cl)C1	ZINC000584901821	355956252	/nfs/dbraw/zinc/95/62/52/355956252.db2.gz	SRKQYDXIXRSLMN-JTQLQIEISA-N	1	0	283.759	1.043	50	0		CDAARO
CCOC(=O)CC[NH2+][C@H](C)[C@@H]1COc2ccccc2O1	ZINC000002183405	355963332	/nfs/dbraw/zinc/96/33/32/355963332.db2.gz	VPEJVSUDRBRPKB-RISCZKNCSA-N	1	0	279.336	1.758	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCCN(Cc2ccc(F)c(F)c2)C1=O	ZINC000012031638	356286585	/nfs/dbraw/zinc/28/65/85/356286585.db2.gz	ZPSPJBPNECTHMD-OAHLLOKOSA-N	1	0	298.333	1.380	50	0		CDAARO
O=C(NCCO)c1ccc(-n2ccnc2)cc1Cl	ZINC000012336464	356293898	/nfs/dbraw/zinc/29/38/98/356293898.db2.gz	MJHLWQVUMJSRCH-UHFFFAOYSA-N	1	0	265.700	1.248	50	0		CDAARO
COc1cccc(CN2CCC[C@](O)(C[NH+](C)C)C2=O)c1	ZINC000012714424	356320600	/nfs/dbraw/zinc/32/06/00/356320600.db2.gz	WVHGYTFFCKFQIN-INIZCTEOSA-N	1	0	292.379	1.110	50	0		CDAARO
COc1ccc(CC(=O)N2CCC[N@H+](C)CC2)c(OC)c1	ZINC000032716597	356347014	/nfs/dbraw/zinc/34/70/14/356347014.db2.gz	RZGRYOLOGHPCDF-UHFFFAOYSA-N	1	0	292.379	1.410	50	0		CDAARO
COC(=O)c1ccc(CN2CCCC[C@@H]2C(N)=O)cc1	ZINC000032751435	356359058	/nfs/dbraw/zinc/35/90/58/356359058.db2.gz	QKJJTWMCXYPJMR-CYBMUJFWSA-N	1	0	276.336	1.313	50	0		CDAARO
O=C(NCC[NH2+]Cc1ccccc1F)c1ccco1	ZINC000004498123	356369808	/nfs/dbraw/zinc/36/98/08/356369808.db2.gz	FCXWOXBJYANZPZ-UHFFFAOYSA-N	1	0	262.284	1.938	50	0		CDAARO
O=S(=O)([C@H]1CCC[NH2+]C1)N1CCc2ccccc21	ZINC000019477525	356487022	/nfs/dbraw/zinc/48/70/22/356487022.db2.gz	DSRSUBHKUWCDAA-LBPRGKRZSA-N	1	0	266.366	1.131	50	0		CDAARO
Cc1cc(C)cc(OCCOCCN2CC[NH+](C)CC2)c1	ZINC000019792562	356504702	/nfs/dbraw/zinc/50/47/02/356504702.db2.gz	AMRKSYWLVGDYDG-UHFFFAOYSA-N	1	0	292.423	1.946	50	0		CDAARO
CCOc1ccc(OCCN2CC[NH+](C)CC2)cc1	ZINC000020118095	356525800	/nfs/dbraw/zinc/52/58/00/356525800.db2.gz	FFTUXLGNIZTNAE-UHFFFAOYSA-N	1	0	264.369	1.712	50	0		CDAARO
c1ccc(C[NH+]2CCC(N3CCOCC3)CC2)cc1	ZINC000019889917	356514767	/nfs/dbraw/zinc/51/47/67/356514767.db2.gz	YGGZEPRGJLVRSE-UHFFFAOYSA-N	1	0	260.381	1.983	50	0		CDAARO
COC(=O)CCC[NH+]1CCN(c2ccccc2)CC1	ZINC000022538805	356616277	/nfs/dbraw/zinc/61/62/77/356616277.db2.gz	PMMRWJHMHSTMOI-UHFFFAOYSA-N	1	0	262.353	1.762	50	0		CDAARO
CC(C)(C)CC(C)(C)NC(=O)NC[C@H]1C[NH2+]CCOC1	ZINC000072156061	356636050	/nfs/dbraw/zinc/63/60/50/356636050.db2.gz	ZREBMEHVHSHLLC-GFCCVEGCSA-N	1	0	285.432	1.736	50	0		CDAARO
COCCCNC(=O)[C@H](C)[NH2+][C@@H]1CCCC[C@H]1C	ZINC000034938543	356824115	/nfs/dbraw/zinc/82/41/15/356824115.db2.gz	RIQBSKGFCAYSLS-FRRDWIJNSA-N	1	0	256.390	1.696	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCCNc2ncc(F)cn2)C[C@H](C)O1	ZINC000269529604	357077535	/nfs/dbraw/zinc/07/75/35/357077535.db2.gz	YDTPLFGLKSZJHI-TXEJJXNPSA-N	1	0	282.363	1.917	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1cnc(C(=O)OC)cn1	ZINC000584908606	357143476	/nfs/dbraw/zinc/14/34/76/357143476.db2.gz	IZDFHCPCBCONTQ-NSHDSACASA-N	1	0	278.356	1.550	50	0		CDAARO
Cc1cc(N[C@H]2CCCN(c3ncccn3)C2)nc(N)[nH+]1	ZINC000052426980	357272991	/nfs/dbraw/zinc/27/29/91/357272991.db2.gz	HWFHUHKLNKEFLK-NSHDSACASA-N	1	0	285.355	1.238	50	0		CDAARO
C[C@@H]([NH2+]C1CCCC1)C(=O)Nc1ccc(C(N)=O)cc1	ZINC000033040233	357326498	/nfs/dbraw/zinc/32/64/98/357326498.db2.gz	LKDNLFYXAGAFMK-SNVBAGLBSA-N	1	0	275.352	1.645	50	0		CDAARO
Cc1nnc2n1CC[C@@H]([N@@H+](C)Cc1cccn1C)CC2	ZINC000409421260	357451146	/nfs/dbraw/zinc/45/11/46/357451146.db2.gz	YCRQQTYQQNGPFJ-ZDUSSCGKSA-N	1	0	273.384	1.762	50	0		CDAARO
c1ccc(-c2ccc(N3CCC[NH2+]CC3)nn2)cc1	ZINC000062152159	357470307	/nfs/dbraw/zinc/47/03/07/357470307.db2.gz	BZHONZCRWRTGTE-UHFFFAOYSA-N	1	0	254.337	1.943	50	0		CDAARO
C=Cc1cccc(C[N@H+]2C[C@@H]3C[NH2+]C[C@]3(C(=O)[O-])C2)c1	ZINC000065381405	357534417	/nfs/dbraw/zinc/53/44/17/357534417.db2.gz	HKMVIBDXJWDYGR-HOCLYGCPSA-N	1	0	272.348	1.436	50	0		CDAARO
Cc1ccc(NC(=O)C[NH2+][C@H](C(N)=O)C(C)C)cc1F	ZINC000065386834	357535458	/nfs/dbraw/zinc/53/54/58/357535458.db2.gz	ARFJHMHPEZFBGK-ZDUSSCGKSA-N	1	0	281.331	1.172	50	0		CDAARO
COC(=O)CCCNc1nc(CC[NH3+])nc2ccccc21	ZINC000065398423	357538144	/nfs/dbraw/zinc/53/81/44/357538144.db2.gz	NTKKCNFSBQGFLC-UHFFFAOYSA-N	1	0	288.351	1.496	50	0		CDAARO
[NH2+]=C1S[C@@H]2CS(=O)(=O)C[C@H]2N1Cc1ccccc1	ZINC000100747848	283270855	/nfs/dbraw/zinc/27/08/55/283270855.db2.gz	YWVLQFWRKMBPBJ-GHMZBOCLSA-N	1	0	282.390	1.336	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC([N@@H+]2CCC[C@@H](O)C2)CC1	ZINC000067796542	357627764	/nfs/dbraw/zinc/62/77/64/357627764.db2.gz	UZONPELMGKAXTA-CYBMUJFWSA-N	1	0	284.400	1.843	50	0		CDAARO
CO[C@H]1CN(c2nccc(C3CCCC3)n2)CC[C@H]1[NH3+]	ZINC000071775976	357781080	/nfs/dbraw/zinc/78/10/80/357781080.db2.gz	UUYLUUIGJAJCDS-OCCSQVGLSA-N	1	0	276.384	1.687	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)[C@H]1CC[NH2+]C1	ZINC000247452542	358447811	/nfs/dbraw/zinc/44/78/11/358447811.db2.gz	ZXPWLZIIQYCWHW-HBNTYKKESA-N	1	0	280.318	1.889	50	0		CDAARO
CO[C@@H]1CCN(C(=O)CCc2cccs2)[C@H](C[NH3+])C1	ZINC000195557550	358560954	/nfs/dbraw/zinc/56/09/54/358560954.db2.gz	XYEWXMJHTUYLIE-NWDGAFQWSA-N	1	0	282.409	1.645	50	0		CDAARO
Cc1cccc(N2CCC(N[C@@H]3CC[NH2+]C3)CC2)c1	ZINC000426422771	358652410	/nfs/dbraw/zinc/65/24/10/358652410.db2.gz	FPQXPLLGUNKIPQ-OAHLLOKOSA-N	1	0	259.397	1.915	50	0		CDAARO
CC[N@@H+]1CCC[C@@](C)(C(=O)NCCn2nc(C)nc2C)C1	ZINC000095364447	358685974	/nfs/dbraw/zinc/68/59/74/358685974.db2.gz	YEENDYWFQCROME-OAHLLOKOSA-N	1	0	293.415	1.133	50	0		CDAARO
CCC[N@@H+]1C[C@H]2CC[C@@H]1CN(C(=O)c1ccnn1CC)C2	ZINC000095368285	358686602	/nfs/dbraw/zinc/68/66/02/358686602.db2.gz	RZUFSISZIYEFJO-ZIAGYGMSSA-N	1	0	290.411	1.849	50	0		CDAARO
Cc1nnc(N2CC[C@@]3(O)CC[NH2+]C[C@H]3C2)c2ccccc12	ZINC000095374200	358688777	/nfs/dbraw/zinc/68/87/77/358688777.db2.gz	FUBCLLSHIFPYCV-GUYCJALGSA-N	1	0	298.390	1.489	50	0		CDAARO
Cc1nn(C)c2nc(N3CCC[C@@H]([NH+](C)C)C3)sc12	ZINC000095526638	358695722	/nfs/dbraw/zinc/69/57/22/358695722.db2.gz	UOQHTOFQFJULHJ-SNVBAGLBSA-N	1	0	279.413	1.869	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)NC(C)(C)c1nnc(N)s1	ZINC000097570796	358785643	/nfs/dbraw/zinc/78/56/43/358785643.db2.gz	XRNXWMYSXVSOOC-VIFPVBQESA-N	1	0	297.428	1.346	50	0		CDAARO
Cc1cc(C(=O)NCC[C@H]2CCC[N@H+]2C)cnc1C	ZINC000097641786	358789798	/nfs/dbraw/zinc/78/97/98/358789798.db2.gz	WQVITJBOCUHSIM-CQSZACIVSA-N	1	0	261.369	1.913	50	0		CDAARO
Cc1nc2c(c(=O)[nH]1)C[N@H+](CCc1ccccc1)C2	ZINC000097729521	358794769	/nfs/dbraw/zinc/79/47/69/358794769.db2.gz	WQXBWZFZJLWRES-UHFFFAOYSA-N	1	0	255.321	1.637	50	0		CDAARO
[NH3+]CC[C@H]1C[N@H+](Cc2cccc3[nH]ccc32)CCO1	ZINC000097785217	358798904	/nfs/dbraw/zinc/79/89/04/358798904.db2.gz	UGPBYYPGBIBMOL-ZDUSSCGKSA-N	1	0	259.353	1.718	50	0		CDAARO
COc1ccc(/C=C/CN2CC[N@H+](C)[C@@H](CO)C2)cc1	ZINC000215156504	358876324	/nfs/dbraw/zinc/87/63/24/358876324.db2.gz	RJAWDZVFBUWSNC-NHZBNJEXSA-N	1	0	276.380	1.317	50	0		CDAARO
CO[C@@H]1CCCC[C@@H]1[NH+]1CCN(C(=O)c2ccco2)CC1	ZINC000000759071	359007681	/nfs/dbraw/zinc/00/76/81/359007681.db2.gz	HRVLJQXAERGABT-UONOGXRCSA-N	1	0	292.379	1.995	50	0		CDAARO
CCC(=O)N1CCC[N@@H+](CC)C2(CCOCC2)C1	ZINC000257181164	359255834	/nfs/dbraw/zinc/25/58/34/359255834.db2.gz	MPUDEOMEAIOXEJ-UHFFFAOYSA-N	1	0	254.374	1.500	50	0		CDAARO
CC(C)[N@@H+](CC(N)=O)C[C@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC000408518895	359910352	/nfs/dbraw/zinc/91/03/52/359910352.db2.gz	IUJJTNJLQRMREL-ZDUSSCGKSA-N	1	0	297.443	1.467	50	0		CDAARO
CCC(=O)N1CCC[C@@H]1[C@H]1CCC[N@H+]1[C@H](CC)C(N)=O	ZINC000257365337	359945362	/nfs/dbraw/zinc/94/53/62/359945362.db2.gz	MPZQBWVCEQDELF-JHJVBQTASA-N	1	0	281.400	1.116	50	0		CDAARO
C[C@@H]1C[C@H]([NH3+])CCN1S(=O)(=O)CC1CCCC1	ZINC000566412020	360112325	/nfs/dbraw/zinc/11/23/25/360112325.db2.gz	PVXSTWNKVDCPEA-ZYHUDNBSSA-N	1	0	260.403	1.318	50	0		CDAARO
C[C@@H]1CN(C)CCN1C(=O)c1ccc(C[NH+](C)C)cc1	ZINC000089938497	360198056	/nfs/dbraw/zinc/19/80/56/360198056.db2.gz	UHOGYVZICJGKTI-CYBMUJFWSA-N	1	0	275.396	1.524	50	0		CDAARO
Cc1c[nH+]c(C)n1C[C@H]1CCN(C(=O)c2ccnn2C)C1	ZINC000409421003	360230277	/nfs/dbraw/zinc/23/02/77/360230277.db2.gz	VKJSMVKZPZBNKP-ZDUSSCGKSA-N	1	0	287.367	1.396	50	0		CDAARO
Cc1[nH]nc2ncc(C[NH2+][C@@H]3CCCCNC3=O)cc12	ZINC000089568203	360462202	/nfs/dbraw/zinc/46/22/02/360462202.db2.gz	OUHWCOCJQRNNIL-GFCCVEGCSA-N	1	0	273.340	1.025	50	0		CDAARO
Cc1nc([C@H]2CCOC2)cc(N(C)CCC[NH+](C)C)n1	ZINC000426574911	360684381	/nfs/dbraw/zinc/68/43/81/360684381.db2.gz	LYSFRDFDOWJENZ-ZDUSSCGKSA-N	1	0	278.400	1.677	50	0		CDAARO
Cc1c2cc(C)ccc2[nH]c1CN1C[C@@H]([NH3+])[C@H](O)C1	ZINC000426584106	360686622	/nfs/dbraw/zinc/68/66/22/360686622.db2.gz	SOOWHXBZGTWYEE-IUODEOHRSA-N	1	0	259.353	1.289	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2ncccc2OC)n1C	ZINC000426414809	360667394	/nfs/dbraw/zinc/66/73/94/360667394.db2.gz	VHFUWMXXJLXFIG-UHFFFAOYSA-N	1	0	279.369	1.230	50	0		CDAARO
C[C@@H](C(=O)N1CCC(c2ncon2)CC1)[NH+]1CCCCC1	ZINC000426734592	360701163	/nfs/dbraw/zinc/70/11/63/360701163.db2.gz	YVJRPYUVFHTOBQ-LBPRGKRZSA-N	1	0	292.383	1.650	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCN(C(=O)c2cnc3ccccc3n2)C1	ZINC000179213807	189178424	/nfs/dbraw/zinc/17/84/24/189178424.db2.gz	BDNGGPIKORYWLT-NEPJUHHUSA-N	1	0	284.363	1.829	50	0		CDAARO
CC(C)(C)C[NH+]1CCN(C(=O)[C@H]2CCCO2)CC1	ZINC000036125459	361005589	/nfs/dbraw/zinc/00/55/89/361005589.db2.gz	UOCRWWAEAMBEON-GFCCVEGCSA-N	1	0	254.374	1.356	50	0		CDAARO
Cc1ccccc1OCC(=O)N1CCC[C@@H]([C@@H](C)[NH3+])C1	ZINC000299739665	200852524	/nfs/dbraw/zinc/85/25/24/200852524.db2.gz	RDHMSAKSBQQJBQ-ZIAGYGMSSA-N	1	0	276.380	1.960	50	0		CDAARO
CN(C)C(=O)[C@H]1CCCN1C(=O)C[C@H]([NH3+])c1ccccc1	ZINC000036136327	361076549	/nfs/dbraw/zinc/07/65/49/361076549.db2.gz	GBUTWXZOOVFZJS-UONOGXRCSA-N	1	0	289.379	1.156	50	0		CDAARO
CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1Cc1cn2cccnc2n1	ZINC000180841538	189278516	/nfs/dbraw/zinc/27/85/16/189278516.db2.gz	LDIOZIFBJUHSOX-LSDHHAIUSA-N	1	0	285.395	1.788	50	0		CDAARO
CCOc1cc2c(cc1C[NH2+]C[C@H](C)O)O[C@H](C)C2	ZINC000035111532	361258578	/nfs/dbraw/zinc/25/85/78/361258578.db2.gz	DAOZUFSMWUNKFJ-WDEREUQCSA-N	1	0	265.353	1.879	50	0		CDAARO
O=C1NCCN1C1CC[NH+](Cc2ccc(F)cc2)CC1	ZINC000049333011	363932015	/nfs/dbraw/zinc/93/20/15/363932015.db2.gz	YUQXKEYQFFOFMQ-UHFFFAOYSA-N	1	0	277.343	1.815	50	0		CDAARO
Cc1cc(S(=O)(=O)N2CCC[NH2+]CC2)ccc1F	ZINC000019680023	364078761	/nfs/dbraw/zinc/07/87/61/364078761.db2.gz	SWFVMRJDBKYQFA-UHFFFAOYSA-N	1	0	272.345	1.118	50	0		CDAARO
COC[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCC2)C1CC1	ZINC000248701680	364267713	/nfs/dbraw/zinc/26/77/13/364267713.db2.gz	GHLLPYBTIIODOB-RQJABVFESA-N	1	0	251.370	1.959	50	0		CDAARO
CCn1cnnc1[C@H]1CCCN(Cc2ccn(C)n2)C1	ZINC000271181705	364963650	/nfs/dbraw/zinc/96/36/50/364963650.db2.gz	ZWEKZEPGBGDIHB-LBPRGKRZSA-N	1	0	274.372	1.411	50	0		CDAARO
CCn1nccc1C(=O)N1CC[C@H]([NH+](CC)CC)C1	ZINC000216536323	189705199	/nfs/dbraw/zinc/70/51/99/189705199.db2.gz	OEAQYZWSVYDXPN-LBPRGKRZSA-N	1	0	264.373	1.459	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)c1c[nH]cn1	ZINC000249688648	365161193	/nfs/dbraw/zinc/16/11/93/365161193.db2.gz	IILQGTCZUSMBLT-CHWSQXEVSA-N	1	0	262.357	1.499	50	0		CDAARO
C[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)[C@H](N)c1ccccc1	ZINC000251831574	366920010	/nfs/dbraw/zinc/92/00/10/366920010.db2.gz	POSFYXUKUUMCSE-VHDGCEQUSA-N	1	0	273.380	1.382	50	0		CDAARO
C[N@H+](CCNC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C)C1CC1	ZINC000089917519	366966231	/nfs/dbraw/zinc/96/62/31/366966231.db2.gz	SWCPTBHNEWPFRO-UPJWGTAASA-N	1	0	281.400	1.193	50	0		CDAARO
CCCn1nnnc1CN1CCC[C@H]([NH+]2CCCC2)CC1	ZINC000089960685	366985843	/nfs/dbraw/zinc/98/58/43/366985843.db2.gz	ZUEQOWYCWAZSCT-AWEZNQCLSA-N	1	0	292.431	1.533	50	0		CDAARO
OC[C@@H]1C[C@H](O)C[N@@H+]1C[C@H]1CCC2(CCCCC2)O1	ZINC000252539860	367813661	/nfs/dbraw/zinc/81/36/61/367813661.db2.gz	ONVICQYWLIWPIY-MELADBBJSA-N	1	0	269.385	1.296	50	0		CDAARO
Cc1c[nH]c(CN(C)C[C@]2(O)CCC[N@@H+]3CCCC[C@@H]32)n1	ZINC000063834512	368704325	/nfs/dbraw/zinc/70/43/25/368704325.db2.gz	BOEAQNAHCTVZMB-GDBMZVCRSA-N	1	0	292.427	1.529	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CCC1CCN(S(C)(=O)=O)CC1	ZINC000089929756	370196265	/nfs/dbraw/zinc/19/62/65/370196265.db2.gz	DCHXQPXFLNVPOG-CYBMUJFWSA-N	1	0	288.457	1.923	50	0		CDAARO
Cn1ncc2cc(NC(=O)NCC3CC[NH2+]CC3)ccc21	ZINC000299791515	372764743	/nfs/dbraw/zinc/76/47/43/372764743.db2.gz	FADQKFSAKBAAQB-UHFFFAOYSA-N	1	0	287.367	1.694	50	0		CDAARO
COCc1cc(CNC(=O)C[C@H](C)n2ccnc2C)[nH]n1	ZINC000299776871	372754456	/nfs/dbraw/zinc/75/44/56/372754456.db2.gz	MQCXSYYIEKVZAU-JTQLQIEISA-N	1	0	291.355	1.329	50	0		CDAARO
O=C(NC[C@@]1(O)CC[NH2+]C1)Nc1ccc2ccccc2c1	ZINC000299779881	372756908	/nfs/dbraw/zinc/75/69/08/372756908.db2.gz	OGQRXNLELKUJQK-MRXNPFEDSA-N	1	0	285.347	1.686	50	0		CDAARO
C[N@@H+]1CCCC2(CCN(C(=O)CCc3cn[nH]c3)CC2)C1	ZINC000299797743	372768728	/nfs/dbraw/zinc/76/87/28/372768728.db2.gz	SMVRIWCNODXOCL-UHFFFAOYSA-N	1	0	290.411	1.677	50	0		CDAARO
CSCC(=O)NCc1c(C)ncc2c1CC[NH2+]C2	ZINC000299795746	372770126	/nfs/dbraw/zinc/77/01/26/372770126.db2.gz	MTDLWDGHAGAOHF-UHFFFAOYSA-N	1	0	265.382	1.015	50	0		CDAARO
c1nnn2c1CO[C@H]1C[N@H+](C3Cc4ccccc4C3)CC[C@@H]12	ZINC000299800229	372771618	/nfs/dbraw/zinc/77/16/18/372771618.db2.gz	WFRVKMIGRJQXCJ-IRXDYDNUSA-N	1	0	296.374	1.591	50	0		CDAARO
C[NH+](C)[C@H]1CCN(C(=O)[C@](C)(O)CCc2ccccc2)C1	ZINC000253392249	373682119	/nfs/dbraw/zinc/68/21/19/373682119.db2.gz	HHICDLAAOORSGV-DOTOQJQBSA-N	1	0	290.407	1.533	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@H]1NC(=O)Cc1c(F)cccc1F	ZINC000095048568	373693950	/nfs/dbraw/zinc/69/39/50/373693950.db2.gz	GXCZDYPQUCEUOH-TVQRCGJNSA-N	1	0	268.307	1.764	50	0		CDAARO
CC[N@@H+]1CC[C@@H]2[C@H](C1)OCCN2C(=O)c1cccnc1	ZINC000253416336	373725975	/nfs/dbraw/zinc/72/59/75/373725975.db2.gz	CZBUNVDHKQZPBT-KGLIPLIRSA-N	1	0	275.352	1.017	50	0		CDAARO
CCN(CC[NH+]1CCCCCC1)C(=O)[C@@H]1CCOC1	ZINC000055042011	373763281	/nfs/dbraw/zinc/76/32/81/373763281.db2.gz	KKRMPTIJBULPCV-CQSZACIVSA-N	1	0	268.401	1.747	50	0		CDAARO
CC(C)N(Cc1ccccc1Cl)C(=O)[C@@H](N)CC[NH3+]	ZINC000055088839	374136220	/nfs/dbraw/zinc/13/62/20/374136220.db2.gz	SKJNJBZALIGLMX-ZDUSSCGKSA-N	1	0	283.803	1.753	50	0		CDAARO
Cc1noc(C)c1CN(C)c1cc(C2CC([NH3+])C2)ncn1	ZINC000218895824	541929904	/nfs/dbraw/zinc/92/99/04/541929904.db2.gz	RXJOQOQZCMKGBA-UHFFFAOYSA-N	1	0	287.367	1.923	50	0		CDAARO
CC[NH+](CC)CCn1c2ccccc2n(CC(C)=O)c1=N	ZINC000334157476	206121238	/nfs/dbraw/zinc/12/12/38/206121238.db2.gz	SHNOXLZAICESCE-UHFFFAOYSA-N	1	0	288.395	1.853	50	0		CDAARO
[NH3+]CCCS(=O)(=O)c1ccc(Br)cc1	ZINC000011896965	374470071	/nfs/dbraw/zinc/47/00/71/374470071.db2.gz	BVLMBBYHOIZKEF-UHFFFAOYSA-N	1	0	278.171	1.572	50	0		CDAARO
C[C@H](O)[C@H](C)[NH+]1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000108323655	412824306	/nfs/dbraw/zinc/82/43/06/412824306.db2.gz	STCDWRMUHCPXON-OFQRWUPVSA-N	1	0	278.396	1.107	50	0		CDAARO
Cn1cc(C(=O)C[C@@H]2CCC[N@@H+]2C[C@H]2CCOC2)cn1	ZINC000108326717	412824897	/nfs/dbraw/zinc/82/48/97/412824897.db2.gz	ZMTYBABQLQKULY-OCCSQVGLSA-N	1	0	277.368	1.494	50	0		CDAARO
C[C@H](COc1cccc(F)c1)NC(=O)[C@H]1CCCC[NH2+]1	ZINC000095426461	374927563	/nfs/dbraw/zinc/92/75/63/374927563.db2.gz	ZLSLKIDFLODKIK-BXUZGUMPSA-N	1	0	280.343	1.851	50	0		CDAARO
C[N@H+](Cc1cccnc1)C1CCN(c2ncccn2)CC1	ZINC000095432236	374932610	/nfs/dbraw/zinc/93/26/10/374932610.db2.gz	CALIPOBKVAOKCG-UHFFFAOYSA-N	1	0	283.379	1.972	50	0		CDAARO
CCN(CC)C(=O)N1CCC[C@@H]1C[N@@H+]1CCC[C@@H]1CO	ZINC000095433351	374933878	/nfs/dbraw/zinc/93/38/78/374933878.db2.gz	KGMNIUHAYFHWJW-ZIAGYGMSSA-N	1	0	283.416	1.369	50	0		CDAARO
CCc1nn(C)c(CC)c1C[NH2+][C@@H]1CCN(C(C)=O)C1	ZINC000095440133	374940529	/nfs/dbraw/zinc/94/05/29/374940529.db2.gz	SLTVGKRJOJGLPS-GFCCVEGCSA-N	1	0	278.400	1.255	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1cccc(Nc2ncccn2)c1	ZINC000095479602	374970893	/nfs/dbraw/zinc/97/08/93/374970893.db2.gz	CYDURFNPCROOKF-UHFFFAOYSA-N	1	0	299.378	1.902	50	0		CDAARO
C[S@](=O)C1(C[NH2+]Cc2ccc3c(c2)OCCO3)CCC1	ZINC000280618617	375008809	/nfs/dbraw/zinc/00/88/09/375008809.db2.gz	KSVOZIQQPCZBDT-FQEVSTJZSA-N	1	0	295.404	1.849	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+][C@@H]1CCCC[C@H]1S(C)(=O)=O	ZINC000095940759	375037873	/nfs/dbraw/zinc/03/78/73/375037873.db2.gz	CMUFVEOSXRYYBA-GHMZBOCLSA-N	1	0	291.413	1.131	50	0		CDAARO
C[C@H](CC(=O)N1[C@H](C)COC[C@H]1C)C1CC[NH2+]CC1	ZINC000299740386	375202203	/nfs/dbraw/zinc/20/22/03/375202203.db2.gz	ZFDNVGYKEJQWMJ-JHJVBQTASA-N	1	0	268.401	1.648	50	0		CDAARO
Cc1nn(C)c(C(=O)NC2CC[NH+](C)CC2)c1Cl	ZINC000002781504	375327405	/nfs/dbraw/zinc/32/74/05/375327405.db2.gz	SKKPFSFYPVRZHP-UHFFFAOYSA-N	1	0	270.764	1.206	50	0		CDAARO
[NH3+]C[C@@H]1CCCCN1C(=O)/C=C\C1CCOCC1	ZINC000493336701	375443459	/nfs/dbraw/zinc/44/34/59/375443459.db2.gz	NETVNBKOGDQAMW-ZFDPJTLLSA-N	1	0	252.358	1.309	50	0		CDAARO
COc1ccc(OC)c(NC(=S)NCC[NH+](C)C)c1	ZINC000003357549	375661343	/nfs/dbraw/zinc/66/13/43/375661343.db2.gz	LKDBIAPMRPWOOT-UHFFFAOYSA-N	1	0	283.397	1.552	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCN(C(=O)/C=C\c2ccccn2)C1	ZINC000606441365	375823124	/nfs/dbraw/zinc/82/31/24/375823124.db2.gz	JDLGPTAELRLQNY-YMVSPQSISA-N	1	0	259.353	1.681	50	0		CDAARO
Cc1nc(C[NH3+])cc(N(C)CC[C@H](O)c2ccccc2)n1	ZINC000067850289	377259976	/nfs/dbraw/zinc/25/99/76/377259976.db2.gz	SEUSWUMNYQFWAE-HNNXBMFYSA-N	1	0	286.379	1.804	50	0		CDAARO
CCNc1nc(C)c(C(=O)N2CC[NH2+][C@@H](CC)C2)s1	ZINC000067908764	377295426	/nfs/dbraw/zinc/29/54/26/377295426.db2.gz	XWMYNEHJOWSLIG-JTQLQIEISA-N	1	0	282.413	1.707	50	0		CDAARO
O=C(NCCc1c[nH]cn1)c1ccnc(OCC2CC2)c1	ZINC000245108448	377867456	/nfs/dbraw/zinc/86/74/56/377867456.db2.gz	SXQSAUXEVCHKBL-UHFFFAOYSA-N	1	0	286.335	1.566	50	0		CDAARO
[NH3+]C[C@@H]1CCC[C@H]1NS(=O)(=O)c1cc(F)cc(F)c1	ZINC000089091612	295257539	/nfs/dbraw/zinc/25/75/39/295257539.db2.gz	OSULEEQSACYXDR-QPUJVOFHSA-N	1	0	290.335	1.371	50	0		CDAARO
O=C1CC[C@@H]2C[N@H+](C[C@H]3CCOC3)CC[C@H]2N1C1CC1	ZINC000343556287	378907278	/nfs/dbraw/zinc/90/72/78/378907278.db2.gz	XLWKOTKFGILDGQ-UMVBOHGHSA-N	1	0	278.396	1.498	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)c1ccc(Cl)s1	ZINC000051172543	184565299	/nfs/dbraw/zinc/56/52/99/184565299.db2.gz	FGKZKIVTRNULQO-RQJHMYQMSA-N	1	0	260.746	1.118	50	0		CDAARO
CCOC(=O)CCCCN1CC[NH+](C2CCC2)CC1	ZINC000096417426	390512185	/nfs/dbraw/zinc/51/21/85/390512185.db2.gz	LFRMYLRLIJJYPO-UHFFFAOYSA-N	1	0	268.401	1.890	50	0		CDAARO
O=C(C[NH2+]Cc1c[nH]nc1-c1cccnc1)N1CCCC1	ZINC000097159585	390801168	/nfs/dbraw/zinc/80/11/68/390801168.db2.gz	JOSXYPFXVCKXHK-UHFFFAOYSA-N	1	0	285.351	1.184	50	0		CDAARO
CC(C)c1noc(-c2cn(C3CC[NH2+]CC3)nn2)n1	ZINC000096516238	391104632	/nfs/dbraw/zinc/10/46/32/391104632.db2.gz	SQICVZHTYDWGMT-UHFFFAOYSA-N	1	0	262.317	1.376	50	0		CDAARO
CC(C)(C)CN1CCC[C@](O)(C[NH+]2CCCC2)C1=O	ZINC000015071233	391521081	/nfs/dbraw/zinc/52/10/81/391521081.db2.gz	AEAUGOZHAUSKGR-HNNXBMFYSA-N	1	0	268.401	1.482	50	0		CDAARO
Cc1cc(N2CCCN(c3ncncn3)CC2)cc[nH+]1	ZINC000222342108	391906988	/nfs/dbraw/zinc/90/69/88/391906988.db2.gz	PZVYIFUSXQDNNH-UHFFFAOYSA-N	1	0	270.340	1.292	50	0		CDAARO
CC(C)OCC[N@@H+]1CCCN(C(=O)c2ccccn2)CC1	ZINC000089887872	392515010	/nfs/dbraw/zinc/51/50/10/392515010.db2.gz	WWTGGDJSEMFVIU-UHFFFAOYSA-N	1	0	291.395	1.655	50	0		CDAARO
OCCC1([NH2+]Cc2ccc(O)cc2)CCOCC1	ZINC000097104779	296542408	/nfs/dbraw/zinc/54/24/08/296542408.db2.gz	ZCGYRXNFEAOGSN-UHFFFAOYSA-N	1	0	251.326	1.413	50	0		CDAARO
CCS(=O)(=O)NCC[N@@H+]1[C@H](C)C[C@@H]2CCCC[C@@H]21	ZINC000195531489	397727855	/nfs/dbraw/zinc/72/78/55/397727855.db2.gz	RBZCOTIIGANSMM-AGIUHOORSA-N	1	0	274.430	1.579	50	0		CDAARO
COC(C[NH3+])(OC)c1cncc(Br)c1	ZINC000238336520	397785490	/nfs/dbraw/zinc/78/54/90/397785490.db2.gz	WZWAEECVCPKGLG-UHFFFAOYSA-N	1	0	261.119	1.248	50	0		CDAARO
CO[C@]1(C)C[C@H](NC(=O)[C@H]2CCC[NH2+]C2)C1(C)C	ZINC000246636371	286170842	/nfs/dbraw/zinc/17/08/42/286170842.db2.gz	KOLFHEAYEQJMLV-COPLHBTASA-N	1	0	254.374	1.306	50	0		CDAARO
CCO[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CCC[NH2+]C2)C1(C)C	ZINC000246853319	286243486	/nfs/dbraw/zinc/24/34/86/286243486.db2.gz	UASFHPXVZIJZAP-YNEHKIRRSA-N	1	0	268.401	1.648	50	0		CDAARO
CC[C@@H]([NH2+][C@@H](C)C(=O)NC(N)=O)c1ccc(C)cc1	ZINC000012798221	286918773	/nfs/dbraw/zinc/91/87/73/286918773.db2.gz	VBUXGDAJPNQTCS-CMPLNLGQSA-N	1	0	263.341	1.619	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@@H](O)C2)c(OC)c1OC	ZINC000004990289	170050813	/nfs/dbraw/zinc/05/08/13/170050813.db2.gz	JVARUSOZNFPFEX-GFCCVEGCSA-N	1	0	281.352	1.669	50	0		CDAARO
CCC[C@@]1(C(=O)OCC)C[C@@H](CSC(N)=[NH2+])OC1=O	ZINC000005979106	170165176	/nfs/dbraw/zinc/16/51/76/170165176.db2.gz	FVMXZJUGGLQTQM-UFBFGSQYSA-N	1	0	288.369	1.278	50	0		CDAARO
C[C@@H]1NC(=O)N(C2CC[NH+](Cc3ccccc3)CC2)C1=O	ZINC000006760106	170241632	/nfs/dbraw/zinc/24/16/32/170241632.db2.gz	MUELMPXIOWBHPX-LBPRGKRZSA-N	1	0	287.363	1.591	50	0		CDAARO
COc1ccc(S(=O)(=O)[C@@H](C[NH3+])c2ccco2)cc1	ZINC000007951921	170309436	/nfs/dbraw/zinc/30/94/36/170309436.db2.gz	JPOTVNMYTULOKV-ZDUSSCGKSA-N	1	0	281.333	1.762	50	0		CDAARO
CC[C@H](C)[NH2+]C[C@H](O)COc1ccccc1OC	ZINC000008844747	170357431	/nfs/dbraw/zinc/35/74/31/170357431.db2.gz	VXJQVAMMFVYRJF-RYUDHWBXSA-N	1	0	253.342	1.823	50	0		CDAARO
COc1cc(C[NH2+]Cc2cnn(C)c2)cc(OC)c1OC	ZINC000020146182	171032863	/nfs/dbraw/zinc/03/28/63/171032863.db2.gz	BQBHBDAGKMKERY-UHFFFAOYSA-N	1	0	291.351	1.736	50	0		CDAARO
[NH3+]CCS[C@@H]1CC(=O)N(Cc2ccc(F)cc2)C1=O	ZINC000020457732	171208652	/nfs/dbraw/zinc/20/86/52/171208652.db2.gz	MQEKXEWNTNOXOW-LLVKDONJSA-N	1	0	282.340	1.145	50	0		CDAARO
COC(=O)CCNC(=O)N1CCC(C[NH+]2CCCC2)CC1	ZINC000020532090	171240494	/nfs/dbraw/zinc/24/04/94/171240494.db2.gz	ZQVAYPYHZRDNKX-UHFFFAOYSA-N	1	0	297.399	1.067	50	0		CDAARO
Cc1nc2ccccn2c1CN1CC[N@@H+](C)[C@@H](CCO)C1	ZINC000020601025	171266800	/nfs/dbraw/zinc/26/68/00/171266800.db2.gz	VWHKOZYKCBKVFS-AWEZNQCLSA-N	1	0	288.395	1.141	50	0		CDAARO
Cc1cccc(C)c1OC[C@H](O)CN1CC[NH+](C)CC1	ZINC000021487204	171304483	/nfs/dbraw/zinc/30/44/83/171304483.db2.gz	KFADLJKPIHFAGI-OAHLLOKOSA-N	1	0	278.396	1.291	50	0		CDAARO
[NH3+]CCNCCOCCOc1ccc(Cl)cc1	ZINC000022034209	171350202	/nfs/dbraw/zinc/35/02/02/171350202.db2.gz	FQLITJGMIMLQIX-UHFFFAOYSA-N	1	0	258.749	1.284	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)c1nccnc1N)c1cccs1	ZINC000022687872	171395642	/nfs/dbraw/zinc/39/56/42/171395642.db2.gz	CCLCGOXMXPCVME-VIFPVBQESA-N	1	0	291.380	1.153	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)c1ccc[nH]c1=O)c1ccsc1	ZINC000023133320	171414136	/nfs/dbraw/zinc/41/41/36/171414136.db2.gz	HKAYNAJLAUPLAN-GFCCVEGCSA-N	1	0	291.376	1.469	50	0		CDAARO
CC(C)(C)c1csc(NC(=O)N[C@H]2CC[NH2+]C2)n1	ZINC000035287435	172105097	/nfs/dbraw/zinc/10/50/97/172105097.db2.gz	HESXGCQHEAHAOQ-QMMMGPOBSA-N	1	0	268.386	1.924	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N1CCC[C@@H]([NH3+])C1	ZINC000037116485	172967600	/nfs/dbraw/zinc/96/76/00/172967600.db2.gz	VVOJNXBPQSEJHS-LLVKDONJSA-N	1	0	272.345	1.246	50	0		CDAARO
C[NH+](C)CCCNC(=O)Cn1cnc(Cl)c1Cl	ZINC000040162843	174196936	/nfs/dbraw/zinc/19/69/36/174196936.db2.gz	RLOVYXMSSHVQNX-UHFFFAOYSA-N	1	0	279.171	1.258	50	0		CDAARO
CC(C)[C@@H]1CN(CC(=O)N(C)C)CCC[N@@H+]1CC1CC1	ZINC000071730515	176255998	/nfs/dbraw/zinc/25/59/98/176255998.db2.gz	HZZZADFOWORUDQ-HNNXBMFYSA-N	1	0	281.444	1.517	50	0		CDAARO
COc1cc(Cl)cc(C(=O)N2CC[C@@H]([NH3+])[C@@H](OC)C2)c1	ZINC000071765188	176261780	/nfs/dbraw/zinc/26/17/80/176261780.db2.gz	WRYAEYDKPNUWPR-OLZOCXBDSA-N	1	0	298.770	1.537	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(C(=O)Cc2ccccc2O)CC1	ZINC000072144232	176324244	/nfs/dbraw/zinc/32/42/44/176324244.db2.gz	NVGJZWOLHUTJDI-CQSZACIVSA-N	1	0	276.380	1.877	50	0		CDAARO
Cc1ncc(C(=O)N2CCCC[C@@H]2CC[NH+](C)C)c(=O)[nH]1	ZINC000072478392	176407684	/nfs/dbraw/zinc/40/76/84/176407684.db2.gz	VMRRJJKYHILIMC-GFCCVEGCSA-N	1	0	292.383	1.025	50	0		CDAARO
CCOC(=O)C1CC[NH+](C[C@@H](O)COC2CCCC2)CC1	ZINC000012419924	424377232	/nfs/dbraw/zinc/37/72/32/424377232.db2.gz	DDDDSBLKSQZIAX-CQSZACIVSA-N	1	0	299.411	1.582	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2CSc3ccccc32)CC[NH2+]1	ZINC000092239667	274329847	/nfs/dbraw/zinc/32/98/47/274329847.db2.gz	OWPSIYPOLGRTBT-PWSUYJOCSA-N	1	0	262.378	1.696	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1cc(=O)[nH]c2cc(F)ccc21	ZINC000125463313	274604383	/nfs/dbraw/zinc/60/43/83/274604383.db2.gz	YNKPVIHQYYCZES-VIFPVBQESA-N	1	0	289.310	1.101	50	0		CDAARO
CC(C)[NH2+][C@@H]1CCn2c(=O)[nH]c3cccc(c32)[C@H]1O	ZINC000003785294	275657311	/nfs/dbraw/zinc/65/73/11/275657311.db2.gz	ZSTCZWJCLIRCOJ-DGCLKSJQSA-N	1	0	261.325	1.133	50	0	in-man	CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)c1ccc2c(c1)CCO2	ZINC000122566098	277278177	/nfs/dbraw/zinc/27/81/77/277278177.db2.gz	UWLBSDXPYUKTQI-ZDUSSCGKSA-N	1	0	260.337	1.446	50	0		CDAARO
C[C@@H]([NH2+]C[C@H]1CN(C)CCN1C)c1ccccc1N(C)C	ZINC000093945023	278355213	/nfs/dbraw/zinc/35/52/13/278355213.db2.gz	YMQXQUKAMNASFG-CABCVRRESA-N	1	0	290.455	1.649	50	0		CDAARO
CC[C@H]1c2ccsc2CC[N@H+]1CCC(=O)NC(N)=O	ZINC000011473574	281281225	/nfs/dbraw/zinc/28/12/25/281281225.db2.gz	MNUVNRYOBJVSLH-JTQLQIEISA-N	1	0	281.381	1.642	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)/C=C\c2cccc(F)c2)C1	ZINC000255105244	289356375	/nfs/dbraw/zinc/35/63/75/289356375.db2.gz	TVRAPDFLXCCHHK-CFHLNLSMSA-N	1	0	262.328	1.907	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)/C=C\c2cnc(C)s2)C1	ZINC000255129161	289357511	/nfs/dbraw/zinc/35/75/11/289357511.db2.gz	WXERZMJLYDLDHK-ISALQUGTSA-N	1	0	265.382	1.675	50	0		CDAARO
[NH3+]Cc1ccc(C(=O)N2CCOC[C@@H]2C2CC2)cc1	ZINC000186481817	295278033	/nfs/dbraw/zinc/27/80/33/295278033.db2.gz	NQOXZUWNBFLQMN-CQSZACIVSA-N	1	0	260.337	1.396	50	0		CDAARO
C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNS(C)(=O)=O)C1	ZINC000048908214	297227816	/nfs/dbraw/zinc/22/78/16/297227816.db2.gz	GGGWFTKZIBZUKJ-GHMZBOCLSA-N	1	0	262.419	1.292	50	0		CDAARO
CCC[C@H](CNC(=O)c1ccc(F)c(O)c1)[NH+](C)C	ZINC000534577659	328310323	/nfs/dbraw/zinc/31/03/23/328310323.db2.gz	XFNMJIXETLUVFE-LLVKDONJSA-N	1	0	268.332	1.991	50	0		CDAARO
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@@H]1C[NH2+]C[C@H]1O	ZINC000534587523	328316124	/nfs/dbraw/zinc/31/61/24/328316124.db2.gz	XPFOQIWSQBGKMQ-HZPDHXFCSA-N	1	0	297.358	1.808	50	0		CDAARO
CC[N@@H+]1CCC[C@H](Nc2ncc(F)c(OC)n2)C1	ZINC000534642922	328329142	/nfs/dbraw/zinc/32/91/42/328329142.db2.gz	XAPIIDXPXKVKHT-VIFPVBQESA-N	1	0	254.309	1.521	50	0		CDAARO
c1ccc2nc(N3CCC4(CC3)C[NH2+]CCO4)cnc2c1	ZINC000534645340	328330619	/nfs/dbraw/zinc/33/06/19/328330619.db2.gz	ALKQNYZCBGYRFP-UHFFFAOYSA-N	1	0	284.363	1.589	50	0		CDAARO
Cc1cccc([C@@H](CNC(=O)c2cncnc2)[NH+](C)C)c1	ZINC000534637759	328334646	/nfs/dbraw/zinc/33/46/46/328334646.db2.gz	AIKWFYVHQFXSFY-OAHLLOKOSA-N	1	0	284.363	1.818	50	0		CDAARO
O=C(CN1Cc2ccccc2C1)NC[C@H]1CC[N@@H+](C2CC2)C1	ZINC000534659650	328342314	/nfs/dbraw/zinc/34/23/14/328342314.db2.gz	DEYUPVXLJWNRIV-CQSZACIVSA-N	1	0	299.418	1.603	50	0		CDAARO
COC[C@H](CO)NC(=O)CC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000534676112	328356322	/nfs/dbraw/zinc/35/63/22/328356322.db2.gz	SBHSXGFIZINYFB-LBPRGKRZSA-N	1	0	286.416	1.057	50	0		CDAARO
CN1CC[C@H]([NH2+]C[C@]2(O)CCCOC2)[C@@H]1c1ccccc1	ZINC000585094280	482828730	/nfs/dbraw/zinc/82/87/30/482828730.db2.gz	AFPQUXSEPKLJMZ-YESZJQIVSA-N	1	0	290.407	1.563	50	0		CDAARO
CN(C[C@@H]1CCCC[N@@H+]1C)c1ncccc1C(N)=O	ZINC000670444942	482994529	/nfs/dbraw/zinc/99/45/29/482994529.db2.gz	PZEFQPIDMLAIDN-NSHDSACASA-N	1	0	262.357	1.101	50	0		CDAARO
Cc1n[nH]cc1CN(C)C(=O)C[N@H+](C)C1CCCC1	ZINC000670449826	483009617	/nfs/dbraw/zinc/00/96/17/483009617.db2.gz	QHSDFYFQIXQZKW-UHFFFAOYSA-N	1	0	264.373	1.551	50	0		CDAARO
Cc1ncc(CO)c(C[N@H+](C)CCCn2cccn2)c1O	ZINC000670452960	483022556	/nfs/dbraw/zinc/02/25/56/483022556.db2.gz	CNKWXNZYDXBGSU-UHFFFAOYSA-N	1	0	290.367	1.307	50	0		CDAARO
O=C(C1CCC1)N1CCC[N@H+](C[C@H]2CCOC2)CC1	ZINC000670455939	483032633	/nfs/dbraw/zinc/03/26/33/483032633.db2.gz	RBIFKQBPRXVWNW-CYBMUJFWSA-N	1	0	266.385	1.357	50	0		CDAARO
CN1C[C@H](C[N@H+](C)CC(=O)NCC2CCCCC2)CC1=O	ZINC000670457710	483038805	/nfs/dbraw/zinc/03/88/05/483038805.db2.gz	QPNSZHJLAPCVJN-AWEZNQCLSA-N	1	0	295.427	1.093	50	0		CDAARO
CCOC(=O)N1CC[C@H]([NH2+]CCCn2ccccc2=O)C1	ZINC000670461663	483045196	/nfs/dbraw/zinc/04/51/96/483045196.db2.gz	VQAPRTWOVLUIBD-ZDUSSCGKSA-N	1	0	293.367	1.059	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CCc2nc(C)cc(=O)[nH]2)n1	ZINC000670462569	483050716	/nfs/dbraw/zinc/05/07/16/483050716.db2.gz	ZDQQVQGNDDLAMX-GFCCVEGCSA-N	1	0	289.383	1.525	50	0		CDAARO
COc1nc(NCC[C@H]2CCCC[N@@H+]2C)ncc1F	ZINC000670462626	483051003	/nfs/dbraw/zinc/05/10/03/483051003.db2.gz	RYDPQZJMIRMJNR-SNVBAGLBSA-N	1	0	268.336	1.911	50	0		CDAARO
C[C@H](CCc1ccccc1)[NH2+]CCC1N=NC(=O)N1C	ZINC000670469489	483064520	/nfs/dbraw/zinc/06/45/20/483064520.db2.gz	FHYHBEFBXFTWKK-GFCCVEGCSA-N	1	0	274.368	1.674	50	0		CDAARO
Cn1c(CC[NH3+])nnc1SCC[C@@H]1CC1(F)F	ZINC000426698264	534683177	/nfs/dbraw/zinc/68/31/77/534683177.db2.gz	NTEHKBLYJYEZJD-SSDOTTSWSA-N	1	0	262.329	1.454	50	0		CDAARO
COc1ccc(C[NH2+]C[C@@H]2COCCO2)cc1OC	ZINC000032578254	524072154	/nfs/dbraw/zinc/07/21/54/524072154.db2.gz	MRFIURSVARUYIG-GFCCVEGCSA-N	1	0	267.325	1.209	50	0		CDAARO
CC(C)(C[NH2+][C@H]1CCN(c2ccccn2)C1)S(C)(=O)=O	ZINC000096494399	527180738	/nfs/dbraw/zinc/18/07/38/527180738.db2.gz	VHMOUFWTWYQGCB-LBPRGKRZSA-N	1	0	297.424	1.073	50	0		CDAARO
[NH3+][C@@H]1CCC[C@@H](C(=O)NC[C@H](O)c2c(F)cccc2F)C1	ZINC000299748190	527350021	/nfs/dbraw/zinc/35/00/21/527350021.db2.gz	GJOZHKQPXQWVRR-BREBYQMCSA-N	1	0	298.333	1.632	50	0		CDAARO
CC(C)c1nccn1C[C@@H](O)C[NH+]1C[C@@H](C)O[C@H](C)C1	ZINC000096484733	528372160	/nfs/dbraw/zinc/37/21/60/528372160.db2.gz	OQPUCFZDIPNVQJ-MCIONIFRSA-N	1	0	281.400	1.477	50	0		CDAARO
CC1CCN(CC(=O)Nc2ccn(-c3cc[nH+]cc3)n2)CC1	ZINC000268512612	535276431	/nfs/dbraw/zinc/27/64/31/535276431.db2.gz	CVUUPAVEUUEZSX-UHFFFAOYSA-N	1	0	299.378	1.938	50	0		CDAARO
CC(C)[N@@H+]1CCCN(C(=O)[C@@H](N)c2ccccc2)CC1	ZINC000097049156	567903497	/nfs/dbraw/zinc/90/34/97/567903497.db2.gz	RQDDIQPKAZVNQM-HNNXBMFYSA-N	1	0	275.396	1.629	50	0		CDAARO
CC[C@@H](C(=O)Nc1ccc(-c2ncn(C)n2)cc1)[NH+](C)C	ZINC000097140516	567905074	/nfs/dbraw/zinc/90/50/74/567905074.db2.gz	BOPKWZYEVDODRB-ZDUSSCGKSA-N	1	0	287.367	1.761	50	0		CDAARO
NC[C@@H]1C[C@H]([C@H]2CC[C@@H](C(F)(F)F)NC2)CC[NH2+]1	ZINC000757207443	577035903	/nfs/dbraw/zinc/03/59/03/577035903.db2.gz	BEYZMBORRMATFB-RCWTZXSCSA-N	1	0	265.323	1.244	50	0		CDAARO
C[C@@H]1C[C@H]([C@@H]2CC[C@@H](C(F)(F)F)NC2)NC[C@H]1[NH3+]	ZINC000757210035	577036285	/nfs/dbraw/zinc/03/62/85/577036285.db2.gz	HQFSEQAUFRVGQX-ILAIQSSSSA-N	1	0	265.323	1.242	50	0		CDAARO
CN(C)C1(C(=O)Nc2ccc3c(c2F)CC[NH2+]C3)CC1	ZINC000888096560	617758578	/nfs/dbraw/zinc/75/85/78/617758578.db2.gz	JMJUUKUBLOCXKM-UHFFFAOYSA-N	1	0	277.343	1.504	50	0		CDAARO
Cc1cccnc1N1CCN([C@H]2C[NH+]3CCC2CC3)CC1	ZINC000825236510	1161938353	/nfs/dbraw/zinc/93/83/53/1161938353.db2.gz	GWVHGTLRAXTGRM-INIZCTEOSA-N	1	0	286.423	1.606	50	0		CDAARO
OC[C@H]1CCCN(CC[NH2+]C2CSCCSC2)C1	ZINC000952990813	818910299	/nfs/dbraw/zinc/91/02/99/818910299.db2.gz	XENAPDFQADJMOE-LBPRGKRZSA-N	1	0	290.498	1.129	50	0		CDAARO
CCOC(=O)N1CCC([N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000023282398	820179910	/nfs/dbraw/zinc/17/99/10/820179910.db2.gz	HLABMGJVARLIJR-TXEJJXNPSA-N	1	0	270.373	1.717	50	0		CDAARO
O=C(NCC1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccoc1	ZINC000952984626	820385154	/nfs/dbraw/zinc/38/51/54/820385154.db2.gz	PZDVRKALAPWCBT-AWEZNQCLSA-N	1	0	292.379	1.758	50	0		CDAARO
Cc1cccc(C[NH2+]CCN2CCC[C@@H](CO)C2)n1	ZINC000952975073	821894488	/nfs/dbraw/zinc/89/44/88/821894488.db2.gz	NWRSFECDFSVAGA-CQSZACIVSA-N	1	0	263.385	1.184	50	0		CDAARO
CCc1ccc(C[N@@H+]2CC[C@@H](N3CCOCC3)[C@H](O)C2)o1	ZINC000023128787	822064170	/nfs/dbraw/zinc/06/41/70/822064170.db2.gz	SMLRKTVUDZUKGS-HZPDHXFCSA-N	1	0	294.395	1.109	50	0		CDAARO
[NH3+][C@H]1[C@H]2C=C[C@H](C2)[C@H]1C(=O)N(Cc1ccncc1)C1CC1	ZINC000952989374	822357749	/nfs/dbraw/zinc/35/77/49/822357749.db2.gz	WRMXMOIJJFBOJR-CLWVCHIJSA-N	1	0	283.375	1.722	50	0		CDAARO
NC(=O)[C@@H]1CCC[N@@H+]([C@@H]2CCc3ccccc3C2)C1	ZINC000023282358	822635183	/nfs/dbraw/zinc/63/51/83/822635183.db2.gz	KAFBBKJAOLFKCB-HUUCEWRRSA-N	1	0	258.365	1.741	50	0		CDAARO
CCC1CCC(CNC(=O)[C@]2([NH3+])CC[C@@H](O)C2)CC1	ZINC000952884281	910458046	/nfs/dbraw/zinc/45/80/46/910458046.db2.gz	XTXQQAOIFVBRIA-SJQFEJMWSA-N	1	0	268.401	1.561	50	0		CDAARO
CC[N@H+](C)C1(CNS(=O)(=O)N2CCCC2)CCCC1	ZINC000823067918	925667575	/nfs/dbraw/zinc/66/75/75/925667575.db2.gz	ZJXNDPLYLJIGMW-UHFFFAOYSA-N	1	0	289.445	1.181	50	0		CDAARO
Cc1nccc(NCC(C)(C)N2CC[NH+](C)CC2)n1	ZINC000823789365	925732567	/nfs/dbraw/zinc/73/25/67/925732567.db2.gz	GZMVUQKRKHIEJM-UHFFFAOYSA-N	1	0	263.389	1.223	50	0		CDAARO
Cc1[nH]ccc1C(=O)NCC[C@@H](C)[NH+]1CCN(C)CC1	ZINC000823789395	925733125	/nfs/dbraw/zinc/73/31/25/925733125.db2.gz	LPQFYOZBDNVDOY-GFCCVEGCSA-N	1	0	278.400	1.079	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CN(C)c2nc(C)cnc2C)C1	ZINC000824412338	925821232	/nfs/dbraw/zinc/82/12/32/925821232.db2.gz	GJPKDRRXJIIHIJ-AWEZNQCLSA-N	1	0	278.400	1.498	50	0		CDAARO
COc1nc(NC[C@@H]2CCC[N@@H+]2C(C)C)ncc1F	ZINC000824845771	925840828	/nfs/dbraw/zinc/84/08/28/925840828.db2.gz	IGKWMJSEJGIETQ-JTQLQIEISA-N	1	0	268.336	1.909	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)[C@@H]1C[C@@H]2C=C[C@H]1C2	ZINC000828111331	926036366	/nfs/dbraw/zinc/03/63/66/926036366.db2.gz	CMUSHRIZIIOUNW-HZSPNIEDSA-N	1	0	271.364	1.552	50	0		CDAARO
OC[C@H]1CCCCN1CC[NH2+]C1CSCCSC1	ZINC000828710945	926168393	/nfs/dbraw/zinc/16/83/93/926168393.db2.gz	QOLSWFBDRJLYRH-CYBMUJFWSA-N	1	0	290.498	1.271	50	0		CDAARO
Cc1ccncc1C(=O)NCCC[N@@H+]1CCCC[C@H]1CO	ZINC000828710763	926169046	/nfs/dbraw/zinc/16/90/46/926169046.db2.gz	BUTZVRMHPKOJST-AWEZNQCLSA-N	1	0	291.395	1.357	50	0		CDAARO
CC(C)N(C)C[C@@H](C)[NH2+]Cc1cccc(CO)c1	ZINC000828827586	926194237	/nfs/dbraw/zinc/19/42/37/926194237.db2.gz	JNWQNCLNTKQRBR-CYBMUJFWSA-N	1	0	250.386	1.997	50	0		CDAARO
COc1ccccc1/C=C/C[NH2+]CCN(C)OC	ZINC000585118428	930979966	/nfs/dbraw/zinc/97/99/66/930979966.db2.gz	OORBTHRUMIPJJZ-SOFGYWHQSA-N	1	0	250.342	1.791	50	0		CDAARO
CN(C[C@@H]1CCCC[N@@H+]1C)C(=O)c1cccc(=O)[nH]1	ZINC001506405286	975152182	/nfs/dbraw/zinc/15/21/82/975152182.db2.gz	AVRGKSQUNKAROX-NSHDSACASA-N	1	0	263.341	1.344	50	0		CDAARO
CCNC(=O)c1ccc(NC(=O)CC2C[NH2+]C2)cc1Cl	ZINC001506418820	975157142	/nfs/dbraw/zinc/15/71/42/975157142.db2.gz	TZPNOOMUDOXRQC-UHFFFAOYSA-N	1	0	295.770	1.638	50	0		CDAARO
NC(=O)[C@@H]1CCC[N@@H+]1CCSCc1ccccc1	ZINC000192618787	342468333	/nfs/dbraw/zinc/46/83/33/342468333.db2.gz	IROMJZHYWBRQPD-ZDUSSCGKSA-N	1	0	264.394	1.870	50	0		CDAARO
C[NH+](C)CCCN1C(=O)N[C@@H](Cc2ccccc2)C1=O	ZINC000004073985	230368418	/nfs/dbraw/zinc/36/84/18/230368418.db2.gz	YDWXKRCTOVMVAJ-ZDUSSCGKSA-N	1	0	275.352	1.101	50	0	biogenic	CDAARO
CC[N@@H+]1CCN(C(=O)[C@@]2(C)CCCCO2)CC1(C)C	ZINC000584903686	341987056	/nfs/dbraw/zinc/98/70/56/341987056.db2.gz	JPLACJYVNRISCH-OAHLLOKOSA-N	1	0	268.401	1.888	50	0		CDAARO
Cc1nn(C)c2nc(NCC[NH+]3CCCC3)sc12	ZINC000095531796	185004734	/nfs/dbraw/zinc/00/47/34/185004734.db2.gz	KGHWCSPZQKQZRN-UHFFFAOYSA-N	1	0	265.386	1.846	50	0		CDAARO
Cc1csc(N2CC[N@@H+](CCCO)C[C@H]2C)n1	ZINC000106844320	349506865	/nfs/dbraw/zinc/50/68/65/349506865.db2.gz	ICGJFEIWZVGCSI-LLVKDONJSA-N	1	0	255.387	1.344	50	0		CDAARO
NC(=O)[C@@H](C[NH2+][C@@H]1CCSC1)Cc1ccc(F)cc1	ZINC000097375218	342002728	/nfs/dbraw/zinc/00/27/28/342002728.db2.gz	MBIVMDAVBWVICO-DGCLKSJQSA-N	1	0	282.384	1.565	50	0		CDAARO
NC(=O)[C@H](C[NH2+][C@H]1CCSC1)Cc1ccc(F)cc1	ZINC000097375219	342002835	/nfs/dbraw/zinc/00/28/35/342002835.db2.gz	MBIVMDAVBWVICO-AAEUAGOBSA-N	1	0	282.384	1.565	50	0		CDAARO
O=C(C[N@H+]1CCC[C@@H]1CO)NC1CCCCCCC1	ZINC000095948535	185038783	/nfs/dbraw/zinc/03/87/83/185038783.db2.gz	ZTQGKLQKMOAFPN-CQSZACIVSA-N	1	0	268.401	1.672	50	0		CDAARO
COC(=O)N1CCC[C@@H]([NH2+][C@@H](C)c2ccccn2)C1	ZINC000095980730	185053169	/nfs/dbraw/zinc/05/31/69/185053169.db2.gz	MIHWMBXPSKWOOP-NWDGAFQWSA-N	1	0	263.341	1.963	50	0		CDAARO
C[C@H]([NH2+]CC(=O)NCc1ccc(F)cc1)C1CCOCC1	ZINC000095985404	185055576	/nfs/dbraw/zinc/05/55/76/185055576.db2.gz	OJXMRDWETHLVAC-LBPRGKRZSA-N	1	0	294.370	1.847	50	0		CDAARO
O=C(NCc1ccccc1C[N@H+]1CC[C@@H](O)C1)C1CC1	ZINC000096006293	185062594	/nfs/dbraw/zinc/06/25/94/185062594.db2.gz	AEBVRWGZTNZVJD-OAHLLOKOSA-N	1	0	274.364	1.279	50	0		CDAARO
COc1ccc(OCC[N@H+](C)[C@H](C)C[S@](C)=O)cc1	ZINC000096012897	185066047	/nfs/dbraw/zinc/06/60/47/185066047.db2.gz	NOGUJTHNANSQPL-CWTRNNRKSA-N	1	0	285.409	1.773	50	0		CDAARO
O=C(CC[NH+]1CCSCC1)Nc1nnc(C2CC2)s1	ZINC000240163618	361747086	/nfs/dbraw/zinc/74/70/86/361747086.db2.gz	JCOSQOJLQXQOIY-UHFFFAOYSA-N	1	0	298.437	1.793	50	0		CDAARO
CC(C)(C)[C@@H](O)C[C@@H](CO)[NH2+]Cc1cnn2ccccc12	ZINC000241301044	361752259	/nfs/dbraw/zinc/75/22/59/361752259.db2.gz	LPXKIEWONAQRQE-ZFWWWQNUSA-N	1	0	291.395	1.582	50	0		CDAARO
CCCC[N@H+](C)CCNC(=O)N1CCO[C@H](C)[C@H]1C	ZINC000241588417	361752806	/nfs/dbraw/zinc/75/28/06/361752806.db2.gz	PDAJBIUDMKJSQW-CHWSQXEVSA-N	1	0	271.405	1.537	50	0		CDAARO
C[NH+](C)CCO[C@@H]1COCC[C@H]1NC(=O)CC1=CCCC1	ZINC000219037579	282109119	/nfs/dbraw/zinc/10/91/19/282109119.db2.gz	YVDVWQNEOJDQIR-HUUCEWRRSA-N	1	0	296.411	1.339	50	0		CDAARO
C[C@H]([NH2+]Cc1ccon1)C1(N2CCOCC2)CCCC1	ZINC000195570222	342628812	/nfs/dbraw/zinc/62/88/12/342628812.db2.gz	IAMLTSFRWHFRAR-ZDUSSCGKSA-N	1	0	279.384	1.798	50	0		CDAARO
Cc1nc(CC[N@H+]2CCC[C@@]3(CN(C)C(=O)O3)C2)cs1	ZINC000244659837	361854823	/nfs/dbraw/zinc/85/48/23/361854823.db2.gz	HJTPNSZQKOZLBM-CQSZACIVSA-N	1	0	295.408	1.911	50	0		CDAARO
Cc1cnn(CC(=O)NCc2ccccc2C[NH+](C)C)c1	ZINC000244852498	361866470	/nfs/dbraw/zinc/86/64/70/361866470.db2.gz	UTMQQHRENYEICS-UHFFFAOYSA-N	1	0	286.379	1.570	50	0		CDAARO
COc1ccccc1C[N@H+](CCO)CCn1nccc1C	ZINC000244873585	361867562	/nfs/dbraw/zinc/86/75/62/361867562.db2.gz	WSMQLYJZWRCMHA-UHFFFAOYSA-N	1	0	289.379	1.695	50	0		CDAARO
c1cncc(-c2noc([C@H]3C[NH2+]CC34CCOCC4)n2)c1	ZINC000097945045	342166452	/nfs/dbraw/zinc/16/64/52/342166452.db2.gz	SQFWBAPXUFKWSO-GFCCVEGCSA-N	1	0	286.335	1.615	50	0		CDAARO
CN(C)c1ccc2c3c1cccc3C(=O)N(CC[NH3+])C2=O	ZINC000096928013	185132225	/nfs/dbraw/zinc/13/22/25/185132225.db2.gz	IQKFJZKSENZCLN-UHFFFAOYSA-N	1	0	283.331	1.461	50	0		CDAARO
CC(C)[C@H]([NH3+])C(=O)N1CC[C@@H](Oc2cccnc2)C1	ZINC000097234165	342205453	/nfs/dbraw/zinc/20/54/53/342205453.db2.gz	AHDSUBVIBYULCZ-OLZOCXBDSA-N	1	0	263.341	1.045	50	0		CDAARO
Cc1ncsc1CC[NH+]1CCC(Cn2ccnn2)CC1	ZINC000097021022	185153771	/nfs/dbraw/zinc/15/37/71/185153771.db2.gz	HFBXYCBNWBWLQJ-UHFFFAOYSA-N	1	0	291.424	1.998	50	0		CDAARO
Cc1ccc2ccccc2c1Cn1cc(C[C@@H]([NH3+])CO)nn1	ZINC000585134240	342215400	/nfs/dbraw/zinc/21/54/00/342215400.db2.gz	JNCQGGNAYQGDCU-CQSZACIVSA-N	1	0	296.374	1.650	50	0		CDAARO
c1n[nH]cc1O[C@@H]1COC[C@@H]1[NH2+][C@H]1CCc2ccccc21	ZINC000685940994	539045914	/nfs/dbraw/zinc/04/59/14/539045914.db2.gz	NELPNJYBKPVPIM-HRCADAONSA-N	1	0	285.347	1.833	50	0		CDAARO
C[C@@H]1C[N@H+](C)C[C@H]1NS(=O)(=O)Cc1cccc(F)c1	ZINC000257366339	539096154	/nfs/dbraw/zinc/09/61/54/539096154.db2.gz	SQRLRIPLTKSQCW-ZWNOBZJWSA-N	1	0	286.372	1.195	50	0		CDAARO
CNC(=O)C1CC[NH+](CC(=O)N2[C@H](C)CCC[C@H]2C)CC1	ZINC000025755266	539133696	/nfs/dbraw/zinc/13/36/96/539133696.db2.gz	UWZLBWPIDFMDJH-CHWSQXEVSA-N	1	0	295.427	1.234	50	0		CDAARO
Cc1ncc(CN2CC[N@@H+](CC(C)(C)O)C[C@H]2C)o1	ZINC000585120799	362039872	/nfs/dbraw/zinc/03/98/72/362039872.db2.gz	LTVCTQSLZIBLJC-LLVKDONJSA-N	1	0	267.373	1.260	50	0		CDAARO
CCCCNC(=O)[C@H](C)N1C[C@@H](C)[N@@H+](CC)[C@@H](C)C1	ZINC000585116120	362043691	/nfs/dbraw/zinc/04/36/91/362043691.db2.gz	HRPZFKXUQZLWMC-MJBXVCDLSA-N	1	0	269.433	1.706	50	0		CDAARO
Cc1noc([C@@H]2CN(Cc3ccncc3F)CCN2C)n1	ZINC000585116754	362045172	/nfs/dbraw/zinc/04/51/72/362045172.db2.gz	HIJLCSLWFHDIEX-ZDUSSCGKSA-N	1	0	291.330	1.401	50	0		CDAARO
C[C@H](C(=O)N1CCO[C@@](C)(c2ccccc2)C1)[NH+](C)C	ZINC000585131676	362056876	/nfs/dbraw/zinc/05/68/76/362056876.db2.gz	COCWGOAPPSRHFE-CZUORRHYSA-N	1	0	276.380	1.711	50	0		CDAARO
CCc1cccc(S(=O)(=O)N2CC[C@@H]([NH2+]C)C2)c1	ZINC000095972586	342431854	/nfs/dbraw/zinc/43/18/54/342431854.db2.gz	RHNGNXMUGDGSKX-GFCCVEGCSA-N	1	0	268.382	1.231	50	0		CDAARO
CNC(=O)[C@H]1CC[N@H+](Cc2cccc(SC)c2)C1	ZINC000097743185	529926245	/nfs/dbraw/zinc/92/62/45/529926245.db2.gz	PZJOUTFOPDZMDO-LBPRGKRZSA-N	1	0	264.394	1.976	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C/C(=O)N1CC[N@@H+](C)C[C@@H]1C	ZINC000089512384	362310878	/nfs/dbraw/zinc/31/08/78/362310878.db2.gz	AWTWCPHJYBPIHE-PORFMDCZSA-N	1	0	296.802	1.558	50	0		CDAARO
[NH3+][C@H]1C[C@@H](c2cc(NCCCCCO)ncn2)C1	ZINC000252527905	362391413	/nfs/dbraw/zinc/39/14/13/362391413.db2.gz	DPZHQKJHBCGWBR-PHIMTYICSA-N	1	0	250.346	1.256	50	0		CDAARO
Cn1nccc1C1CC[NH+](Cc2ccnc(N)c2)CC1	ZINC000191468982	362439356	/nfs/dbraw/zinc/43/93/56/362439356.db2.gz	ILDPFMOAPDJENX-UHFFFAOYSA-N	1	0	271.368	1.777	50	0		CDAARO
COCCCC(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1C	ZINC000106842344	345813064	/nfs/dbraw/zinc/81/30/64/345813064.db2.gz	MIALZHWAHRXJRF-CHWSQXEVSA-N	1	0	254.374	1.498	50	0		CDAARO
C[C@H]1CCC[NH2+][C@H]1CNC(=O)CCC(F)(F)F	ZINC000088833034	346100054	/nfs/dbraw/zinc/10/00/54/346100054.db2.gz	VESGOPWVXBZQEY-IUCAKERBSA-N	1	0	252.280	1.833	50	0		CDAARO
O=C(C[C@@H]1CC[NH2+]C1)NCCCc1ccccc1F	ZINC000097698611	185654065	/nfs/dbraw/zinc/65/40/65/185654065.db2.gz	LTPDOIVIXWORLD-LBPRGKRZSA-N	1	0	264.344	1.874	50	0		CDAARO
Cn1cc([C@H]2OCC[C@H]2C[NH2+]Cc2ccco2)cn1	ZINC000089755327	347612119	/nfs/dbraw/zinc/61/21/19/347612119.db2.gz	XYQRVOAYRTXDFW-FZMZJTMJSA-N	1	0	261.325	1.881	50	0		CDAARO
CO[C@H]1[C@@H]2CC[C@H]1CN(C(=O)[C@H]1CC13CC[NH2+]CC3)C2	ZINC000584885640	349344014	/nfs/dbraw/zinc/34/40/14/349344014.db2.gz	ALRGWHZJYVMSGY-RQJABVFESA-N	1	0	278.396	1.260	50	0		CDAARO
C[C@H](CN1CCOCC1)[NH2+]Cc1nc2ccccc2o1	ZINC000584889686	349348604	/nfs/dbraw/zinc/34/86/04/349348604.db2.gz	YBFNMHFIBDDCBK-GFCCVEGCSA-N	1	0	275.352	1.638	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@H](NC(=O)c2cnc(N)s2)C1	ZINC000584893986	349354145	/nfs/dbraw/zinc/35/41/45/349354145.db2.gz	NCXQBIZAYBZTSI-QMMMGPOBSA-N	1	0	268.386	1.158	50	0		CDAARO
Cc1cc(CC(=O)N2CC[NH+](CC3CCCC3)CC2)on1	ZINC000584895035	349355107	/nfs/dbraw/zinc/35/51/07/349355107.db2.gz	JKSCIXRJIDNDNH-UHFFFAOYSA-N	1	0	291.395	1.860	50	0		CDAARO
CC[N@H+](C)C1(CNC(=O)c2c[nH]c(=O)cn2)CCCCC1	ZINC000584898488	349360094	/nfs/dbraw/zinc/36/00/94/349360094.db2.gz	HVCJIUKTCTWVSI-UHFFFAOYSA-N	1	0	292.383	1.154	50	0		CDAARO
CC(C)[C@@H](CNc1cccc(C(=O)N(C)C)n1)[NH+](C)C	ZINC000584900404	349362413	/nfs/dbraw/zinc/36/24/13/349362413.db2.gz	KIAOLUBXIZCYOT-CYBMUJFWSA-N	1	0	278.400	1.782	50	0		CDAARO
[NH3+]CCc1ccc(C(=O)NCc2cncn2C2CC2)cc1	ZINC000584900784	349362876	/nfs/dbraw/zinc/36/28/76/349362876.db2.gz	QLHXPSQLCSZPDH-UHFFFAOYSA-N	1	0	284.363	1.649	50	0		CDAARO
C[NH+](C)C[C@@H]1CN(Cc2ccccc2F)C[C@@H]1CO	ZINC000091254673	180114950	/nfs/dbraw/zinc/11/49/50/180114950.db2.gz	OGFAZNRGMDJBST-ZIAGYGMSSA-N	1	0	266.360	1.428	50	0		CDAARO
O=c1ccc(C[C@@H]2CC[N@@H+](C3CCOCC3)C2)c[nH]1	ZINC000091364886	180142239	/nfs/dbraw/zinc/14/22/39/180142239.db2.gz	YICBWYSSMWFUAQ-ZDUSSCGKSA-N	1	0	262.353	1.418	50	0		CDAARO
CC(C)c1cc(C(=O)NCC[N@@H+]2CCCC[C@@H]2CO)on1	ZINC000091585583	180199641	/nfs/dbraw/zinc/19/96/41/180199641.db2.gz	KLWFZXOBCINWLX-GFCCVEGCSA-N	1	0	295.383	1.375	50	0		CDAARO
O[C@H](CNc1ncccn1)C[NH+]1CCCCCC1	ZINC000091593598	180201882	/nfs/dbraw/zinc/20/18/82/180201882.db2.gz	QVPUOCAIGGDZEK-GFCCVEGCSA-N	1	0	250.346	1.125	50	0		CDAARO
Cc1cnc(N)nc1NCCC[N@H+]1CCC[C@H](C)C1	ZINC000091616655	180208492	/nfs/dbraw/zinc/20/84/92/180208492.db2.gz	XNIZGCGQTHJELH-NSHDSACASA-N	1	0	263.389	1.901	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1CCC[C@H](c2nncn2C2CC2)C1	ZINC000091629565	180210018	/nfs/dbraw/zinc/21/00/18/180210018.db2.gz	JWIPMRAUTBYEJN-WCQYABFASA-N	1	0	264.373	1.563	50	0		CDAARO
Cc1cnc(CN2C[C@H]([NH+](C)C)[C@@H](C3CC3)C2)cn1	ZINC000091663995	180221125	/nfs/dbraw/zinc/22/11/25/180221125.db2.gz	PGWKLORTQLGPHQ-CABCVRRESA-N	1	0	260.385	1.557	50	0		CDAARO
CCn1c(Cn2ccnc2)nnc1C1CC[NH+](C)CC1	ZINC000091769215	180249230	/nfs/dbraw/zinc/24/92/30/180249230.db2.gz	ZLWFCZHLHIRLFZ-UHFFFAOYSA-N	1	0	274.372	1.352	50	0		CDAARO
CCCN1CCC[C@@]2(CC[N@H+](Cc3nc(C)no3)C2)C1=O	ZINC000091737360	180244465	/nfs/dbraw/zinc/24/44/65/180244465.db2.gz	URNLFQIRMCMVBF-HNNXBMFYSA-N	1	0	292.383	1.603	50	0		CDAARO
CC1(C)CN(CC(F)(F)F)CC[N@@H+]1C[C@H]1CCOC1	ZINC000110707142	350284470	/nfs/dbraw/zinc/28/44/70/350284470.db2.gz	KYCZXFPPKGVTPH-LLVKDONJSA-N	1	0	280.334	1.981	50	0		CDAARO
Cc1cc(NC(=O)NC[C@@H](C)[N@@H+]2CCC[C@@H](C)C2)n(C)n1	ZINC000106070992	186101719	/nfs/dbraw/zinc/10/17/19/186101719.db2.gz	JHIQXVUMPHXRQY-DGCLKSJQSA-N	1	0	293.415	1.970	50	0		CDAARO
Cc1occc1CNC(=O)NC[C@@H]1C[N@@H+]2CCC[C@H]2CO1	ZINC000106838886	186139174	/nfs/dbraw/zinc/13/91/74/186139174.db2.gz	XNAICLHEIUUBRE-UONOGXRCSA-N	1	0	293.367	1.250	50	0		CDAARO
Cc1ccc(C(=O)N[C@@H](C)C[N@@H+]2CCC[C@@H](C)C2)c(=O)[nH]1	ZINC000106927659	186152146	/nfs/dbraw/zinc/15/21/46/186152146.db2.gz	LALSFUNMHQMMEF-YPMHNXCESA-N	1	0	291.395	1.534	50	0		CDAARO
CC[NH+]1CCC(Nc2ncnc3c2cnn3C)CC1	ZINC000014269231	366144804	/nfs/dbraw/zinc/14/48/04/366144804.db2.gz	CGHBTSPSECEDCF-UHFFFAOYSA-N	1	0	260.345	1.260	50	0		CDAARO
Ic1ccccc1N1CC[NH2+]CC1	ZINC000037483592	283041606	/nfs/dbraw/zinc/04/16/06/283041606.db2.gz	RJZVGHMLORZACI-UHFFFAOYSA-N	1	0	288.132	1.701	50	0		CDAARO
O=C(CC[NH+]1CCCC1)NC[C@@H]1COc2ccccc2O1	ZINC000000379339	355907218	/nfs/dbraw/zinc/90/72/18/355907218.db2.gz	LGIMQBGKELFJBB-CYBMUJFWSA-N	1	0	290.363	1.429	50	0		CDAARO
Cc1cc[n+](CCON2C(=O)c3ccccc3C2=O)cc1	ZINC000000406269	355909397	/nfs/dbraw/zinc/90/93/97/355909397.db2.gz	YDVOJXQOHALCAF-UHFFFAOYSA-N	1	0	283.307	1.510	50	0		CDAARO
CC[NH2+]Cc1cc(Br)ccc1OCC(N)=O	ZINC000002882856	355986566	/nfs/dbraw/zinc/98/65/66/355986566.db2.gz	OFZGFNZLEPRDRQ-UHFFFAOYSA-N	1	0	287.157	1.423	50	0		CDAARO
COc1cc(N2CCC[C@@H](CC[NH3+])C2)nc(OC)n1	ZINC000032560957	356264869	/nfs/dbraw/zinc/26/48/69/356264869.db2.gz	AUWFVXNLQUDNEB-JTQLQIEISA-N	1	0	266.345	1.059	50	0		CDAARO
C[C@H]1CCCN(C(=O)c2ccc(C(N)=O)s2)[C@@H]1C[NH3+]	ZINC000299739073	356267026	/nfs/dbraw/zinc/26/70/26/356267026.db2.gz	KGSYODOZTGVROB-DTWKUNHWSA-N	1	0	281.381	1.046	50	0		CDAARO
CC(C)[N@H+](CC(=O)Nc1sccc1C(N)=O)C1CC1	ZINC000032777888	356363466	/nfs/dbraw/zinc/36/34/66/356363466.db2.gz	QOEOMQPAFPVKQK-UHFFFAOYSA-N	1	0	281.381	1.658	50	0		CDAARO
O[C@@H](COCc1ccc2c(c1)OCO2)C[NH+]1CCCC1	ZINC000014238195	356381294	/nfs/dbraw/zinc/38/12/94/356381294.db2.gz	SETSJNISPQKTMF-CYBMUJFWSA-N	1	0	279.336	1.389	50	0		CDAARO
C[NH+]1CCC(NS(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000014252164	356382361	/nfs/dbraw/zinc/38/23/61/356382361.db2.gz	PUSHCRMRXFVQNA-UHFFFAOYSA-N	1	0	288.800	1.713	50	0		CDAARO
CC[NH+]1CCC(NC(=O)COc2ccccc2C)CC1	ZINC000016580032	356442001	/nfs/dbraw/zinc/44/20/01/356442001.db2.gz	OBLYZIFZJONSFI-UHFFFAOYSA-N	1	0	276.380	1.974	50	0		CDAARO
C[C@@H](CN1CC[NH+](C)CC1)OC(=O)c1cccc(F)c1	ZINC000019367907	356482717	/nfs/dbraw/zinc/48/27/17/356482717.db2.gz	ODMNRTFCRVSWLT-LBPRGKRZSA-N	1	0	280.343	1.618	50	0		CDAARO
COc1cc(OC)c(OC)cc1C[NH2+]CCN(C)C	ZINC000019871907	356512219	/nfs/dbraw/zinc/51/22/19/356512219.db2.gz	XSBZGNUKMGYNMK-UHFFFAOYSA-N	1	0	268.357	1.364	50	0		CDAARO
CCC[NH+]1CCC([NH+]2CCC(C(=O)[O-])CC2)CC1	ZINC000019735730	356497981	/nfs/dbraw/zinc/49/79/81/356497981.db2.gz	WVQARFWGLDYKMP-UHFFFAOYSA-N	1	0	254.374	1.657	50	0		CDAARO
O=C(C[NH2+]C[C@@H]1CCCO1)Nc1cccc(F)c1	ZINC000020055620	356523922	/nfs/dbraw/zinc/52/39/22/356523922.db2.gz	VGLDXKUHHKZEQE-LBPRGKRZSA-N	1	0	252.289	1.533	50	0		CDAARO
CN1CC[NH+](CCCCOc2ccc(CO)cc2)CC1	ZINC000022995815	356625933	/nfs/dbraw/zinc/62/59/33/356625933.db2.gz	FOXVSTUFPDKNPO-UHFFFAOYSA-N	1	0	278.396	1.585	50	0		CDAARO
CC[N@H+](CCN1C(=O)CNC1=O)Cc1cccc(F)c1	ZINC000024843660	356662459	/nfs/dbraw/zinc/66/24/59/356662459.db2.gz	TUAZHSSKWMEZKS-UHFFFAOYSA-N	1	0	279.315	1.199	50	0		CDAARO
COc1cc(C[NH2+]CCN(C)C)cc2c1OCO2	ZINC000025607399	356679578	/nfs/dbraw/zinc/67/95/78/356679578.db2.gz	GAORAEZFSVQKTL-UHFFFAOYSA-N	1	0	252.314	1.075	50	0		CDAARO
NS(=O)(=O)c1ccc(OCC[NH+]2CCCCCC2)cc1	ZINC000027269481	356705283	/nfs/dbraw/zinc/70/52/83/356705283.db2.gz	FPKJBVGSJXTMGU-UHFFFAOYSA-N	1	0	298.408	1.589	50	0		CDAARO
[NH3+]CCSCc1nc(=O)c2c3c(sc2[nH]1)CCC3	ZINC000031775956	356770008	/nfs/dbraw/zinc/77/00/08/356770008.db2.gz	BNYMMPYECXDWJI-UHFFFAOYSA-N	1	0	281.406	1.665	50	0		CDAARO
Cc1cc2ncn(CC(=O)NC[C@@H]3CCCO3)c2cc1C	ZINC000032497900	356780861	/nfs/dbraw/zinc/78/08/61/356780861.db2.gz	GGKGUDNMARMHGK-ZDUSSCGKSA-N	1	0	287.363	1.948	50	0		CDAARO
C[NH+](C)CCNc1ncnc2[nH]cc(Br)c21	ZINC000032919178	356790083	/nfs/dbraw/zinc/79/00/83/356790083.db2.gz	CEEQCAATIKZPFC-UHFFFAOYSA-N	1	0	284.161	1.694	50	0		CDAARO
Cc1cccc(-c2cc(N3CC[NH2+]CC3)ncn2)c1	ZINC000032918554	356790595	/nfs/dbraw/zinc/79/05/95/356790595.db2.gz	WRYFNLJHAWSJRH-UHFFFAOYSA-N	1	0	254.337	1.862	50	0		CDAARO
Cc1ccc(C)c([C@@H]2CN(C(=O)CC[NH3+])[C@H](C)CO2)c1	ZINC000119065958	357252452	/nfs/dbraw/zinc/25/24/52/357252452.db2.gz	LKEVFEUBNCOJDV-HIFRSBDPSA-N	1	0	276.380	1.941	50	0		CDAARO
Cc1cccc([C@H](C(=O)N2C[C@H]3CC[C@@H](C2)[NH2+]3)N(C)C)c1	ZINC000065375381	357533331	/nfs/dbraw/zinc/53/33/31/357533331.db2.gz	YMXMKVQFRRYDOY-OWCLPIDISA-N	1	0	287.407	1.561	50	0		CDAARO
Cc1cc(N(C)Cc2ccoc2)nc(N2CCOCC2)[nH+]1	ZINC000065410101	357538891	/nfs/dbraw/zinc/53/88/91/357538891.db2.gz	LALGEVCCADFQHZ-UHFFFAOYSA-N	1	0	288.351	1.851	50	0		CDAARO
O=C(c1ccc(OC[C@@H]2CCC[NH2+]2)cc1)N1CCOCC1	ZINC000066323503	357562063	/nfs/dbraw/zinc/56/20/63/357562063.db2.gz	AXQVRZVSUITRTF-AWEZNQCLSA-N	1	0	290.363	1.290	50	0		CDAARO
Cc1nc(NC[C@@H]2COCCO2)cc(C2CC[NH2+]CC2)n1	ZINC000067755544	357624973	/nfs/dbraw/zinc/62/49/73/357624973.db2.gz	IXLSXWMUUHWCJJ-CYBMUJFWSA-N	1	0	292.383	1.079	50	0		CDAARO
O=C(Nc1cnc2n1CCCC2)[C@@H]1CC12CC[NH2+]CC2	ZINC000067654568	357616851	/nfs/dbraw/zinc/61/68/51/357616851.db2.gz	WPASLITXQFWLTB-NSHDSACASA-N	1	0	274.368	1.548	50	0		CDAARO
Cc1nc(C[NH3+])cc(NC[C@@H](O)c2ccccc2)n1	ZINC000067934214	357638972	/nfs/dbraw/zinc/63/89/72/357638972.db2.gz	XJEOGOGECMSSRO-CYBMUJFWSA-N	1	0	258.325	1.389	50	0		CDAARO
CCO[C@H](C)c1nc(C)c(C(=O)N(C)[C@H]2CC[NH2+]C2)s1	ZINC000299740026	357700198	/nfs/dbraw/zinc/70/01/98/357700198.db2.gz	USSVKWJDKLVXGE-MNOVXSKESA-N	1	0	297.424	1.983	50	0		CDAARO
C[N@H+](CCO)Cc1ccc(CCC(C)(C)O)cc1	ZINC000072425420	357834931	/nfs/dbraw/zinc/83/49/31/357834931.db2.gz	DAAVKGXZKNQIRV-UHFFFAOYSA-N	1	0	251.370	1.814	50	0		CDAARO
CCCC(=O)NCCNc1cc(N(C)C)nc(C)[nH+]1	ZINC000072436809	357836116	/nfs/dbraw/zinc/83/61/16/357836116.db2.gz	MQSYHLQIOBDKBD-UHFFFAOYSA-N	1	0	265.361	1.179	50	0		CDAARO
CSC[C@@H](C)C(=O)N1CC[NH+](C2CCOCC2)CC1	ZINC000175833675	188968920	/nfs/dbraw/zinc/96/89/20/188968920.db2.gz	JEOKVXUHJLQGAX-GFCCVEGCSA-N	1	0	286.441	1.309	50	0		CDAARO
Cc1ccc(S(=O)(=O)C[C@@H](C)[NH2+][C@@H]2CCCOC2)cc1	ZINC000097113281	357983088	/nfs/dbraw/zinc/98/30/88/357983088.db2.gz	STBBBSOVXPAXJB-ZIAGYGMSSA-N	1	0	297.420	1.926	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)NCc2cnn3ccccc23)C1	ZINC000072475280	358072198	/nfs/dbraw/zinc/07/21/98/358072198.db2.gz	YHRWAAIUIYPRLR-CMPLNLGQSA-N	1	0	258.325	1.078	50	0		CDAARO
[NH3+]CCCCCC(=O)N1CCN(c2nccs2)CC1	ZINC000019470297	358064043	/nfs/dbraw/zinc/06/40/43/358064043.db2.gz	LAZOJVNYFQVKNT-UHFFFAOYSA-N	1	0	282.413	1.311	50	0		CDAARO
[NH3+]C[C@@H]1CN(CCc2cccc(Cl)c2)C(=O)O1	ZINC000019669031	358102899	/nfs/dbraw/zinc/10/28/99/358102899.db2.gz	KKQKQIDBCYXSMH-LLVKDONJSA-N	1	0	254.717	1.662	50	0		CDAARO
CCS(=O)(=O)N[C@H](C)C[NH+]1C[C@H](C)C[C@@H](C)C1	ZINC000195539373	358559868	/nfs/dbraw/zinc/55/98/68/358559868.db2.gz	TZRBOVVJLDBQPF-IJLUTSLNSA-N	1	0	262.419	1.292	50	0		CDAARO
C[C@@H](O)CN(C)c1cc(N2CCCCC2)ncn1	ZINC000195575081	358567089	/nfs/dbraw/zinc/56/70/89/358567089.db2.gz	GOEFMOIDNZIUIR-LLVKDONJSA-N	1	0	250.346	1.284	50	0		CDAARO
COc1ccc2c(c1)CC[N@H+]([C@H](C)C(=O)NC1CC1)CC2	ZINC000095368491	358687749	/nfs/dbraw/zinc/68/77/49/358687749.db2.gz	JEEMTAKLOBNSNV-GFCCVEGCSA-N	1	0	288.391	1.763	50	0		CDAARO
CN(Cc1ccon1)C(=O)CC[C@@H]1CCCC[N@@H+]1C	ZINC000095368602	358687778	/nfs/dbraw/zinc/68/77/78/358687778.db2.gz	YAZQKQIWRVKAMW-ZDUSSCGKSA-N	1	0	265.357	1.898	50	0		CDAARO
Cc1ncnc(N2CCC[C@](O)(C[NH+](C)C)CC2)c1C	ZINC000095373857	358688514	/nfs/dbraw/zinc/68/85/14/358688514.db2.gz	UUDMWLCENGRHCC-OAHLLOKOSA-N	1	0	278.400	1.376	50	0		CDAARO
CCO[C@H](C)CN(C)c1nc(N)[nH+]c(C)c1CC	ZINC000095377097	358689349	/nfs/dbraw/zinc/68/93/49/358689349.db2.gz	TZHKWIMWLWAUBP-SECBINFHSA-N	1	0	252.362	1.791	50	0		CDAARO
c1cnn(-c2cccc(-c3nc4c([nH]3)C[NH2+]CC4)c2)c1	ZINC000095389562	358692097	/nfs/dbraw/zinc/69/20/97/358692097.db2.gz	CCNZHHBJCHDMDU-UHFFFAOYSA-N	1	0	265.320	1.908	50	0		CDAARO
CCc1[nH+]c(N)nc(NCc2cnn3cccnc23)c1C	ZINC000095392161	358692863	/nfs/dbraw/zinc/69/28/63/358692863.db2.gz	PIOUJMQMGQRYKD-UHFFFAOYSA-N	1	0	283.339	1.584	50	0		CDAARO
C[NH2+]C[C@H]1CC(F)(F)CN1C(=O)OC(C)(C)C	ZINC000095743281	358701614	/nfs/dbraw/zinc/70/16/14/358701614.db2.gz	LDLHTVXAQWRDGH-MRVPVSSYSA-N	1	0	250.289	1.851	50	0		CDAARO
OCc1ccc2c(c1)CN(Cc1c[nH]cn1)CCO2	ZINC000097288858	358764724	/nfs/dbraw/zinc/76/47/24/358764724.db2.gz	FXWZULYKRPFVLS-UHFFFAOYSA-N	1	0	259.309	1.297	50	0		CDAARO
COc1ccc([C@@]2(C(=O)NCC[NH3+])CC2(C)C)cc1	ZINC000096142238	358709550	/nfs/dbraw/zinc/70/95/50/358709550.db2.gz	XHHBWYYOIYYCIO-OAHLLOKOSA-N	1	0	262.353	1.438	50	0		CDAARO
CCCCn1nc(C2CC2)nc1CCN1CC[NH+](C)CC1	ZINC000096137952	358709648	/nfs/dbraw/zinc/70/96/48/358709648.db2.gz	GYHHXGQGOARLJT-UHFFFAOYSA-N	1	0	291.443	1.746	50	0		CDAARO
CC[NH+](CC)CCCNC(=O)c1ccccc1O	ZINC000011639290	358773741	/nfs/dbraw/zinc/77/37/41/358773741.db2.gz	JIMRNKDHUGWLCL-UHFFFAOYSA-N	1	0	250.342	1.854	50	0		CDAARO
CNc1ncccc1C(=O)NCC[C@@H]1CCC[N@@H+]1C	ZINC000097436938	358776128	/nfs/dbraw/zinc/77/61/28/358776128.db2.gz	SSFDHECXPZHEBM-NSHDSACASA-N	1	0	262.357	1.337	50	0		CDAARO
CC(C)([NH3+])C(=O)N1CCO[C@H](c2ccc(F)cc2)C1	ZINC000040923860	358824650	/nfs/dbraw/zinc/82/46/50/358824650.db2.gz	DKPQMJJWJNHACA-LBPRGKRZSA-N	1	0	266.316	1.463	50	0		CDAARO
Clc1cccnc1N1CCN(Cc2c[nH]cn2)CC1	ZINC000097655376	358790677	/nfs/dbraw/zinc/79/06/77/358790677.db2.gz	IPKJQNAZUDSZIN-UHFFFAOYSA-N	1	0	277.759	1.780	50	0		CDAARO
Cc1cc(=O)oc(C)c1C(=O)NCC[NH+]1CCCCC1	ZINC000000521510	366515846	/nfs/dbraw/zinc/51/58/46/366515846.db2.gz	OXSIYFXSXAYRNX-UHFFFAOYSA-N	1	0	278.352	1.472	50	0		CDAARO
Cc1nn(C)cc1CN(C)C[C@@H]1CC[N@H+](C)C1(C)C	ZINC000215203138	358878942	/nfs/dbraw/zinc/87/89/42/358878942.db2.gz	MINBJBDRVOTXDK-AWEZNQCLSA-N	1	0	264.417	1.891	50	0		CDAARO
COC[C@H]1CCC[N@H+](Cc2cnc(N(C)C)nc2)C1	ZINC000215667065	358898419	/nfs/dbraw/zinc/89/84/19/358898419.db2.gz	HOTJCNFDKOGNBQ-LBPRGKRZSA-N	1	0	264.373	1.401	50	0		CDAARO
Cc1noc(C)c1CN1C[C@H](O)[C@@H]([NH+]2CCCCC2)C1	ZINC000215764541	358902049	/nfs/dbraw/zinc/90/20/49/358902049.db2.gz	GFPDPWJTRGHHQZ-GJZGRUSLSA-N	1	0	279.384	1.322	50	0		CDAARO
CN(Cc1ncc[nH]1)CC(C)(C)C[NH+]1CCOCC1	ZINC000216083616	358923083	/nfs/dbraw/zinc/92/30/83/358923083.db2.gz	DNQMDKPFYAKMKL-UHFFFAOYSA-N	1	0	266.389	1.200	50	0		CDAARO
COc1cccc2ccc(C[N@@H+]3CC[C@H](NC(C)=O)C3)nc21	ZINC000216339601	358938650	/nfs/dbraw/zinc/93/86/50/358938650.db2.gz	SAMJGZKPSGJLPS-HNNXBMFYSA-N	1	0	299.374	1.954	50	0		CDAARO
[NH2+]=C1Nc2nc3ccccc3n2[C@@H](c2ccco2)N1	ZINC000004702788	283410351	/nfs/dbraw/zinc/41/03/51/283410351.db2.gz	SZVHEKCVJYJHNS-NSHDSACASA-N	1	0	253.265	1.916	50	0		CDAARO
Cc1n[nH]c(C)c1CCN(C)C(=O)C[NH+]1CCCC1	ZINC000216420868	358943490	/nfs/dbraw/zinc/94/34/90/358943490.db2.gz	RJZIOBLTPAFTOK-UHFFFAOYSA-N	1	0	264.373	1.123	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNC(=O)Cc1cc(C)no1	ZINC000219626531	359109022	/nfs/dbraw/zinc/10/90/22/359109022.db2.gz	SNKAMSCVSVRNNG-LBPRGKRZSA-N	1	0	265.357	1.516	50	0		CDAARO
Cc1cc(O)ccc1C(=O)NCCC1(O)CC[NH+](C)CC1	ZINC000223372494	359420737	/nfs/dbraw/zinc/42/07/37/359420737.db2.gz	UPGTZVLPUQZEPK-UHFFFAOYSA-N	1	0	292.379	1.277	50	0		CDAARO
O=C(Nc1ccc2ccccc2c1)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000000402963	359519982	/nfs/dbraw/zinc/51/99/82/359519982.db2.gz	RPDYJTXWIGUABB-ZIAGYGMSSA-N	1	0	256.305	1.501	50	0		CDAARO
COC[C@@H]1C[N@H+](Cc2ccc(F)c(F)c2)C[C@H]1C(N)=O	ZINC000257188454	359532072	/nfs/dbraw/zinc/53/20/72/359532072.db2.gz	FLXKKOWHMOBQGA-WDEREUQCSA-N	1	0	284.306	1.145	50	0		CDAARO
CC[NH+]1CCC(c2nc(CN3CCN(C)CC3)no2)CC1	ZINC000067803316	359723580	/nfs/dbraw/zinc/72/35/80/359723580.db2.gz	OQBFLENEOXBQAE-UHFFFAOYSA-N	1	0	293.415	1.016	50	0		CDAARO
CN(CC[N@H+](C)C1CC1)C(=O)Cc1ccnc(F)c1	ZINC000408522179	359920474	/nfs/dbraw/zinc/92/04/74/359920474.db2.gz	FDHAXSCJUDKALQ-UHFFFAOYSA-N	1	0	265.332	1.316	50	0		CDAARO
COC(=O)[C@H]1CN(CCN(C)c2ccccc2)C[C@@H](C)O1	ZINC000089496900	359941442	/nfs/dbraw/zinc/94/14/42/359941442.db2.gz	MFKXNTWVFWBQSH-UKRRQHHQSA-N	1	0	292.379	1.385	50	0		CDAARO
CO[C@]12CC[N@H+](CCO)[C@H]1C[C@H](Oc1ccccn1)CC2	ZINC000426622885	360691201	/nfs/dbraw/zinc/69/12/01/360691201.db2.gz	DILFPPVLJGFFDC-IJEWVQPXSA-N	1	0	292.379	1.465	50	0		CDAARO
C[NH2+]Cc1nnc(SC2CCSCC2)n1C	ZINC000426383878	360662855	/nfs/dbraw/zinc/66/28/55/360662855.db2.gz	QZHYQLGYNGWCHL-UHFFFAOYSA-N	1	0	258.416	1.522	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)CCc2cccc(F)c2F)C1	ZINC000178519638	189123178	/nfs/dbraw/zinc/12/31/78/189123178.db2.gz	KWVOFGRKIDLPQU-SNVBAGLBSA-N	1	0	268.307	1.705	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)CCCOc2ccc(F)cc2F)C1	ZINC000178519064	189123453	/nfs/dbraw/zinc/12/34/53/189123453.db2.gz	MWGBRBJTCBJKMS-NSHDSACASA-N	1	0	298.333	1.931	50	0		CDAARO
Cn1c(CC[NH3+])nnc1SCCCOc1ccccc1	ZINC000426394776	360663356	/nfs/dbraw/zinc/66/33/56/360663356.db2.gz	ZCIDDMPZXAQNCE-UHFFFAOYSA-N	1	0	292.408	1.878	50	0		CDAARO
CC1(C)C[N@H+](CCNC(N)=O)C[C@@H]1c1ccccc1	ZINC000426423132	360667842	/nfs/dbraw/zinc/66/78/42/360667842.db2.gz	VLLLFWXJBOQPSR-CYBMUJFWSA-N	1	0	261.369	1.780	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)COc2ccccc2F)C1	ZINC000178556558	189126457	/nfs/dbraw/zinc/12/64/57/189126457.db2.gz	QSSWKSDBBDWJSH-SNVBAGLBSA-N	1	0	252.289	1.012	50	0		CDAARO
CCn1cc(C(=O)C(=O)NCCC[NH+]2CCCCC2)cn1	ZINC000179353972	189188503	/nfs/dbraw/zinc/18/85/03/189188503.db2.gz	HFGFYHJMUGSLIL-UHFFFAOYSA-N	1	0	292.383	1.078	50	0		CDAARO
CO[C@]12CC[N@H+](CCn3nc(C)cc3C)[C@H]1C[C@@H](O)CC2	ZINC000299799323	200880823	/nfs/dbraw/zinc/88/08/23/200880823.db2.gz	FRDPMBYBFHBZHX-HRCADAONSA-N	1	0	293.411	1.504	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc(F)cc2Cl)C[C@H]1CCO	ZINC000104320415	361586094	/nfs/dbraw/zinc/58/60/94/361586094.db2.gz	SFKPLDOPQHOBPL-CYBMUJFWSA-N	1	0	286.778	1.978	50	0		CDAARO
CC(C)CC[N@@H+]1CCN(Cc2cc[nH]n2)C[C@H]1CCO	ZINC000104362960	361587207	/nfs/dbraw/zinc/58/72/07/361587207.db2.gz	AJWMXLCPEMPDQS-OAHLLOKOSA-N	1	0	280.416	1.324	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2cc(C)no2)CC1	ZINC000089606856	366884166	/nfs/dbraw/zinc/88/41/66/366884166.db2.gz	VKKVTIVOJVZVNQ-UHFFFAOYSA-N	1	0	281.356	1.071	50	0		CDAARO
C[C@H](NC(=O)Cc1ccc(O)cc1)C1=CC[N@H+](C)CC1	ZINC000272742891	365375405	/nfs/dbraw/zinc/37/54/05/365375405.db2.gz	CYVQBLDXOULDIJ-LBPRGKRZSA-N	1	0	274.364	1.701	50	0		CDAARO
C[N@H+](CCNC(=O)N1CCOC(C)(C)C1)C1CCCC1	ZINC000089919537	366968084	/nfs/dbraw/zinc/96/80/84/366968084.db2.gz	WXNGDPDCRGEXDO-UHFFFAOYSA-N	1	0	283.416	1.681	50	0		CDAARO
CC[C@H](CO)[NH+]1CCN(Cc2ncc(C3CC3)o2)CC1	ZINC000089943519	366976424	/nfs/dbraw/zinc/97/64/24/366976424.db2.gz	QVICGJTYGRGOTA-CYBMUJFWSA-N	1	0	279.384	1.441	50	0		CDAARO
CCC[C@H](C(=O)NCCc1c(C)noc1C)[NH+](C)C	ZINC000089949416	366978608	/nfs/dbraw/zinc/97/86/08/366978608.db2.gz	XGUUTYJLJVOMLB-CYBMUJFWSA-N	1	0	267.373	1.680	50	0		CDAARO
CCCCC[NH2+][C@H]1CS(=O)(=O)C[C@H]1N1CCCC1	ZINC000089953460	366980129	/nfs/dbraw/zinc/98/01/29/366980129.db2.gz	BMVSEMLBNHMGAH-QWHCGFSZSA-N	1	0	274.430	1.028	50	0		CDAARO
Cn1nncc1C[NH2+][C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000090201401	367025379	/nfs/dbraw/zinc/02/53/79/367025379.db2.gz	NBLUTUFBXXSEKA-NSHDSACASA-N	1	0	295.387	1.304	50	0		CDAARO
COc1ccc(CN(C)C2C[NH2+]C2)c(Cl)c1OC	ZINC000090289480	367029859	/nfs/dbraw/zinc/02/98/59/367029859.db2.gz	RUIVURDFSXTBDP-UHFFFAOYSA-N	1	0	270.760	1.761	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@H]1NS(=O)(=O)c1ccc(F)cc1F	ZINC000094345687	367465946	/nfs/dbraw/zinc/46/59/46/367465946.db2.gz	IYXWKDHMGWXYCZ-LDYMZIIASA-N	1	0	290.335	1.241	50	0		CDAARO
C1CC1N1CC[C@@H]([NH2+][C@H]2CCC[C@@H]3OCC[C@H]32)C1	ZINC000252476882	367544015	/nfs/dbraw/zinc/54/40/15/367544015.db2.gz	DDKVDDDJKINLNF-UNQGMJICSA-N	1	0	250.386	1.770	50	0		CDAARO
O=C(N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(C2CC2)on1	ZINC000252527965	367785302	/nfs/dbraw/zinc/78/53/02/367785302.db2.gz	DVQNAUDUYWZIEJ-NEPJUHHUSA-N	1	0	275.352	1.909	50	0		CDAARO
O=C(N[C@H]1CCC[N@@H+](C2CCCCC2)C1)c1cnc[nH]1	ZINC000299771335	372750984	/nfs/dbraw/zinc/75/09/84/372750984.db2.gz	WKBIWDAQXFJBMD-LBPRGKRZSA-N	1	0	276.384	1.937	50	0		CDAARO
Cc1cc(C)n(CC[N@@H+](C)CCCc2nccn2C)n1	ZINC000299777881	372755050	/nfs/dbraw/zinc/75/50/50/372755050.db2.gz	PKKSWXZKQIKLIX-UHFFFAOYSA-N	1	0	275.400	1.798	50	0		CDAARO
O=C(Nc1ccc(Cl)cc1)N[C@@H]1C[NH2+]CC[C@H]1O	ZINC000299785778	372761893	/nfs/dbraw/zinc/76/18/93/372761893.db2.gz	MBGNAAHORSFJBJ-GHMZBOCLSA-N	1	0	269.732	1.184	50	0		CDAARO
CNC(=S)NC[C@H](c1ccccc1OC)[NH+]1CCCC1	ZINC000015348413	372815218	/nfs/dbraw/zinc/81/52/18/372815218.db2.gz	LLCSLTLUMQPSFR-CYBMUJFWSA-N	1	0	293.436	1.926	50	0		CDAARO
CN(C[C@H]1CCC[N@@H+]([C@@H]2C=CCCC2)C1)S(C)(=O)=O	ZINC000253417346	373725325	/nfs/dbraw/zinc/72/53/25/373725325.db2.gz	XDRNTGIBIUYOCI-ZIAGYGMSSA-N	1	0	286.441	1.699	50	0		CDAARO
Cc1cc(C)cc(NC(=O)NCC[NH+]2CCC(O)CC2)c1	ZINC000206610151	374179594	/nfs/dbraw/zinc/17/95/94/374179594.db2.gz	DBGOOXHNLZMFII-UHFFFAOYSA-N	1	0	291.395	1.882	50	0		CDAARO
O=C(NCc1ccccc1-n1ccnc1)[C@H]1CCCC[NH2+]1	ZINC000423762875	246043735	/nfs/dbraw/zinc/04/37/35/246043735.db2.gz	QLOJXCOQOSILBN-CQSZACIVSA-N	1	0	284.363	1.631	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C[NH3+])c(C)c1	ZINC000111372815	374185527	/nfs/dbraw/zinc/18/55/27/374185527.db2.gz	NNZXZYPCNWCOHI-GFCCVEGCSA-N	1	0	268.382	1.415	50	0		CDAARO
Cn1cc(C(=O)C[C@H]2CCC[N@@H+]2C[C@H]2CCOC2)cn1	ZINC000108326722	412824835	/nfs/dbraw/zinc/82/48/35/412824835.db2.gz	ZMTYBABQLQKULY-TZMCWYRMSA-N	1	0	277.368	1.494	50	0		CDAARO
Cc1cc(CN(C)C(=O)[C@H]2CCCCC[N@@H+]2C)no1	ZINC000095354998	374887731	/nfs/dbraw/zinc/88/77/31/374887731.db2.gz	OOGWYFMSDFVJGU-CYBMUJFWSA-N	1	0	265.357	1.816	50	0		CDAARO
CCc1[nH+]c(N)nc(NCCNc2cccnc2)c1C	ZINC000095377799	374891658	/nfs/dbraw/zinc/89/16/58/374891658.db2.gz	KNCHAICFGZJWSP-UHFFFAOYSA-N	1	0	272.356	1.849	50	0		CDAARO
CC[C@H]([NH2+]CCN1CCN(C(C)=O)CC1)c1ccccc1	ZINC000095420284	374921659	/nfs/dbraw/zinc/92/16/59/374921659.db2.gz	MTUJTLPPFRRJAO-KRWDZBQOSA-N	1	0	289.423	1.891	50	0		CDAARO
CCS(=O)(=O)CC[NH2+][C@H]1CCc2ccc(F)cc21	ZINC000095421749	374923086	/nfs/dbraw/zinc/92/30/86/374923086.db2.gz	LGJUSTWTCDLPPP-ZDUSSCGKSA-N	1	0	271.357	1.837	50	0		CDAARO
CCC[C@@H]([NH3+])C(=O)N1CCC(N2CCCCC2=O)CC1	ZINC000095466813	374961033	/nfs/dbraw/zinc/96/10/33/374961033.db2.gz	JCHFVOYADMJKGH-CYBMUJFWSA-N	1	0	281.400	1.117	50	0		CDAARO
C[C@@H](c1cccnc1)[N@@H+]1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1	ZINC000095402695	374906354	/nfs/dbraw/zinc/90/63/54/374906354.db2.gz	FKWXPHZMOYVKMZ-AAEUAGOBSA-N	1	0	299.378	1.844	50	0		CDAARO
CCCCO[C@@H]1C[C@@H]([NH2+][C@@H]2CCN(C)C2=O)C1(C)C	ZINC000095407258	374908988	/nfs/dbraw/zinc/90/89/88/374908988.db2.gz	PYFLVOMQWNGHTF-JHJVBQTASA-N	1	0	268.401	1.791	50	0		CDAARO
CCCCCS(=O)(=O)N1CCN(C)c2cc[nH+]cc21	ZINC000095993355	375049404	/nfs/dbraw/zinc/04/94/04/375049404.db2.gz	LMKAZZRWYSWWLE-UHFFFAOYSA-N	1	0	283.397	1.858	50	0		CDAARO
O=C(c1ccco1)N1CCN(C[C@H](O)c2ccco2)CC1	ZINC000030534498	375612650	/nfs/dbraw/zinc/61/26/50/375612650.db2.gz	PTTOUJCTRVMIQJ-LBPRGKRZSA-N	1	0	290.319	1.364	50	0		CDAARO
COc1ccccc1[C@H](C)NC(=O)C[N@@H+]1CCC[C@H]1CO	ZINC000242047899	376021825	/nfs/dbraw/zinc/02/18/25/376021825.db2.gz	VQZJMRYFBFPXJP-STQMWFEESA-N	1	0	292.379	1.329	50	0		CDAARO
C[NH+](C)[C@@]1(CNC(=O)c2cc(C3CC3)n[nH]2)CCSC1	ZINC000067955934	377332313	/nfs/dbraw/zinc/33/23/13/377332313.db2.gz	UKBOAJLFAMTGIH-CQSZACIVSA-N	1	0	294.424	1.454	50	0		CDAARO
C[C@@H](c1ccncc1)[NH+]1CCC(Nc2cnccn2)CC1	ZINC000571875816	377562438	/nfs/dbraw/zinc/56/24/38/377562438.db2.gz	AXNPIHQFGXVBDN-ZDUSSCGKSA-N	1	0	283.379	1.931	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)[C@H]1CC[C@@H](O)CC1	ZINC000252514325	377689277	/nfs/dbraw/zinc/68/92/77/377689277.db2.gz	CHLMLXAUZSRYBR-BETUJISGSA-N	1	0	277.368	1.469	50	0		CDAARO
CCc1nsc(N[C@@H]2CCC[N@H+](CCOC)C2)n1	ZINC000089295665	377813247	/nfs/dbraw/zinc/81/32/47/377813247.db2.gz	URYQWJGAEOWGMJ-SNVBAGLBSA-N	1	0	270.402	1.623	50	0		CDAARO
CCC(=O)O[C@H](CN1CCCC1=O)C[NH+]1CCCCC1	ZINC000001407142	377875182	/nfs/dbraw/zinc/87/51/82/377875182.db2.gz	TYPSXUFZGDLBRA-ZDUSSCGKSA-N	1	0	282.384	1.417	50	0		CDAARO
COCCNC(=S)NC[C@@H](C)[N@@H+]1CCCC[C@H]1C	ZINC000245224814	377940533	/nfs/dbraw/zinc/94/05/33/377940533.db2.gz	FOGGBQFYTSWHRG-VXGBXAGGSA-N	1	0	273.446	1.360	50	0		CDAARO
CCS(=O)(=O)NCCC[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C	ZINC000245338662	378070130	/nfs/dbraw/zinc/07/01/30/378070130.db2.gz	NQBLXMYGWIIOIN-JHJVBQTASA-N	1	0	276.446	1.730	50	0		CDAARO
COC(=O)c1ccc(S(=O)(=O)CC2CC[NH2+]CC2)cc1	ZINC000585672396	378674532	/nfs/dbraw/zinc/67/45/32/378674532.db2.gz	LUVQRUSRKOFVBJ-UHFFFAOYSA-N	1	0	297.376	1.247	50	0		CDAARO
COc1cccc(C(=O)NCCC[NH+]2CCCC2)c1	ZINC000010450007	379659060	/nfs/dbraw/zinc/65/90/60/379659060.db2.gz	MPTPEFLMZMJCLQ-UHFFFAOYSA-N	1	0	262.353	1.911	50	0		CDAARO
CC(=O)N1CCC([NH2+]Cc2ccc3c(c2)OCO3)CC1	ZINC000000217718	169578679	/nfs/dbraw/zinc/57/86/79/169578679.db2.gz	IMSCZSOCTFEOSR-UHFFFAOYSA-N	1	0	276.336	1.516	50	0		CDAARO
CC(=O)NCc1cnc2cc(C)nn2c1[C@@H]1CCC[NH2+]1	ZINC000242687743	256867753	/nfs/dbraw/zinc/86/77/53/256867753.db2.gz	UUAFRIIMJPHDJB-LBPRGKRZSA-N	1	0	273.340	1.098	50	0		CDAARO
CC(C)(C)OC(=O)[C@H](c1ccccc1)N1CC[C@H]([NH3+])C1=O	ZINC000096300613	256888313	/nfs/dbraw/zinc/88/83/13/256888313.db2.gz	XDUUTRYCHAVIAF-STQMWFEESA-N	1	0	290.363	1.629	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@@H]1NC(=O)c1cc(F)ccc1F	ZINC000094345383	184786009	/nfs/dbraw/zinc/78/60/09/184786009.db2.gz	TXMKFQLMJRWGAD-PELKAZGASA-N	1	0	254.280	1.693	50	0		CDAARO
C[NH+](C)CCn1c2ccccc2c2c1-c1nnnn1CCC2	ZINC000000199605	390134880	/nfs/dbraw/zinc/13/48/80/390134880.db2.gz	XKCDHMMEPPYALL-UHFFFAOYSA-N	1	0	296.378	1.803	50	0		CDAARO
CC[C@@H]1C[N@H+](C[C@H]2CCCCO2)CCN1CCOC	ZINC000247134671	390247870	/nfs/dbraw/zinc/24/78/70/390247870.db2.gz	KPPNWDCVDXNCCP-HUUCEWRRSA-N	1	0	270.417	1.598	50	0		CDAARO
Fc1c(F)c(F)c(-n2c[n+]3c(n2)CCC3)c(F)c1F	ZINC000038307484	390418004	/nfs/dbraw/zinc/41/80/04/390418004.db2.gz	VASMYZBMPCWVBE-UHFFFAOYSA-N	1	0	276.188	1.802	50	0		CDAARO
Cc1cc(Cl)cc2c(=O)n(C[C@H]3C[NH2+]CCO3)cnc12	ZINC000043103013	390430621	/nfs/dbraw/zinc/43/06/21/390430621.db2.gz	GCNBUGJSTOVGAX-LLVKDONJSA-N	1	0	293.754	1.347	50	0		CDAARO
CC(C)[NH2+][C@@H]1CCn2c(=O)[nH]c3cccc(c32)[C@@H]1O	ZINC000043163828	390430748	/nfs/dbraw/zinc/43/07/48/390430748.db2.gz	ZSTCZWJCLIRCOJ-YPMHNXCESA-N	1	0	261.325	1.133	50	0	in-man	CDAARO
Cc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2C2OCCO2)n1	ZINC000092936875	390509932	/nfs/dbraw/zinc/50/99/32/390509932.db2.gz	VNTBVMBUXPGEGM-CYBMUJFWSA-N	1	0	278.352	1.823	50	0		CDAARO
O=C(N[C@H]1CC[N@H+](CC2CCCC2)C1)[C@@H]1CCCOC1	ZINC000096431853	390520321	/nfs/dbraw/zinc/52/03/21/390520321.db2.gz	YZJRSFOBPNVZRI-CABCVRRESA-N	1	0	280.412	1.794	50	0		CDAARO
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@H](C[NH3+])C2)c1	ZINC000178580869	390680240	/nfs/dbraw/zinc/68/02/40/390680240.db2.gz	DPRVYRVTQLZBDW-BYCMXARLSA-N	1	0	274.364	1.606	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+][C@H]1CCOC2(CCOCC2)C1	ZINC000077356642	390810399	/nfs/dbraw/zinc/81/03/99/390810399.db2.gz	OYPJOLBKMLHTRS-ZDUSSCGKSA-N	1	0	279.384	1.844	50	0		CDAARO
OC[C@]1(O)CC[N@H+](Cc2cc3ccccc3s2)C1	ZINC000215574723	390995836	/nfs/dbraw/zinc/99/58/36/390995836.db2.gz	PIBZQBOXYFKAIK-AWEZNQCLSA-N	1	0	263.362	1.830	50	0		CDAARO
CCOC[C@H](O)C[N@@H+]1C[C@H](O)C[C@@H]1c1cccc(F)c1	ZINC000281939398	391430625	/nfs/dbraw/zinc/43/06/25/391430625.db2.gz	TWBVNBWULSYDPO-RBSFLKMASA-N	1	0	283.343	1.331	50	0		CDAARO
CN(C)c1ncc2c(n1)CCC[C@H]2[NH2+]C1CCOCC1	ZINC000012702258	391481731	/nfs/dbraw/zinc/48/17/31/391481731.db2.gz	YSJLSYBWLFOBHV-CYBMUJFWSA-N	1	0	276.384	1.689	50	0		CDAARO
Nc1ncc(-c2cc(F)cc3c2O[C@H](C[NH3+])C3)cn1	ZINC000067714840	391962681	/nfs/dbraw/zinc/96/26/81/391962681.db2.gz	XTBXBBHKPGKVQT-JTQLQIEISA-N	1	0	260.272	1.127	50	0		CDAARO
Cn1nccc1C(=O)N1CCNC[C@@H]1c1cccc(F)c1	ZINC000261989034	131181020	/nfs/dbraw/zinc/18/10/20/131181020.db2.gz	OUTCMLHZTISSNH-CQSZACIVSA-N	1	0	288.326	1.346	50	0		CDAARO
C[NH+](C)CCN(C[C@@H]1CCCO1)C(=O)Cc1cccnc1	ZINC000096410131	393181423	/nfs/dbraw/zinc/18/14/23/393181423.db2.gz	MWGFHIQRSCASAS-HNNXBMFYSA-N	1	0	291.395	1.193	50	0		CDAARO
CC(C)Cc1nc(-c2ccnc(N3CC[NH2+]CC3)n2)no1	ZINC000036532790	134820011	/nfs/dbraw/zinc/82/00/11/134820011.db2.gz	GLFCDJSXVOZRAH-UHFFFAOYSA-N	1	0	288.355	1.135	50	0		CDAARO
CO[C@@]1(C)C[C@@H](O)C12CCN(c1cc[nH+]cc1)CC2	ZINC000092028148	135075176	/nfs/dbraw/zinc/07/51/76/135075176.db2.gz	YQGIEYZHVCBLPH-KGLIPLIRSA-N	1	0	262.353	1.838	50	0		CDAARO
Cn1cccc1CC(=O)NN1Cc2ccccc2C1=[NH2+]	ZINC000102142697	397835528	/nfs/dbraw/zinc/83/55/28/397835528.db2.gz	LBHACWMUOSPMKE-UHFFFAOYSA-N	1	0	268.320	1.440	50	0		CDAARO
CCOC(=O)[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)[C@@H]([NH3+])C1	ZINC000095743405	285940823	/nfs/dbraw/zinc/94/08/23/285940823.db2.gz	LJJYOYONMCBZHC-GARJFASQSA-N	1	0	286.372	1.570	50	0		CDAARO
C[C@H](Oc1ccc(F)c(F)c1)C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178530023	148064351	/nfs/dbraw/zinc/06/43/51/148064351.db2.gz	IBCFTXKFLAADGC-VHSXEESVSA-N	1	0	284.306	1.539	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)c1ccc(-n2cnnc2)cc1	ZINC000269185721	286923091	/nfs/dbraw/zinc/92/30/91/286923091.db2.gz	KZBCFOACABTVNM-IUODEOHRSA-N	1	0	299.378	1.609	50	0		CDAARO
CNC(=S)NC[C@@H](c1ccco1)[NH+]1CCCCC1	ZINC000003335608	169880300	/nfs/dbraw/zinc/88/03/00/169880300.db2.gz	ATOXTUHGUVHLDY-NSHDSACASA-N	1	0	267.398	1.901	50	0		CDAARO
CCOC(=O)c1[nH]c2ccccc2c1NC(=O)C[NH2+]C	ZINC000004785332	170017215	/nfs/dbraw/zinc/01/72/15/170017215.db2.gz	FSLRDTJQEXQRNI-UHFFFAOYSA-N	1	0	275.308	1.503	50	0		CDAARO
CCOc1cc(C[NH2+]C)ccc1O[C@@H](C)C(=O)NC	ZINC000004851148	170030088	/nfs/dbraw/zinc/03/00/88/170030088.db2.gz	LGRDJVAIQHXGGF-JTQLQIEISA-N	1	0	266.341	1.318	50	0		CDAARO
COc1cc(CN2CCC([NH3+])CC2)cc(OC)c1OC	ZINC000005002255	170053036	/nfs/dbraw/zinc/05/30/36/170053036.db2.gz	FRZBIKUJFOMWQK-UHFFFAOYSA-N	1	0	280.368	1.636	50	0		CDAARO
CCC(CC)C(=O)c1c[nH]c(C(=O)NCC[NH+](C)C)c1	ZINC000005642544	170123790	/nfs/dbraw/zinc/12/37/90/170123790.db2.gz	AGQKDMPSFPASQM-UHFFFAOYSA-N	1	0	279.384	1.925	50	0		CDAARO
Cc1ccc(C)c(S(=O)(=O)NCCC[NH+](C)C)c1	ZINC000005698311	170130261	/nfs/dbraw/zinc/13/02/61/170130261.db2.gz	IBOAEXMWRSIXIC-UHFFFAOYSA-N	1	0	270.398	1.533	50	0		CDAARO
COCCC[NH2+]CC(=O)N1CCc2ccccc2C1	ZINC000005870231	170148989	/nfs/dbraw/zinc/14/89/89/170148989.db2.gz	IZNZMHZYWCSPBC-UHFFFAOYSA-N	1	0	262.353	1.197	50	0		CDAARO
CC[C@H](C)[NH2+]C[C@@H](O)COc1ccccc1OC	ZINC000008844749	170357460	/nfs/dbraw/zinc/35/74/60/170357460.db2.gz	VXJQVAMMFVYRJF-NWDGAFQWSA-N	1	0	253.342	1.823	50	0		CDAARO
[NH3+][C@H](CC(=O)N1CCSCC1)c1ccccc1	ZINC000020257286	171111777	/nfs/dbraw/zinc/11/17/77/171111777.db2.gz	SLKVVWNOATXNGX-GFCCVEGCSA-N	1	0	250.367	1.652	50	0		CDAARO
Cc1ccc(OCCOCCN2CC[NH2+]CC2)cc1C	ZINC000022577175	171392740	/nfs/dbraw/zinc/39/27/40/171392740.db2.gz	SEJSIPCGSGGEOP-UHFFFAOYSA-N	1	0	278.396	1.604	50	0		CDAARO
[NH3+]C[C@H](c1ccccc1Cl)N1CCS(=O)CC1	ZINC000035287516	172104882	/nfs/dbraw/zinc/10/48/82/172104882.db2.gz	LWOODSYOUCLNPK-GFCCVEGCSA-N	1	0	272.801	1.404	50	0		CDAARO
C[C@@H]([NH2+]C1CCN(C(N)=O)CC1)c1ccc2c(c1)OCO2	ZINC000037283482	173091259	/nfs/dbraw/zinc/09/12/59/173091259.db2.gz	VJTYBACORWPULN-SNVBAGLBSA-N	1	0	291.351	1.609	50	0		CDAARO
Cn1ccnc1[C@@H]1OCCC[C@H]1C[NH2+][C@@H]1CCC[C@H]1O	ZINC000657489765	414390292	/nfs/dbraw/zinc/39/02/92/414390292.db2.gz	WBXGKGGLAVRMQB-REWJHTLYSA-N	1	0	279.384	1.391	50	0		CDAARO
CO[C@H]1CN(C(=O)c2cccc3cnccc32)CC[C@H]1[NH3+]	ZINC000071405868	176156046	/nfs/dbraw/zinc/15/60/46/176156046.db2.gz	CFWFSKBLNDOLKP-CABCVRRESA-N	1	0	285.347	1.423	50	0		CDAARO
CC(C)C[N@@H+]1CCN(Cc2ccncc2)C[C@@H]1CCO	ZINC000071750966	176260146	/nfs/dbraw/zinc/26/01/46/176260146.db2.gz	VUSIRGSVBFXBFO-INIZCTEOSA-N	1	0	277.412	1.606	50	0		CDAARO
O=C([O-])[C@@H]1CC2(C[N@@H+]1CCc1ccccc1)CC[NH2+]CC2	ZINC000072135202	176322212	/nfs/dbraw/zinc/32/22/12/176322212.db2.gz	FQXYEVURLQSPMY-HNNXBMFYSA-N	1	0	288.391	1.758	50	0		CDAARO
CN1CCN(C(=O)c2ccccc2[C@@H]2CC[NH2+]C2)CC1	ZINC000072169874	176332653	/nfs/dbraw/zinc/33/26/53/176332653.db2.gz	WJVLKEXSZCUMEN-CYBMUJFWSA-N	1	0	273.380	1.151	50	0		CDAARO
Cc1nccn1CC[N@@H+](C)[C@H]1CCOC2(CCOCC2)C1	ZINC000077487795	177274301	/nfs/dbraw/zinc/27/43/01/177274301.db2.gz	NXTPLLVAQSMEJI-HNNXBMFYSA-N	1	0	293.411	1.852	50	0		CDAARO
C[NH+](C)[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(C(N)=O)cc1	ZINC000408512920	261068492	/nfs/dbraw/zinc/06/84/92/261068492.db2.gz	ZKQYSISPWLJXGF-UONOGXRCSA-N	1	0	289.379	1.388	50	0		CDAARO
COc1ccc2c(c1)[nH]c1c2ncnc1N1CC[NH+](C)CC1	ZINC000005025356	274139948	/nfs/dbraw/zinc/13/99/48/274139948.db2.gz	LHSUYNQCHWGEFY-UHFFFAOYSA-N	1	0	297.362	1.872	50	0		CDAARO
CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CCN2C(=O)NC[C@@H]2C1	ZINC000191080889	276179626	/nfs/dbraw/zinc/17/96/26/276179626.db2.gz	DVCHTSDRHWOKMQ-BFHYXJOUSA-N	1	0	263.385	1.688	50	0		CDAARO
CCOc1cc(N2CC[C@H]([NH+]3CC=CC3)C2)ncn1	ZINC000125650551	276370686	/nfs/dbraw/zinc/37/06/86/276370686.db2.gz	AQOHXTXEQUVYBZ-LBPRGKRZSA-N	1	0	260.341	1.326	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1Cc1nc2c([nH]1)C(=O)NCC(C)(C)C2	ZINC000065408929	277065060	/nfs/dbraw/zinc/06/50/60/277065060.db2.gz	BGFPYGABZHEARM-SNVBAGLBSA-N	1	0	276.384	1.359	50	0		CDAARO
CC(C)(C)CN1CCC[C@](O)(C[NH2+]C(C)(C)C)C1=O	ZINC000012373082	277144933	/nfs/dbraw/zinc/14/49/33/277144933.db2.gz	IYAKXKHUIMZKFW-HNNXBMFYSA-N	1	0	270.417	1.774	50	0		CDAARO
CSCC(=O)N(C)C[C@H]1Cc2ccccc2C[N@@H+]1C	ZINC000077298351	278126615	/nfs/dbraw/zinc/12/66/15/278126615.db2.gz	DRYBTSVASIGNLO-CQSZACIVSA-N	1	0	278.421	1.865	50	0		CDAARO
Cc1c[nH]c(CC[NH2+][C@H]2CCOC3(CCOCC3)C2)n1	ZINC000077321641	278615950	/nfs/dbraw/zinc/61/59/50/278615950.db2.gz	NSQJEPKZJOVUFU-ZDUSSCGKSA-N	1	0	279.384	1.578	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1C(=O)Cc1ccc(F)cc1F	ZINC000095067591	279647891	/nfs/dbraw/zinc/64/78/91/279647891.db2.gz	DBIUNGUHQGAXAA-GFCCVEGCSA-N	1	0	268.307	1.847	50	0		CDAARO
CCO[C@@H]1C[C@@H](O)C12CC[NH+](C[C@H](O)C(F)(F)F)CC2	ZINC000181715416	279825461	/nfs/dbraw/zinc/82/54/61/279825461.db2.gz	CCENWSOZKFLRMB-OUAUKWLOSA-N	1	0	297.317	1.162	50	0		CDAARO
Cc1nc2c(c(=O)[nH]1)C[N@H+](Cc1ccccc1)CC2	ZINC000033550100	282007289	/nfs/dbraw/zinc/00/72/89/282007289.db2.gz	IGVWHXWXRQGWDW-UHFFFAOYSA-N	1	0	255.321	1.637	50	0		CDAARO
CCOc1ccc(/C=C\C(=O)N2CC[NH2+]C[C@H]2C)cc1	ZINC000254944211	289346845	/nfs/dbraw/zinc/34/68/45/289346845.db2.gz	RRWTYSBNNHQSMV-OYVUYXNMSA-N	1	0	274.364	1.919	50	0		CDAARO
[NH3+]C[C@@H]1CCCN1C(=O)/C=C\c1c(F)cccc1F	ZINC000255124134	289357743	/nfs/dbraw/zinc/35/77/43/289357743.db2.gz	AKTNUSGHKAPJOE-GFVADAIESA-N	1	0	266.291	1.928	50	0		CDAARO
Cc1cc(F)cc(S(=O)(=O)N[C@@H]2CCC[C@H]2C[NH3+])c1	ZINC000195544571	301304918	/nfs/dbraw/zinc/30/49/18/301304918.db2.gz	BNIYWYFVJDFDOE-GXFFZTMASA-N	1	0	286.372	1.540	50	0		CDAARO
CCS(=O)(=O)NC[C@@H](C)[NH2+]C1(c2cccc(C)c2)CC1	ZINC000534574554	328309496	/nfs/dbraw/zinc/30/94/96/328309496.db2.gz	LAXSNJBCZQNQLI-CYBMUJFWSA-N	1	0	296.436	1.902	50	0		CDAARO
C[C@@H](C(=O)NCC1(CN2CCOCC2)CC1)n1cccc1	ZINC000534585446	328314888	/nfs/dbraw/zinc/31/48/88/328314888.db2.gz	KVSXCJZMNSLDSO-AWEZNQCLSA-N	1	0	291.395	1.278	50	0		CDAARO
CC[C@@H](NC(=O)C[NH+]1CCCCCC1)c1ncnn1CC	ZINC000534592848	328319004	/nfs/dbraw/zinc/31/90/04/328319004.db2.gz	UBBGLCFXMIZPKO-CYBMUJFWSA-N	1	0	293.415	1.741	50	0		CDAARO
c1cnc2c(c1)cccc2OCC[NH2+][C@@H]1CCOC1	ZINC000534652941	328338323	/nfs/dbraw/zinc/33/83/23/328338323.db2.gz	HOPPVQRBQZKNST-CYBMUJFWSA-N	1	0	258.321	1.992	50	0		CDAARO
CCN(CCOC)C(=O)N[C@@H](c1nccn1C)C(C)C	ZINC000534656674	328340227	/nfs/dbraw/zinc/34/02/27/328340227.db2.gz	YUOSZVYFOWDRHM-GFCCVEGCSA-N	1	0	282.388	1.795	50	0		CDAARO
CCOc1ccnc(NCC[C@H]2CCC[N@H+](C)C2)n1	ZINC000534671620	328347827	/nfs/dbraw/zinc/34/78/27/328347827.db2.gz	FVCHIBZVAYTXFL-GFCCVEGCSA-N	1	0	264.373	1.441	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@H]1CCC(C)(C)C[C@H]1C	ZINC000097099850	323207364	/nfs/dbraw/zinc/20/73/64/323207364.db2.gz	YRBLQUQCMWXHCS-NEPJUHHUSA-N	1	0	276.446	1.730	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@H](C)C1CCCCC1	ZINC000097373718	323208014	/nfs/dbraw/zinc/20/80/14/323208014.db2.gz	RHSHODIBZYRPCU-LLVKDONJSA-N	1	0	262.419	1.484	50	0		CDAARO
C[C@H](CS(C)(=O)=O)[NH2+]CCCOC1CCCC1	ZINC000182687573	323295122	/nfs/dbraw/zinc/29/51/22/323295122.db2.gz	GZVBXCNQAVZFLG-LLVKDONJSA-N	1	0	263.403	1.358	50	0		CDAARO
CCOc1cc(NC[C@H]2C[N@H+](CC(C)C)CCO2)ncn1	ZINC000185116708	323382764	/nfs/dbraw/zinc/38/27/64/323382764.db2.gz	YFPRTZMDJBHDJK-ZDUSSCGKSA-N	1	0	294.399	1.644	50	0		CDAARO
CSC[C@H]1CCCN(c2cc(C)[nH+]c(N)n2)C1	ZINC000091412023	482448600	/nfs/dbraw/zinc/44/86/00/482448600.db2.gz	JGMKDTWPPRZYGG-JTQLQIEISA-N	1	0	252.387	1.947	50	0		CDAARO
[NH3+]CCCNC(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC000082240076	482769195	/nfs/dbraw/zinc/76/91/95/482769195.db2.gz	WWOAQMLBTHTUNL-UHFFFAOYSA-N	1	0	251.717	1.900	50	0		CDAARO
Cc1csc(C[N@@H+](C)[C@@H]2CCNC(=O)CC2)n1	ZINC000670438677	482981317	/nfs/dbraw/zinc/98/13/17/482981317.db2.gz	KIPXBBCSWHAFDL-JTQLQIEISA-N	1	0	253.371	1.552	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]CCn2cnc(C)c2C)CC1	ZINC000670439403	482983110	/nfs/dbraw/zinc/98/31/10/482983110.db2.gz	IYXPAJWPJRRXHT-UHFFFAOYSA-N	1	0	294.399	1.710	50	0		CDAARO
C[NH+](C)C[C@@]1(CO)CCCN(C(=O)CCC2CCC2)C1	ZINC000670448893	483003434	/nfs/dbraw/zinc/00/34/34/483003434.db2.gz	ILMJZUJBEQOWPC-INIZCTEOSA-N	1	0	282.428	1.729	50	0		CDAARO
Cc1ccc2ncn([C@H]3COC4(C3)CC[NH2+]CC4)c(=O)c2c1	ZINC000670451526	483012490	/nfs/dbraw/zinc/01/24/90/483012490.db2.gz	OSIDPTDNVOPGPK-CYBMUJFWSA-N	1	0	299.374	1.789	50	0		CDAARO
CCCc1nc(NCC[N@@H+]2CCC[C@@H](CO)C2)no1	ZINC000670455462	483031278	/nfs/dbraw/zinc/03/12/78/483031278.db2.gz	FXFYLCJPZISQIG-LLVKDONJSA-N	1	0	268.361	1.138	50	0		CDAARO
COCC[N@@H+]1CC[C@H](c2ncnn2-c2cccnc2)C1	ZINC000670468367	483059690	/nfs/dbraw/zinc/05/96/90/483059690.db2.gz	JHGMCSWCFZMOLA-LBPRGKRZSA-N	1	0	273.340	1.098	50	0		CDAARO
CCC[C@@]1(C)NC(=O)N(CC[C@@H]2CCCC[N@@H+]2C)C1=O	ZINC000084740527	483322296	/nfs/dbraw/zinc/32/22/96/483322296.db2.gz	OPOXHXKECXOTKQ-SWLSCSKDSA-N	1	0	281.400	1.971	50	0		CDAARO
CC[N@H+](CCCc1cn[nH]c1)CC(=O)NC(C)(C)C	ZINC000084774739	483326289	/nfs/dbraw/zinc/32/62/89/483326289.db2.gz	AYGHHMRQDMBOJX-UHFFFAOYSA-N	1	0	266.389	1.579	50	0		CDAARO
COc1cc(Cl)c(C[NH2+]C(C)(CO)CO)cc1Cl	ZINC000096499893	533931333	/nfs/dbraw/zinc/93/13/33/533931333.db2.gz	IZSOHHGCFALDDP-UHFFFAOYSA-N	1	0	294.178	1.835	50	0		CDAARO
Cc1ccc(C[C@@H]([NH2+]CCS(C)(=O)=O)C2CC2)cc1	ZINC000096476768	534129566	/nfs/dbraw/zinc/12/95/66/534129566.db2.gz	LTCWPLSLHGRFAO-OAHLLOKOSA-N	1	0	281.421	1.950	50	0		CDAARO
Cc1c2ccccc2oc1[C@H](C)NC(=O)[C@H]1C[C@H](O)C[NH2+]1	ZINC000299741681	525989213	/nfs/dbraw/zinc/98/92/13/525989213.db2.gz	ADFQOFHVPPJFCW-GMXVVIOVSA-N	1	0	288.347	1.641	50	0		CDAARO
CC(C)(C[NH2+]CC(C)(C)c1ccccc1)NS(C)(=O)=O	ZINC000096490767	527170012	/nfs/dbraw/zinc/17/00/12/527170012.db2.gz	HPEGNXFMYHPMGB-UHFFFAOYSA-N	1	0	298.452	1.882	50	0		CDAARO
CCN(Cc1noc(C)n1)C(=O)C[NH+](CC)CC	ZINC000222579898	528081379	/nfs/dbraw/zinc/08/13/79/528081379.db2.gz	SFNZZBOUSXVJQQ-UHFFFAOYSA-N	1	0	254.334	1.068	50	0		CDAARO
Cc1ccc([C@@H](O)CN2CC[N@@H+](C)C[C@@H]2C)cc1C	ZINC000089643189	545567557	/nfs/dbraw/zinc/56/75/57/545567557.db2.gz	DIPUAHUTSUGSST-HOCLYGCPSA-N	1	0	262.397	1.973	50	0		CDAARO
CC(C)(C)c1n[nH]cc1C[NH2+]CC(=O)NCc1ccco1	ZINC000097159278	567904865	/nfs/dbraw/zinc/90/48/65/567904865.db2.gz	YOIZIHABFVBMMV-UHFFFAOYSA-N	1	0	290.367	1.706	50	0		CDAARO
C[C@@H]1CC[C@H]([NH3+])[C@H]([C@H]2CC[C@H](C(F)(F)F)NC2)N1	ZINC000757216087	577036356	/nfs/dbraw/zinc/03/63/56/577036356.db2.gz	XPGJYWYAEPVISB-KJPMQGKISA-N	1	0	265.323	1.385	50	0		CDAARO
CC[C@@H]([NH3+])[C@]1(O)CCCN(C(=O)OC(C)(C)C)C1	ZINC000958528701	615523681	/nfs/dbraw/zinc/52/36/81/615523681.db2.gz	ZNUGSAZMWZVNIU-MFKMUULPSA-N	1	0	258.362	1.486	50	0		CDAARO
CN(CCC[NH+](C)C)C(=O)/C=C/c1cc(CO)cs1	ZINC000952976306	615877568	/nfs/dbraw/zinc/87/75/68/615877568.db2.gz	LXPIDOYMFTXSAQ-AATRIKPKSA-N	1	0	282.409	1.664	50	0		CDAARO
CNC(=O)C[NH+]1CCC(CNC(=O)C2CCCCC2)CC1	ZINC000952966940	616600402	/nfs/dbraw/zinc/60/04/02/616600402.db2.gz	LJIINUCRQJTPAR-UHFFFAOYSA-N	1	0	295.427	1.141	50	0		CDAARO
NCc1nnc(NCCC2CC[NH+](C3CCCC3)CC2)o1	ZINC001772700277	1159436292	/nfs/dbraw/zinc/43/62/92/1159436292.db2.gz	BKDGOGNOTMVHDW-UHFFFAOYSA-N	1	0	293.415	1.985	50	0		CDAARO
Cc1nc[nH]c1CN(CC[NH+](C)C)Cc1ccco1	ZINC001772705984	1159440760	/nfs/dbraw/zinc/44/07/60/1159440760.db2.gz	FQDRKYMLSYRYTD-UHFFFAOYSA-N	1	0	262.357	1.875	50	0		CDAARO
Cc1nc(C[N@@H+]2C[C@@H]3COCC[C@]3(CO)C2)sc1C	ZINC001772709162	1159443542	/nfs/dbraw/zinc/44/35/42/1159443542.db2.gz	IEFZHPWFBLACFJ-TZMCWYRMSA-N	1	0	282.409	1.591	50	0		CDAARO
CNCc1nnc(N(C)CC[NH+]2CCCCCC2)o1	ZINC001772712168	1159445335	/nfs/dbraw/zinc/44/53/35/1159445335.db2.gz	OOZKSWSFLDXWGG-UHFFFAOYSA-N	1	0	267.377	1.101	50	0		CDAARO
CNC(=O)C[C@@H]1CCN(c2nc(N(C)C)[nH+]c(C)c2C)C1	ZINC001704337352	1177693065	/nfs/dbraw/zinc/69/30/65/1177693065.db2.gz	QXDDHLGNOYXQKB-LBPRGKRZSA-N	1	0	291.399	1.122	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc3ccccc3n2)C[C@@H]1CCO	ZINC000020785456	824875543	/nfs/dbraw/zinc/87/55/43/824875543.db2.gz	PJGBYORCFDGMPZ-INIZCTEOSA-N	1	0	285.391	1.733	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCCN(Cc2ccccc2F)C1=O	ZINC000011873108	825097439	/nfs/dbraw/zinc/09/74/39/825097439.db2.gz	UEEMUPUBCKVOJG-OAHLLOKOSA-N	1	0	280.343	1.241	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)Nc1cccc(C)n1	ZINC000275071415	826130143	/nfs/dbraw/zinc/13/01/43/826130143.db2.gz	WOHRGZMZHMAHAC-LBPRGKRZSA-N	1	0	262.357	1.996	50	0		CDAARO
Cc1nc(C)n(CCCNC(=O)C(C)(C)[NH+]2CCCC2)n1	ZINC000426739124	826558435	/nfs/dbraw/zinc/55/84/35/826558435.db2.gz	WPXCYNAJOGBHBT-UHFFFAOYSA-N	1	0	293.415	1.276	50	0		CDAARO
CC/C=C(\C)C[N@@H+]1CC[C@@H](CNC(=O)c2nnc[nH]2)C1	ZINC000067879042	826880888	/nfs/dbraw/zinc/88/08/88/826880888.db2.gz	VXMKLOHBYZZZSM-QNCMIEPLSA-N	1	0	277.372	1.213	50	0		CDAARO
Cc1cc(F)cc(N2CC[NH+]([C@H]3CCC[C@H]3O)CC2)n1	ZINC000952992872	827839101	/nfs/dbraw/zinc/83/91/01/827839101.db2.gz	SIRQJNBZEMRSSZ-UONOGXRCSA-N	1	0	279.359	1.565	50	0		CDAARO
CCCS(=O)(=O)NC[C@@H](C(C)C)[NH+]1CCCC1	ZINC000049736707	828048556	/nfs/dbraw/zinc/04/85/56/828048556.db2.gz	QRZSJJAKDIUEKR-LBPRGKRZSA-N	1	0	262.419	1.436	50	0		CDAARO
Cn1cc(CN2CC[C@@H]([NH+]3CCCCCC3)[C@H](O)C2)cn1	ZINC000014965183	828259988	/nfs/dbraw/zinc/25/99/88/828259988.db2.gz	BKJRAQIOJIBUPN-HZPDHXFCSA-N	1	0	292.427	1.231	50	0		CDAARO
O=C(/C=C/c1c(F)cccc1F)N[C@H]1COC2(C[NH2+]C2)C1	ZINC000952832844	910401441	/nfs/dbraw/zinc/40/14/41/910401441.db2.gz	SNXALYQQXVZJFH-ORAHPGNNSA-N	1	0	294.301	1.225	50	0		CDAARO
CCCOc1cccc(NC(=O)[C@@]2([NH3+])CC[C@@H](O)C2)c1	ZINC000952884249	910458535	/nfs/dbraw/zinc/45/85/35/910458535.db2.gz	RPOJIQADDSFYRL-IUODEOHRSA-N	1	0	278.352	1.656	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]CCn1cnc(C)c1C	ZINC000823557582	925710091	/nfs/dbraw/zinc/71/00/91/925710091.db2.gz	WGEQHGIJXQFXDB-GFCCVEGCSA-N	1	0	275.400	1.937	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)NC1(CO)CCCC1	ZINC000828686741	926163841	/nfs/dbraw/zinc/16/38/41/926163841.db2.gz	INPUJEVOSZYEGX-GFCCVEGCSA-N	1	0	254.374	1.282	50	0		CDAARO
OC[C@@H]1CCC[N@H+](CCCNc2ncccc2F)C1	ZINC000828711276	926168506	/nfs/dbraw/zinc/16/85/06/926168506.db2.gz	XUEFSSQPLIOVGI-GFCCVEGCSA-N	1	0	267.348	1.727	50	0		CDAARO
CC(C)CCc1nc([C@@H]([NH3+])CO)n(-c2ccc(F)cc2)n1	ZINC000828784063	926182177	/nfs/dbraw/zinc/18/21/77/926182177.db2.gz	HOOUOWMPOZILRP-ZDUSSCGKSA-N	1	0	292.358	1.987	50	0		CDAARO
[NH3+]CCn1nc(-c2ccc(F)cc2)n(C2CC2)c1=O	ZINC000888106985	937246084	/nfs/dbraw/zinc/24/60/84/937246084.db2.gz	KDGICSZHNUPLOV-UHFFFAOYSA-N	1	0	262.288	1.145	50	0		CDAARO
CC1CCC2(CC1)OC[C@@H](C[NH2+]Cc1cnn(C)c1)O2	ZINC000584908412	930678032	/nfs/dbraw/zinc/67/80/32/930678032.db2.gz	FOODVLUAMFLOPU-HNFVBEJKSA-N	1	0	279.384	1.832	50	0		CDAARO
CNC(=O)COc1ccccc1C[N@H+](C)[C@@H]1CCC[C@H]1O	ZINC000585084518	930876207	/nfs/dbraw/zinc/87/62/07/930876207.db2.gz	LNRLVKWUQIZWJB-ZIAGYGMSSA-N	1	0	292.379	1.157	50	0		CDAARO
CCN1CCC[C@@H]([N@@H+]2CCC[C@H](CN3CCCC3=O)C2)C1	ZINC000042987519	932214157	/nfs/dbraw/zinc/21/41/57/932214157.db2.gz	MSEIUFLSRDEAKW-JKSUJKDBSA-N	1	0	293.455	1.805	50	0		CDAARO
Cc1nc(C[N@@H+](C)[C@@H]2C[C@@H]3C[C@H](O)C[C@@H]3C2)cc(=O)[nH]1	ZINC001529160030	968997271	/nfs/dbraw/zinc/99/72/71/968997271.db2.gz	ZSJSOVUHPMIZAN-WVKUQDAKSA-N	1	0	277.368	1.472	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](C(=O)Nc2cnn(C(C)C)c2)C1	ZINC001506399319	975149290	/nfs/dbraw/zinc/14/92/90/975149290.db2.gz	DTDCOYRVPCHEEJ-GFCCVEGCSA-N	1	0	280.372	1.371	50	0		CDAARO
CC[C@H]1CN(CCn2cnnc2)CC[N@@H+]1C(C)C	ZINC001506410793	975152979	/nfs/dbraw/zinc/15/29/79/975152979.db2.gz	XKLNIJUKSIUOEA-ZDUSSCGKSA-N	1	0	251.378	1.083	50	0		CDAARO
CC[N@@H+](Cc1cncn1CCOC)C[C@@H]1CCCO1	ZINC001506416679	975155269	/nfs/dbraw/zinc/15/52/69/975155269.db2.gz	FROJLLHMTILUKJ-AWEZNQCLSA-N	1	0	267.373	1.530	50	0		CDAARO
CCN(CC[NH+]1CCCC1)C(=O)c1ccc(N)nc1	ZINC001506425026	975159393	/nfs/dbraw/zinc/15/93/93/975159393.db2.gz	KLTXKNLLNVORSC-UHFFFAOYSA-N	1	0	262.357	1.222	50	0		CDAARO
CCC[C@@H]1C[N@H+](CCCn2nnnc2C)C[C@H]1N(C)C	ZINC000082140426	177924042	/nfs/dbraw/zinc/92/40/42/177924042.db2.gz	LJUGNFBIAAJZGT-ZIAGYGMSSA-N	1	0	280.420	1.034	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)N1CCCCCC1)C1CCOCC1	ZINC000096492013	230382662	/nfs/dbraw/zinc/38/26/62/230382662.db2.gz	INJRJHWLPQDKOK-CYBMUJFWSA-N	1	0	268.401	1.794	50	0		CDAARO
Cc1nc(C(F)(F)F)ncc1CN1CC[NH2+][C@H](C)C1	ZINC000426388094	230416568	/nfs/dbraw/zinc/41/65/68/230416568.db2.gz	ZWSZKPHCJROLDS-MRVPVSSYSA-N	1	0	274.290	1.598	50	0		CDAARO
CCc1nnc(CNC(=O)C2CC[NH+](C(C)C)CC2)s1	ZINC000095519379	185002176	/nfs/dbraw/zinc/00/21/76/185002176.db2.gz	ZRRJDYQWOWWOLE-UHFFFAOYSA-N	1	0	296.440	1.837	50	0		CDAARO
Cc1nn(C)c(C)c1C(=O)N1C[C@H]2CC[C@@H](C1)[N@H+](C)C2	ZINC000220535500	230397442	/nfs/dbraw/zinc/39/74/42/230397442.db2.gz	GGUDLKIIHDUTPH-STQMWFEESA-N	1	0	276.384	1.203	50	0		CDAARO
COc1ccc([C@H](C)[NH2+]C(CO)CO)c2ccccc12	ZINC000095968595	185047667	/nfs/dbraw/zinc/04/76/67/185047667.db2.gz	YEKKIJRCCJEMCI-NSHDSACASA-N	1	0	275.348	1.852	50	0		CDAARO
COC(=O)[C@]12CCC[C@H]1C[N@H+](Cc1nc(C)ccc1O)C2	ZINC000096009044	185063819	/nfs/dbraw/zinc/06/38/19/185063819.db2.gz	UKOURTZGXNRNRN-LRDDRELGSA-N	1	0	290.363	1.871	50	0		CDAARO
C[C@@H]1C[C@H]([NH2+]C[C@H](O)CO)C[C@@H](c2ccccc2)C1	ZINC000238857287	361741019	/nfs/dbraw/zinc/74/10/19/361741019.db2.gz	YPSZPHVKLRDAEC-TUUVXOQKSA-N	1	0	263.381	1.902	50	0		CDAARO
CC[N@@H+]1CC[C@@H]2[C@H](C1)OCCN2C(=O)[C@@H](C)CSC	ZINC000241316716	361752519	/nfs/dbraw/zinc/75/25/19/361752519.db2.gz	LUHUULSRFSAWEP-XQQFMLRXSA-N	1	0	286.441	1.307	50	0		CDAARO
Cc1ccc2nc(C(=O)NCCC[NH+]3CCCC3)cn2c1	ZINC000097939158	342101607	/nfs/dbraw/zinc/10/16/07/342101607.db2.gz	NRMCTNDMLQKLHW-UHFFFAOYSA-N	1	0	286.379	1.858	50	0		CDAARO
CN(C)c1ccc(CCNC(=O)[C@H]2CCC[NH2+]C2)cc1	ZINC000096132611	185104869	/nfs/dbraw/zinc/10/48/69/185104869.db2.gz	DDRRPKGJQDVRRR-AWEZNQCLSA-N	1	0	275.396	1.411	50	0		CDAARO
[NH3+][C@H](CC(=O)N1CC[C@]2(CCOC2)C1)c1ccccc1	ZINC000195544248	342626624	/nfs/dbraw/zinc/62/66/24/342626624.db2.gz	RVJQCDJBVJEHSH-ZBFHGGJFSA-N	1	0	274.364	1.716	50	0		CDAARO
COc1cccc(O)c1C(=O)N1CC([NH+]2CCCCC2)C1	ZINC000244691000	361856760	/nfs/dbraw/zinc/85/67/60/361856760.db2.gz	JATUDRWYQXTLGZ-UHFFFAOYSA-N	1	0	290.363	1.711	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)CCc1nc(-c2ccoc2)no1	ZINC000125438393	187184464	/nfs/dbraw/zinc/18/44/64/187184464.db2.gz	YFTZGKQQYNLBFL-JTQLQIEISA-N	1	0	290.323	1.083	50	0		CDAARO
CCO[C@H]1C[C@](O)(C[NH2+]Cc2c(C)nn(C)c2C)C1(C)C	ZINC000188903388	342204116	/nfs/dbraw/zinc/20/41/16/342204116.db2.gz	CCIFIINIYUFDEQ-HOCLYGCPSA-N	1	0	295.427	1.693	50	0		CDAARO
NC(=O)[C@H]1CCC[N@H+](Cc2cccc3cc[nH]c32)C1	ZINC000097020236	185153239	/nfs/dbraw/zinc/15/32/39/185153239.db2.gz	ZDPIMJYFRXWCKT-ZDUSSCGKSA-N	1	0	257.337	1.865	50	0		CDAARO
CN(C)[C@@H](C(=O)NC1CC[NH2+]CC1)c1cccc(F)c1	ZINC000218872702	282167614	/nfs/dbraw/zinc/16/76/14/282167614.db2.gz	GMKHTFWNKSHAFA-CQSZACIVSA-N	1	0	279.359	1.297	50	0		CDAARO
CCCC[C@H](NC1CC[NH+]([C@@H]2CCOC2)CC1)C(=O)OC	ZINC000585091308	362019965	/nfs/dbraw/zinc/01/99/65/362019965.db2.gz	CGCCLUWTGJLQQF-CABCVRRESA-N	1	0	298.427	1.561	50	0		CDAARO
c1nnc(C[NH2+]CCC[C@H]2CCO2)n1-c1ccccc1	ZINC000585117785	362046187	/nfs/dbraw/zinc/04/61/87/362046187.db2.gz	XCGCFRFGIKRBBC-AWEZNQCLSA-N	1	0	272.352	1.926	50	0		CDAARO
CCc1noc(CC)c1CC(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178532864	362245221	/nfs/dbraw/zinc/24/52/21/362245221.db2.gz	HYSSWHKUWSZVBA-JTQLQIEISA-N	1	0	265.357	1.149	50	0		CDAARO
C[NH+](C)CCN(Cc1cccs1)C(=O)c1ccon1	ZINC000083851097	362254474	/nfs/dbraw/zinc/25/44/74/362254474.db2.gz	ZKWJAIYKNSIBBS-UHFFFAOYSA-N	1	0	279.365	1.940	50	0		CDAARO
Cc1noc(C)c1CCCNC(=O)NCC(C)(C)[NH+](C)C	ZINC000084898491	362276144	/nfs/dbraw/zinc/27/61/44/362276144.db2.gz	ZYSYTHFAQNWRRP-UHFFFAOYSA-N	1	0	296.415	1.863	50	0		CDAARO
Cc1ccccc1CSCC(=O)NC[C@@]1(O)CC[NH2+]C1	ZINC000252494854	362388082	/nfs/dbraw/zinc/38/80/82/362388082.db2.gz	OGQISZJDDGBKGO-OAHLLOKOSA-N	1	0	294.420	1.069	50	0		CDAARO
[NH3+]C1CC(c2cc(N[C@H]3CC[C@H](O)CC3)ncn2)C1	ZINC000252536673	362392253	/nfs/dbraw/zinc/39/22/53/362392253.db2.gz	JDEUWULJSTWZAW-LOTOBDBSSA-N	1	0	262.357	1.397	50	0		CDAARO
CO[C@H](C)CC(=O)OCCC[N@@H+]1CCOC[C@H]1C	ZINC000095467923	362568415	/nfs/dbraw/zinc/56/84/15/362568415.db2.gz	VEIFANOOLNSDJY-VXGBXAGGSA-N	1	0	259.346	1.065	50	0		CDAARO
CC(=O)N1CCN([C@@H]2C[N@H+]([C@@H]3C=CCCC3)C[C@@H]2C)CC1	ZINC000607974384	345491533	/nfs/dbraw/zinc/49/15/33/345491533.db2.gz	CTFCRIMRPWSGPK-USXIJHARSA-N	1	0	291.439	1.580	50	0		CDAARO
CC[C@@H](NC(=O)N1CC[C@H](C[NH+](C)C)C1)c1noc(C)n1	ZINC000130233802	346646973	/nfs/dbraw/zinc/64/69/73/346646973.db2.gz	FCNQJRMTYWTAEI-VXGBXAGGSA-N	1	0	295.387	1.422	50	0		CDAARO
COc1csc(C(=O)N2C[C@@H](C)[NH2+][C@@H](C)C2)c1	ZINC000128863123	187395351	/nfs/dbraw/zinc/39/53/51/187395351.db2.gz	WFQIWBUFIWVTPV-DTORHVGOSA-N	1	0	254.355	1.579	50	0		CDAARO
COc1ccc(CCNC(=O)C[C@@H]2CC[NH2+]C2)cc1OC	ZINC000089717465	179854535	/nfs/dbraw/zinc/85/45/35/179854535.db2.gz	IGDHREUULWOCHS-ZDUSSCGKSA-N	1	0	292.379	1.362	50	0		CDAARO
COC(=O)CC1CC[NH+]([C@H]2CCCC[C@H]2O)CC1	ZINC000089886837	179876745	/nfs/dbraw/zinc/87/67/45/179876745.db2.gz	MHOKJCRWCGYSAY-QWHCGFSZSA-N	1	0	255.358	1.565	50	0		CDAARO
COc1cc(OC)nc(NCC2(C[NH+]3CCCC3)CC2)n1	ZINC000584885042	349343384	/nfs/dbraw/zinc/34/33/84/349343384.db2.gz	SOQRTIVLTCZZTK-UHFFFAOYSA-N	1	0	292.383	1.204	50	0		CDAARO
COCC1(CNC(=O)CC2CC[NH2+]CC2)CCCC1	ZINC000584887766	349346588	/nfs/dbraw/zinc/34/65/88/349346588.db2.gz	SBINKMYPBOACEB-UHFFFAOYSA-N	1	0	268.401	1.699	50	0		CDAARO
CCCS(=O)(=O)NC[C@@H](C)[NH2+]Cc1cnc(C)cc1C	ZINC000584888224	349346594	/nfs/dbraw/zinc/34/65/94/349346594.db2.gz	SOAXEZATQTYCFD-CYBMUJFWSA-N	1	0	299.440	1.506	50	0		CDAARO
O=C(NCCC[N@H+]1CCCC[C@H]1CO)c1cncc(F)c1	ZINC000584890595	349349427	/nfs/dbraw/zinc/34/94/27/349349427.db2.gz	FFNUUEKJWFLWMQ-AWEZNQCLSA-N	1	0	295.358	1.187	50	0		CDAARO
O=C(NC1(CO)CCCCCC1)[C@H]1CC12CC[NH2+]CC2	ZINC000584895284	349356045	/nfs/dbraw/zinc/35/60/45/349356045.db2.gz	ZLIGQMBNNAQZJY-CYBMUJFWSA-N	1	0	280.412	1.578	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN(C2CSCCSC2)C1	ZINC000584900323	349362464	/nfs/dbraw/zinc/36/24/64/349362464.db2.gz	FVZCZUTWEOSAGT-GFCCVEGCSA-N	1	0	290.498	1.345	50	0		CDAARO
COCC[C@]1(O)CC[N@H+](Cc2cncn2C2CC2)C[C@H]1C	ZINC000091305147	180131324	/nfs/dbraw/zinc/13/13/24/180131324.db2.gz	XGNYHHSURRANOO-CZUORRHYSA-N	1	0	293.411	1.827	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2ccc(CO)cc2)C[C@@H]1[NH+](C)C	ZINC000091320031	180133718	/nfs/dbraw/zinc/13/37/18/180133718.db2.gz	NIVBYBCIAOUGFP-HOTGVXAUSA-N	1	0	290.407	1.981	50	0		CDAARO
CC(C)Cc1cc(C(=O)N2CC[N@@H+]3CCC[C@@H]3C2)n(C)n1	ZINC000091440751	180156817	/nfs/dbraw/zinc/15/68/17/180156817.db2.gz	PWSDXVRCNGNDML-CQSZACIVSA-N	1	0	290.411	1.539	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@H]2CSc3ccccc32)C1	ZINC000092239252	180350799	/nfs/dbraw/zinc/35/07/99/180350799.db2.gz	WCVFTYSWBRFJRF-JQWIXIFHSA-N	1	0	262.378	1.683	50	0		CDAARO
Cc1cc(O)cc(C(=O)NC[C@@H]2C[N@@H+]3CCC[C@H]3CO2)c1	ZINC000107138626	186161056	/nfs/dbraw/zinc/16/10/56/186161056.db2.gz	VIKNQNSMFXMCOY-DZGCQCFKSA-N	1	0	290.363	1.294	50	0		CDAARO
Cc1ccc(C[N@@H+]2CC[C@H](C(N)=O)C2)cc1Cl	ZINC000193588904	362976634	/nfs/dbraw/zinc/97/66/34/362976634.db2.gz	NEXICDXNLZNOSV-NSHDSACASA-N	1	0	252.745	1.956	50	0		CDAARO
Cc1nc(Cl)cc(N2CCC([NH+]3CCOCC3)CC2)n1	ZINC000583650877	366007669	/nfs/dbraw/zinc/00/76/69/366007669.db2.gz	JAAQUASXTYBSSV-UHFFFAOYSA-N	1	0	296.802	1.739	50	0		CDAARO
C[C@]1(CO)CCCN1C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000121952449	187006698	/nfs/dbraw/zinc/00/66/98/187006698.db2.gz	VXLZVGIMJLESKC-MRXNPFEDSA-N	1	0	297.443	1.852	50	0		CDAARO
Cc1ccc(C(=O)N2CCO[C@@H]([C@H](C)[NH3+])C2)c(F)c1	ZINC000122866893	187056283	/nfs/dbraw/zinc/05/62/83/187056283.db2.gz	WHDSFAOILQHEJM-GXFFZTMASA-N	1	0	266.316	1.322	50	0		CDAARO
COC(=O)CC1([NH3+])CCN(C(=O)OC(C)(C)C)CC1	ZINC000012650239	290969670	/nfs/dbraw/zinc/96/96/70/290969670.db2.gz	UJWYRWKTHZQRLH-UHFFFAOYSA-N	1	0	272.345	1.278	50	0		CDAARO
CCCC[C@@H](C[NH3+])NS(=O)(=O)N1CCCCCC1	ZINC000130507813	282904747	/nfs/dbraw/zinc/90/47/47/282904747.db2.gz	YVGHMYYLVQDWME-LBPRGKRZSA-N	1	0	277.434	1.214	50	0		CDAARO
C[C@@H](Nc1ncnc2c1cnn2C)c1ccncc1	ZINC000014215860	366133077	/nfs/dbraw/zinc/13/30/77/366133077.db2.gz	BGHGKBFEFDQPCH-SECBINFHSA-N	1	0	254.297	1.931	50	0		CDAARO
COc1ccc(C[NH2+]C[C@@H]2CCCO2)cc1OC	ZINC000000299726	355901952	/nfs/dbraw/zinc/90/19/52/355901952.db2.gz	ZPKUANIUQZWSSL-LBPRGKRZSA-N	1	0	251.326	1.972	50	0		CDAARO
COc1ccc(NC(=S)N2CCN(C)CC2)c(OC)c1	ZINC000000307288	355903176	/nfs/dbraw/zinc/90/31/76/355903176.db2.gz	VFOKPANLFITZOB-UHFFFAOYSA-N	1	0	295.408	1.648	50	0		CDAARO
C[C@H]1C[C@@H]([NH3+])CCN1C(=O)c1ccc2c(c1)CCO2	ZINC000124675706	356059507	/nfs/dbraw/zinc/05/95/07/356059507.db2.gz	UBXKCAHAEQIVCG-GWCFXTLKSA-N	1	0	260.337	1.573	50	0		CDAARO
O=C(C[NH2+][C@H]1CCCSC1)NCCc1ccccc1	ZINC000097371057	356089042	/nfs/dbraw/zinc/08/90/42/356089042.db2.gz	ZBWQHKUKVZQWGV-AWEZNQCLSA-N	1	0	278.421	1.831	50	0		CDAARO
C[C@H]1CCCN(C(=O)c2ccc(C(N)=O)s2)[C@H]1C[NH3+]	ZINC000299739074	356266996	/nfs/dbraw/zinc/26/69/96/356266996.db2.gz	KGSYODOZTGVROB-IUCAKERBSA-N	1	0	281.381	1.046	50	0		CDAARO
Cc1cc(C)c(C(=O)N2CCO[C@H](CC[NH+](C)C)C2)o1	ZINC000012050972	356286529	/nfs/dbraw/zinc/28/65/29/356286529.db2.gz	DVZBQBMEEAWLEM-CYBMUJFWSA-N	1	0	280.368	1.689	50	0		CDAARO
Cc1cc2oc(=O)cc(C[N@H+](C)CCO)c2cc1C	ZINC000004340572	356304351	/nfs/dbraw/zinc/30/43/51/356304351.db2.gz	NXPJHRDROQNVOU-UHFFFAOYSA-N	1	0	261.321	1.834	50	0	biogenic	CDAARO
O=C(Cn1cncn1)NC[C@H](c1ccccc1)[NH+]1CCCC1	ZINC000032903745	356421677	/nfs/dbraw/zinc/42/16/77/356421677.db2.gz	XYIZKVCUJPQCOL-OAHLLOKOSA-N	1	0	299.378	1.231	50	0		CDAARO
CC[NH+]1CCN(CCC(=O)Nc2cccc(OC)c2)CC1	ZINC000019359354	356483083	/nfs/dbraw/zinc/48/30/83/356483083.db2.gz	QOMKLXICBPQQKA-UHFFFAOYSA-N	1	0	291.395	1.661	50	0		CDAARO
COc1cc(OC)c(OC)cc1CN1CCC[N@H+](C)CC1	ZINC000019537681	356491473	/nfs/dbraw/zinc/49/14/73/356491473.db2.gz	LBDYZZVDMIATNP-UHFFFAOYSA-N	1	0	294.395	1.850	50	0		CDAARO
CCc1ccc(OCCOCCN2CC[NH+](C)CC2)cc1	ZINC000019792533	356504148	/nfs/dbraw/zinc/50/41/48/356504148.db2.gz	CSFGUMGHJUXQTA-UHFFFAOYSA-N	1	0	292.423	1.892	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C1CCN(C(=O)C(C)(C)C)CC1	ZINC000037142534	363469737	/nfs/dbraw/zinc/46/97/37/363469737.db2.gz	CBBMBJPVKQFCLM-UHFFFAOYSA-N	1	0	278.400	1.845	50	0		CDAARO
Cc1ccc(COC[C@@H](O)C[NH+]2CCN(C)CC2)cc1	ZINC000023114598	356627808	/nfs/dbraw/zinc/62/78/08/356627808.db2.gz	LFHHZWGBVDKOFO-INIZCTEOSA-N	1	0	278.396	1.120	50	0		CDAARO
Cc1ccccc1CNC(=O)NC[C@H]1C[NH2+]CCOC1	ZINC000072172671	356640061	/nfs/dbraw/zinc/64/00/61/356640061.db2.gz	ZZYJLBNWQKKSQJ-CYBMUJFWSA-N	1	0	277.368	1.030	50	0		CDAARO
CC1(C)Cc2nc(N3CCC(O)CC3)ncc2[C@H]([NH3+])C1	ZINC000091305565	358509710	/nfs/dbraw/zinc/50/97/10/358509710.db2.gz	MFDXXQBPWWTBPD-GFCCVEGCSA-N	1	0	276.384	1.410	50	0		CDAARO
COC(=O)c1ccc(C[N@H+](C)C2CCN(C)CC2)cc1	ZINC000000216012	356734847	/nfs/dbraw/zinc/73/48/47/356734847.db2.gz	MQMCZUJPOQBHNC-UHFFFAOYSA-N	1	0	276.380	1.999	50	0		CDAARO
Cc1cc(NC(=O)C[N@H+]2C[C@H](C)C[C@H](C)C2)n(C)n1	ZINC000029597024	356739235	/nfs/dbraw/zinc/73/92/35/356739235.db2.gz	LZBXWGCXYPADTN-PHIMTYICSA-N	1	0	264.373	1.645	50	0		CDAARO
C[C@@H](C(N)=O)N1CCN([C@@H](C)c2ccccc2Cl)CC1	ZINC000029686023	356741638	/nfs/dbraw/zinc/74/16/38/356741638.db2.gz	WYMYQGIADAEYED-RYUDHWBXSA-N	1	0	295.814	1.892	50	0		CDAARO
NC(=O)[C@H]1CCC[N@H+](Cc2cc(F)ccc2F)C1	ZINC000000757252	356813566	/nfs/dbraw/zinc/81/35/66/356813566.db2.gz	WUYXDWVKDYOUBK-VIFPVBQESA-N	1	0	254.280	1.662	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC(CC[NH3+])CC2)cc1	ZINC000034927272	356824591	/nfs/dbraw/zinc/82/45/91/356824591.db2.gz	LGWTYKKOWIXVAF-UHFFFAOYSA-N	1	0	282.409	1.745	50	0		CDAARO
[NH3+][C@@H](C(=O)NCCNc1cccnc1)c1ccccc1	ZINC000071753067	356873518	/nfs/dbraw/zinc/87/35/18/356873518.db2.gz	XRWDMWGGYPFVRX-CQSZACIVSA-N	1	0	270.336	1.310	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(C[C@@H](O)c2ccccc2F)C[C@H]1C	ZINC000247245487	356964967	/nfs/dbraw/zinc/96/49/67/356964967.db2.gz	SSGNZJTYUPBOKE-DVOMOZLQSA-N	1	0	296.386	1.246	50	0		CDAARO
CN(C)c1nc(N2CC[NH+](C)CC2)nc2ccccc21	ZINC000041147118	357026236	/nfs/dbraw/zinc/02/62/36/357026236.db2.gz	LLJLXJLTSGRUJC-UHFFFAOYSA-N	1	0	271.368	1.448	50	0		CDAARO
COC(=O)c1ccc(COC[C@@H]2CCC[NH2+]C2)cc1	ZINC000042782953	357080549	/nfs/dbraw/zinc/08/05/49/357080549.db2.gz	AYJVPFIHTHNGHQ-CYBMUJFWSA-N	1	0	263.337	1.989	50	0		CDAARO
CC[NH2+][C@@H](C)CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1	ZINC000058040593	357374461	/nfs/dbraw/zinc/37/44/61/357374461.db2.gz	BSHSKNSMRZLQBW-LBPRGKRZSA-N	1	0	299.415	1.454	50	0		CDAARO
C[C@H](CO)[NH2+]CC(=O)Nc1ccc(F)c(F)c1F	ZINC000065385451	357534181	/nfs/dbraw/zinc/53/41/81/357534181.db2.gz	CIIRRYWKDLSFCD-ZCFIWIBFSA-N	1	0	262.231	1.013	50	0		CDAARO
c1ccc(-c2ncc(CN3CC[C@H]4CC[C@@H](C3)[NH2+]4)cn2)nc1	ZINC000065462815	357543725	/nfs/dbraw/zinc/54/37/25/357543725.db2.gz	MKGUVUSVNZBZLJ-CABCVRRESA-N	1	0	295.390	1.865	50	0		CDAARO
CC(C)C(=O)N1CCC(C[NH2+][C@H](C)Cn2cncn2)CC1	ZINC000065530636	357547813	/nfs/dbraw/zinc/54/78/13/357547813.db2.gz	JTSRCTYEBGSSPH-CYBMUJFWSA-N	1	0	293.415	1.151	50	0		CDAARO
Cn1nc(COCc2cccc(F)c2)c2c1CC[NH2+]C2	ZINC000066323487	357562079	/nfs/dbraw/zinc/56/20/79/357562079.db2.gz	HADDGEDAYKBKRK-UHFFFAOYSA-N	1	0	275.327	1.922	50	0		CDAARO
[NH3+]C[C@@H]1CN(Cc2ccccc2Cn2cccn2)CCO1	ZINC000067739548	357622863	/nfs/dbraw/zinc/62/28/63/357622863.db2.gz	YBHIYDLAPHGYET-MRXNPFEDSA-N	1	0	286.379	1.091	50	0		CDAARO
CC[NH+]1CCN(CC(=O)N(C)c2ccccc2)CC1	ZINC000022029747	357594612	/nfs/dbraw/zinc/59/46/12/357594612.db2.gz	UAZVDNKMAPAFJP-UHFFFAOYSA-N	1	0	261.369	1.287	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@@H](CNC(=O)c2c(O)cccc2O)C1	ZINC000067673387	357618230	/nfs/dbraw/zinc/61/82/30/357618230.db2.gz	GBIRQQUAWLGXBI-LBPRGKRZSA-N	1	0	292.379	1.806	50	0		CDAARO
Cc1cc(C(=O)NCC[C@H]2C[N@H+](CC(C)C)CCO2)[nH]n1	ZINC000067726064	357621465	/nfs/dbraw/zinc/62/14/65/357621465.db2.gz	PFVHYNPIWAEZFV-ZDUSSCGKSA-N	1	0	294.399	1.195	50	0		CDAARO
C[NH+]1CCC(CNC(=O)COc2ccccc2)CC1	ZINC000023013424	357646088	/nfs/dbraw/zinc/64/60/88/357646088.db2.gz	MKEOVPMPJPUWCF-UHFFFAOYSA-N	1	0	262.353	1.523	50	0		CDAARO
CCC[C@@]1(C2CC[NH2+]CC2)NC(=O)N(CCCCF)C1=O	ZINC000067868648	357633980	/nfs/dbraw/zinc/63/39/80/357633980.db2.gz	GIQJMZVGZYLYJT-HNNXBMFYSA-N	1	0	299.390	1.826	50	0		CDAARO
OC(C[C@H]1C[NH2+]CCN1)(c1ccccc1)c1ccccc1	ZINC000071771313	357780593	/nfs/dbraw/zinc/78/05/93/357780593.db2.gz	ZBTILVNCHKEHME-KRWDZBQOSA-N	1	0	282.387	1.874	50	0		CDAARO
CCCC(=O)N1CCN(c2cc(C)[nH+]c(NCC)n2)CC1	ZINC000072436817	357836154	/nfs/dbraw/zinc/83/61/54/357836154.db2.gz	UTNBTCLLCLXBLC-UHFFFAOYSA-N	1	0	291.399	1.666	50	0		CDAARO
COc1ccc(C(=O)N2CC[N@@H+]3CCC[C@H]3C2)c(OC)c1	ZINC000027932318	357938336	/nfs/dbraw/zinc/93/83/36/357938336.db2.gz	MPKZPVIHODPMLW-LBPRGKRZSA-N	1	0	290.363	1.624	50	0		CDAARO
C[NH+](C)CC(=O)NC1(c2ccc(F)cc2F)CCOCC1	ZINC000097101827	357972300	/nfs/dbraw/zinc/97/23/00/357972300.db2.gz	DSABDVYDKWGOFV-UHFFFAOYSA-N	1	0	298.333	1.648	50	0		CDAARO
CC(=O)Nc1ccc(C[N@@H+]2CCCC[C@@]2(C)C(N)=O)cc1	ZINC000097113962	357983184	/nfs/dbraw/zinc/98/31/84/357983184.db2.gz	ZZDIYPAQGILOKW-INIZCTEOSA-N	1	0	289.379	1.875	50	0		CDAARO
C[C@H](c1ccccc1)[C@H](C)[NH2+]CC(=O)NC(=O)NC1CC1	ZINC000097110020	357985921	/nfs/dbraw/zinc/98/59/21/357985921.db2.gz	WGLKOWYAGKHJRB-RYUDHWBXSA-N	1	0	289.379	1.756	50	0		CDAARO
C[NH2+][C@H]1CCN(Cc2ccc(OC)c(OC)c2OC)C1	ZINC000097229212	358043509	/nfs/dbraw/zinc/04/35/09/358043509.db2.gz	MYKHCWVGADUJSP-LBPRGKRZSA-N	1	0	280.368	1.506	50	0		CDAARO
COC[C@@H](O)C[N@H+](C)C[C@@H](O)c1ccc(Cl)cc1	ZINC000195530853	358559054	/nfs/dbraw/zinc/55/90/54/358559054.db2.gz	FFIDXSZSAZAVAS-QWHCGFSZSA-N	1	0	273.760	1.313	50	0		CDAARO
C[NH2+]C1CCC(N2C(=O)c3ccccc3C2=O)CC1	ZINC000036881173	358618272	/nfs/dbraw/zinc/61/82/72/358618272.db2.gz	VQWNOAOPKKCYMW-UHFFFAOYSA-N	1	0	258.321	1.813	50	0		CDAARO
Cc1n[nH]c(C)c1CCCNC(=O)[C@@H]1CCCCC[N@H+]1C	ZINC000095367312	358686842	/nfs/dbraw/zinc/68/68/42/358686842.db2.gz	NSLSKJXAUMJYRC-HNNXBMFYSA-N	1	0	292.427	1.950	50	0		CDAARO
CCCc1nnc(N2CC[C@H]([NH+](CC)CC)C2)o1	ZINC000095376538	358689502	/nfs/dbraw/zinc/68/95/02/358689502.db2.gz	HGVFCJDYMNZDRL-NSHDSACASA-N	1	0	252.362	1.943	50	0		CDAARO
CCn1cncc1CNC(=O)CC[C@@H]1CCCC[N@@H+]1C	ZINC000095388504	358692300	/nfs/dbraw/zinc/69/23/00/358692300.db2.gz	ZUKJHAAQTLBBLI-ZDUSSCGKSA-N	1	0	278.400	1.784	50	0		CDAARO
COCCC(=O)N1C[C@@H](c2ccc(C)cc2)[C@H]([NH+](C)C)C1	ZINC000095507406	358695985	/nfs/dbraw/zinc/69/59/85/358695985.db2.gz	RDYQYDWPTQACDJ-JKSUJKDBSA-N	1	0	290.407	1.888	50	0		CDAARO
C[N@@H+]1CC[C@H](C(=O)NCCCSCc2ccco2)C1	ZINC000097259352	358763416	/nfs/dbraw/zinc/76/34/16/358763416.db2.gz	RKAKBCUJBUUPEY-LBPRGKRZSA-N	1	0	282.409	1.971	50	0		CDAARO
Cc1cc2c(cc1C[N@@H+]1CC[C@](C)(O)[C@@H](O)C1)OCO2	ZINC000096136412	358708490	/nfs/dbraw/zinc/70/84/90/358708490.db2.gz	VPXGRWDZWFACLE-GJZGRUSLSA-N	1	0	279.336	1.041	50	0		CDAARO
C[N@@H+]1CCC2(CCN(C(=O)C3(C)CC3)CC2)[C@@H](CO)C1	ZINC000097425715	358775213	/nfs/dbraw/zinc/77/52/13/358775213.db2.gz	LMXNZAKNNYTBCB-CYBMUJFWSA-N	1	0	280.412	1.339	50	0		CDAARO
CC(C)c1nc(CN2CC[NH+](CCCCO)CC2)co1	ZINC000097447101	358777630	/nfs/dbraw/zinc/77/76/30/358777630.db2.gz	VLHZPLMHMRHLSU-UHFFFAOYSA-N	1	0	281.400	1.688	50	0		CDAARO
CC[N@@H+]1CC[C@H](C(=O)NCc2csc(CSC)n2)C1	ZINC000097636572	358789216	/nfs/dbraw/zinc/78/92/16/358789216.db2.gz	WCBNXCHFVGCQFV-JTQLQIEISA-N	1	0	299.465	1.964	50	0		CDAARO
Cc1occc1C(=O)N1CC[N@@H+](C2CCCC2)C[C@H](O)C1	ZINC000097698632	358793842	/nfs/dbraw/zinc/79/38/42/358793842.db2.gz	UIVMCSNRVYYKPK-AWEZNQCLSA-N	1	0	292.379	1.649	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1C(=O)NCCOCc1ccccc1	ZINC000097759336	358798006	/nfs/dbraw/zinc/79/80/06/358798006.db2.gz	KMRFAUGLSIZUGI-HNNXBMFYSA-N	1	0	276.380	1.804	50	0		CDAARO
Cc1noc(CN(C)c2cc(C3CC([NH3+])C3)ncn2)n1	ZINC000219041966	359076640	/nfs/dbraw/zinc/07/66/40/359076640.db2.gz	VSESPGWGTSJVDY-UHFFFAOYSA-N	1	0	274.328	1.009	50	0		CDAARO
O=c1cc([C@H]2CCC[NH2+]C2)nc(Cc2ccsc2)[nH]1	ZINC000023339268	359093459	/nfs/dbraw/zinc/09/34/59/359093459.db2.gz	RMPDXLZSVRNDSO-NSHDSACASA-N	1	0	275.377	1.889	50	0		CDAARO
COC[C@H](C[NH+]1CCN(c2ccccc2)CC1)OC	ZINC000071771407	359104989	/nfs/dbraw/zinc/10/49/89/359104989.db2.gz	RIDXJEOOMOOKEG-HNNXBMFYSA-N	1	0	264.369	1.470	50	0		CDAARO
CC[C@H](C)[C@H]([NH3+])C(=O)NCCc1noc(C(C)C)n1	ZINC000220465045	359174515	/nfs/dbraw/zinc/17/45/15/359174515.db2.gz	RADGFRCAECOJAK-ONGXEEELSA-N	1	0	268.361	1.225	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2ccc[nH]2)CC1	ZINC000089414441	359284050	/nfs/dbraw/zinc/28/40/50/359284050.db2.gz	DYYHZXRREGMHIK-UHFFFAOYSA-N	1	0	265.357	1.103	50	0		CDAARO
O=C(c1cccnc1)N1CC[NH+](C2CCCC2)CC1	ZINC000000239811	359378499	/nfs/dbraw/zinc/37/84/99/359378499.db2.gz	GQHQVOZDZPMTNH-UHFFFAOYSA-N	1	0	259.353	1.782	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)c2ccnc(C3CC3)n2)C1	ZINC000261805364	359570061	/nfs/dbraw/zinc/57/00/61/359570061.db2.gz	WETNABLWEHCQBA-NSHDSACASA-N	1	0	260.341	1.178	50	0		CDAARO
c1ccc([C@H]2CCC[N@H+]2CCN2CCOCC2)nc1	ZINC000571902469	359671781	/nfs/dbraw/zinc/67/17/81/359671781.db2.gz	MWGVWMNKLCQMTQ-OAHLLOKOSA-N	1	0	261.369	1.551	50	0		CDAARO
CC(C)[C@@H]([NH2+]CC(=O)NC1CC1)[C@H](O)c1ccccc1	ZINC000408516361	359899412	/nfs/dbraw/zinc/89/94/12/359899412.db2.gz	NCTBCRZQRYTQCU-HZPDHXFCSA-N	1	0	276.380	1.613	50	0		CDAARO
C[N@H+](CCCOc1ccccc1)C[C@H]1COC(=O)N1	ZINC000408524206	359933692	/nfs/dbraw/zinc/93/36/92/359933692.db2.gz	REEIPXPCTQJGQI-LBPRGKRZSA-N	1	0	264.325	1.496	50	0		CDAARO
CCC(=O)N1CCC[C@@H]1[C@H]1CCCN1[C@H]1CCOC1=O	ZINC000257365300	359943997	/nfs/dbraw/zinc/94/39/97/359943997.db2.gz	FWSWBDBIQGSYPF-UPJWGTAASA-N	1	0	280.368	1.167	50	0		CDAARO
[NH3+]C[C@H]1CN(C(=O)Cc2ccc(Cl)cc2)CCO1	ZINC000011887308	360400903	/nfs/dbraw/zinc/40/09/03/360400903.db2.gz	ULXDHFGOEJCBCS-LBPRGKRZSA-N	1	0	268.744	1.069	50	0		CDAARO
COc1ccc2c(c1)nc(C)cc2C(=O)N1CC[C@H](C[NH3+])C1	ZINC000426493023	360574455	/nfs/dbraw/zinc/57/44/55/360574455.db2.gz	AGNQPYMWRJITAY-GFCCVEGCSA-N	1	0	299.374	1.973	50	0		CDAARO
Cc1nc(C(F)(F)F)ncc1CN1CCC([NH3+])CC1	ZINC000426582924	360685728	/nfs/dbraw/zinc/68/57/28/360685728.db2.gz	XHHRGQUXTSANJO-UHFFFAOYSA-N	1	0	274.290	1.727	50	0		CDAARO
CC1(CNC(=O)c2cc(Cl)ccc2OCC[NH3+])COC1	ZINC000426634087	360692083	/nfs/dbraw/zinc/69/20/83/360692083.db2.gz	CZNLPBORCANVTF-UHFFFAOYSA-N	1	0	298.770	1.444	50	0		CDAARO
CC1(C)CC(CC(=O)NCCn2ccnn2)CC(C)(C)[NH2+]1	ZINC000426380351	360661433	/nfs/dbraw/zinc/66/14/33/360661433.db2.gz	JDZVNQJLVPDWER-UHFFFAOYSA-N	1	0	293.415	1.341	50	0		CDAARO
CNC(=O)c1nc(-c2ccc([C@@H](C)[NH+]3CCCC3)cc2)n[nH]1	ZINC000426405139	360664958	/nfs/dbraw/zinc/66/49/58/360664958.db2.gz	MODHALUUMDCWPA-LLVKDONJSA-N	1	0	299.378	1.988	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)Cc2ccccc2Br)C1	ZINC000178566919	189127844	/nfs/dbraw/zinc/12/78/44/189127844.db2.gz	XNXQZDXMRZFBPL-JTQLQIEISA-N	1	0	297.196	1.799	50	0		CDAARO
C[C@H](Cn1cccn1)C(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1C	ZINC000248085696	361261614	/nfs/dbraw/zinc/26/16/14/361261614.db2.gz	BGJZJDRRCQDOFD-RBSFLKMASA-N	1	0	290.411	1.604	50	0		CDAARO
CC[NH+](CC)CCCN1CCOCC2(CCOCC2)C1	ZINC000191824372	361331401	/nfs/dbraw/zinc/33/14/01/361331401.db2.gz	ITACVTQUNWPJPK-UHFFFAOYSA-N	1	0	284.444	1.847	50	0		CDAARO
Cn1c(SC[C@@H]2CCCOC2)nnc1C1CC[NH2+]CC1	ZINC000426635235	361339824	/nfs/dbraw/zinc/33/98/24/361339824.db2.gz	DIEUOFSLDXOOBI-LLVKDONJSA-N	1	0	296.440	1.801	50	0		CDAARO
O=S(=O)(NC1CC[NH2+]CC1)c1ccc(F)c(F)c1F	ZINC000036286278	361425368	/nfs/dbraw/zinc/42/53/68/361425368.db2.gz	BYDUTDYHHLEUSU-UHFFFAOYSA-N	1	0	294.298	1.134	50	0		CDAARO
COc1ccc2c3c1O[C@@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)[N@@H+](C)CC[C@]314	ZINC000000490120	361448427	/nfs/dbraw/zinc/44/84/27/361448427.db2.gz	OROGSEYTTFOCAN-OTIOCJJCSA-N	1	0	299.370	1.501	50	0	in-vitro	CDAARO
C[C@H]([NH2+][C@@H]1CCCN(c2ccn(C)n2)C1=O)[C@H]1CCCO1	ZINC000183781882	189367438	/nfs/dbraw/zinc/36/74/38/189367438.db2.gz	PKDVEXAPQXECKH-YNEHKIRRSA-N	1	0	292.383	1.073	50	0		CDAARO
COc1ccccc1[C@@H]1CCCN1C(=O)[C@H]1C[NH2+]CCO1	ZINC000187656361	189472534	/nfs/dbraw/zinc/47/25/34/189472534.db2.gz	OHOPGQOATITGTK-DZGCQCFKSA-N	1	0	290.363	1.347	50	0		CDAARO
CC[N@H+](C)C[C@@]1(O)CCCN(Cc2ccccc2F)C1=O	ZINC000012589772	370720761	/nfs/dbraw/zinc/72/07/61/370720761.db2.gz	KDMJZPDYCJXFMZ-INIZCTEOSA-N	1	0	294.370	1.631	50	0		CDAARO
Nc1cc(N)[nH+]c(SCCOc2ccccc2F)n1	ZINC000002138896	364522288	/nfs/dbraw/zinc/52/22/88/364522288.db2.gz	XMRJVHFUISUHAM-UHFFFAOYSA-N	1	0	280.328	1.951	50	0		CDAARO
C[C@H](Cc1ccccc1)C[N@H+](C)[C@H]1CCS(=O)(=O)C1	ZINC000249392946	364649686	/nfs/dbraw/zinc/64/96/86/364649686.db2.gz	AMHRAJYPBBKZIT-HIFRSBDPSA-N	1	0	281.421	1.984	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)NC(C)(C)C[NH+](C)C	ZINC000457228520	365292062	/nfs/dbraw/zinc/29/20/62/365292062.db2.gz	XLIDGTMYJOAEIS-UHFFFAOYSA-N	1	0	252.362	1.025	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@H]1[NH2+]Cc1c[nH]nc1C	ZINC000089948803	366977750	/nfs/dbraw/zinc/97/77/50/366977750.db2.gz	CFWLSPBMPBTRQR-TZMCWYRMSA-N	1	0	264.373	1.455	50	0		CDAARO
O=C(NCc1cc[nH]n1)N1CCCC[C@H]([NH+]2CCCC2)C1	ZINC000095953307	284004282	/nfs/dbraw/zinc/00/42/82/284004282.db2.gz	UILJVYNHQLWKLI-AWEZNQCLSA-N	1	0	291.399	1.570	50	0		CDAARO
O=C([C@H]1CCOC1)N1CCC[C@H]1C[NH+]1CCCC1	ZINC000066943829	296125158	/nfs/dbraw/zinc/12/51/58/296125158.db2.gz	GARQBOVUXTXDBF-STQMWFEESA-N	1	0	252.358	1.110	50	0		CDAARO
Cc1ccc2nc(C[NH+]3CCCCC3)cc(=O)n2c1	ZINC000001651029	369136009	/nfs/dbraw/zinc/13/60/09/369136009.db2.gz	ILGQMUKEXZUNBU-UHFFFAOYSA-N	1	0	257.337	1.989	50	0		CDAARO
C[C@@H]1CN(C(=O)N[C@@H]2CC[N@H+](CC3CCCC3)C2)CCO1	ZINC000076088314	369492831	/nfs/dbraw/zinc/49/28/31/369492831.db2.gz	DBSHYGAXSQOWOI-UKRRQHHQSA-N	1	0	295.427	1.681	50	0		CDAARO
Cc1nn[nH]c1C(=O)NCC1CC[NH+](C2CCCC2)CC1	ZINC000299757449	372745307	/nfs/dbraw/zinc/74/53/07/372745307.db2.gz	HNNSILJOBTYSNY-UHFFFAOYSA-N	1	0	291.399	1.498	50	0		CDAARO
CSCCC[N@@H+]1CC[C@@H](Nc2ncccn2)[C@H](O)C1	ZINC000299768894	372750749	/nfs/dbraw/zinc/75/07/49/372750749.db2.gz	QVVNUOROTJIEJB-VXGBXAGGSA-N	1	0	282.413	1.077	50	0		CDAARO
O=C(N[C@H]1CCC[N@@H+](C2CCCC2)C1)c1cnc[nH]1	ZINC000299774521	372753042	/nfs/dbraw/zinc/75/30/42/372753042.db2.gz	DPPKNMFXJNMLOF-NSHDSACASA-N	1	0	262.357	1.547	50	0		CDAARO
CCc1ocnc1C(=O)N[C@H]1C[N@@H+](C(C)C)C[C@@H]1OC	ZINC000299787554	372762561	/nfs/dbraw/zinc/76/25/61/372762561.db2.gz	NGCJOTGYMRRGJT-JQWIXIFHSA-N	1	0	281.356	1.074	50	0		CDAARO
CN(Cc1ccccc1Cl)C(=O)[C@H]1C[C@H](O)C[NH2+]1	ZINC000037798676	373118742	/nfs/dbraw/zinc/11/87/42/373118742.db2.gz	DHTAFAAUTDCRCT-CMPLNLGQSA-N	1	0	268.744	1.021	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@@H]1C[N@@H+](C)C[C@@H]1C	ZINC000076058262	541886577	/nfs/dbraw/zinc/88/65/77/541886577.db2.gz	FKGJHZJSEDWKHW-CMPLNLGQSA-N	1	0	286.372	1.363	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)Cn1cc(C)cn1	ZINC000253601379	373938448	/nfs/dbraw/zinc/93/84/48/373938448.db2.gz	QVVFUQDRWQXYRW-LSDHHAIUSA-N	1	0	290.411	1.667	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCN(C(=O)[C@H](C)Oc2cccnc2)C1	ZINC000247116534	189936538	/nfs/dbraw/zinc/93/65/38/189936538.db2.gz	LYTVFLHLPODGPA-RWMBFGLXSA-N	1	0	277.368	1.435	50	0		CDAARO
O=C(NCC[NH+]1CCC(O)CC1)Nc1cccc(Cl)c1	ZINC000206610208	374179382	/nfs/dbraw/zinc/17/93/82/374179382.db2.gz	WJYGCKGJNFDQKW-UHFFFAOYSA-N	1	0	297.786	1.918	50	0		CDAARO
Cc1cccc(S(=O)(=O)N2CCC[C@@H]([C@@H](C)[NH3+])C2)c1	ZINC000111713084	374201579	/nfs/dbraw/zinc/20/15/79/374201579.db2.gz	NUQJHVBUEBXYOM-CHWSQXEVSA-N	1	0	282.409	1.743	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]C[C@H](Cc2cnn(C)c2)C(N)=O)[C@H](C)C1	ZINC000108334309	412824076	/nfs/dbraw/zinc/82/40/76/412824076.db2.gz	VTRNWUXGEIXWOT-UXOAXIEHSA-N	1	0	292.427	1.478	50	0		CDAARO
COC(=O)C[C@H]1CSCC[N@@H+]1CCc1ccccn1	ZINC000095417555	374920437	/nfs/dbraw/zinc/92/04/37/374920437.db2.gz	ZJOIQDAIINEUJM-ZDUSSCGKSA-N	1	0	280.393	1.605	50	0		CDAARO
CC[C@H](O)C[NH+]1CCN(Cc2ccc(O)c(OC)c2)CC1	ZINC000095467801	374963681	/nfs/dbraw/zinc/96/36/81/374963681.db2.gz	WVIZXYTVJZJFCI-AWEZNQCLSA-N	1	0	294.395	1.289	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCN(C(=O)COc2cccc(F)c2)C1	ZINC000299740343	375202478	/nfs/dbraw/zinc/20/24/78/375202478.db2.gz	YQPZBWGYRSSJEO-NEPJUHHUSA-N	1	0	280.343	1.790	50	0		CDAARO
CN(C)S(=O)(=O)c1cccc(C[NH2+]C2CCCC2)c1	ZINC000003338995	375653981	/nfs/dbraw/zinc/65/39/81/375653981.db2.gz	BPKFWGKHHSXYLN-UHFFFAOYSA-N	1	0	282.409	1.969	50	0		CDAARO
O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)C1CC1	ZINC000032247882	375922137	/nfs/dbraw/zinc/92/21/37/375922137.db2.gz	HEBDRGFKYPHGHS-HNNXBMFYSA-N	1	0	274.364	1.414	50	0		CDAARO
CC1(C)NC(=O)N(CC[N@@H+]2CC[C@H]3CCCC[C@H]3C2)C1=O	ZINC000241795468	376019270	/nfs/dbraw/zinc/01/92/70/376019270.db2.gz	RZLCTGGONMSZQL-OLZOCXBDSA-N	1	0	293.411	1.829	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CCNC(=O)N[C@H](CCO)C1CC1	ZINC000242302264	376021766	/nfs/dbraw/zinc/02/17/66/376021766.db2.gz	YQWYKBRBUCCBAU-TZMCWYRMSA-N	1	0	283.416	1.321	50	0		CDAARO
CCCn1cc(CN2CCN3CC[N@H+](C)C[C@H]3C2)c(C)n1	ZINC000244584343	376033235	/nfs/dbraw/zinc/03/32/35/376033235.db2.gz	CXNUIIAGFYRCHX-INIZCTEOSA-N	1	0	291.443	1.033	50	0		CDAARO
c1cc(C[N@@H+]2CCS[C@H]3COCC[C@H]32)ccn1	ZINC000246245409	376581037	/nfs/dbraw/zinc/58/10/37/376581037.db2.gz	HDVUHCFWUIJPGR-OLZOCXBDSA-N	1	0	250.367	1.788	50	0		CDAARO
CCCS(=O)(=O)CCN(C)[C@H]1CC[N@H+](CC)C[C@H]1C	ZINC000246477363	376875551	/nfs/dbraw/zinc/87/55/51/376875551.db2.gz	GHMCJYAQJCAXNM-KGLIPLIRSA-N	1	0	290.473	1.473	50	0		CDAARO
Cc1cc(N2CCC(CNS(C)(=O)=O)CC2)cc[nH+]1	ZINC000245171660	377890142	/nfs/dbraw/zinc/89/01/42/377890142.db2.gz	XOSASOXZSAWFDI-UHFFFAOYSA-N	1	0	283.397	1.156	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]C[C@H]1C[C@@H](O)CN1Cc1ccccc1	ZINC000245338904	378071510	/nfs/dbraw/zinc/07/15/10/378071510.db2.gz	PFCSRQKJBGGIGP-SVGFKBNWSA-N	1	0	290.407	1.389	50	0		CDAARO
COc1ccc(OC)c2[nH]c(C(=O)N3CC[NH2+]CC3)cc21	ZINC000041127999	379337400	/nfs/dbraw/zinc/33/74/00/379337400.db2.gz	PKXYHFDYTWEWQK-UHFFFAOYSA-N	1	0	289.335	1.231	50	0		CDAARO
C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCS(=O)(=O)C1	ZINC000095419611	184975306	/nfs/dbraw/zinc/97/53/06/184975306.db2.gz	MYZKRBHRNFAQKZ-QWRGUYRKSA-N	1	0	279.471	1.931	50	0		CDAARO
CC[C@@H]([NH2+]C[C@@H]1CC=CCC1)C(=O)N1CCOCC1	ZINC000095434098	184983425	/nfs/dbraw/zinc/98/34/25/184983425.db2.gz	PMHNHCZOSREWDT-ZIAGYGMSSA-N	1	0	266.385	1.570	50	0		CDAARO
CC1=C[C@H](C)[C@@H]2C(=O)N(CCC[NH+](C)C)C(=O)[C@@H]2C1	ZINC000101788752	390459580	/nfs/dbraw/zinc/45/95/80/390459580.db2.gz	OLVIZFKZLFJCGX-XQQFMLRXSA-N	1	0	264.369	1.525	50	0		CDAARO
Cc1ccsc1CNC(=O)C[N@@H+]1CCC[C@H]1CCCO	ZINC000096424256	390516166	/nfs/dbraw/zinc/51/61/66/390516166.db2.gz	ODYGTSNNIUTIEA-ZDUSSCGKSA-N	1	0	296.436	1.910	50	0		CDAARO
C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)[C@H]2C[NH2+]CCO2)C1	ZINC000187819050	390852194	/nfs/dbraw/zinc/85/21/94/390852194.db2.gz	OBMWJTAAOCXTGY-BYCMXARLSA-N	1	0	292.354	1.724	50	0		CDAARO
Nc1ncccc1C[NH+]1CCC(O)(c2cccnc2)CC1	ZINC000215355101	390993370	/nfs/dbraw/zinc/99/33/70/390993370.db2.gz	FHXWDVGKRWMMEK-UHFFFAOYSA-N	1	0	284.363	1.542	50	0		CDAARO
CC(C)[C@H](CNC(=O)OC(C)(C)C)[NH+]1CCN(C)CC1	ZINC000083502356	391482307	/nfs/dbraw/zinc/48/23/07/391482307.db2.gz	HJXQAKDESBIICR-ZDUSSCGKSA-N	1	0	285.432	1.783	50	0		CDAARO
CN(C(=O)Nc1cccc2n[nH]cc21)[C@@H]1CC[N@H+](C)C1	ZINC000299802897	391721564	/nfs/dbraw/zinc/72/15/64/391721564.db2.gz	XUWTYLVIMTUUHR-SNVBAGLBSA-N	1	0	273.340	1.731	50	0		CDAARO
C[C@H]1COCC[C@@H]1[NH2+]Cc1ccc(S(C)(=O)=O)cc1	ZINC000191752796	391648934	/nfs/dbraw/zinc/64/89/34/391648934.db2.gz	MDAWBTPEJDIOLW-FZMZJTMJSA-N	1	0	283.393	1.605	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+](C[C@H]2COCCO2)C1	ZINC000431010252	391706274	/nfs/dbraw/zinc/70/62/74/391706274.db2.gz	NFVAZVCQMPNXPU-ZNMIVQPWSA-N	1	0	298.427	1.419	50	0		CDAARO
Nc1ncc(-c2cc(F)cc3c2O[C@@H](C[NH3+])C3)cn1	ZINC000067714839	391963014	/nfs/dbraw/zinc/96/30/14/391963014.db2.gz	XTBXBBHKPGKVQT-SNVBAGLBSA-N	1	0	260.272	1.127	50	0		CDAARO
COc1cc(C)ccc1CNC(=O)C1(C[NH3+])CCOCC1	ZINC000261930841	131178183	/nfs/dbraw/zinc/17/81/83/131178183.db2.gz	LPXZLYMAQZLSBZ-UHFFFAOYSA-N	1	0	292.379	1.375	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NCCc1cnn(C)c1	ZINC000096421668	393185335	/nfs/dbraw/zinc/18/53/35/393185335.db2.gz	QAHDQDNCKFEFCG-CQSZACIVSA-N	1	0	278.400	1.342	50	0		CDAARO
CC(=O)N(Cc1noc(C)n1)[C@H]1CC[N@@H+](C(C)C)C1	ZINC000084281105	483270432	/nfs/dbraw/zinc/27/04/32/483270432.db2.gz	XZADMPFIXCXFTJ-LBPRGKRZSA-N	1	0	266.345	1.209	50	0		CDAARO
C[C@H](Cn1cccn1)[NH2+]CC1(N(C)C)CCCC1	ZINC000347211546	153449401	/nfs/dbraw/zinc/44/94/01/153449401.db2.gz	SSYGZBAZWSYPFI-CYBMUJFWSA-N	1	0	250.390	1.736	50	0		CDAARO
C[C@@H]1C[C@@H]1N1C[C@@H](Nc2ncnc(N)c2Cl)CC1=O	ZINC000372967595	160161629	/nfs/dbraw/zinc/16/16/29/160161629.db2.gz	OASGNRZBMIGLEO-CSMHCCOUSA-N	1	0	281.747	1.133	50	0		CDAARO
CC[NH2+]Cc1cc(Cl)c(OCC(N)=O)c(OC)c1	ZINC000006497321	170207209	/nfs/dbraw/zinc/20/72/09/170207209.db2.gz	BIQPLYYGYLPXCU-UHFFFAOYSA-N	1	0	272.732	1.322	50	0		CDAARO
Cc1ccccc1C[N@@H+](C)[C@@H](C)C(=O)N1CCNC1=O	ZINC000007681056	170297404	/nfs/dbraw/zinc/29/74/04/170297404.db2.gz	VFFYFBNAJYXQBW-LBPRGKRZSA-N	1	0	275.352	1.367	50	0		CDAARO
C[NH+](C)Cc1ccccc1CNC(=O)c1ccc[nH]c1=O	ZINC000009917569	170390864	/nfs/dbraw/zinc/39/08/64/170390864.db2.gz	UNMBZOABBVWJKE-UHFFFAOYSA-N	1	0	285.347	1.779	50	0		CDAARO
OCC[NH+]1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000019882167	170908430	/nfs/dbraw/zinc/90/84/30/170908430.db2.gz	DQLSFUSWLGQZGP-UHFFFAOYSA-N	1	0	256.296	1.075	50	0		CDAARO
Cn1cc(C[NH2+]C[C@H]2COc3ccccc3O2)cn1	ZINC000020138120	171025213	/nfs/dbraw/zinc/02/52/13/171025213.db2.gz	MZQUKFAIUVMYSM-LBPRGKRZSA-N	1	0	259.309	1.350	50	0		CDAARO
COc1cc(CN2CCO[C@H](CC[NH+](C)C)C2)ccc1F	ZINC000020449506	171207494	/nfs/dbraw/zinc/20/74/94/171207494.db2.gz	WTUQHZBZUUWPKF-CQSZACIVSA-N	1	0	296.386	1.987	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)N[C@H](C)c2ccccc2)CC1	ZINC000020595110	171263995	/nfs/dbraw/zinc/26/39/95/171263995.db2.gz	SHMPXRSYAAWEMI-OAHLLOKOSA-N	1	0	289.423	1.891	50	0		CDAARO
[NH2+]=C(NCc1ccccc1)NS(=O)(=O)c1cccs1	ZINC000020857122	171276475	/nfs/dbraw/zinc/27/64/75/171276475.db2.gz	MPULLJTYPZEXBP-UHFFFAOYSA-N	1	0	295.389	1.751	50	0		CDAARO
CCOC(=O)C1=C(C[NH+]2C[C@H](C)C[C@@H](C)C2)NC(=O)NC1	ZINC000025785348	171465784	/nfs/dbraw/zinc/46/57/84/171465784.db2.gz	GJEPAFXAYMWDHL-GHMZBOCLSA-N	1	0	295.383	1.094	50	0		CDAARO
COc1cccc([C@@H]2C[C@@H]2C(=O)N2CC[NH2+]CC2)c1	ZINC000038478365	174141972	/nfs/dbraw/zinc/14/19/72/174141972.db2.gz	RYLRSJOYKZNHBE-KBPBESRZSA-N	1	0	260.337	1.231	50	0		CDAARO
C[NH2+]CC(=O)N[C@@H](C)c1cnn(-c2ccccc2OC)c1	ZINC000071681520	176245333	/nfs/dbraw/zinc/24/53/33/176245333.db2.gz	DWQONKLKBNPIRA-NSHDSACASA-N	1	0	288.351	1.278	50	0		CDAARO
C/C=C/Cc1nnc(C(=O)N2CC[N@@H+]3CCC[C@@H]3C2)o1	ZINC000071715217	176249539	/nfs/dbraw/zinc/24/95/39/176249539.db2.gz	LTKYDKBRQOILFR-KXMPLOMGSA-N	1	0	276.340	1.108	50	0		CDAARO
CC(C)[C@H]1CN(CC(=O)N(C)C)CCC[N@@H+]1CC1CC1	ZINC000071730516	176256162	/nfs/dbraw/zinc/25/61/62/176256162.db2.gz	HZZZADFOWORUDQ-OAHLLOKOSA-N	1	0	281.444	1.517	50	0		CDAARO
CC(=O)NCc1ccc(OC2CC[NH+](C)CC2)cc1	ZINC000072117805	176319343	/nfs/dbraw/zinc/31/93/43/176319343.db2.gz	KNAKTOOJOZFZDV-UHFFFAOYSA-N	1	0	262.353	1.796	50	0		CDAARO
OCCOCC[N@@H+]1CCC[C@H]1c1ccc(F)cc1	ZINC000072153020	176328182	/nfs/dbraw/zinc/32/81/82/176328182.db2.gz	GBJTWVSUODMEFK-AWEZNQCLSA-N	1	0	253.317	1.972	50	0		CDAARO
NC(=O)CC[N@@H+]1CCC[C@@H](Nc2ccc(F)cc2)C1	ZINC000072163023	176330651	/nfs/dbraw/zinc/33/06/51/176330651.db2.gz	JBKYCQRUHWQNRM-CYBMUJFWSA-N	1	0	265.332	1.577	50	0		CDAARO
[NH3+][C@H]1CCN(c2ccc(C(=O)Nc3ccccc3)cn2)C1	ZINC000072332507	176370537	/nfs/dbraw/zinc/37/05/37/176370537.db2.gz	CDGVOCAZKUHHES-ZDUSSCGKSA-N	1	0	282.347	1.871	50	0		CDAARO
Cc1nc(CN2CC[NH+](C[C@@H]3CCOC3)CC2)cs1	ZINC000076877304	177125927	/nfs/dbraw/zinc/12/59/27/177125927.db2.gz	ONKVOMAFVZCTKR-ZDUSSCGKSA-N	1	0	281.425	1.606	50	0		CDAARO
Cc1n[nH]c(CCC(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1C	ZINC000077300837	177250553	/nfs/dbraw/zinc/25/05/53/177250553.db2.gz	KNQWOOJGQXIZGL-GXTWGEPZSA-N	1	0	276.384	1.122	50	0		CDAARO
CCOC(=O)c1coc(N2CC([N@@H+]3CCCC[C@@H]3C)C2)n1	ZINC000077353578	177255664	/nfs/dbraw/zinc/25/56/64/177255664.db2.gz	FMCZUGAKCWJJGV-NSHDSACASA-N	1	0	293.367	1.914	50	0		CDAARO
CC(=O)N(Cc1ncc(C(C)C)o1)[C@@H]1CC[NH2+]C1	ZINC000078878692	177399546	/nfs/dbraw/zinc/39/95/46/177399546.db2.gz	BBPCZOMOPFDMKH-LLVKDONJSA-N	1	0	251.330	1.508	50	0		CDAARO
[NH3+]CCOc1ccc(F)cc1C(=O)N[C@H]1CC[C@H](O)CC1	ZINC000426739713	274946264	/nfs/dbraw/zinc/94/62/64/274946264.db2.gz	JIGNZMUGSMITIB-HAQNSBGRSA-N	1	0	296.342	1.197	50	0		CDAARO
CC(C)(C)OC(=O)N1C[C@H]2CCCCN2C[C@@H]1C[NH3+]	ZINC000238853196	277195899	/nfs/dbraw/zinc/19/58/99/277195899.db2.gz	IPIMDODCXFTYQT-NEPJUHHUSA-N	1	0	269.389	1.419	50	0		CDAARO
C[NH2+][C@H]1c2cc(Br)ccc2OC[C@H]1CO	ZINC000003912788	277301317	/nfs/dbraw/zinc/30/13/17/277301317.db2.gz	GRTHRMQDCVCQBA-RDDDGLTNSA-N	1	0	272.142	1.711	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H](O)C[N@@H+]1C[C@@H]1CCc2ccccc2C1	ZINC000195578098	277368274	/nfs/dbraw/zinc/36/82/74/277368274.db2.gz	CJYXIPGPCYXWNO-WQVCFCJDSA-N	1	0	289.375	1.400	50	0		CDAARO
COC[C@H](C)[NH2+][C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000095968485	277587332	/nfs/dbraw/zinc/58/73/32/277587332.db2.gz	XQHITRLHDYTTOL-HOTGVXAUSA-N	1	0	291.439	1.822	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N2CCC[C@H](O)C2)c1C	ZINC000032519454	279087678	/nfs/dbraw/zinc/08/76/78/279087678.db2.gz	YGBLQPCDHGFEOO-NSHDSACASA-N	1	0	250.346	1.121	50	0		CDAARO
Cc1ccc2[nH]c([C@@H]3CCC[N@@H+]([C@H]4CCNC4=O)C3)nc2c1	ZINC000245944920	281025894	/nfs/dbraw/zinc/02/58/94/281025894.db2.gz	BGRAIOFQXOHUIS-DOMZBBRYSA-N	1	0	298.390	1.939	50	0		CDAARO
CC1CCC(C[N@@H+]2C[C@H]3OCCN(C)[C@@H]3C2)CC1	ZINC000093642450	289059534	/nfs/dbraw/zinc/05/95/34/289059534.db2.gz	JRBOKPHKHFWPRU-NEXFUWMNSA-N	1	0	252.402	1.828	50	0		CDAARO
CC(C)Cc1cc(CN2CCC3(CC2)C[NH2+]CCO3)no1	ZINC000534580337	328311588	/nfs/dbraw/zinc/31/15/88/328311588.db2.gz	ALMANMNSSFQJMC-UHFFFAOYSA-N	1	0	293.411	1.828	50	0		CDAARO
C[NH+]1CCC(CCC(=O)NC2(CO)CCCCC2)CC1	ZINC000534589451	328317326	/nfs/dbraw/zinc/31/73/26/328317326.db2.gz	BUWUXEKKMQLRKX-UHFFFAOYSA-N	1	0	282.428	1.920	50	0		CDAARO
C[NH+](C)CC[C@@H](NC(=O)c1cnc[nH]1)c1ccccc1	ZINC000534643580	328329322	/nfs/dbraw/zinc/32/93/22/328329322.db2.gz	FJYZWXMLVQVHFS-CYBMUJFWSA-N	1	0	272.352	1.833	50	0		CDAARO
O=C(NCCSCc1ccccc1)[C@@H]1C=CC[NH2+]1	ZINC000534645442	328330613	/nfs/dbraw/zinc/33/06/13/328330613.db2.gz	QKVNMJDTZCRGGF-ZDUSSCGKSA-N	1	0	262.378	1.564	50	0		CDAARO
CC(=O)NC(C)(C)C[C@H](C)[NH2+]Cc1cscn1	ZINC000534645908	328331204	/nfs/dbraw/zinc/33/12/04/328331204.db2.gz	QLMQVZREQWMBKI-VIFPVBQESA-N	1	0	255.387	1.926	50	0		CDAARO
COCC1(NC(=O)[C@@H]2CC23CC[NH2+]CC3)CCCC1	ZINC000534658763	328341279	/nfs/dbraw/zinc/34/12/79/328341279.db2.gz	XGLZRFNPVBICSL-LBPRGKRZSA-N	1	0	266.385	1.452	50	0		CDAARO
C[NH+]1CCN(c2ccc(C(=O)NCc3cc[nH]n3)cc2)CC1	ZINC000534664623	328344746	/nfs/dbraw/zinc/34/47/46/328344746.db2.gz	AROXYCFMJNHRET-UHFFFAOYSA-N	1	0	299.378	1.092	50	0		CDAARO
CC(C)C[C@@H]([NH2+]C1CCOCC1)c1ncnn1C	ZINC000534674478	328348993	/nfs/dbraw/zinc/34/89/93/328348993.db2.gz	SEHGPJCYQDBBOJ-GFCCVEGCSA-N	1	0	252.362	1.671	50	0		CDAARO
Cc1ccn2nc(C(=O)N3CCC[C@H]([NH3+])C3)cc2c1	ZINC000534662456	328350313	/nfs/dbraw/zinc/35/03/13/328350313.db2.gz	BRZDWAPSISNBHG-NSHDSACASA-N	1	0	258.325	1.206	50	0		CDAARO
CNC(=O)c1ccc(NC(=O)[C@@H]([NH3+])CCSC)c(C)c1	ZINC000040462254	1160545226	/nfs/dbraw/zinc/54/52/26/1160545226.db2.gz	YVQRDFYQBPMCIG-NSHDSACASA-N	1	0	295.408	1.374	50	0		CDAARO
C1CC1[C@@H]1C[N@@H+](C2CSCCSC2)CCO1	ZINC000670451123	483017323	/nfs/dbraw/zinc/01/73/23/483017323.db2.gz	XWRHATNGOZRBOJ-LBPRGKRZSA-N	1	0	259.440	1.946	50	0		CDAARO
CN(C(=O)C[N@H+](C)C[C@H]1CC(=O)N(C)C1)C1CCCCC1	ZINC000670465120	483055341	/nfs/dbraw/zinc/05/53/41/483055341.db2.gz	VYKVEFBPNVTUOV-CYBMUJFWSA-N	1	0	295.427	1.188	50	0		CDAARO
COc1cccc(CNC(=O)[C@H](C)[NH+]2CCCCCC2)n1	ZINC000084001197	483234361	/nfs/dbraw/zinc/23/43/61/483234361.db2.gz	YMUNUQFOFCRGAE-ZDUSSCGKSA-N	1	0	291.395	1.971	50	0		CDAARO
C[C@@H]1C[C@H]([NH3+])CCN1C(=O)Cc1cccc(F)c1	ZINC000124794303	533898018	/nfs/dbraw/zinc/89/80/18/533898018.db2.gz	KUPIMUMTGLKBIB-ZWNOBZJWSA-N	1	0	250.317	1.706	50	0		CDAARO
O=C(NC[C@@H](O)c1ccccc1Cl)[C@@H]1CC[NH2+]C1	ZINC000299740131	526488646	/nfs/dbraw/zinc/48/86/46/526488646.db2.gz	WDSJZOBWBABXAG-BXKDBHETSA-N	1	0	268.744	1.099	50	0		CDAARO
CC(C)Oc1cccc([C@H](O)CNC(=O)[C@H](C)[NH+](C)C)c1	ZINC000096475383	528244171	/nfs/dbraw/zinc/24/41/71/528244171.db2.gz	BPGFBNBJWDAVBZ-SWLSCSKDSA-N	1	0	294.395	1.574	50	0		CDAARO
CCC(CC)C[N@@H+]1CCC[C@H](NS(C)(=O)=O)C1	ZINC000096487699	528753523	/nfs/dbraw/zinc/75/35/23/528753523.db2.gz	KATKJAXINVYPMO-LBPRGKRZSA-N	1	0	262.419	1.436	50	0		CDAARO
CC[N@@H+]1CCCN(c2ccc3nnc(C4CC4)n3n2)CC1	ZINC000096453675	529045653	/nfs/dbraw/zinc/04/56/53/529045653.db2.gz	WBSJBKWBDUISID-UHFFFAOYSA-N	1	0	286.383	1.534	50	0		CDAARO
C[C@H]1CC[C@H](c2ccc(NS(C)(=O)=O)cc2)C[NH2+]1	ZINC000757216176	577036137	/nfs/dbraw/zinc/03/61/37/577036137.db2.gz	YFZMMQOOIVEXHT-JQWIXIFHSA-N	1	0	268.382	1.914	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@](O)([C@H]([NH3+])c2ccns2)C1	ZINC000958528252	613980723	/nfs/dbraw/zinc/98/07/23/613980723.db2.gz	LLILTSKFDXHRON-ZWNOBZJWSA-N	1	0	299.396	1.515	50	0		CDAARO
CC(=O)c1cc(C[NH2+]CCCc2csc(N)n2)n(C)c1	ZINC000952981893	614248794	/nfs/dbraw/zinc/24/87/94/614248794.db2.gz	OJIPIGDSAWEVGY-UHFFFAOYSA-N	1	0	292.408	1.989	50	0		CDAARO
Cc1cc(OC(F)F)c(C(=O)NOC[C@H](C)[NH3+])s1	ZINC000888094406	617754266	/nfs/dbraw/zinc/75/42/66/617754266.db2.gz	XFLVBDRFENNPTH-YFKPBYRVSA-N	1	0	280.296	1.667	50	0		CDAARO
COCCCCN(C)C(=O)[C@@H]1CC[C@H]2C[C@H](C)C[N@@H+]2C1	ZINC000952995802	616862545	/nfs/dbraw/zinc/86/25/45/616862545.db2.gz	ZFNHYCKCPNNLIC-ZNMIVQPWSA-N	1	0	282.428	1.992	50	0		CDAARO
COCc1nccc(N2CC[C@H]([NH+](C)C)[C@H]2C)n1	ZINC000928995732	620830100	/nfs/dbraw/zinc/83/01/00/620830100.db2.gz	IYNHGTIAPYEZJA-MNOVXSKESA-N	1	0	250.346	1.152	50	0		CDAARO
Cc1cccc(C)c1NC(=O)N1C[C@H]2C[NH2+]C[C@@]2(CO)C1	ZINC001772702049	1159436930	/nfs/dbraw/zinc/43/69/30/1159436930.db2.gz	QHDSSKOELDLMFT-CJNGLKHVSA-N	1	0	289.379	1.349	50	0		CDAARO
CCc1ccccc1OCCN1C[C@@H]2C[NH2+]C[C@]2(CO)C1	ZINC001772705223	1159439990	/nfs/dbraw/zinc/43/99/90/1159439990.db2.gz	GAWAPFNLOXJMJS-DOTOQJQBSA-N	1	0	290.407	1.142	50	0		CDAARO
Cn1ccnc1CC[N@@H+]1CCCN(C(=O)C2(C)CC2)CC1	ZINC001772710889	1159445039	/nfs/dbraw/zinc/44/50/39/1159445039.db2.gz	XDEBDFVSVIPXLU-UHFFFAOYSA-N	1	0	290.411	1.297	50	0		CDAARO
CCN1CCC([NH2+][C@H]2COC[C@H]2Cc2ccncc2)CC1	ZINC001704333699	1177691776	/nfs/dbraw/zinc/69/17/76/1177691776.db2.gz	DXIJKUGESOPUER-WBVHZDCISA-N	1	0	289.423	1.713	50	0		CDAARO
COc1ccc(C[N@H+](C)[C@H]2C[C@H]3CNC(=O)C[C@H]3C2)cn1	ZINC001704345047	1177694824	/nfs/dbraw/zinc/69/48/24/1177694824.db2.gz	URGHMJLLCJNFLY-HZSPNIEDSA-N	1	0	289.379	1.437	50	0		CDAARO
Nc1nc2c(c(NCC3=CCCCC3)n1)CC[NH2+]CC2	ZINC000072478947	833315386	/nfs/dbraw/zinc/31/53/86/833315386.db2.gz	KRYYOSHJISGIIJ-UHFFFAOYSA-N	1	0	273.384	1.659	50	0		CDAARO
CC[NH+](CC)CCNc1cc([C@H]2CCOC2)ncn1	ZINC000426523753	833352165	/nfs/dbraw/zinc/35/21/65/833352165.db2.gz	XOXHEWISTOWSLK-LBPRGKRZSA-N	1	0	264.373	1.156	50	0		CDAARO
C[NH+](C)CCOC(=O)c1cc2ccccc2oc1=O	ZINC000022014715	829341872	/nfs/dbraw/zinc/34/18/72/829341872.db2.gz	RYPCZPGOOPCWFI-UHFFFAOYSA-N	1	0	261.277	1.511	50	0		CDAARO
Cc1cccc(CN2CCC[C@@](O)(C[NH+](C)C)C2=O)c1	ZINC000014981610	829828893	/nfs/dbraw/zinc/82/88/93/829828893.db2.gz	HDLPWILQYZLWQD-MRXNPFEDSA-N	1	0	276.380	1.410	50	0		CDAARO
Cc1cc(OCCOCCNCC[NH3+])cc(C)c1Cl	ZINC000022034170	829844010	/nfs/dbraw/zinc/84/40/10/829844010.db2.gz	IGFBTJUQDDPBHJ-UHFFFAOYSA-N	1	0	286.803	1.901	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)C2CCCC2)CC1	ZINC000038582769	832240193	/nfs/dbraw/zinc/24/01/93/832240193.db2.gz	JXTNCJUSIALOPO-UHFFFAOYSA-N	1	0	268.401	1.651	50	0		CDAARO
C[N@@H+]1CCCC[C@H](CNC(=O)NCc2ncccn2)C1	ZINC000858619649	832302940	/nfs/dbraw/zinc/30/29/40/832302940.db2.gz	PBCDWJAOBHLUHR-GFCCVEGCSA-N	1	0	277.372	1.008	50	0		CDAARO
Cc1cc(C(=O)N2CC[NH2+]C(C)(C)C2)c2cnn(C)c2n1	ZINC000177938378	832483008	/nfs/dbraw/zinc/48/30/08/832483008.db2.gz	RYAFOYHMAZJXSO-UHFFFAOYSA-N	1	0	287.367	1.101	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CNCc2ccc(Cl)o2)C1	ZINC000068368136	833881003	/nfs/dbraw/zinc/88/10/03/833881003.db2.gz	DPOYDWRAZUDUFK-LLVKDONJSA-N	1	0	272.776	1.991	50	0		CDAARO
Cc1nc(CO[C@@H]2CCC[N@@H+](C3CCC3)C2)no1	ZINC000675017364	899870905	/nfs/dbraw/zinc/87/09/05/899870905.db2.gz	UUVFMXZSSPGSDC-GFCCVEGCSA-N	1	0	251.330	1.912	50	0		CDAARO
CC(C)[N@H+](C)C[C@H](C)C(=O)NCc1csc(N)n1	ZINC000820636551	925540258	/nfs/dbraw/zinc/54/02/58/925540258.db2.gz	BAYQKZGPQQAZAS-VIFPVBQESA-N	1	0	270.402	1.318	50	0		CDAARO
C[C@H](C[NH+]1CCCCC1)c1ncnn1CC(C)(C)O	ZINC000822279779	925614871	/nfs/dbraw/zinc/61/48/71/925614871.db2.gz	KMPDRUWXQCQYQB-GFCCVEGCSA-N	1	0	266.389	1.638	50	0		CDAARO
CN(C)c1nc(NCC[C@@H]2CCCC[N@@H+]2C)ncc1F	ZINC000823777747	925728501	/nfs/dbraw/zinc/72/85/01/925728501.db2.gz	NNWHMKWBUSMEDM-NSHDSACASA-N	1	0	281.379	1.968	50	0		CDAARO
COCCn1ccnc1CN1CC([N@@H+]2CCCC[C@H]2C)C1	ZINC000824466326	925823522	/nfs/dbraw/zinc/82/35/22/925823522.db2.gz	PKTLNUCXMLOJDS-CQSZACIVSA-N	1	0	292.427	1.588	50	0		CDAARO
Cc1nc(C)c(C(=O)NCCC[N@@H+]2CCCC[C@@H]2CO)o1	ZINC000828710819	926169426	/nfs/dbraw/zinc/16/94/26/926169426.db2.gz	KABLPCIIRWHFMZ-CYBMUJFWSA-N	1	0	295.383	1.258	50	0		CDAARO
CC(C)NC(=O)[C@]1(CCO)CC[N@H+](Cc2ccccc2)C1	ZINC000581811535	927203950	/nfs/dbraw/zinc/20/39/50/927203950.db2.gz	MBDWHNAEMGZMQA-KRWDZBQOSA-N	1	0	290.407	1.786	50	0		CDAARO
O=C(NCCc1ccccn1)[C@H]1CC[C@H]2CCCC[N@@H+]21	ZINC000585122386	930988785	/nfs/dbraw/zinc/98/87/85/930988785.db2.gz	ZCCFDUNEFGKILK-HUUCEWRRSA-N	1	0	273.380	1.757	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CN1CCC(c2nnc[nH]2)CC1	ZINC000243893003	937583232	/nfs/dbraw/zinc/58/32/32/937583232.db2.gz	ANJNSDVIPKNAPN-CYBMUJFWSA-N	1	0	263.389	1.468	50	0		CDAARO
Cc1ccc(C[N@H+]2C[C@@H](Cc3ccncc3)[C@H](O)C2)nc1	ZINC001529166967	969000386	/nfs/dbraw/zinc/00/03/86/969000386.db2.gz	GDERLAIGHZBUCD-NVXWUHKLSA-N	1	0	283.375	1.820	50	0		CDAARO
CCC[C@]1(CO)CN(Cc2cccnc2OC)CC[C@@H]1O	ZINC001529191681	969010684	/nfs/dbraw/zinc/01/06/84/969010684.db2.gz	BLRPLNMZINSJKF-GOEBONIOSA-N	1	0	294.395	1.436	50	0		CDAARO
Cc1cccnc1N1CC[C@H](N2CC[NH+](C)CC2)C1	ZINC001506403516	975150624	/nfs/dbraw/zinc/15/06/24/975150624.db2.gz	SPRKLPUNSKDBEO-AWEZNQCLSA-N	1	0	260.385	1.216	50	0		CDAARO
CCc1nc(N2CC[N@H+](C(C)C)[C@H](CC)C2)no1	ZINC001506416459	975155549	/nfs/dbraw/zinc/15/55/49/975155549.db2.gz	BOFRHUONMWYMCA-LLVKDONJSA-N	1	0	252.362	1.941	50	0		CDAARO
COCC(=O)Nc1ccc(NC(=O)[C@H]([NH3+])C(C)C)cc1C	ZINC001506419618	975157258	/nfs/dbraw/zinc/15/72/58/975157258.db2.gz	GSZQGTOFYDKKTK-CQSZACIVSA-N	1	0	293.367	1.502	50	0		CDAARO
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[NH2+]C[C@H]2C)c1	ZINC000124350956	187133692	/nfs/dbraw/zinc/13/36/92/187133692.db2.gz	YNGHHRANQQACSL-BYCMXARLSA-N	1	0	274.364	1.619	50	0		CDAARO
Cc1nn(C)c(C)c1C[NH2+]C[C@H]1COC2(CCOCC2)O1	ZINC000096494769	230383782	/nfs/dbraw/zinc/38/37/82/230383782.db2.gz	HSTJKKJDEZRVDQ-ZDUSSCGKSA-N	1	0	295.383	1.049	50	0		CDAARO
CC(C)[NH2+]CCN[C@H](C)c1nnnn1-c1ccccc1	ZINC000193496228	342473373	/nfs/dbraw/zinc/47/33/73/342473373.db2.gz	CRBSRHMUTRFZFE-GFCCVEGCSA-N	1	0	274.372	1.311	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@@H]([NH3+])Cc2ccccc2)CCS1	ZINC000096481277	529374364	/nfs/dbraw/zinc/37/43/64/529374364.db2.gz	CKQZODARTLASAD-KGLIPLIRSA-N	1	0	278.421	1.910	50	0		CDAARO
Cc1nccn1CC[NH2+][C@H]1CCC(=O)N(CC2CC2)CC1	ZINC000584903725	341993960	/nfs/dbraw/zinc/99/39/60/341993960.db2.gz	SUVSDVHAMXVRMQ-HNNXBMFYSA-N	1	0	290.411	1.572	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@H]2CC(=O)N(C(C)C)C2)C[C@@H]1[NH+](C)C	ZINC000107504239	398149314	/nfs/dbraw/zinc/14/93/14/398149314.db2.gz	HGQKWBCUMCHDEJ-RDBSUJKOSA-N	1	0	295.427	1.042	50	0		CDAARO
CCOCCCNC(=O)[C@H]([NH3+])Cc1ccccc1	ZINC000095920264	185031298	/nfs/dbraw/zinc/03/12/98/185031298.db2.gz	RNDUOAAKJVEZQY-CYBMUJFWSA-N	1	0	250.342	1.099	50	0		CDAARO
[NH3+][C@H](Cc1ccccc1)C(=O)NCc1ccccn1	ZINC000095920270	185032026	/nfs/dbraw/zinc/03/20/26/185032026.db2.gz	WOXOKVLQAOKFAD-CQSZACIVSA-N	1	0	255.321	1.268	50	0		CDAARO
Cc1cc(C)n(CCC(=O)N[C@H]2CC[N@@H+]3CCCC[C@H]23)n1	ZINC000095949388	185039174	/nfs/dbraw/zinc/03/91/74/185039174.db2.gz	VLKVGEYKTIZUIV-LSDHHAIUSA-N	1	0	290.411	1.633	50	0		CDAARO
C[NH2+]C[C@H](C)CNC(=O)CCc1cccc(F)c1	ZINC000095971599	185048915	/nfs/dbraw/zinc/04/89/15/185048915.db2.gz	VOZQSSBJCRQHGL-NSHDSACASA-N	1	0	252.333	1.730	50	0		CDAARO
C[C@H]([NH3+])C(=O)Nc1nc(-c2ccc(O)cc2)cs1	ZINC000095996150	185060555	/nfs/dbraw/zinc/06/05/55/185060555.db2.gz	CSHLYZGNXHLHSC-ZETCQYMHSA-N	1	0	263.322	1.801	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)CCC(=O)c1ccc(C)s1	ZINC000241383497	361752128	/nfs/dbraw/zinc/75/21/28/361752128.db2.gz	MVTZZNTZGIGHKQ-PWSUYJOCSA-N	1	0	296.392	1.122	50	0		CDAARO
CNS(=O)(=O)N1CC[NH+](CC2CCCCCC2)CC1	ZINC000242288032	361756225	/nfs/dbraw/zinc/75/62/25/361756225.db2.gz	YKNMETXGONWMQX-UHFFFAOYSA-N	1	0	289.445	1.039	50	0		CDAARO
C[C@H]1CC[N@H+](C[C@@H](O)COC(C)(C)C)CCS1	ZINC000248979593	361771077	/nfs/dbraw/zinc/77/10/77/361771077.db2.gz	FIQNDXGUDAJWIW-NWDGAFQWSA-N	1	0	261.431	1.990	50	0		CDAARO
Cc1ccc(CN2C(=[NH2+])S[C@@H]3CS(=O)(=O)C[C@H]32)cc1	ZINC000136786772	342119832	/nfs/dbraw/zinc/11/98/32/342119832.db2.gz	JYVNZVYQTGDGNP-VXGBXAGGSA-N	1	0	296.417	1.644	50	0		CDAARO
CN1CC[N@H+](CCC2OCCO2)[C@H](c2ccccc2)C1	ZINC000125238070	187175875	/nfs/dbraw/zinc/17/58/75/187175875.db2.gz	YJQIEYTXVWRKFF-HNNXBMFYSA-N	1	0	276.380	1.738	50	0		CDAARO
CNC(=O)[C@@H]1CCCC[N@@H+]1CCCc1cccnc1	ZINC000243893657	361829369	/nfs/dbraw/zinc/82/93/69/361829369.db2.gz	ATAZIMHVSZQALD-AWEZNQCLSA-N	1	0	261.369	1.615	50	0		CDAARO
Cc1nnsc1CN(C)C[C@H](C)[NH+]1CCCC1	ZINC000244601809	361854132	/nfs/dbraw/zinc/85/41/32/361854132.db2.gz	DSBITIJCVQVWGM-JTQLQIEISA-N	1	0	254.403	1.763	50	0		CDAARO
Cc1nnsc1CN(C)CCn1cc(Cl)cn1	ZINC000244817075	361864414	/nfs/dbraw/zinc/86/44/14/361864414.db2.gz	STZVONSIRISWEP-UHFFFAOYSA-N	1	0	271.777	1.828	50	0		CDAARO
COC1CC[NH+](CCNC(=O)c2ccc(C)c(O)c2)CC1	ZINC000097235025	342205587	/nfs/dbraw/zinc/20/55/87/342205587.db2.gz	VFSMOPLDKWNTHC-UHFFFAOYSA-N	1	0	292.379	1.541	50	0		CDAARO
C/C=C/C[C@@H](CO)[NH2+]C1CCN(c2nnc(C)s2)CC1	ZINC000253430509	361941379	/nfs/dbraw/zinc/94/13/79/361941379.db2.gz	ZYJNVOXOUARWRI-OOPCZODUSA-N	1	0	296.440	1.732	50	0		CDAARO
Cn1cncc1COC(=O)c1ccn2c[nH+]cc2c1	ZINC000097034330	185157306	/nfs/dbraw/zinc/15/73/06/185157306.db2.gz	ZXYKAHPZEYZKIQ-UHFFFAOYSA-N	1	0	256.265	1.425	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN(c2cc(N)c(N)c[nH+]2)CC1	ZINC000669382531	539072493	/nfs/dbraw/zinc/07/24/93/539072493.db2.gz	BDQZAQBDDKBILK-UHFFFAOYSA-N	1	0	293.371	1.303	50	0		CDAARO
CNS(=O)(=O)[C@H]1CC[N@H+](Cc2ccccc2C2CC2)C1	ZINC000584908344	539102394	/nfs/dbraw/zinc/10/23/94/539102394.db2.gz	LBYRSFXOFQXINH-AWEZNQCLSA-N	1	0	294.420	1.688	50	0		CDAARO
CCCn1cc(C[NH2+][C@H]2CCN(C(C)=O)C[C@H]2C)cn1	ZINC000084760620	342268798	/nfs/dbraw/zinc/26/87/98/342268798.db2.gz	RXGQZULKIGPIHH-DOMZBBRYSA-N	1	0	278.400	1.640	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)OCc2ccccc2)CC1(F)F	ZINC000221010925	342286324	/nfs/dbraw/zinc/28/63/24/342286324.db2.gz	MATYFHSYNPENMM-NSHDSACASA-N	1	0	270.279	1.992	50	0		CDAARO
c1cn([C@@H]2CCC[N@@H+](CCO[C@H]3CCCCO3)CC2)nn1	ZINC000585116338	362043157	/nfs/dbraw/zinc/04/31/57/362043157.db2.gz	RBLIVZWAXAORLQ-CABCVRRESA-N	1	0	294.399	1.848	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2C[C@@H]([NH+](C)C)C2(C)C)ns1	ZINC000585130417	362055797	/nfs/dbraw/zinc/05/57/97/362055797.db2.gz	PKTBUHZHECDVIO-WDEREUQCSA-N	1	0	267.398	1.910	50	0		CDAARO
C[C@H]1C[C@H](C)C[NH+](CCNC(=O)c2cc(C3CC3)n[nH]2)C1	ZINC000036394389	362060638	/nfs/dbraw/zinc/06/06/38/362060638.db2.gz	ORHHEFURZAZZFW-RYUDHWBXSA-N	1	0	290.411	1.995	50	0		CDAARO
C[C@H]1CC[N@H+](CC2CCN(C(=O)C(C)(C)C)CC2)C[C@H]1O	ZINC000253369531	342416160	/nfs/dbraw/zinc/41/61/60/342416160.db2.gz	DTGBUCMTQHLTFP-DZGCQCFKSA-N	1	0	296.455	1.974	50	0		CDAARO
Cc1[nH]ccc1C(=O)Nc1ccc(N2CC[NH+](C)CC2)nc1	ZINC000332095273	136383507	/nfs/dbraw/zinc/38/35/07/136383507.db2.gz	AIYJCWBEOVPMKL-UHFFFAOYSA-N	1	0	299.378	1.722	50	0		CDAARO
CCOc1c(F)cccc1C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179053155	362250712	/nfs/dbraw/zinc/25/07/12/362250712.db2.gz	FYDIAZGQRYJPEK-JTQLQIEISA-N	1	0	266.316	1.658	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccc3nccn3c2)C[C@H](C)[NH2+]1	ZINC000179152395	362252154	/nfs/dbraw/zinc/25/21/54/362252154.db2.gz	RGJNPNFPNSKBBT-PHIMTYICSA-N	1	0	258.325	1.157	50	0		CDAARO
Cc1nn(CC[NH+]2CCCCC2)c(C)c1CCO	ZINC000194432713	362346014	/nfs/dbraw/zinc/34/60/14/362346014.db2.gz	YZCWQDAVGNMKGM-UHFFFAOYSA-N	1	0	251.374	1.521	50	0		CDAARO
C[N@H+](CC[C@@H]1CCCCO1)CCn1cc[nH]c1=O	ZINC000252493443	362388711	/nfs/dbraw/zinc/38/87/11/362388711.db2.gz	NBZZVXGUHOJEBS-LBPRGKRZSA-N	1	0	253.346	1.067	50	0		CDAARO
C[C@@H]1CC[N@H+](CC2CCSCC2)CC[S@]1=O	ZINC000602637832	344510479	/nfs/dbraw/zinc/51/04/79/344510479.db2.gz	ODMHPKDLGUOQKD-BDJLRTHQSA-N	1	0	261.456	1.973	50	0		CDAARO
C[C@H](CCNC(=O)N1CCC[C@@H](O)C1)[NH+]1CCCCC1	ZINC000097108166	185534502	/nfs/dbraw/zinc/53/45/02/185534502.db2.gz	XKZYTXHJPVWKCQ-ZIAGYGMSSA-N	1	0	283.416	1.417	50	0		CDAARO
C[C@H](NC(=O)N1CCC[C@H](CO)C1)C(C)(C)C[NH+](C)C	ZINC000085424014	179059756	/nfs/dbraw/zinc/05/97/56/179059756.db2.gz	UOXYRYRHJIZLRN-STQMWFEESA-N	1	0	285.432	1.377	50	0		CDAARO
O=C(C[NH+]1CCC(c2cccs2)CC1)N1CCOCC1	ZINC000085473432	179077795	/nfs/dbraw/zinc/07/77/95/179077795.db2.gz	QISWXYDLRYDTPZ-UHFFFAOYSA-N	1	0	294.420	1.786	50	0		CDAARO
C=C1C(C(C)=O)[N+](=O)c2cc(OCC)ccc2N1O	ZINC000136208076	346619159	/nfs/dbraw/zinc/61/91/59/346619159.db2.gz	LCIFGANWEIGIBU-UHFFFAOYSA-N	1	0	263.273	1.703	50	0		CDAARO
C[C@@H](c1cccnc1)N1CCO[C@H](CNc2cccnn2)C1	ZINC000089910026	347624346	/nfs/dbraw/zinc/62/43/46/347624346.db2.gz	YVSVLCYLHJZVPM-DZGCQCFKSA-N	1	0	299.378	1.746	50	0		CDAARO
C[C@H]1CC[NH2+]C[C@@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC000086996426	179376752	/nfs/dbraw/zinc/37/67/52/179376752.db2.gz	JGJCAMQSEJPZRW-CPCISQLKSA-N	1	0	272.270	1.832	50	0		CDAARO
COc1csc(C(=O)N2C[C@H](C)[NH2+][C@@H](C)C2)c1	ZINC000128863341	187394909	/nfs/dbraw/zinc/39/49/09/187394909.db2.gz	WFQIWBUFIWVTPV-IUCAKERBSA-N	1	0	254.355	1.579	50	0		CDAARO
CC[NH+]1CCN(Cc2ccc(Br)nc2)CC1	ZINC000139664827	348725221	/nfs/dbraw/zinc/72/52/21/348725221.db2.gz	DMNPLEDMMNWHTL-UHFFFAOYSA-N	1	0	284.201	1.982	50	0		CDAARO
Cc1nn(C)c(C)c1[C@H](C)NC(=O)CC[NH+]1CCCC1	ZINC000076320000	348748946	/nfs/dbraw/zinc/74/89/46/348748946.db2.gz	OTHBXYOQVQHEOB-NSHDSACASA-N	1	0	278.400	1.700	50	0		CDAARO
O=C(NCc1cc(C2CC2)n[nH]1)[C@H]1CC12CC[NH2+]CC2	ZINC000584884148	349342511	/nfs/dbraw/zinc/34/25/11/349342511.db2.gz	WSVGSDWSRNFBQN-GFCCVEGCSA-N	1	0	274.368	1.293	50	0		CDAARO
O=C(NC[C@H]1CCOC1)C1([NH+]2CCCC2)CCCCC1	ZINC000584886759	349344783	/nfs/dbraw/zinc/34/47/83/349344783.db2.gz	ACPFIUGLHFDPJY-CQSZACIVSA-N	1	0	280.412	1.938	50	0		CDAARO
Cn1cc(CC[NH2+]C2CCN(Cc3ccco3)CC2)cn1	ZINC000584888094	349346661	/nfs/dbraw/zinc/34/66/61/349346661.db2.gz	XGXUJDPXAKIYRV-UHFFFAOYSA-N	1	0	288.395	1.810	50	0		CDAARO
Cc1nc[nH]c1C(=O)N1CCC[N@@H+](C(C)C)CC1	ZINC000584888438	349347435	/nfs/dbraw/zinc/34/74/35/349347435.db2.gz	CBNQRNCVCXPKSG-UHFFFAOYSA-N	1	0	250.346	1.274	50	0		CDAARO
OCc1ccc2c(c1)C[N@H+]([C@H]1CCSC1)CCO2	ZINC000584890892	349349614	/nfs/dbraw/zinc/34/96/14/349349614.db2.gz	RIXVLKBNZCQSGK-ZDUSSCGKSA-N	1	0	265.378	1.879	50	0		CDAARO
CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1[NH2+]Cc1nccn1C	ZINC000089949192	179891147	/nfs/dbraw/zinc/89/11/47/179891147.db2.gz	SUGJNMPXUHWHHN-JSGCOSHPSA-N	1	0	290.411	1.547	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C(=O)c1cncc(O)c1	ZINC000584895450	349355896	/nfs/dbraw/zinc/35/58/96/349355896.db2.gz	QRYCMIRJCDBNQU-UHFFFAOYSA-N	1	0	277.368	1.734	50	0		CDAARO
C[NH+](C)[C@@H]1CCC[C@H]1NC(=O)c1ccncc1Cl	ZINC000584898947	349360845	/nfs/dbraw/zinc/36/08/45/349360845.db2.gz	ZIWMUZCGJDPMSJ-VXGBXAGGSA-N	1	0	267.760	1.948	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)c2cccc3c2CCC3=O)C1	ZINC000584899192	349361437	/nfs/dbraw/zinc/36/14/37/349361437.db2.gz	LGBCODRZJBTBBV-LBPRGKRZSA-N	1	0	286.375	1.887	50	0		CDAARO
[NH3+][C@H](CCN1CCOCC1)CSc1ccccc1	ZINC000090569161	180007576	/nfs/dbraw/zinc/00/75/76/180007576.db2.gz	XVHVBUNXLXLXKG-CYBMUJFWSA-N	1	0	266.410	1.828	50	0		CDAARO
Cc1cnc(NCC[N@@H+]2CCCC[C@@H]2CO)nc1N(C)C	ZINC000065380950	362948730	/nfs/dbraw/zinc/94/87/30/362948730.db2.gz	UGUMOVCIQJFIQG-CYBMUJFWSA-N	1	0	293.415	1.110	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](C(=O)N2C[C@@H]3CC=CC[C@@H]3C2)C1	ZINC000065376241	362948813	/nfs/dbraw/zinc/94/88/13/362948813.db2.gz	XXPUGQRCHBVYJJ-QLFBSQMISA-N	1	0	278.396	1.379	50	0		CDAARO
C[C@H]([NH2+]C[C@@]1(O)CCOC1)c1ccc(F)cc1F	ZINC000090850236	180046227	/nfs/dbraw/zinc/04/62/27/180046227.db2.gz	QLEPXFNGJBUKCW-ZANVPECISA-N	1	0	257.280	1.767	50	0		CDAARO
CC(C)c1nc(CN(C)C(=O)[C@H]2C[NH2+]CCO2)cs1	ZINC000091270462	180118071	/nfs/dbraw/zinc/11/80/71/180118071.db2.gz	OVHLITARKAALQW-LLVKDONJSA-N	1	0	283.397	1.213	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2cccc(-c3ncc[nH]3)c2)C[C@@H]1C1CC1	ZINC000091649792	180216617	/nfs/dbraw/zinc/21/66/17/180216617.db2.gz	ZQUKKPWWEZPLFN-CABCVRRESA-N	1	0	296.374	1.886	50	0		CDAARO
Cc1cc(C[NH2+]C[C@H]2CN(C)CCO2)ccc1F	ZINC000105470761	186059209	/nfs/dbraw/zinc/05/92/09/186059209.db2.gz	RIHJIYLITJLJAG-ZDUSSCGKSA-N	1	0	252.333	1.554	50	0		CDAARO
CC(C)N1C[C@H](C)[C@H]([NH2+][C@H](C)CCS(C)(=O)=O)C1	ZINC000110689017	350262589	/nfs/dbraw/zinc/26/25/89/350262589.db2.gz	NOZLPZMXLCFMPC-YNEHKIRRSA-N	1	0	276.446	1.128	50	0		CDAARO
C[C@@]1(O)CC[N@@H+]([C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000110696237	350268086	/nfs/dbraw/zinc/26/80/86/350268086.db2.gz	WADUQEFWEPFWRH-DOTOQJQBSA-N	1	0	288.391	1.634	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(Cc2ncc(C(C)(C)C)o2)C[C@@H]1C	ZINC000106906590	186149448	/nfs/dbraw/zinc/14/94/48/186149448.db2.gz	PCMDBYWDCVKEEB-STQMWFEESA-N	1	0	295.427	1.859	50	0		CDAARO
CCCCNC(=O)[C@H]1CC[C@@H](C)[N@H+](Cc2cnc[nH]2)C1	ZINC000092400536	180377186	/nfs/dbraw/zinc/37/71/86/180377186.db2.gz	UIFUJGYWAHLGKQ-OLZOCXBDSA-N	1	0	278.400	1.927	50	0		CDAARO
Cc1occc1CNC(=O)NC[C@H]1C[N@@H+]2CCC[C@H]2CO1	ZINC000106838884	186138957	/nfs/dbraw/zinc/13/89/57/186138957.db2.gz	XNAICLHEIUUBRE-KBPBESRZSA-N	1	0	293.367	1.250	50	0		CDAARO
C[NH2+][C@H]1CCN(C(=O)OCc2ccccc2)C[C@@H]1F	ZINC000107272480	186164246	/nfs/dbraw/zinc/16/42/46/186164246.db2.gz	ABMWQTWKPOPMIO-STQMWFEESA-N	1	0	266.316	1.955	50	0		CDAARO
COC[C@H](O)C[NH2+][C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000107515582	186177155	/nfs/dbraw/zinc/17/71/55/186177155.db2.gz	ZCHUYHRRODXDLS-FVQBIDKESA-N	1	0	278.396	1.419	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CN(C(=O)c2ccc(F)cc2F)CCO1	ZINC000122852742	187056155	/nfs/dbraw/zinc/05/61/55/187056155.db2.gz	AESPSNCJCAWSAN-UFBFGSQYSA-N	1	0	270.279	1.153	50	0		CDAARO
O=C1NCCCC[C@@H]1NCc1ccc(F)cc1F	ZINC000036976790	363304635	/nfs/dbraw/zinc/30/46/35/363304635.db2.gz	GVGCBYCQRLUUME-LBPRGKRZSA-N	1	0	254.280	1.723	50	0		CDAARO
[NH3+]CCc1nc2ccccc2c(NCCN2CCCC2=O)n1	ZINC000065535836	363311068	/nfs/dbraw/zinc/31/10/68/363311068.db2.gz	WWZSMNKXEJRFEU-UHFFFAOYSA-N	1	0	299.378	1.165	50	0		CDAARO
Cc1cc(N2CCCCC2)nc(N2CCOCC2)[nH+]1	ZINC000000073494	355883533	/nfs/dbraw/zinc/88/35/33/355883533.db2.gz	WGDWWOAMIRSBCZ-UHFFFAOYSA-N	1	0	262.357	1.612	50	0		CDAARO
NC(=O)CCOC1CC[NH+](Cc2ccccc2)CC1	ZINC000000161461	355892808	/nfs/dbraw/zinc/89/28/08/355892808.db2.gz	RKOOIPLMPUSYSJ-UHFFFAOYSA-N	1	0	262.353	1.543	50	0		CDAARO
C[C@@H]1CCCN(C(=O)/C=C\c2ccnn2C)[C@H]1C[NH3+]	ZINC000255064942	355981786	/nfs/dbraw/zinc/98/17/86/355981786.db2.gz	GDVOBBWQOYIQSU-ANCZFUFASA-N	1	0	262.357	1.019	50	0		CDAARO
CCCOc1ccc(CN2CCO[C@H](C[NH3+])C2)cc1	ZINC000067868879	356098106	/nfs/dbraw/zinc/09/81/06/356098106.db2.gz	BHGMOAWWFCJJTG-OAHLLOKOSA-N	1	0	264.369	1.635	50	0		CDAARO
CCn1cnnc1[C@@H](C)Nc1cc(C)[nH+]c(N(C)C)n1	ZINC000032547833	356230781	/nfs/dbraw/zinc/23/07/81/356230781.db2.gz	DFESDCMFPOXLFP-SNVBAGLBSA-N	1	0	275.360	1.636	50	0		CDAARO
COCc1cc(C(=O)N(C)[C@@H]2CC[NH2+]C2)ccc1F	ZINC000299738518	356263694	/nfs/dbraw/zinc/26/36/94/356263694.db2.gz	BWMZOMSXVAOEKH-GFCCVEGCSA-N	1	0	266.316	1.406	50	0		CDAARO
COc1ccc(C[NH2+][C@@H](C)CN2CCOCC2)cc1O	ZINC000036932750	356283410	/nfs/dbraw/zinc/28/34/10/356283410.db2.gz	OJPALARLYPHRJJ-LBPRGKRZSA-N	1	0	280.368	1.211	50	0		CDAARO
C[NH+](C)CCCNC(=O)C(=O)Nc1ccc2[nH]ccc2c1	ZINC000013629524	356350831	/nfs/dbraw/zinc/35/08/31/356350831.db2.gz	RPADFDCBOGWJGZ-UHFFFAOYSA-N	1	0	288.351	1.174	50	0		CDAARO
C[NH+](C)CCCNS(=O)(=O)c1ccc(F)cc1F	ZINC000013938994	356366899	/nfs/dbraw/zinc/36/68/99/356366899.db2.gz	FSBVSXFEXOHELE-UHFFFAOYSA-N	1	0	278.324	1.195	50	0		CDAARO
Cc1cc(C(=O)CN2CCC[C@@H](O)C2)c(C)n1C	ZINC000032797151	356373049	/nfs/dbraw/zinc/37/30/49/356373049.db2.gz	OWHQNPQSOIECAQ-GFCCVEGCSA-N	1	0	250.342	1.281	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)[C@H]2Cc3ccccc3S2)CC1	ZINC000032878800	356406309	/nfs/dbraw/zinc/40/63/09/356406309.db2.gz	JIFCOXRHTKJVJI-CQSZACIVSA-N	1	0	276.405	1.868	50	0		CDAARO
O=C([C@H]1CCC[NH2+]C1)N1CCN(Cc2ccccc2)CC1	ZINC000019410979	356484709	/nfs/dbraw/zinc/48/47/09/356484709.db2.gz	KNRYCLCSSAKTCH-INIZCTEOSA-N	1	0	287.407	1.330	50	0		CDAARO
OCCN1CC[NH+](Cc2ccc3ccccc3c2)CC1	ZINC000019606771	356493281	/nfs/dbraw/zinc/49/32/81/356493281.db2.gz	GUIYHSGMULUPEN-UHFFFAOYSA-N	1	0	270.376	1.950	50	0		CDAARO
Cc1cccc(OCCOCCNCC[NH3+])c1C	ZINC000019772571	356500990	/nfs/dbraw/zinc/50/09/90/356500990.db2.gz	AWICDFZLODXSJW-UHFFFAOYSA-N	1	0	252.358	1.247	50	0		CDAARO
CCCNC(=O)NCC1(C(F)(F)F)CC[NH2+]CC1	ZINC000725264662	538455613	/nfs/dbraw/zinc/45/56/13/538455613.db2.gz	CUSFKXMTCKXXBM-UHFFFAOYSA-N	1	0	267.295	1.628	50	0		CDAARO
COCCN1CC[NH+](CC2Cc3ccccc3C2)CC1	ZINC000022891994	356623977	/nfs/dbraw/zinc/62/39/77/356623977.db2.gz	GDMXETBBNKFUMR-UHFFFAOYSA-N	1	0	274.408	1.665	50	0		CDAARO
COc1cc(OC)c(OC)cc1C[N@@H+]1CCC[C@@H](CO)C1	ZINC000023114813	356628854	/nfs/dbraw/zinc/62/88/54/356628854.db2.gz	DGWARBXGZCGBBG-GFCCVEGCSA-N	1	0	295.379	1.917	50	0		CDAARO
CS(=O)(=O)c1cccc2sc(N3CC[NH2+]CC3)nc21	ZINC000026422412	356692422	/nfs/dbraw/zinc/69/24/22/356692422.db2.gz	ZRPFEZCQTQTBRF-UHFFFAOYSA-N	1	0	297.405	1.109	50	0		CDAARO
C[C@@H]1CN(C(=O)CN2CCc3ccccc3C2)C[C@@H](C)O1	ZINC000032819260	356681793	/nfs/dbraw/zinc/68/17/93/356681793.db2.gz	YXFJXHIWHYHDEO-ZIAGYGMSSA-N	1	0	288.391	1.681	50	0		CDAARO
COc1cc(C(=O)NC2CC[NH+](C)CC2)ccc1N	ZINC000034618897	356817357	/nfs/dbraw/zinc/81/73/57/356817357.db2.gz	XBYFLVPPIOYEJF-UHFFFAOYSA-N	1	0	263.341	1.101	50	0		CDAARO
C[NH+](C)Cc1ccc(CNC(=O)c2cncnc2)cc1	ZINC000354914767	356825245	/nfs/dbraw/zinc/82/52/45/356825245.db2.gz	CAXAVDDBANANCD-UHFFFAOYSA-N	1	0	270.336	1.468	50	0		CDAARO
COC(=O)c1ccc(CN2CCC([NH3+])CC2)s1	ZINC000036644451	356876877	/nfs/dbraw/zinc/87/68/77/356876877.db2.gz	CMQFMUXISGTDAP-UHFFFAOYSA-N	1	0	254.355	1.458	50	0		CDAARO
Cn1cc(CCC(=O)N[C@@H]2CCC[C@@H]([NH+](C)C)C2)cn1	ZINC000095408063	357217941	/nfs/dbraw/zinc/21/79/41/357217941.db2.gz	RKRZSQPCVFPRGG-ZIAGYGMSSA-N	1	0	278.400	1.342	50	0		CDAARO
Cc1cc(F)c(S(=O)(=O)NCC(C)(C)[NH3+])cc1F	ZINC000095432139	357516552	/nfs/dbraw/zinc/51/65/52/357516552.db2.gz	PLFSHYMFTYYXPK-UHFFFAOYSA-N	1	0	278.324	1.289	50	0		CDAARO
COc1cc2c(cc1CN1[C@@H]3CC[C@H]1C[NH2+]CC3)OCO2	ZINC000065461644	357543139	/nfs/dbraw/zinc/54/31/39/357543139.db2.gz	VDVIUTKOOFSKIU-OLZOCXBDSA-N	1	0	290.363	1.750	50	0		CDAARO
C[NH+]1CCC(CNS(=O)(=O)c2ccccc2F)CC1	ZINC000022999711	357581771	/nfs/dbraw/zinc/58/17/71/357581771.db2.gz	LMOCNUFNXNUGJI-UHFFFAOYSA-N	1	0	286.372	1.446	50	0		CDAARO
CCNc1cc(C)[nH+]c(NCCNC(=O)C(C)(C)C)n1	ZINC000067601936	357614586	/nfs/dbraw/zinc/61/45/86/357614586.db2.gz	BPUMFDUTZSLPMW-UHFFFAOYSA-N	1	0	279.388	1.791	50	0		CDAARO
C[NH+](C)CC[C@H]1CN(C(=O)c2ccc(Cl)cn2)CCO1	ZINC000071775793	357780919	/nfs/dbraw/zinc/78/09/19/357780919.db2.gz	UMVAPDGDXYQEQL-LBPRGKRZSA-N	1	0	297.786	1.528	50	0		CDAARO
Cc1nn(C)c2ncc(CN3CC[NH2+]C[C@H]3C)cc12	ZINC000097095592	357953579	/nfs/dbraw/zinc/95/35/79/357953579.db2.gz	XBYLFUFJDPGVMP-SNVBAGLBSA-N	1	0	259.357	1.070	50	0		CDAARO
Cc1ccc(S(=O)(=O)C[C@H](C)[NH2+]C2CCOCC2)cc1	ZINC000097113259	357982966	/nfs/dbraw/zinc/98/29/66/357982966.db2.gz	UIBCDMHUMATMGQ-ZDUSSCGKSA-N	1	0	297.420	1.926	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)NCc1cccs1)[C@H]1CCCO1	ZINC000097111728	357986870	/nfs/dbraw/zinc/98/68/70/357986870.db2.gz	JQKZQHSNNKZJIV-ZYHUDNBSSA-N	1	0	268.382	1.521	50	0		CDAARO
C[C@H]1C[C@H]([NH2+]CC2(O)CCS(=O)(=O)CC2)C[C@@H](C)C1	ZINC000240555588	291145659	/nfs/dbraw/zinc/14/56/59/291145659.db2.gz	GWMNMLHSZUDSKF-ITGUQSILSA-N	1	0	289.441	1.340	50	0		CDAARO
CCNC(=O)C[NH2+]C[C@H](c1cccc(OC)c1)N(C)C	ZINC000020070534	358321309	/nfs/dbraw/zinc/32/13/09/358321309.db2.gz	FVMPYCJJOZNSKZ-CQSZACIVSA-N	1	0	279.384	1.024	50	0		CDAARO
O=C(NC[C@@H]1C[N@H+](Cc2ccccc2)CCCO1)C(F)F	ZINC000194900590	358544156	/nfs/dbraw/zinc/54/41/56/358544156.db2.gz	GEGFYIVAHIEDKV-CYBMUJFWSA-N	1	0	298.333	1.659	50	0		CDAARO
COc1cccc([C@H]2CN(C(=O)[C@@H]([NH3+])C(C)C)CCO2)c1	ZINC000195554405	358556429	/nfs/dbraw/zinc/55/64/29/358556429.db2.gz	ABUACHFVWCPLLF-CABCVRRESA-N	1	0	292.379	1.578	50	0		CDAARO
COCCOc1ccc(-c2nc3c([nH]2)C[NH2+]CC3)cc1	ZINC000095380919	358690304	/nfs/dbraw/zinc/69/03/04/358690304.db2.gz	ZTYJJINFFSOGCZ-UHFFFAOYSA-N	1	0	273.336	1.748	50	0		CDAARO
COc1cc(C(=O)N2C[C@@H](C(C)C)[C@H]([NH+](C)C)C2)ccn1	ZINC000095384250	358690439	/nfs/dbraw/zinc/69/04/39/358690439.db2.gz	AZVCWWJWXWELRY-UONOGXRCSA-N	1	0	291.395	1.748	50	0		CDAARO
CCCc1nnc(N(C)CCC[NH+]2CCCC2)o1	ZINC000095390827	358692113	/nfs/dbraw/zinc/69/21/13/358692113.db2.gz	BJBCFNZJNYTPBU-UHFFFAOYSA-N	1	0	252.362	1.944	50	0		CDAARO
Cc1cc(C(=O)N2CCC[C@@H]([NH+]3CCCC3)CC2)[nH]n1	ZINC000095399400	358693011	/nfs/dbraw/zinc/69/30/11/358693011.db2.gz	KAZIUTRVONLQCX-CYBMUJFWSA-N	1	0	276.384	1.809	50	0		CDAARO
CC[NH+]1CCC(CC(=O)N[C@H](C)c2ncnn2C)CC1	ZINC000095503111	358695894	/nfs/dbraw/zinc/69/58/94/358695894.db2.gz	TUHFYBMYXRLRHJ-LLVKDONJSA-N	1	0	279.388	1.114	50	0		CDAARO
CN(Cc1nc([C@@H]2CCOC2)no1)C1CC[NH+](C)CC1	ZINC000096161391	358710894	/nfs/dbraw/zinc/71/08/94/358710894.db2.gz	ZJQDHFHXMQGOBB-LLVKDONJSA-N	1	0	280.372	1.100	50	0		CDAARO
C[NH+]1CCN(Cc2ccc(-c3ccc(N)nc3)nc2)CC1	ZINC000097394194	358772732	/nfs/dbraw/zinc/77/27/32/358772732.db2.gz	PKJXSHLCEUMPEW-UHFFFAOYSA-N	1	0	283.379	1.473	50	0		CDAARO
Cn1c(C[N@@H+]2CCC[C@](O)(CO)CC2)cc2ccccc21	ZINC000097505437	358781547	/nfs/dbraw/zinc/78/15/47/358781547.db2.gz	VRVDPTFCPXCLFC-QGZVFWFLSA-N	1	0	288.391	1.888	50	0		CDAARO
COC[C@@H]1CCC[N@H+](Cc2cnc(N(C)C)nc2)C1	ZINC000215667116	358898457	/nfs/dbraw/zinc/89/84/57/358898457.db2.gz	HOTJCNFDKOGNBQ-GFCCVEGCSA-N	1	0	264.373	1.401	50	0		CDAARO
CCc1ccc(CN2CCN(CCC[NH+](C)C)CC2)nc1	ZINC000216099504	358925013	/nfs/dbraw/zinc/92/50/13/358925013.db2.gz	HRJQJOUPSLRFGV-UHFFFAOYSA-N	1	0	290.455	1.713	50	0		CDAARO
CC[N@H+](CCn1cccn1)Cc1ccc(OC)nc1	ZINC000216121240	358927096	/nfs/dbraw/zinc/92/70/96/358927096.db2.gz	ZDPFVOMLZSBROK-UHFFFAOYSA-N	1	0	260.341	1.809	50	0		CDAARO
CCO[C@@H]1C[C@H]([N@H+](C)CC(=O)NC[C@@H]2CCCO2)C1(C)C	ZINC000084800686	359005174	/nfs/dbraw/zinc/00/51/74/359005174.db2.gz	WBPCDOZWOBPXHX-MELADBBJSA-N	1	0	298.427	1.417	50	0		CDAARO
CNC(=O)C1CC[NH+](CCOc2ccccc2F)CC1	ZINC000012333797	359010188	/nfs/dbraw/zinc/01/01/88/359010188.db2.gz	RNLYREKDUYMPHU-UHFFFAOYSA-N	1	0	280.343	1.663	50	0		CDAARO
[NH3+]C1(Cc2ccccc2Cl)CCS(=O)(=O)CC1	ZINC000098213638	359100675	/nfs/dbraw/zinc/10/06/75/359100675.db2.gz	CKDQAGPYACDWMR-UHFFFAOYSA-N	1	0	273.785	1.789	50	0		CDAARO
COc1ccc(C[C@H](C)[NH2+]CCN2CCOCC2)cc1	ZINC000023283340	359223929	/nfs/dbraw/zinc/22/39/29/359223929.db2.gz	BZAUUIFCGIRSNS-AWEZNQCLSA-N	1	0	278.396	1.548	50	0		CDAARO
CC(=O)N1CCC([NH2+][C@@H]2COCC[C@@H]2OCC2CC2)CC1	ZINC000223007934	359392754	/nfs/dbraw/zinc/39/27/54/359392754.db2.gz	BIKUBYZDJVMHRC-CVEARBPZSA-N	1	0	296.411	1.171	50	0		CDAARO
Cc1nnc([C@H](C)Nc2cc(C3CC([NH3+])C3)ncn2)[nH]1	ZINC000223757872	359452444	/nfs/dbraw/zinc/45/24/44/359452444.db2.gz	YPVPQNDZUVQFSZ-WFRXLMHJSA-N	1	0	273.344	1.281	50	0		CDAARO
O=C(Cc1cccnc1)NCCC12CCC[NH+]1CCC2	ZINC000223768229	359454320	/nfs/dbraw/zinc/45/43/20/359454320.db2.gz	YVSNOMLXIMQQAQ-UHFFFAOYSA-N	1	0	273.380	1.759	50	0		CDAARO
CCO[C@H]1C[N@H+](Cc2ccc3c(c2)CCO3)C[C@@H]1O	ZINC000223950844	359478424	/nfs/dbraw/zinc/47/84/24/359478424.db2.gz	XCKMSEGSSGHSPE-ZFWWWQNUSA-N	1	0	263.337	1.203	50	0		CDAARO
CS(=O)(=O)N1CCC([NH2+]Cc2ccccc2F)CC1	ZINC000030656297	359617594	/nfs/dbraw/zinc/61/75/94/359617594.db2.gz	HILMHCZJGAZIHV-UHFFFAOYSA-N	1	0	286.372	1.339	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1C(=O)N1CCOC2(CCCC2)C1	ZINC000095422743	482833892	/nfs/dbraw/zinc/83/38/92/482833892.db2.gz	NEUUJCDKPULZNO-ZDUSSCGKSA-N	1	0	266.385	1.642	50	0		CDAARO
Cn1nccc1[C@H]1CCC[N@H+](CCOC[C@H]2CCCO2)C1	ZINC000257365605	359946467	/nfs/dbraw/zinc/94/64/67/359946467.db2.gz	XGJAVXYGOXDYAZ-LSDHHAIUSA-N	1	0	293.411	1.795	50	0		CDAARO
C[NH2+]CCN(C)C(=O)[C@@H](C)n1ccnc1C(C)C	ZINC000252478835	283523971	/nfs/dbraw/zinc/52/39/71/283523971.db2.gz	AVRZEYLQMAKOGD-LLVKDONJSA-N	1	0	252.362	1.245	50	0		CDAARO
Cc1noc(C)c1[C@H](C)C(=O)N1CC[NH2+]C[C@H]1C	ZINC000124366793	360361855	/nfs/dbraw/zinc/36/18/55/360361855.db2.gz	TXVNCXVXXBTTBC-BDAKNGLRSA-N	1	0	251.330	1.215	50	0		CDAARO
Cc1n[nH]c(C)c1[C@H](C)NC(=O)N1CC[NH+](C(C)C)CC1	ZINC000426477176	360566324	/nfs/dbraw/zinc/56/63/24/360566324.db2.gz	HSFNXYLZYJKGSJ-NSHDSACASA-N	1	0	293.415	1.823	50	0		CDAARO
C[NH2+]Cc1nnc(SCCc2cccc(C)n2)n1C	ZINC000426361893	360659593	/nfs/dbraw/zinc/65/95/93/360659593.db2.gz	FMZNSTQXRLRSFB-UHFFFAOYSA-N	1	0	277.397	1.573	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C/C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178578595	189128032	/nfs/dbraw/zinc/12/80/32/189128032.db2.gz	MNITYQZAKWKYOX-FSIBCCDJSA-N	1	0	282.775	1.202	50	0		CDAARO
CCn1nccc1-c1ccc(CN2CC[NH+](C)CC2)cn1	ZINC000426684571	360696720	/nfs/dbraw/zinc/69/67/20/360696720.db2.gz	VWDZYYXFWJHRKZ-UHFFFAOYSA-N	1	0	285.395	1.712	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2ccc3nccn3c2)C1	ZINC000178982872	189159695	/nfs/dbraw/zinc/15/96/95/189159695.db2.gz	HUIGQSMURBRHPU-LLVKDONJSA-N	1	0	258.325	1.016	50	0		CDAARO
CN(C(=O)CCc1cccc(F)c1F)[C@H]1CC[NH2+]C1	ZINC000179050872	189165321	/nfs/dbraw/zinc/16/53/21/189165321.db2.gz	AGPCRFZFRLCRCE-NSHDSACASA-N	1	0	268.307	1.718	50	0		CDAARO
COc1ccc(CC(=O)NC[C@H]2CCC[NH2+]C2)cc1F	ZINC000129746531	360877815	/nfs/dbraw/zinc/87/78/15/360877815.db2.gz	IBBRXIFGGMJKNR-LBPRGKRZSA-N	1	0	280.343	1.493	50	0		CDAARO
C[C@@H](C(=O)NCc1cc2ccc(F)cc2[nH]c1=O)[NH+](C)C	ZINC000426529171	360980117	/nfs/dbraw/zinc/98/01/17/360980117.db2.gz	AOHWJFSCZQYAMJ-VIFPVBQESA-N	1	0	291.326	1.646	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)c2ccc(-c3ccncc3)cc2)C1	ZINC000426552160	361012571	/nfs/dbraw/zinc/01/25/71/361012571.db2.gz	YQYKAVVJYVJEBX-OAHLLOKOSA-N	1	0	267.332	1.922	50	0		CDAARO
CCc1[nH]nc(C(=O)N2C[C@H]3CC[C@@H](C2)[C@H]3[NH+](C)C)c1C	ZINC000299777760	200869498	/nfs/dbraw/zinc/86/94/98/200869498.db2.gz	ONAYMYBYTBUBCL-JYAVWHMHSA-N	1	0	290.411	1.693	50	0		CDAARO
Cn1nccc1CCNC(=O)CCC1CC[NH+](C)CC1	ZINC000299788054	200875054	/nfs/dbraw/zinc/87/50/54/200875054.db2.gz	WASRLDPVCXGOBF-UHFFFAOYSA-N	1	0	278.400	1.201	50	0		CDAARO
Cc1ccc(C[NH2+][C@@H]2CCC(=O)NC23CCC3)c(C)n1	ZINC000367257506	361255937	/nfs/dbraw/zinc/25/59/37/361255937.db2.gz	JCIXTIIOBDGZNT-CQSZACIVSA-N	1	0	273.380	1.989	50	0		CDAARO
CCN(CCO)C(=O)N[C@@H](Cn1ccnc1)C(C)(C)C	ZINC000426635359	361340130	/nfs/dbraw/zinc/34/01/30/361340130.db2.gz	KXQCBBADOZVLCY-LBPRGKRZSA-N	1	0	282.388	1.322	50	0		CDAARO
Cc1ccccc1CNC(=O)C[NH2+][C@@H](C)[C@H]1CCCO1	ZINC000183086601	189346095	/nfs/dbraw/zinc/34/60/95/189346095.db2.gz	AOVOGUFCVXVSDS-DZGCQCFKSA-N	1	0	276.380	1.768	50	0		CDAARO
COc1ccc(CN2CC[N@H+](C)[C@H](CCO)C2)cc1OC	ZINC000104416676	361587270	/nfs/dbraw/zinc/58/72/70/361587270.db2.gz	QAPWEELCULRWEQ-CQSZACIVSA-N	1	0	294.395	1.202	50	0		CDAARO
CC(=O)c1ccc(N2CCN(C[C@@H](C)O)C[C@@H]2C)nc1	ZINC000192799453	363994945	/nfs/dbraw/zinc/99/49/45/363994945.db2.gz	JALYUSJFNXSZPO-NWDGAFQWSA-N	1	0	277.368	1.176	50	0		CDAARO
CC(=O)Nc1ccc(C[NH2+]C2CCN(C)CC2)cc1	ZINC000017313824	364025748	/nfs/dbraw/zinc/02/57/48/364025748.db2.gz	XRAMRJQJYLDCFB-UHFFFAOYSA-N	1	0	261.369	1.829	50	0		CDAARO
CC(C)CCOC1CC[NH+](CC(=O)N2CCOCC2)CC1	ZINC000193110071	364964299	/nfs/dbraw/zinc/96/42/99/364964299.db2.gz	ZKLASCDOSUAUHV-UHFFFAOYSA-N	1	0	298.427	1.372	50	0		CDAARO
CCS(=O)(=O)C[C@H](C)[NH2+][C@H]1CC(C)(C)OC1(C)C	ZINC000089635942	366891844	/nfs/dbraw/zinc/89/18/44/366891844.db2.gz	LXGZOTHIHGFQDF-QWRGUYRKSA-N	1	0	277.430	1.745	50	0		CDAARO
C[C@@H](C(=O)Nc1cnc(N(C)C)nc1)[N@H+]1[C@H](C)CC[C@@H]1C	ZINC000089922772	366966176	/nfs/dbraw/zinc/96/61/76/366966176.db2.gz	PVVAYOZJJOETQU-TUAOUCFPSA-N	1	0	291.399	1.742	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)OCc2ccccc2)C[C@H]1F	ZINC000079035468	367349342	/nfs/dbraw/zinc/34/93/42/367349342.db2.gz	SYVUWEZGXXHYPH-VXGBXAGGSA-N	1	0	252.289	1.694	50	0		CDAARO
Cc1cc(C(=O)N[C@@H]2CC[NH2+]C[C@@H]2C)ccc1F	ZINC000094345011	367405848	/nfs/dbraw/zinc/40/58/48/367405848.db2.gz	VRECQTRJNSHGGO-GXFFZTMASA-N	1	0	250.317	1.862	50	0		CDAARO
COC[C@H]1CC[N@H+](Cc2ccc3c(c2)nnn3C)C1	ZINC000020352374	369961789	/nfs/dbraw/zinc/96/17/89/369961789.db2.gz	LSADPVDHHPVLJR-LBPRGKRZSA-N	1	0	260.341	1.437	50	0		CDAARO
O=c1cc(C[N@H+]2CC[C@](O)(CO)C2)[nH]c2ccc(F)cc12	ZINC000299765254	372748752	/nfs/dbraw/zinc/74/87/52/372748752.db2.gz	KZVGTALGEZSOQX-OAHLLOKOSA-N	1	0	292.310	1.009	50	0		CDAARO
Cc1ccccc1CCC(=O)NC[C@]1(O)CCC[NH2+]C1	ZINC000299773971	372752822	/nfs/dbraw/zinc/75/28/22/372752822.db2.gz	HAZGNKQTIGDOMH-INIZCTEOSA-N	1	0	276.380	1.158	50	0		CDAARO
Cc1ncn(C)c1C(=O)N[C@H]1CCC[N@@H+](C2CCCC2)C1	ZINC000299798577	372768415	/nfs/dbraw/zinc/76/84/15/372768415.db2.gz	SZJUFPVZEVKHIK-ZDUSSCGKSA-N	1	0	290.411	1.865	50	0		CDAARO
CN(C[C@H]1CC[N@H+](C)C1(C)C)C(=O)CCCn1ccnc1	ZINC000299800832	372771565	/nfs/dbraw/zinc/77/15/65/372771565.db2.gz	JAKDNUXWTFNWEG-CQSZACIVSA-N	1	0	292.427	1.852	50	0		CDAARO
Cc1cc(=O)cc(C(=O)NC2(C[NH+]3CCCCC3)CC2)o1	ZINC000299802184	372773467	/nfs/dbraw/zinc/77/34/67/372773467.db2.gz	YURDAKBQLLQXGI-UHFFFAOYSA-N	1	0	290.363	1.697	50	0		CDAARO
CCCCS(=O)(=O)N1CC[C@H]([NH+]2CCCCC2)C1	ZINC000341202086	373474489	/nfs/dbraw/zinc/47/44/89/373474489.db2.gz	BEFXZAHHADZALG-ZDUSSCGKSA-N	1	0	274.430	1.677	50	0		CDAARO
C[C@H](C(=O)N1CCCC1)[N@@H+]1CCCC[C@H]1Cn1cncn1	ZINC000253378009	373680126	/nfs/dbraw/zinc/68/01/26/373680126.db2.gz	YYCUTIJGGFRPEX-KGLIPLIRSA-N	1	0	291.399	1.144	50	0		CDAARO
CC[C@@H]1C[N@@H+]([C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)CCN1C[C@H](C)O	ZINC000108157334	412814362	/nfs/dbraw/zinc/81/43/62/412814362.db2.gz	SBPKRZCDZFOEHU-NPJQDHAYSA-N	1	0	296.455	1.577	50	0		CDAARO
[NH3+]C1(Cc2cccc(F)c2)CCS(=O)(=O)CC1	ZINC000255187045	374265426	/nfs/dbraw/zinc/26/54/26/374265426.db2.gz	AYKRTSUVVJJDOS-UHFFFAOYSA-N	1	0	257.330	1.274	50	0		CDAARO
Cc1ccccc1CCNC(=O)N1CC[C@@H](C[NH3+])C1	ZINC000416875915	374810211	/nfs/dbraw/zinc/81/02/11/374810211.db2.gz	VCFSTSQADXQHMB-ZDUSSCGKSA-N	1	0	261.369	1.528	50	0		CDAARO
C1=CC[C@@H](C[N@H+]2CC[C@H](CN3CCOCC3)C2)CC1	ZINC000093664011	374776623	/nfs/dbraw/zinc/77/66/23/374776623.db2.gz	MSTSDPOUJXITSU-HZPDHXFCSA-N	1	0	264.413	1.997	50	0		CDAARO
CC(C)OC[C@H](O)C[N@@H+]1CCc2ccc(O)cc2C1	ZINC000095426440	374927303	/nfs/dbraw/zinc/92/73/03/374927303.db2.gz	HULZCWKTKITVDH-OAHLLOKOSA-N	1	0	265.353	1.536	50	0		CDAARO
C[C@H](c1cccnc1)[N@@H+]1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1	ZINC000095402696	374906380	/nfs/dbraw/zinc/90/63/80/374906380.db2.gz	FKWXPHZMOYVKMZ-YPMHNXCESA-N	1	0	299.378	1.844	50	0		CDAARO
COCCn1ccc(NC(=O)[C@H](C)[NH+]2[C@H](C)CC[C@H]2C)n1	ZINC000097108170	375148526	/nfs/dbraw/zinc/14/85/26/375148526.db2.gz	NCFDLOMEDMOKKI-UPJWGTAASA-N	1	0	294.399	1.729	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C[C@H](O)CO[C@@H](C)c1ccccc1	ZINC000097160005	375151605	/nfs/dbraw/zinc/15/16/05/375151605.db2.gz	QGUQJSCGBZWWNI-BBRMVZONSA-N	1	0	289.379	1.946	50	0		CDAARO
CCc1cccc(S(=O)(=O)N2CC[C@H]([NH3+])C[C@H]2C)c1	ZINC000299740293	375201033	/nfs/dbraw/zinc/20/10/33/375201033.db2.gz	YCKPFYZYYDNKMD-YPMHNXCESA-N	1	0	282.409	1.749	50	0		CDAARO
CCn1cc(C(=O)N[C@@H](C)C[NH+]2CCC(C)CC2)cn1	ZINC000002782462	375326934	/nfs/dbraw/zinc/32/69/34/375326934.db2.gz	GPGBWRDNYXKGAU-ZDUSSCGKSA-N	1	0	278.400	1.753	50	0		CDAARO
C[C@H](C(=O)NCC(F)(F)F)[N@H+](C)C[C@H]1CCCCO1	ZINC000241942398	376020889	/nfs/dbraw/zinc/02/08/89/376020889.db2.gz	UMGFQTBMGKDCLS-NXEZZACHSA-N	1	0	282.306	1.554	50	0		CDAARO
COCCNC(=O)[C@@H](C)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C(C)C	ZINC000246281971	376604417	/nfs/dbraw/zinc/60/44/17/376604417.db2.gz	HXHUPBOMGKMDSI-KFWWJZLASA-N	1	0	297.443	1.085	50	0		CDAARO
CN1C(=O)[C@H]2[C@H]3CCC[N@@H+]3[C@@H](c3ccc(F)cc3)[C@H]2C1=O	ZINC000248050603	377195300	/nfs/dbraw/zinc/19/53/00/377195300.db2.gz	QZZNCEYZNMCPSB-RFGFWPKPSA-N	1	0	288.322	1.576	50	0		CDAARO
Cc1c(-c2ccccc2)n[nH]c1C(=O)N[C@@H]1CC[C@@H]([NH3+])C1	ZINC000067975605	377339948	/nfs/dbraw/zinc/33/99/48/377339948.db2.gz	NODXQXUZPPTYHI-CHWSQXEVSA-N	1	0	284.363	1.995	50	0		CDAARO
C[NH+]1CCC(CNC(=O)C(=O)Nc2ccccc2F)CC1	ZINC000022999026	256842422	/nfs/dbraw/zinc/84/24/22/256842422.db2.gz	YESVRBNTOKJIMA-UHFFFAOYSA-N	1	0	293.342	1.222	50	0		CDAARO
CNc1snc(C)c1C(=O)N1C[C@@H](C)[C@H]([NH+](C)C)C1	ZINC000095402450	184967649	/nfs/dbraw/zinc/96/76/49/184967649.db2.gz	BTXDYVUGBQUACI-PSASIEDQSA-N	1	0	282.413	1.515	50	0		CDAARO
CC[C@H]([NH2+]C[C@H]1CC=CCC1)C(=O)N1CCOCC1	ZINC000095434095	184983267	/nfs/dbraw/zinc/98/32/67/184983267.db2.gz	PMHNHCZOSREWDT-KBPBESRZSA-N	1	0	266.385	1.570	50	0		CDAARO
C[N@H+](CCN1C(=O)CCC1=O)[C@@H]1CCc2ccccc21	ZINC000032928760	390221558	/nfs/dbraw/zinc/22/15/58/390221558.db2.gz	UFSPZPUFJGZNAQ-CQSZACIVSA-N	1	0	272.348	1.755	50	0		CDAARO
Cc1noc(C)c1C[C@H](C)NC(=O)NCC[N@H+](C)C(C)C	ZINC000096415457	390512147	/nfs/dbraw/zinc/51/21/47/390512147.db2.gz	PNMUKMQNCHXDTG-NSHDSACASA-N	1	0	296.415	1.862	50	0		CDAARO
COC[C@H](O)C[N@H+](C)Cc1cccc(NC(C)=O)c1	ZINC000096424652	390515950	/nfs/dbraw/zinc/51/59/50/390515950.db2.gz	RBLVADOZIVVZMI-CQSZACIVSA-N	1	0	266.341	1.084	50	0		CDAARO
Cc1cnc(N)nc1N(C)CC[C@H](C)[NH+]1CCCC1	ZINC000091424929	390889747	/nfs/dbraw/zinc/88/97/47/390889747.db2.gz	KOAWLUILMXZQDZ-LBPRGKRZSA-N	1	0	263.389	1.678	50	0		CDAARO
O=C(C[NH+]1CCCC1)NCc1cc(-c2ccccc2)n[nH]1	ZINC000219572345	391057550	/nfs/dbraw/zinc/05/75/50/391057550.db2.gz	WNHAAHOVYWUZOK-UHFFFAOYSA-N	1	0	284.363	1.789	50	0		CDAARO
CCN1CCC[C@@H]1C[NH2+][C@@H](C)C(=O)NC1CCCC1	ZINC000020300538	391585107	/nfs/dbraw/zinc/58/51/07/391585107.db2.gz	ZWGSMRCMUMXBCS-GXTWGEPZSA-N	1	0	267.417	1.508	50	0		CDAARO
CS[C@@H]1CCC[C@@H]1[N@H+](C)CC(=O)N1CCOCC1	ZINC000110642576	392786374	/nfs/dbraw/zinc/78/63/74/392786374.db2.gz	PRPJFNRITHLYGP-NWDGAFQWSA-N	1	0	272.414	1.061	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)C2(c3ccccc3F)CC2)C1	ZINC000269161022	132122411	/nfs/dbraw/zinc/12/24/11/132122411.db2.gz	MEOJKNJOAMJWFS-LLVKDONJSA-N	1	0	262.328	1.665	50	0		CDAARO
Cc1ccccc1[C@H](O)CNC(=O)[C@@H]1CCC[C@H]([NH3+])C1	ZINC000269213530	132132617	/nfs/dbraw/zinc/13/26/17/132132617.db2.gz	IYFBIMQUPSHZCH-VNHYZAJKSA-N	1	0	276.380	1.662	50	0		CDAARO
COC[C@@H](C)[NH2+][C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000095968488	393154974	/nfs/dbraw/zinc/15/49/74/393154974.db2.gz	XQHITRLHDYTTOL-HZPDHXFCSA-N	1	0	291.439	1.822	50	0		CDAARO
Cn1nccc1C(=O)NCC1CCN(c2cc[nH+]cc2)CC1	ZINC000093065742	135079195	/nfs/dbraw/zinc/07/91/95/135079195.db2.gz	DRZIAHPLDQRJHE-UHFFFAOYSA-N	1	0	299.378	1.462	50	0		CDAARO
Cc1cc(NC(=O)CC2(C[NH3+])CCCCC2)nn1C	ZINC000261569273	140350507	/nfs/dbraw/zinc/35/05/07/140350507.db2.gz	MAURNNGHKAAACN-UHFFFAOYSA-N	1	0	264.373	1.966	50	0		CDAARO
CC(C)C[C@@H]([NH3+])C(=O)N(C)C1Cc2ccccc2C1	ZINC000071750063	397908959	/nfs/dbraw/zinc/90/89/59/397908959.db2.gz	ZERYYZQZTMPXJI-OAHLLOKOSA-N	1	0	260.381	1.986	50	0		CDAARO
CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1[NH3+]	ZINC000072187475	285883247	/nfs/dbraw/zinc/88/32/47/285883247.db2.gz	ORRVKLSXTZZGJV-NXEZZACHSA-N	1	0	272.345	1.134	50	0		CDAARO
COc1cc(C[NH2+]C(C)(C)C)ccc1OCCO	ZINC000005063622	170062996	/nfs/dbraw/zinc/06/29/96/170062996.db2.gz	OTJNFQACPQSIOY-UHFFFAOYSA-N	1	0	253.342	1.954	50	0		CDAARO
COc1cccc2[nH]c(C(=O)NCCC[NH+](C)C)cc21	ZINC000005271603	170081724	/nfs/dbraw/zinc/08/17/24/170081724.db2.gz	RJCYGOOXOMQNMY-UHFFFAOYSA-N	1	0	275.352	1.858	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1cc(C(=O)c2ccccc2)c[nH]1	ZINC000006605649	170218415	/nfs/dbraw/zinc/21/84/15/170218415.db2.gz	HGIOFYMWMGDEDF-UHFFFAOYSA-N	1	0	299.374	1.927	50	0		CDAARO
COc1cccc(OC[C@H](O)C[NH2+]Cc2ccco2)c1	ZINC000009970652	170392524	/nfs/dbraw/zinc/39/25/24/170392524.db2.gz	HSNSZZHDLPTKFA-GFCCVEGCSA-N	1	0	277.320	1.818	50	0		CDAARO
Cc1cc(OC[C@H](O)C[NH2+][C@@H](C)CCO)ccc1Cl	ZINC000020109926	170997850	/nfs/dbraw/zinc/99/78/50/170997850.db2.gz	ZEOGYNAGHYBYCU-NWDGAFQWSA-N	1	0	287.787	1.749	50	0		CDAARO
[NH3+]C1CCN(C(=O)Cc2ccc(Cl)cc2)CC1	ZINC000020267675	171123912	/nfs/dbraw/zinc/12/39/12/171123912.db2.gz	LYFLYYPDSCKKSO-UHFFFAOYSA-N	1	0	252.745	1.832	50	0		CDAARO
CC(=O)Nc1ccc(CN2CCC[N@@H+](C)CC2)cc1	ZINC000020309972	171143993	/nfs/dbraw/zinc/14/39/93/171143993.db2.gz	HGJIUXDNOUZQNC-UHFFFAOYSA-N	1	0	261.369	1.783	50	0		CDAARO
O[C@H](CN1CC[NH+](Cc2ccccc2)CC1)C(F)(F)F	ZINC000020388115	171177710	/nfs/dbraw/zinc/17/77/10/171177710.db2.gz	PKEONBQBQCKUHP-CYBMUJFWSA-N	1	0	288.313	1.727	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CN2C[C@@H](C)O[C@@H](C)C2)C1	ZINC000020865503	171276882	/nfs/dbraw/zinc/27/68/82/171276882.db2.gz	JAJCIDJDPMTPMG-MJBXVCDLSA-N	1	0	256.390	1.064	50	0		CDAARO
O=C(CN1CC[N@@H+]2CCC[C@@H]2C1)Nc1ccc(F)cc1F	ZINC000022752699	171397375	/nfs/dbraw/zinc/39/73/75/171397375.db2.gz	OPYRJZYOMYNJQF-GFCCVEGCSA-N	1	0	295.333	1.683	50	0		CDAARO
C[NH+]1CCN([C@H](CNC(=O)C2CC2)c2ccsc2)CC1	ZINC000022794223	171399617	/nfs/dbraw/zinc/39/96/17/171399617.db2.gz	XKMVDWQJLFDPKL-CQSZACIVSA-N	1	0	293.436	1.563	50	0		CDAARO
CO[C@@H](C[NH2+]C(C)(C)C)c1ccc(O)c(CO)c1	ZINC000034605306	171845586	/nfs/dbraw/zinc/84/55/86/171845586.db2.gz	UMHASVFLCHGDPW-ZDUSSCGKSA-N	1	0	253.342	1.960	50	0	in-vitro	CDAARO
COc1cccc([C@@H](CNC(=O)c2cn[nH]c2)[NH+](C)C)c1	ZINC000036165171	172482292	/nfs/dbraw/zinc/48/22/92/172482292.db2.gz	AWUVTZYQANQKKR-CQSZACIVSA-N	1	0	288.351	1.451	50	0		CDAARO
CS(=O)(=O)c1cccc(Oc2ncccc2C[NH3+])c1	ZINC000037369463	173158578	/nfs/dbraw/zinc/15/85/78/173158578.db2.gz	SZLPAGGXVKZWNX-UHFFFAOYSA-N	1	0	278.333	1.736	50	0		CDAARO
COc1ccc(OCCN2CC[NH2+][C@@H](C)C2)cc1	ZINC000040456364	174267453	/nfs/dbraw/zinc/26/74/53/174267453.db2.gz	OAEWWXORXMIVFZ-LBPRGKRZSA-N	1	0	250.342	1.368	50	0		CDAARO
c1ccc(-n2nnnc2SC[C@H]2CCC[NH2+]C2)cc1	ZINC000043471665	175053876	/nfs/dbraw/zinc/05/38/76/175053876.db2.gz	CMHKZOHTTUQIAA-NSHDSACASA-N	1	0	275.381	1.754	50	0		CDAARO
Cc1cccc(-n2cccc2CN2CCO[C@@H](C[NH3+])C2)c1	ZINC000071422123	176160887	/nfs/dbraw/zinc/16/08/87/176160887.db2.gz	MXDFLPLIQZCCKQ-KRWDZBQOSA-N	1	0	285.391	1.945	50	0		CDAARO
C[NH2+]CC(=O)N1CCC[C@@H]1c1nc(C(C)C)no1	ZINC000071422205	176160911	/nfs/dbraw/zinc/16/09/11/176160911.db2.gz	NORHUULJDVFFCY-SECBINFHSA-N	1	0	252.318	1.076	50	0		CDAARO
Cc1ccc(CC2(NC(=O)[C@@H]3C[NH2+]CCO3)CC2)cc1	ZINC000071638871	176238308	/nfs/dbraw/zinc/23/83/08/176238308.db2.gz	DZVKLYXBNSTAHX-AWEZNQCLSA-N	1	0	274.364	1.175	50	0		CDAARO
CN1C[C@@]2(CCC[N@H+](CCc3ccccn3)C2)OC1=O	ZINC000072125610	176320812	/nfs/dbraw/zinc/32/08/12/176320812.db2.gz	DRVIKEKMASYGFU-OAHLLOKOSA-N	1	0	275.352	1.541	50	0		CDAARO
COc1ccnc(C[N@H+]2C[C@@H]3[C@H]4CC[C@H](O4)[C@@H]3C2)c1OC	ZINC000072153317	176328042	/nfs/dbraw/zinc/32/80/42/176328042.db2.gz	DLWBIIJHTZYFBE-VWUVDNNOSA-N	1	0	290.363	1.708	50	0		CDAARO
Fc1cccc(CN2CC[NH+](C[C@@H]3CCOC3)CC2)c1	ZINC000072157594	176329447	/nfs/dbraw/zinc/32/94/47/176329447.db2.gz	BIQDBLSMBUGEOC-HNNXBMFYSA-N	1	0	278.371	1.980	50	0		CDAARO
COC[C@H]1CCC[C@H]1Nc1ncnc2c1CC[NH2+]CC2	ZINC000072429023	176402185	/nfs/dbraw/zinc/40/21/85/176402185.db2.gz	WGLLKTZZHDQJHF-DGCLKSJQSA-N	1	0	276.384	1.392	50	0		CDAARO
CC[NH+](CC)[C@H]1CCN(C(=O)c2oc(C)nc2C)C1	ZINC000074176833	176512089	/nfs/dbraw/zinc/51/20/89/176512089.db2.gz	VTPRYUOZLSMSIX-LBPRGKRZSA-N	1	0	265.357	1.848	50	0		CDAARO
CSCCC(=O)N1CCC[C@H](c2ncc[nH]2)C1	ZINC000077343664	177254717	/nfs/dbraw/zinc/25/47/17/177254717.db2.gz	HQFYFOOIPQMYEI-JTQLQIEISA-N	1	0	253.371	1.869	50	0		CDAARO
C[N@@H+]1CC[C@H]2CN(C(=O)NCc3cccs3)C[C@H]21	ZINC000077486900	177274615	/nfs/dbraw/zinc/27/46/15/177274615.db2.gz	KTYAMXMTLSIMQA-CMPLNLGQSA-N	1	0	265.382	1.594	50	0		CDAARO
CN(Cc1nc(-c2ccncc2)no1)C[C@@H]1CC[NH2+]C1	ZINC000077519449	177277587	/nfs/dbraw/zinc/27/75/87/177277587.db2.gz	RMESZVDONGYPLK-LLVKDONJSA-N	1	0	273.340	1.173	50	0		CDAARO
Cc1ccccc1OCCN(C)C(=O)[C@H]1CCC[C@@H]1[NH3+]	ZINC000085367448	292632973	/nfs/dbraw/zinc/63/29/73/292632973.db2.gz	OVZWLLRPFSXDRH-KBPBESRZSA-N	1	0	276.380	1.960	50	0		CDAARO
[NH3+]C1CCN(c2nnc3ccc(Cl)cn32)CC1	ZINC000085347913	274943896	/nfs/dbraw/zinc/94/38/96/274943896.db2.gz	NCFZDOBMLLHUDY-UHFFFAOYSA-N	1	0	251.721	1.310	50	0		CDAARO
CC(C)[NH2+]C[C@H](O)CN[C@H](C)[C@@H]1COc2ccccc2O1	ZINC000004610570	275657008	/nfs/dbraw/zinc/65/70/08/275657008.db2.gz	AANQMDAPDINSQM-WWGRRREGSA-N	1	0	294.395	1.163	50	0		CDAARO
CC(C)c1ccc([C@@H]([NH3+])CNS(=O)(=O)N(C)C)cc1	ZINC000123761571	278045668	/nfs/dbraw/zinc/04/56/68/278045668.db2.gz	NTIYFEMIGNUJBA-ZDUSSCGKSA-N	1	0	285.413	1.206	50	0		CDAARO
CSCc1ccc(C(=O)N2CC[NH2+]C[C@H]2C)cc1	ZINC000124827981	278140321	/nfs/dbraw/zinc/14/03/21/278140321.db2.gz	WECARQCEWDGBOL-LLVKDONJSA-N	1	0	264.394	1.984	50	0		CDAARO
C[C@H](N1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)C(F)(F)F	ZINC000245595155	278232570	/nfs/dbraw/zinc/23/25/70/278232570.db2.gz	HEFQBLKYQXOKIC-SDDRHHMPSA-N	1	0	280.334	1.858	50	0		CDAARO
CC(C)(C)CC[NH2+]CC1(S(C)(=O)=O)CCOCC1	ZINC000097103829	278318878	/nfs/dbraw/zinc/31/88/78/278318878.db2.gz	PVFOCTDHWYEYNL-UHFFFAOYSA-N	1	0	277.430	1.606	50	0		CDAARO
CC(C)NS(=O)(=O)CC[NH2+][C@@H]1CC(C)(C)C[C@@H]1C	ZINC000193131064	279610536	/nfs/dbraw/zinc/61/05/36/279610536.db2.gz	UJNUMLWWYNECJS-NWDGAFQWSA-N	1	0	276.446	1.729	50	0		CDAARO
Cc1c(Cl)cccc1OCC(=O)N1CCC[C@@H]1C[NH3+]	ZINC000262605074	280233497	/nfs/dbraw/zinc/23/34/97/280233497.db2.gz	BHNXFGMAXGBRHT-LLVKDONJSA-N	1	0	282.771	1.977	50	0		CDAARO
CC[C@H]1c2ccsc2CC[N@H+]1CCC(=O)NC(=O)NC	ZINC000030224525	281281269	/nfs/dbraw/zinc/28/12/69/281281269.db2.gz	WNUZGBSUFHGJIL-NSHDSACASA-N	1	0	295.408	1.903	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)[C@H]1CCOc2ccccc21	ZINC000111188999	288318515	/nfs/dbraw/zinc/31/85/15/288318515.db2.gz	DGIVSORBBMSFHR-YPMHNXCESA-N	1	0	260.337	1.373	50	0		CDAARO
[NH3+]C[C@H]1CCCN1c1nc(C(F)(F)F)nc2nc[nH]c21	ZINC000557300206	290340298	/nfs/dbraw/zinc/34/02/98/290340298.db2.gz	LIAZLHMXLQOCFE-ZCFIWIBFSA-N	1	0	286.261	1.299	50	0		CDAARO
CC(C)[C@@H](CNC(=O)Cn1nc2ccccc2n1)[NH+](C)C	ZINC000534580361	328311636	/nfs/dbraw/zinc/31/16/36/328311636.db2.gz	IVKKDXSVMSYVIZ-CQSZACIVSA-N	1	0	289.383	1.134	50	0		CDAARO
O=C(N[C@H]1COC[C@@H]1[NH+]1CCCCC1)c1ccoc1	ZINC000534584943	328314874	/nfs/dbraw/zinc/31/48/74/328314874.db2.gz	MKQKAGISIFEJIP-STQMWFEESA-N	1	0	264.325	1.263	50	0		CDAARO
O=C(NCCc1ncc[nH]1)C1([NH+]2CCCC2)CCCC1	ZINC000534591599	328318364	/nfs/dbraw/zinc/31/83/64/328318364.db2.gz	CCKIGOADFWPKJB-UHFFFAOYSA-N	1	0	276.384	1.477	50	0		CDAARO
O=C([C@H]1C=CC[NH2+]1)N1Cc2cnc(-c3ccccc3)nc2C1	ZINC000534590162	328317910	/nfs/dbraw/zinc/31/79/10/328317910.db2.gz	AJYHKFRCVNANKD-CQSZACIVSA-N	1	0	292.342	1.514	50	0		CDAARO
CCC[C@H](CNC(=O)c1ccc(O)c(F)c1)[NH+](C)C	ZINC000534641463	328336216	/nfs/dbraw/zinc/33/62/16/328336216.db2.gz	VAFOAITXVSSQPX-LLVKDONJSA-N	1	0	268.332	1.991	50	0		CDAARO
CCN(CCn1cccn1)C(=O)[C@@H]1CCC[NH2+]CC1	ZINC000534661940	328349787	/nfs/dbraw/zinc/34/97/87/328349787.db2.gz	LPJNFULPINRKEC-CYBMUJFWSA-N	1	0	264.373	1.121	50	0		CDAARO
COCCN(Cc1ccsc1)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000534664000	328351364	/nfs/dbraw/zinc/35/13/64/328351364.db2.gz	ROSSQBPWQBFYIA-LBPRGKRZSA-N	1	0	266.366	1.251	50	0		CDAARO
CC(C)[C@@H](CNc1ccc(CS(C)(=O)=O)cn1)[NH+](C)C	ZINC000534664247	328351534	/nfs/dbraw/zinc/35/15/34/328351534.db2.gz	KUJBRJSLRHBINF-CYBMUJFWSA-N	1	0	299.440	1.624	50	0		CDAARO
C[NH+](C)Cc1ccccc1CNC(=O)N1CC[C@H](CO)C1	ZINC000304331968	328378745	/nfs/dbraw/zinc/37/87/45/328378745.db2.gz	WPNBXSIVTDDTIO-ZDUSSCGKSA-N	1	0	291.395	1.272	50	0		CDAARO
O=C(Nc1ccn(CC(F)F)n1)[C@@H](C1CC1)[NH+]1CCCC1	ZINC000097376275	323208146	/nfs/dbraw/zinc/20/81/46/323208146.db2.gz	VRAIZWQBHZKQGE-CYBMUJFWSA-N	1	0	298.337	1.961	50	0		CDAARO
C[NH2+]Cc1nc(C)nn1-c1ccc2c(c1)OCCO2	ZINC000096150089	327203936	/nfs/dbraw/zinc/20/39/36/327203936.db2.gz	LGJSMDDSDLBQHV-UHFFFAOYSA-N	1	0	260.297	1.066	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1C[C@H](OC(=O)[C@H](CO)c1ccccc1)C2	ZINC000100068360	482447589	/nfs/dbraw/zinc/44/75/89/482447589.db2.gz	RKUNBYITZUJHSG-QKPAOTATSA-N	1	0	289.375	1.931	50	0	biogenic,investigational	CDAARO
O=C([C@H]1Cc2ccccc2C[NH2+]1)N1CCc2[nH]cnc2C1	ZINC000095368906	482556998	/nfs/dbraw/zinc/55/69/98/482556998.db2.gz	YOWVJOSSPKQAPC-CQSZACIVSA-N	1	0	282.347	1.009	50	0		CDAARO
CN(Cc1nncn1C)[C@@H]1CCN(c2ccc(F)cc2)C1	ZINC000670437993	482980471	/nfs/dbraw/zinc/98/04/71/482980471.db2.gz	ZZBJKLFDIXRXQP-CQSZACIVSA-N	1	0	289.358	1.665	50	0		CDAARO
Cc1ncn(CCNC(=O)C[NH+]2CCCCCC2)c1C	ZINC000670439117	482982816	/nfs/dbraw/zinc/98/28/16/482982816.db2.gz	ISGPDKOLHMQOOQ-UHFFFAOYSA-N	1	0	278.400	1.492	50	0		CDAARO
CC(=O)NCCC1CC[NH+](Cc2cnc(C)n2C)CC1	ZINC000670442989	482989272	/nfs/dbraw/zinc/98/92/72/482989272.db2.gz	BYAIVXYHFIEIPY-UHFFFAOYSA-N	1	0	278.400	1.467	50	0		CDAARO
CC(C)[C@H](CNC(=O)c1cc(O)ccc1N)[NH+]1CCCC1	ZINC000670451317	483013418	/nfs/dbraw/zinc/01/34/18/483013418.db2.gz	BAGREOQKKBONCA-HNNXBMFYSA-N	1	0	291.395	1.825	50	0		CDAARO
Cc1nnc([C@@H](C)NC(=O)c2ccc(CN(C)C)o2)[nH]1	ZINC000670455867	483035230	/nfs/dbraw/zinc/03/52/30/483035230.db2.gz	IFWXDZRZSXECBZ-MRVPVSSYSA-N	1	0	277.328	1.259	50	0		CDAARO
CNC(=O)C[C@@H]1CC[N@H+](CCCOc2ccccc2)C1	ZINC000670459177	483041307	/nfs/dbraw/zinc/04/13/07/483041307.db2.gz	IJYFQMRQPFBFCC-AWEZNQCLSA-N	1	0	276.380	1.914	50	0		CDAARO
OCC[C@H]1CN(c2ncc(Cl)cn2)CC[N@@H+]1CC1CC1	ZINC000670461926	483050672	/nfs/dbraw/zinc/05/06/72/483050672.db2.gz	DAEHXDRPRFXPFP-ZDUSSCGKSA-N	1	0	296.802	1.413	50	0		CDAARO
Cc1n[nH]c(C2CC[NH+]([C@@H]3CCSC3)CC2)n1	ZINC000670470550	483070187	/nfs/dbraw/zinc/07/01/87/483070187.db2.gz	ZMWNDMVVHRJUBQ-LLVKDONJSA-N	1	0	252.387	1.798	50	0		CDAARO
OCCOCC[N@@H+]1CCSC2(CCCCC2)C1	ZINC000084544020	483286377	/nfs/dbraw/zinc/28/63/77/483286377.db2.gz	LBEZUZRXFGKCIF-UHFFFAOYSA-N	1	0	259.415	1.747	50	0		CDAARO
CC[C@@H]1CN(C(=O)c2nc(C)ncc2Cl)C[C@@H]1[NH+](C)C	ZINC000084735547	483320334	/nfs/dbraw/zinc/32/03/34/483320334.db2.gz	BZQMGPDBQLHRLG-PWSUYJOCSA-N	1	0	296.802	1.851	50	0		CDAARO
COCc1nc(NCc2cccnc2)cc(C2CC([NH3+])C2)n1	ZINC000223196616	523214260	/nfs/dbraw/zinc/21/42/60/523214260.db2.gz	KDANCEQNKHSTEQ-UHFFFAOYSA-N	1	0	299.378	1.835	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(CC1)OCC[C@@H]2[NH3+]	ZINC000110915343	538155202	/nfs/dbraw/zinc/15/52/02/538155202.db2.gz	GUJCTKQTCXPTIV-JTQLQIEISA-N	1	0	256.346	1.504	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@@H]1c1ccc(NS(C)(=O)=O)cc1	ZINC000757215122	577036261	/nfs/dbraw/zinc/03/62/61/577036261.db2.gz	VAGOQANJCNJSJX-GWCFXTLKSA-N	1	0	268.382	1.914	50	0		CDAARO
CCN(CCc1nc2c(cccc2C)[nH]1)C(=O)[C@H]1C=CC[NH2+]1	ZINC000952989395	615060460	/nfs/dbraw/zinc/06/04/60/615060460.db2.gz	CZFVQDXRJNYPNS-CQSZACIVSA-N	1	0	298.390	1.790	50	0		CDAARO
CCOc1cc(N2C[C@H]3CC[N@H+](C)C[C@@H]3C2)ncn1	ZINC000952991657	615508371	/nfs/dbraw/zinc/50/83/71/615508371.db2.gz	FUOIOFQEIDEHDL-VXGBXAGGSA-N	1	0	262.357	1.263	50	0		CDAARO
CN(C)[C@@H](CNC(=O)C[NH+]1CCCCCC1)c1ccco1	ZINC000952973334	615974008	/nfs/dbraw/zinc/97/40/08/615974008.db2.gz	SCRXHEVLYNQZPG-AWEZNQCLSA-N	1	0	293.411	1.875	50	0		CDAARO
CC[C@H](C(=O)NCCc1ccc(O)cc1)[N@H+](C)CC	ZINC000822555068	1161928566	/nfs/dbraw/zinc/92/85/66/1161928566.db2.gz	FRRPOAZJWIKXPW-CQSZACIVSA-N	1	0	264.369	1.781	50	0		CDAARO
CSc1nc(N)cc(N(C)C[C@H]2CCC[N@@H+]2C)n1	ZINC000156843174	1178193973	/nfs/dbraw/zinc/19/39/73/1178193973.db2.gz	ICAUVDLFUMYZOA-SECBINFHSA-N	1	0	267.402	1.311	50	0		CDAARO
C[N@@H+]1CCCC[C@@H](CNC(=O)NCc2ncccn2)C1	ZINC000858619650	836011228	/nfs/dbraw/zinc/01/12/28/836011228.db2.gz	PBCDWJAOBHLUHR-LBPRGKRZSA-N	1	0	277.372	1.008	50	0		CDAARO
CCC[NH+]1CCC(N[C@H]2CCCCNC2=O)CC1	ZINC000004030534	837209438	/nfs/dbraw/zinc/20/94/38/837209438.db2.gz	SIAGKKVXHNAWGE-ZDUSSCGKSA-N	1	0	253.390	1.119	50	0		CDAARO
CC(C)C[N@@H+]1CCN(Cc2ccccn2)C[C@H]1CCO	ZINC000107030883	838041039	/nfs/dbraw/zinc/04/10/39/838041039.db2.gz	XQFSTZIQNICWPL-MRXNPFEDSA-N	1	0	277.412	1.606	50	0		CDAARO
C[N@H+]1C[C@H]2CC[C@@H](C1)C2[NH2+]C[C@](C)(O)c1ccsc1	ZINC000863984336	838794583	/nfs/dbraw/zinc/79/45/83/838794583.db2.gz	TUPFNXOWQJVBLQ-KNUOEEMSSA-N	1	0	280.437	1.885	50	0		CDAARO
C[N@@H+]1CCCN(c2cc([C@@H]3CCOC3)ncn2)CC1	ZINC000426405115	839640565	/nfs/dbraw/zinc/64/05/65/839640565.db2.gz	IRICYYHHTGUFKA-GFCCVEGCSA-N	1	0	262.357	1.122	50	0		CDAARO
N#Cc1cnnc(N[C@@H]2[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1	ZINC000398353122	840005570	/nfs/dbraw/zinc/00/55/70/840005570.db2.gz	GQVJPGUKTDLUDL-QLPKVWCKSA-N	1	0	291.358	1.312	50	0		CDAARO
O=C1COC[C@H]2C[NH2+]CC[C@@H]2N1Cc1ccccc1	ZINC000306591083	840045183	/nfs/dbraw/zinc/04/51/83/840045183.db2.gz	VIDQLCPBPXTUGA-KGLIPLIRSA-N	1	0	260.337	1.024	50	0		CDAARO
C[C@@H](CN(C)CCO)[NH2+]CCc1cccc(F)c1	ZINC000952968273	840300376	/nfs/dbraw/zinc/30/03/76/840300376.db2.gz	PDPACOGNQQEMLF-LBPRGKRZSA-N	1	0	254.349	1.270	50	0		CDAARO
c1coc(-c2nnc(CN3CC[N@@H+]4CCCC[C@H]4C3)o2)c1	ZINC000246134918	840499646	/nfs/dbraw/zinc/49/96/46/840499646.db2.gz	CSHGTYJQHJNBPN-LBPRGKRZSA-N	1	0	288.351	2.000	50	0		CDAARO
C[C@H](CCC(=O)N(C)Cc1nccn1C)[NH+]1CCCC1	ZINC000426428400	842009975	/nfs/dbraw/zinc/00/99/75/842009975.db2.gz	UISBMSVFTMVUCU-CYBMUJFWSA-N	1	0	278.400	1.643	50	0		CDAARO
CC(C)(C(=O)NCc1csc(N)n1)[NH+]1CCCC1	ZINC000426486162	842284083	/nfs/dbraw/zinc/28/40/83/842284083.db2.gz	MZOCTEFOLVXJNP-UHFFFAOYSA-N	1	0	268.386	1.046	50	0		CDAARO
c1ccc(-c2ccc(NC[C@@H]3C[NH2+]CCO3)nn2)cc1	ZINC000032598274	842934672	/nfs/dbraw/zinc/93/46/72/842934672.db2.gz	GJIHWFDLLWKXCV-ZDUSSCGKSA-N	1	0	270.336	1.544	50	0		CDAARO
COc1ccc(/C(C)=C\C(=O)N2CC[NH2+][C@H](C)C2)cc1	ZINC000588536739	896944067	/nfs/dbraw/zinc/94/40/67/896944067.db2.gz	JGARUMSFFBYLGH-KXXVWKPMSA-N	1	0	274.364	1.919	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CNCc2cnccc2Cl)C1	ZINC000952869598	910422001	/nfs/dbraw/zinc/42/20/01/910422001.db2.gz	WJAMQSAAWQICAX-GFCCVEGCSA-N	1	0	283.803	1.793	50	0		CDAARO
CC(C)[N@@H+]1CCCN(C(=O)CSc2nccn2C)CC1	ZINC000952873110	910429496	/nfs/dbraw/zinc/42/94/96/910429496.db2.gz	VGMDWPQWHFPAJS-UHFFFAOYSA-N	1	0	296.440	1.455	50	0		CDAARO
CC[C@@H](C)C[NH+]1CCC(O)(c2ccnn2C)CC1	ZINC000952882498	910450217	/nfs/dbraw/zinc/45/02/17/910450217.db2.gz	RMZWHQLKYFISQZ-GFCCVEGCSA-N	1	0	251.374	1.750	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1ccc(OCCO)cc1	ZINC000952884885	910459562	/nfs/dbraw/zinc/45/95/62/910459562.db2.gz	OTDLDEAFNLYKHH-CHWSQXEVSA-N	1	0	292.379	1.222	50	0		CDAARO
CCc1ncc(CN(C)C[C@@H]2CC[N@@H+](CC)C2)cn1	ZINC000823104885	925672603	/nfs/dbraw/zinc/67/26/03/925672603.db2.gz	DVDPTXIZBLDANS-ZDUSSCGKSA-N	1	0	262.401	1.813	50	0		CDAARO
Cc1nc(NC(=O)N2CC[N@@H+](C(C)C)[C@H](C)C2)nn1C	ZINC000048422463	937349125	/nfs/dbraw/zinc/34/91/25/937349125.db2.gz	CGZOWIPNAKZAGW-SNVBAGLBSA-N	1	0	280.376	1.070	50	0		CDAARO
CN(C)c1cc(C[NH2+][C@@H]2CCC(=O)NC23CCC3)ccn1	ZINC000585080540	930853494	/nfs/dbraw/zinc/85/34/94/930853494.db2.gz	MRBXHWWKHBMQKI-CYBMUJFWSA-N	1	0	288.395	1.439	50	0		CDAARO
CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@H+](CC2COCOC2)C1	ZINC000585116869	930969672	/nfs/dbraw/zinc/96/96/72/930969672.db2.gz	KWXCZIXDOYALKN-UKRRQHHQSA-N	1	0	298.427	1.624	50	0		CDAARO
Cc1ccc(=O)n(CC2CC[NH+](CC3(O)CCC3)CC2)n1	ZINC000585502177	932836831	/nfs/dbraw/zinc/83/68/31/932836831.db2.gz	PQSMGPNPHQNSNI-UHFFFAOYSA-N	1	0	291.395	1.179	50	0		CDAARO
Cc1nc(CN(C)CC[N@H+](C)C2CCCC2)no1	ZINC001529160066	968996898	/nfs/dbraw/zinc/99/68/98/968996898.db2.gz	XPOQMBGAVWBNAH-UHFFFAOYSA-N	1	0	252.362	1.684	50	0		CDAARO
CN(C)c1ncc(C[NH2+]CCCc2csc(N)n2)cn1	ZINC001506397989	975148185	/nfs/dbraw/zinc/14/81/85/975148185.db2.gz	QVBOMCWUFYEYIQ-UHFFFAOYSA-N	1	0	292.412	1.304	50	0		CDAARO
CC[N@@H+]1CCC[C@@]2(CCCN(CCn3cnnc3C)C2)C1	ZINC001506412880	975154563	/nfs/dbraw/zinc/15/45/63/975154563.db2.gz	PDDDGCFFKONEOJ-MRXNPFEDSA-N	1	0	291.443	1.784	50	0		CDAARO
CCN(CC[NH+]1CCCC1)Cc1ncnn1CC	ZINC001506415851	975155362	/nfs/dbraw/zinc/15/53/62/975155362.db2.gz	AYNDWDKEFRBVCE-UHFFFAOYSA-N	1	0	251.378	1.216	50	0		CDAARO
C[NH+](C)CCc1nnc(NC(=O)c2cc[nH]c2)s1	ZINC001506417513	975155663	/nfs/dbraw/zinc/15/56/63/975155663.db2.gz	LILMKXUNKVYHAG-UHFFFAOYSA-N	1	0	265.342	1.223	50	0		CDAARO
CNc1ccnc(N2CC[NH+](CCSC)CC2)n1	ZINC001506424952	975159077	/nfs/dbraw/zinc/15/90/77/975159077.db2.gz	NFQZOLUJRRJUQD-UHFFFAOYSA-N	1	0	267.402	1.003	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1ncccc1C(N)=O	ZINC001506424195	975159764	/nfs/dbraw/zinc/15/97/64/975159764.db2.gz	ZIXZNKJJCRWOOW-LLVKDONJSA-N	1	0	262.357	1.467	50	0		CDAARO
O=C(N1CC[NH+](CC2CCCC2)CC1)C1(CO)CC1	ZINC000584902933	341986988	/nfs/dbraw/zinc/98/69/88/341986988.db2.gz	MVDNJHOVGVXJKO-UHFFFAOYSA-N	1	0	266.385	1.093	50	0		CDAARO
CCC[C@@H]1CN(C(=O)c2ccc(=O)[nH]c2)C[C@H]1[NH+](C)C	ZINC000095525543	185003352	/nfs/dbraw/zinc/00/33/52/185003352.db2.gz	STTLNSGRMMVESX-CHWSQXEVSA-N	1	0	277.368	1.177	50	0		CDAARO
O=C(C1CC1)N1CC[N@H+](Cc2ccccc2)C[C@@H](O)C1	ZINC000095523354	185004028	/nfs/dbraw/zinc/00/40/28/185004028.db2.gz	CLEJMYNLUAPCSY-OAHLLOKOSA-N	1	0	274.364	1.102	50	0		CDAARO
Cc1nc2ccsc2c(N[C@@H]2CC[NH2+]C[C@H]2O)n1	ZINC000091468235	282094653	/nfs/dbraw/zinc/09/46/53/282094653.db2.gz	ZRDGAYCVVPPWEL-PSASIEDQSA-N	1	0	264.354	1.134	50	0		CDAARO
O=C1C[C@@H](C[NH2+]C2CSCCSC2)CN1C1CC1	ZINC000584900524	341999617	/nfs/dbraw/zinc/99/96/17/341999617.db2.gz	VOKARVKFKKZRBZ-JTQLQIEISA-N	1	0	286.466	1.436	50	0		CDAARO
Cc1cc(S(=O)(=O)N[C@H]2C[N@@H+](C)C[C@@H]2C)ccc1F	ZINC000084090239	539086100	/nfs/dbraw/zinc/08/61/00/539086100.db2.gz	XKNJIQIIMXAVOD-GWCFXTLKSA-N	1	0	286.372	1.363	50	0		CDAARO
COC1CCC(CCNC(=O)C[N@H+](C)C2CC2)CC1	ZINC000095939116	185035157	/nfs/dbraw/zinc/03/51/57/185035157.db2.gz	ZUHAAIYPDZHNBB-UHFFFAOYSA-N	1	0	268.401	1.792	50	0		CDAARO
CC[C@@H]([NH2+]C1CCSCC1)C(=O)N1CCOCC1	ZINC000095969091	185047393	/nfs/dbraw/zinc/04/73/93/185047393.db2.gz	FNGJREIJKMWTDC-GFCCVEGCSA-N	1	0	272.414	1.109	50	0		CDAARO
C[C@@H](C[C@@H](O)c1cccs1)[NH2+]Cc1cnnn1C	ZINC000095978228	185051889	/nfs/dbraw/zinc/05/18/89/185051889.db2.gz	GJPLLFMZTWDSRY-GXSJLCMTSA-N	1	0	266.370	1.478	50	0		CDAARO
Cn1cc([C@@H]2CC[N@@H+]([C@@H]3Cc4ccccc4[C@H]3O)C2)cn1	ZINC000242242309	361754296	/nfs/dbraw/zinc/75/42/96/361754296.db2.gz	XTSVZHDLTIFBIO-KBRIMQKVSA-N	1	0	283.375	1.868	50	0		CDAARO
CC1CCC(O)(CN2CC[S@](=O)C(C)(C)C2)CC1	ZINC000088615957	539087369	/nfs/dbraw/zinc/08/73/69/539087369.db2.gz	LPMIOXVQAQUDIG-OOKWDQIISA-N	1	0	273.442	1.771	50	0		CDAARO
Cc1cc(C[NH2+][C@H]2CCCCC[C@H]2C(N)=O)no1	ZINC000195571246	342628823	/nfs/dbraw/zinc/62/88/23/342628823.db2.gz	MZGASURYIROXQG-NEPJUHHUSA-N	1	0	251.330	1.507	50	0		CDAARO
Cc1nnsc1CNC(=O)NCC[N@@H+]1CCCC1(C)C	ZINC000585136960	342216095	/nfs/dbraw/zinc/21/60/95/342216095.db2.gz	AIXDDNNFXJATCI-UHFFFAOYSA-N	1	0	297.428	1.520	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@H]1C[N@@H+](C)C[C@H]1C	ZINC000257365989	539096180	/nfs/dbraw/zinc/09/61/80/539096180.db2.gz	FKGJHZJSEDWKHW-PWSUYJOCSA-N	1	0	286.372	1.363	50	0		CDAARO
CC1(C)C[C@@H]([NH2+]CC[C@@H]2CCOC2=O)C(C)(C)O1	ZINC000119832099	342270673	/nfs/dbraw/zinc/27/06/73/342270673.db2.gz	KVYGHHCBOMYYLC-GHMZBOCLSA-N	1	0	255.358	1.875	50	0		CDAARO
C[C@H]([NH2+][C@@H](C)[C@H]1CCCO1)c1nnnn1-c1ccccc1	ZINC000248505616	342270904	/nfs/dbraw/zinc/27/09/04/342270904.db2.gz	WFTZHWHSWLCKDZ-SGMGOOAPSA-N	1	0	287.367	1.880	50	0		CDAARO
CCc1cccc(NC(=O)NC[C@@H]2CC[NH2+]C[C@H]2O)c1	ZINC000426401644	529541036	/nfs/dbraw/zinc/54/10/36/529541036.db2.gz	DZRAYMCOJWGOMX-GXTWGEPZSA-N	1	0	277.368	1.341	50	0		CDAARO
Cc1nnc2n1C[C@H]([NH2+][C@H](C)[C@@H]1C[C@H]1C1CC1)CC2	ZINC000585123196	362053496	/nfs/dbraw/zinc/05/34/96/362053496.db2.gz	MPALWFUWACZIAY-QQUHWDOBSA-N	1	0	260.385	1.926	50	0		CDAARO
CS[C@@H]1CC[C@@H](NC(=O)N2CC[C@H](C[NH+](C)C)C2)C1	ZINC000252584471	342385533	/nfs/dbraw/zinc/38/55/33/342385533.db2.gz	APPWHWAFFFLMAS-JHJVBQTASA-N	1	0	285.457	1.864	50	0		CDAARO
Cc1cc(-n2cncn2)ccc1C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179125859	362252616	/nfs/dbraw/zinc/25/26/16/362252616.db2.gz	DJUHXEOEMPLWFC-CYBMUJFWSA-N	1	0	285.351	1.010	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1C(=O)/C=C/c1cscn1	ZINC000089937790	362323259	/nfs/dbraw/zinc/32/32/59/362323259.db2.gz	LJTHYDJLQYLIET-FSIBCCDJSA-N	1	0	251.355	1.319	50	0		CDAARO
CCNC(=O)N1CC[C@H]([NH2+][C@H](C)c2cnn(C(C)C)c2)C1	ZINC000090412325	362330870	/nfs/dbraw/zinc/33/08/70/362330870.db2.gz	WLWKSMUGPVANSM-OCCSQVGLSA-N	1	0	293.415	1.918	50	0		CDAARO
Cc1c[nH]c(C[N@@H+](C)CC2(C)COC2)c(C)c1=O	ZINC000253537078	362435580	/nfs/dbraw/zinc/43/55/80/362435580.db2.gz	WQDQTEXMFRYTGN-UHFFFAOYSA-N	1	0	250.342	1.872	50	0		CDAARO
CC[N@H+](CCCCO)Cc1[nH]cc(C)c(=O)c1C	ZINC000253537344	362436544	/nfs/dbraw/zinc/43/65/44/362436544.db2.gz	PDYIVNIQQWENHN-UHFFFAOYSA-N	1	0	252.358	1.998	50	0		CDAARO
COc1cc(OC)c([C@@H]2CC[N@H+](C)C[C@H]2O)c(OC)c1	ZINC000038242148	344994325	/nfs/dbraw/zinc/99/43/25/344994325.db2.gz	MGNNDUKLPNLAFW-VXGBXAGGSA-N	1	0	281.352	1.492	50	0		CDAARO
COC(=O)CN1CCC([NH2+][C@H](C)c2cccc(O)c2)CC1	ZINC000192035228	362610045	/nfs/dbraw/zinc/61/00/45/362610045.db2.gz	ZJCODRHSFBLVCL-GFCCVEGCSA-N	1	0	292.379	1.680	50	0		CDAARO
C[C@H](NC(=O)N[C@H]1CCCC[C@@H]1CO)C(C)(C)C[NH+](C)C	ZINC000085425083	179059655	/nfs/dbraw/zinc/05/96/55/179059655.db2.gz	OKKCTEDQBMDOSK-MJBXVCDLSA-N	1	0	299.459	1.813	50	0		CDAARO
COc1csc(C(=O)N2C[C@@H](C)[NH2+][C@H](C)C2)c1	ZINC000128863540	187394943	/nfs/dbraw/zinc/39/49/43/187394943.db2.gz	WFQIWBUFIWVTPV-RKDXNWHRSA-N	1	0	254.355	1.579	50	0		CDAARO
CC(=O)NCCCC(=O)N(C)CC[N@H+](C)C1CCCC1	ZINC000584885925	349344003	/nfs/dbraw/zinc/34/40/03/349344003.db2.gz	KRZWLUUWAXINMR-UHFFFAOYSA-N	1	0	283.416	1.236	50	0		CDAARO
[NH3+][C@H]1CCC[C@@H](C(=O)N2CCC3(CCOCC3)CC2)C1	ZINC000584894872	349355255	/nfs/dbraw/zinc/35/52/55/349355255.db2.gz	HXNXWMHJMLQMHQ-KGLIPLIRSA-N	1	0	280.412	1.923	50	0		CDAARO
CCOC(=O)N1CC[C@H]([N@H+](C)Cc2c[nH]nc2C)C1	ZINC000584895776	349356447	/nfs/dbraw/zinc/35/64/47/349356447.db2.gz	MBGLHNHJVKYQRV-LBPRGKRZSA-N	1	0	266.345	1.381	50	0		CDAARO
Cc1ccoc1C(=O)N1CCC(O)(C[NH+]2CCCC2)CC1	ZINC000584898335	349359898	/nfs/dbraw/zinc/35/98/98/349359898.db2.gz	PRXXJZFMBGBWNE-UHFFFAOYSA-N	1	0	292.379	1.651	50	0		CDAARO
O=C(NCc1ccc2[nH]cnc2c1)[C@@H]1CC12CC[NH2+]CC2	ZINC000584900261	349362255	/nfs/dbraw/zinc/36/22/55/349362255.db2.gz	WOUIYUUMYKAUEI-LBPRGKRZSA-N	1	0	284.363	1.569	50	0		CDAARO
COCCCCN1CCN(C(=O)[C@H](C)[NH+]2CCCC2)CC1	ZINC000584901059	349363285	/nfs/dbraw/zinc/36/32/85/349363285.db2.gz	SZENDMJJYAEVKT-HNNXBMFYSA-N	1	0	297.443	1.042	50	0		CDAARO
C[C@H](C[NH2+][C@@H](C)c1ccc2c(c1)OCO2)[S@](C)=O	ZINC000090843419	180044481	/nfs/dbraw/zinc/04/44/81/180044481.db2.gz	XHZGZIYQENGZDY-AUSHCKSDSA-N	1	0	269.366	1.833	50	0		CDAARO
Cc1cccc(S(=O)(=O)N[C@H]2CCC[NH2+][C@@H]2C)c1	ZINC000091496961	180172416	/nfs/dbraw/zinc/17/24/16/180172416.db2.gz	OYPFHDCQEYMPRI-YPMHNXCESA-N	1	0	268.382	1.414	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@@H]1NC(=O)c1ccc(F)cc1F	ZINC000091496675	180172718	/nfs/dbraw/zinc/17/27/18/180172718.db2.gz	LMXCRDTVFHGTKO-UFBFGSQYSA-N	1	0	254.280	1.835	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCC[NH2+][C@@H]2C)cc1C	ZINC000091496973	180172761	/nfs/dbraw/zinc/17/27/61/180172761.db2.gz	WDDOTLZLDGROTP-OCCSQVGLSA-N	1	0	282.409	1.722	50	0		CDAARO
c1cn(CC[N@@H+]2CCC[C@H](c3nncn3C3CC3)C2)cn1	ZINC000091629827	180210706	/nfs/dbraw/zinc/21/07/06/180210706.db2.gz	USYKCAFTPZPGCZ-ZDUSSCGKSA-N	1	0	286.383	1.689	50	0		CDAARO
Cc1cc(C)c2[nH]c(CN3C[C@@H]4C[C@H]3C[NH2+]4)cc(=O)c2c1	ZINC000091636044	180211588	/nfs/dbraw/zinc/21/15/88/180211588.db2.gz	BDTMCBUEWMYIBH-JSGCOSHPSA-N	1	0	283.375	1.691	50	0		CDAARO
Cc1cc(C)c2[nH]c(C[N@@H+]3CC[C@@H](O)C3)cc(=O)c2c1	ZINC000091657103	180218097	/nfs/dbraw/zinc/21/80/97/180218097.db2.gz	UQQJDSULXFCYAD-CYBMUJFWSA-N	1	0	272.348	1.712	50	0		CDAARO
COc1cc(F)c(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)c(F)c1	ZINC000091755931	180247008	/nfs/dbraw/zinc/24/70/08/180247008.db2.gz	HGMSOZNXSXPBHR-MFKMUULPSA-N	1	0	296.317	1.783	50	0		CDAARO
CC(C)N1CCCC[C@@H]1C[NH2+][C@H](C)CS(C)(=O)=O	ZINC000110706549	350284497	/nfs/dbraw/zinc/28/44/97/350284497.db2.gz	DBEFSNPSGLKEPA-CHWSQXEVSA-N	1	0	276.446	1.272	50	0		CDAARO
CCc1cc(C[NH+]2CCC3(CC2)OCCC[C@H]3O)on1	ZINC000091872079	180278128	/nfs/dbraw/zinc/27/81/28/180278128.db2.gz	NCTPGIPZEOIOOI-CQSZACIVSA-N	1	0	280.368	1.743	50	0		CDAARO
CC[C@@H]1CN(Cc2cc(C)on2)CC[N@@H+]1C[C@H](C)O	ZINC000106906701	186149411	/nfs/dbraw/zinc/14/94/11/186149411.db2.gz	GSVZITIQDWVRKN-SMDDNHRTSA-N	1	0	267.373	1.260	50	0		CDAARO
COc1ccc(CCN2CC[N@H+](C[C@H](C)O)[C@H](C)C2)cc1	ZINC000106840894	186139894	/nfs/dbraw/zinc/13/98/94/186139894.db2.gz	ZBIXTVOIBJNZMX-CABCVRRESA-N	1	0	292.423	1.625	50	0		CDAARO
CC(C)c1nccn1C[C@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000110694202	186313485	/nfs/dbraw/zinc/31/34/85/186313485.db2.gz	OQPUCFZDIPNVQJ-HZSPNIEDSA-N	1	0	281.400	1.477	50	0		CDAARO
COC(=O)[C@@]1(C[NH3+])C[C@@]12CCN(C(=O)OC(C)(C)C)C2	ZINC000260106095	351202202	/nfs/dbraw/zinc/20/22/02/351202202.db2.gz	GXIZSJFUUBKNJU-KGLIPLIRSA-N	1	0	284.356	1.135	50	0		CDAARO
C[N@@H+]1CCCC[C@H](CNC(=O)NCC2=CCOCC2)C1	ZINC000624145144	351440975	/nfs/dbraw/zinc/44/09/75/351440975.db2.gz	LTJJKULBWDTLMW-CQSZACIVSA-N	1	0	281.400	1.364	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)Cc1cccc(F)c1F	ZINC000122626395	187041740	/nfs/dbraw/zinc/04/17/40/187041740.db2.gz	WJVGWWGADXSPDU-NSHDSACASA-N	1	0	268.307	1.718	50	0		CDAARO
Nc1nc(NCc2ccccn2)cc(NC2CC2)n1	ZINC000065406821	363098617	/nfs/dbraw/zinc/09/86/17/363098617.db2.gz	HOQDOJBEGAIKCB-UHFFFAOYSA-N	1	0	256.313	1.640	50	0		CDAARO
C[C@@H](CN1CCOCC1)[N@H+](C)Cc1cccc(O)c1	ZINC000271607482	191239224	/nfs/dbraw/zinc/23/92/24/191239224.db2.gz	JUARGXDLDZIXMZ-ZDUSSCGKSA-N	1	0	264.369	1.545	50	0		CDAARO
C[C@@H](CN1CCOCC1)[NH2+]Cc1cc(F)ccc1F	ZINC000036932630	363295308	/nfs/dbraw/zinc/29/53/08/363295308.db2.gz	ZUGIXARNPBNOTL-NSHDSACASA-N	1	0	270.323	1.775	50	0		CDAARO
C[C@H]([NH3+])C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000121581145	366189180	/nfs/dbraw/zinc/18/91/80/366189180.db2.gz	WQYINDSPEMMTEK-FPMFFAJLSA-N	1	0	262.353	1.448	50	0		CDAARO
COc1cc2ncnc(N3CC[NH+](C)CC3)c2cc1OC	ZINC000000116766	355887845	/nfs/dbraw/zinc/88/78/45/355887845.db2.gz	ULBUABJAUQKQMH-UHFFFAOYSA-N	1	0	288.351	1.399	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)C(=O)Nc1ccc(F)cc1	ZINC000002854919	355984407	/nfs/dbraw/zinc/98/44/07/355984407.db2.gz	NTYBNCQWAGMSGA-ZDUSSCGKSA-N	1	0	293.342	1.365	50	0		CDAARO
OCC[N@H+](C[C@H](O)C(F)(F)F)C1CCCCC1	ZINC000004050529	356016218	/nfs/dbraw/zinc/01/62/18/356016218.db2.gz	FTDPRWLODNNXTF-JTQLQIEISA-N	1	0	255.280	1.537	50	0		CDAARO
COc1cc(C[NH2+]CCOCCO)cc(Cl)c1OC	ZINC000010435730	356258431	/nfs/dbraw/zinc/25/84/31/356258431.db2.gz	VWOQUVFPBPVOBC-UHFFFAOYSA-N	1	0	289.759	1.456	50	0		CDAARO
Cc1cccc(CN2CCC[C@@](O)(C[NH2+]C3CC3)C2=O)c1	ZINC000012441140	356300171	/nfs/dbraw/zinc/30/01/71/356300171.db2.gz	KTDIFONIFLFBTC-QGZVFWFLSA-N	1	0	288.391	1.601	50	0		CDAARO
CNC(=O)NC(=O)C[N@@H+]1CCC[C@H]1c1ccccc1	ZINC000014077195	356373120	/nfs/dbraw/zinc/37/31/20/356373120.db2.gz	GIEXRSAISGJRDB-LBPRGKRZSA-N	1	0	261.325	1.279	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CCC[C@H]1c1cccc(N(C)C)c1	ZINC000127104977	356384995	/nfs/dbraw/zinc/38/49/95/356384995.db2.gz	OOBDHEYVBWJEML-CVEARBPZSA-N	1	0	278.396	1.897	50	0		CDAARO
CC[NH+]1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000019536694	356491439	/nfs/dbraw/zinc/49/14/39/356491439.db2.gz	LBBKNJKLEPMFMH-UHFFFAOYSA-N	1	0	261.369	1.783	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000019790721	356504136	/nfs/dbraw/zinc/50/41/36/356504136.db2.gz	KPJRIDHMLWHCQZ-CQSZACIVSA-N	1	0	298.814	1.717	50	0		CDAARO
COc1ccc(OCC(=O)N2CC[NH+](C(C)C)CC2)cc1	ZINC000019841957	356510036	/nfs/dbraw/zinc/51/00/36/356510036.db2.gz	SZQNBUCVFPCYJF-UHFFFAOYSA-N	1	0	292.379	1.627	50	0		CDAARO
CC(C)NC(=O)N1CCC(C[NH3+])(C(F)(F)F)CC1	ZINC000725264782	538455782	/nfs/dbraw/zinc/45/57/82/538455782.db2.gz	WTMZXIHABNCTKZ-UHFFFAOYSA-N	1	0	267.295	1.708	50	0		CDAARO
CCC1CCC([NH+]2CCN(CCOCCO)CC2)CC1	ZINC000022027636	356598001	/nfs/dbraw/zinc/59/80/01/356598001.db2.gz	XJWBIELNKCIEMP-UHFFFAOYSA-N	1	0	284.444	1.582	50	0		CDAARO
CC[N@H+](CCC(N)=O)Cc1ccc(OC)c(F)c1	ZINC000025366533	356673714	/nfs/dbraw/zinc/67/37/14/356673714.db2.gz	UEASZJXWMJIBRZ-UHFFFAOYSA-N	1	0	254.305	1.532	50	0		CDAARO
NC(=O)[C@H]([NH2+]CCc1ccc2c(c1)OCO2)c1ccccc1	ZINC000026221687	356689075	/nfs/dbraw/zinc/68/90/75/356689075.db2.gz	WNXUIQBYQXTZFZ-MRXNPFEDSA-N	1	0	298.342	1.774	50	0		CDAARO
CCOC(=O)C1=C(C[N@H+](C)[C@@H](C)C(C)(C)C)NC(=O)NC1	ZINC000027134947	356704449	/nfs/dbraw/zinc/70/44/49/356704449.db2.gz	XUQLUYJHBFHCKZ-JTQLQIEISA-N	1	0	297.399	1.483	50	0		CDAARO
CC[C@H](CO)[NH2+]C[C@H](O)Cn1c(C)c(C)c2ccccc21	ZINC000000106239	356734442	/nfs/dbraw/zinc/73/44/42/356734442.db2.gz	CSEDJBHBLGSNMW-CABCVRRESA-N	1	0	290.407	1.980	50	0		CDAARO
C[C@@H]1Cc2cc(C[NH2+]CC(=O)Nc3cnccn3)ccc2O1	ZINC000065424119	357540488	/nfs/dbraw/zinc/54/04/88/357540488.db2.gz	LJWIBWGRVLNEGS-LLVKDONJSA-N	1	0	298.346	1.528	50	0		CDAARO
O=C(NC1CC1)c1cccc(OC[C@@H]2CCC[NH2+]C2)c1	ZINC000066323516	357562050	/nfs/dbraw/zinc/56/20/50/357562050.db2.gz	MXQSAZKBVFLFOY-GFCCVEGCSA-N	1	0	274.364	1.957	50	0		CDAARO
CCCn1ncc(C(=O)N2CC[C@]3(C2)CCC[NH2+]C3)c1C	ZINC000067740219	357622664	/nfs/dbraw/zinc/62/26/64/357622664.db2.gz	ADXMOESCLQTITC-MRXNPFEDSA-N	1	0	290.411	1.817	50	0		CDAARO
CS(=O)(=O)N[C@H]1CC[N@H+](CCCCC(F)(F)F)C1	ZINC000095433792	357624891	/nfs/dbraw/zinc/62/48/91/357624891.db2.gz	FELBFDLHPSZHBU-VIFPVBQESA-N	1	0	288.335	1.343	50	0		CDAARO
C[NH2+]CC(=O)NCc1cccnc1Oc1ccccc1F	ZINC000067833502	357630289	/nfs/dbraw/zinc/63/02/89/357630289.db2.gz	BYGSDOSJPFEGDO-UHFFFAOYSA-N	1	0	289.310	1.849	50	0		CDAARO
CC(C)Cc1cc(C(=O)NC[C@H]2CCC[N@H+](C)C2)[nH]n1	ZINC000067726647	357621507	/nfs/dbraw/zinc/62/15/07/357621507.db2.gz	VCQWNKRKIUJDTP-GFCCVEGCSA-N	1	0	278.400	1.680	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@H]([NH3+])CN1Cc1cccc2[nH]ccc21	ZINC000067956300	357640762	/nfs/dbraw/zinc/64/07/62/357640762.db2.gz	NTQRMNNIAXGAFN-WFASDCNBSA-N	1	0	286.379	1.206	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2cccc(F)c2)CC1	ZINC000023014207	357646656	/nfs/dbraw/zinc/64/66/56/357646656.db2.gz	BOTDJCBLKXJCAV-UHFFFAOYSA-N	1	0	294.370	1.914	50	0		CDAARO
Cc1ccc(O)c(C(=O)N2CC[C@@]3(C2)CCC[NH2+]C3)c1	ZINC000067920296	357637711	/nfs/dbraw/zinc/63/77/11/357637711.db2.gz	NXCAPQZYYFIYAA-INIZCTEOSA-N	1	0	274.364	1.916	50	0		CDAARO
CN(Cc1cnc2ccccc2n1)C(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000072429914	357835281	/nfs/dbraw/zinc/83/52/81/357835281.db2.gz	LOQVWQFVZPNDQY-NWDGAFQWSA-N	1	0	284.363	1.716	50	0		CDAARO
CS(=O)(=O)N[C@@](N)(Cc1ccccc1)c1ccccc1	ZINC000071618121	357838843	/nfs/dbraw/zinc/83/88/43/357838843.db2.gz	HMOGQBNLPAVMMP-HNNXBMFYSA-N	1	0	290.388	1.590	50	0		CDAARO
Cc1cnc(C(=O)NC[C@H](c2ccsc2)[NH+](C)C)cn1	ZINC000023133071	358079218	/nfs/dbraw/zinc/07/92/18/358079218.db2.gz	LSCSTWZNOKTTIQ-CYBMUJFWSA-N	1	0	290.392	1.879	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1C1CN(C(=O)CCc2cnn(C)c2)C1	ZINC000082092245	358147059	/nfs/dbraw/zinc/14/70/59/358147059.db2.gz	LQEKMFMWOGEOBP-CYBMUJFWSA-N	1	0	290.411	1.438	50	0		CDAARO
Cc1cc2cc(C(=O)N3CC[C@@H]([NH3+])[C@H](O)C3)ccc2o1	ZINC000082134900	358148584	/nfs/dbraw/zinc/14/85/84/358148584.db2.gz	ZHRIBLHHFQNRKR-CHWSQXEVSA-N	1	0	274.320	1.275	50	0		CDAARO
O=C(CN1CCCSCC1)Nc1nccs1	ZINC000089984700	358451352	/nfs/dbraw/zinc/45/13/52/358451352.db2.gz	GISLHRQSZROAFS-UHFFFAOYSA-N	1	0	257.384	1.521	50	0		CDAARO
C[C@H](Oc1cccc(OCC[NH+]2CCCCC2)c1)C(N)=O	ZINC000194411357	358519627	/nfs/dbraw/zinc/51/96/27/358519627.db2.gz	OWSPEZDBTPFOLK-ZDUSSCGKSA-N	1	0	292.379	1.804	50	0		CDAARO
C[C@@H](NC(=O)[C@H]1CCC[NH2+]1)c1cccc(F)c1F	ZINC000195554983	358557762	/nfs/dbraw/zinc/55/77/62/358557762.db2.gz	PKJNRXYXNUDCSW-LDYMZIIASA-N	1	0	254.280	1.894	50	0		CDAARO
CC(C)[C@@H]1C[N@H+](Cc2cncnc2)C[C@H]1NC(=O)N(C)C	ZINC000095353785	358683445	/nfs/dbraw/zinc/68/34/45/358683445.db2.gz	PTOQZEPTNCIJEJ-UONOGXRCSA-N	1	0	291.399	1.204	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCC(=O)NCCn2cc(Cl)cn2)C1	ZINC000095373841	358688721	/nfs/dbraw/zinc/68/87/21/358688721.db2.gz	ZLZURVRMVLFXEI-GFCCVEGCSA-N	1	0	298.818	1.775	50	0		CDAARO
CC[N@@H+]1CC[C@@H](C(=O)NCc2csc(CSC)n2)C1	ZINC000097636573	358789656	/nfs/dbraw/zinc/78/96/56/358789656.db2.gz	WCBNXCHFVGCQFV-SNVBAGLBSA-N	1	0	299.465	1.964	50	0		CDAARO
O=C([C@H]1CCc2ccccc21)N1C[C@H]2C[NH2+]C[C@H]2C1	ZINC000097681842	358793084	/nfs/dbraw/zinc/79/30/84/358793084.db2.gz	JYONWFBSNUITFI-GUTXKFCHSA-N	1	0	256.349	1.394	50	0		CDAARO
O=C(NCCn1ccnc1)[C@H]1[C@@H]2C[N@H+](C3CCCC3)C[C@@H]21	ZINC000102528474	358880762	/nfs/dbraw/zinc/88/07/62/358880762.db2.gz	SNSKCFROFILFAI-FICVDOATSA-N	1	0	288.395	1.120	50	0		CDAARO
Cc1c(F)cccc1C[N@H+](C)C[C@@H]1COCCO1	ZINC000215523563	358893364	/nfs/dbraw/zinc/89/33/64/358893364.db2.gz	ZLXABZLDDDWMFC-CYBMUJFWSA-N	1	0	253.317	1.981	50	0		CDAARO
Cn1ccnc1[C@H](O)C1CC[NH+](Cc2ccncc2)CC1	ZINC000215760697	358902128	/nfs/dbraw/zinc/90/21/28/358902128.db2.gz	DWMWTNKMRKVYIN-OAHLLOKOSA-N	1	0	286.379	1.761	50	0		CDAARO
O=C(C[NH2+]C1CC1)N[C@@H]1CCC[C@H]1OCc1ccccc1	ZINC000215911013	358909527	/nfs/dbraw/zinc/90/95/27/358909527.db2.gz	MQBZSMDIIKCLFH-HZPDHXFCSA-N	1	0	288.391	1.993	50	0		CDAARO
Cc1cc(CN2CC[N@@H+](C3CCCC3)C[C@@H](O)C2)on1	ZINC000217139746	358982293	/nfs/dbraw/zinc/98/22/93/358982293.db2.gz	YYTZJOZEHGVEEN-AWEZNQCLSA-N	1	0	279.384	1.404	50	0		CDAARO
OC[C@@H]1CCC[N@@H+]1Cc1ccccc1Cn1cccn1	ZINC000220316483	359163748	/nfs/dbraw/zinc/16/37/48/359163748.db2.gz	PEYRVBQCJOKNLA-INIZCTEOSA-N	1	0	271.364	1.888	50	0		CDAARO
CCOC(=O)[C@]12CC[NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C2	ZINC000261250129	359275800	/nfs/dbraw/zinc/27/58/00/359275800.db2.gz	ZMLGCFGHQXSXAH-NHYWBVRUSA-N	1	0	298.383	1.539	50	0		CDAARO
O=c1[nH]nc2n1CC[N@@H+](CC1CCCCC1)CC2	ZINC000257185292	359512327	/nfs/dbraw/zinc/51/23/27/359512327.db2.gz	WNCLCQIDOJHIQU-UHFFFAOYSA-N	1	0	250.346	1.010	50	0		CDAARO
CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1C[C@@H]1CNC(=O)C1	ZINC000585094337	482828581	/nfs/dbraw/zinc/82/85/81/482828581.db2.gz	LAQZRBYQEKJSNF-IUCAKERBSA-N	1	0	264.291	1.785	50	0		CDAARO
COc1ccc(C(=O)NCC[NH+]2CCCC2)cc1OC	ZINC000000532210	366536301	/nfs/dbraw/zinc/53/63/01/366536301.db2.gz	HJACDFYAISGUAA-UHFFFAOYSA-N	1	0	278.352	1.529	50	0		CDAARO
CC(C)Cn1ccnc1NC(=O)C[N@H+](C)C1CCC1	ZINC000521395361	359966603	/nfs/dbraw/zinc/96/66/03/359966603.db2.gz	SQMCTNXSWIOOMW-UHFFFAOYSA-N	1	0	264.373	1.962	50	0		CDAARO
Nc1ncccc1CN1CC[C@H]([NH+]2CCCCC2)C1	ZINC000062969573	360036920	/nfs/dbraw/zinc/03/69/20/360036920.db2.gz	JKVOEJSZMQEGLS-AWEZNQCLSA-N	1	0	260.385	1.724	50	0		CDAARO
CN1C(=O)N(C)[C@]2(CC[N@H+](Cc3ccccc3)C2)C1=O	ZINC000409420324	360223976	/nfs/dbraw/zinc/22/39/76/360223976.db2.gz	FUNVSFVCCDDCDE-HNNXBMFYSA-N	1	0	273.336	1.155	50	0		CDAARO
[NH3+]C[C@H]1CN(C(=O)c2ccccc2Cl)CCO1	ZINC000011887351	360401013	/nfs/dbraw/zinc/40/10/13/360401013.db2.gz	WHHHJTKYTVWFKJ-VIFPVBQESA-N	1	0	254.717	1.140	50	0		CDAARO
CCCCCNC(=O)Cn1nccc1[C@H]1CCC[NH2+]C1	ZINC000426478014	360565017	/nfs/dbraw/zinc/56/50/17/360565017.db2.gz	MOBRHXXQGDXKRL-ZDUSSCGKSA-N	1	0	278.400	1.657	50	0		CDAARO
Cc1nc[nH]c1CNC(=O)C[C@@H]1CCCC[N@H+]1C	ZINC000426612261	360587393	/nfs/dbraw/zinc/58/73/93/360587393.db2.gz	FAXDSEFIZVYFDI-NSHDSACASA-N	1	0	250.346	1.209	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)c2cnc(-c3ccncc3)s2)C1	ZINC000178266657	189101934	/nfs/dbraw/zinc/10/19/34/189101934.db2.gz	JKQQRFLLXPUKPO-JTQLQIEISA-N	1	0	274.349	1.378	50	0		CDAARO
Cc1cccc(CNC(=O)N(CCO)CC[NH+](C)C)c1	ZINC000426621749	360689612	/nfs/dbraw/zinc/68/96/12/360689612.db2.gz	QGOUPHXVQGMGQY-UHFFFAOYSA-N	1	0	279.384	1.061	50	0		CDAARO
CC[N@@H+]1CCC[C@H](C(=O)NCc2cnc3c(c2)CCC3)C1	ZINC000426656960	360693431	/nfs/dbraw/zinc/69/34/31/360693431.db2.gz	NYJNWQJOEVYAMQ-HNNXBMFYSA-N	1	0	287.407	1.918	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2ccc(-c3ccccn3)cc2)C[C@H]1O	ZINC000426424255	360667612	/nfs/dbraw/zinc/66/76/12/360667612.db2.gz	MOGKXRYTYQXIMQ-NVXWUHKLSA-N	1	0	283.375	1.643	50	0		CDAARO
C[C@H](CCC(=O)N(C)Cc1cnccn1)[NH+]1CCCC1	ZINC000426438728	360670930	/nfs/dbraw/zinc/67/09/30/360670930.db2.gz	OJURCCFXGXGZHC-CYBMUJFWSA-N	1	0	276.384	1.700	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)COc2ccc(F)c(Cl)c2)C1	ZINC000178550219	189126051	/nfs/dbraw/zinc/12/60/51/189126051.db2.gz	KGCKVNZHWHMTHE-VIFPVBQESA-N	1	0	286.734	1.665	50	0		CDAARO
Cc1c[nH]c([C@H](C)NC(=O)c2cccc(OCC[NH3+])c2)n1	ZINC000426662454	361443326	/nfs/dbraw/zinc/44/33/26/361443326.db2.gz	QQOMSFDRGBNTEZ-NSHDSACASA-N	1	0	288.351	1.547	50	0		CDAARO
C[C@@H](C(=O)N1CC(Oc2ccc(F)cc2)C1)[NH+](C)C	ZINC000426683789	361472524	/nfs/dbraw/zinc/47/25/24/361472524.db2.gz	JQKXYSQAEDFWBW-JTQLQIEISA-N	1	0	266.316	1.365	50	0		CDAARO
COC(=O)c1cccc(CSc2nnc(C[NH3+])n2C)c1	ZINC000071373820	361584122	/nfs/dbraw/zinc/58/41/22/361584122.db2.gz	RCMYKHASEXQDHO-UHFFFAOYSA-N	1	0	292.364	1.353	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1ccc(C(N)=O)cn1	ZINC000267530917	363840667	/nfs/dbraw/zinc/84/06/67/363840667.db2.gz	QFGDZVQEARFPCF-LBPRGKRZSA-N	1	0	262.357	1.467	50	0		CDAARO
CCO[C@H]1C[C@](CO)([NH2+]Cc2cncs2)C1(C)C	ZINC000186594218	364615512	/nfs/dbraw/zinc/61/55/12/364615512.db2.gz	KDAAZVNHBSMXNC-WCQYABFASA-N	1	0	270.398	1.799	50	0		CDAARO
NC(=O)C1([NH2+]CC(=O)N2CCCCCCC2)CCCC1	ZINC000089819015	366941449	/nfs/dbraw/zinc/94/14/49/366941449.db2.gz	QHXXZMKBRFWTBC-UHFFFAOYSA-N	1	0	281.400	1.167	50	0		CDAARO
COC[C@@H](O)CN1CCC([NH2+]Cc2ccccc2)CC1	ZINC000089800794	366936918	/nfs/dbraw/zinc/93/69/18/366936918.db2.gz	UIVJVLFGLSPPQT-INIZCTEOSA-N	1	0	278.396	1.248	50	0		CDAARO
CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1[NH2+]Cc1ncc[nH]1	ZINC000089948778	366976413	/nfs/dbraw/zinc/97/64/13/366976413.db2.gz	JIXUYFVYDWFVOF-WCQYABFASA-N	1	0	276.384	1.536	50	0		CDAARO
COc1ccc(NC(=O)CN2C[C@H](C)[C@H](O)C2)cc1Cl	ZINC000239667932	367273936	/nfs/dbraw/zinc/27/39/36/367273936.db2.gz	BSCKULKQEQMMQL-JOYOIKCWSA-N	1	0	298.770	1.600	50	0		CDAARO
O=C(NCC[N@H+]1CC=CCC1)c1cccc2c1OCCO2	ZINC000280282249	367336426	/nfs/dbraw/zinc/33/64/26/367336426.db2.gz	QKMJKVPRGODODW-UHFFFAOYSA-N	1	0	288.347	1.450	50	0		CDAARO
Cc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H](O)C[NH2+]2)cc1F	ZINC000094956484	367747262	/nfs/dbraw/zinc/74/72/62/367747262.db2.gz	RCCZIZIFKNWGKO-GAFUQQFSSA-N	1	0	266.316	1.034	50	0		CDAARO
O=C(c1cc(C2CC2)on1)N1CCC2(C1)CC[NH2+]CC2	ZINC000252550768	368159242	/nfs/dbraw/zinc/15/92/42/368159242.db2.gz	SXJXNGRPWMKMBZ-UHFFFAOYSA-N	1	0	275.352	1.768	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+]1C[C@@H]1CCCC[C@@H]1C	ZINC000097108453	284178846	/nfs/dbraw/zinc/17/88/46/284178846.db2.gz	LHCNCBJSZGOJCB-CYDGBPFRSA-N	1	0	255.358	1.421	50	0		CDAARO
COc1ccc(Cl)cc1NC(=O)N[C@@H]1C[NH2+]CC[C@H]1O	ZINC000299798287	372769149	/nfs/dbraw/zinc/76/91/49/372769149.db2.gz	RWCISFJPLJCOKE-GHMZBOCLSA-N	1	0	299.758	1.193	50	0		CDAARO
CCNC(=O)NC(=O)[C@H](C)[N@H+](C)Cc1ccccc1C	ZINC000015419714	373626287	/nfs/dbraw/zinc/62/62/87/373626287.db2.gz	DWGLQZVSNBNOAE-LBPRGKRZSA-N	1	0	277.368	1.661	50	0		CDAARO
C[C@H](C[NH2+][C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C)N1CCOC[C@H]1C	ZINC000253370237	373680241	/nfs/dbraw/zinc/68/02/41/373680241.db2.gz	OCUWOJHJGIJUTM-LJIZCISZSA-N	1	0	296.455	1.889	50	0		CDAARO
C[C@@H](NC(=O)N1CC[C@H](C[NH+](C)C)C1)c1cnn(C)c1	ZINC000130124401	374356302	/nfs/dbraw/zinc/35/63/02/374356302.db2.gz	USLCLKVVQRYRES-VXGBXAGGSA-N	1	0	279.388	1.074	50	0		CDAARO
c1cnc(N2CC[NH+](C[C@H]3Cc4ccccc4O3)CC2)nc1	ZINC000020820543	374384284	/nfs/dbraw/zinc/38/42/84/374384284.db2.gz	HQJREUFNVUDTJD-OAHLLOKOSA-N	1	0	296.374	1.602	50	0		CDAARO
CCN(CC)C(=O)C1CCN(C(=O)C2([NH3+])CCCC2)CC1	ZINC000096481221	284463420	/nfs/dbraw/zinc/46/34/20/284463420.db2.gz	STEDNWPZQUMPGV-UHFFFAOYSA-N	1	0	295.427	1.365	50	0		CDAARO
c1cnc(N2CCOCC2)c(CNc2cnccn2)c1	ZINC000012297674	374489780	/nfs/dbraw/zinc/48/97/80/374489780.db2.gz	QEEGMOWONPGTHI-UHFFFAOYSA-N	1	0	271.324	1.320	50	0		CDAARO
Cc1ccc(CN2C[C@H](O)[C@@H](O)C2)c(Br)c1	ZINC000278416816	374843244	/nfs/dbraw/zinc/84/32/44/374843244.db2.gz	QYVSOVRIDKGOJD-RYUDHWBXSA-N	1	0	286.169	1.295	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC(C)(C)C[NH3+])c(F)c1	ZINC000095432021	374931236	/nfs/dbraw/zinc/93/12/36/374931236.db2.gz	ASMVZDWQEPBMET-UHFFFAOYSA-N	1	0	260.334	1.150	50	0		CDAARO
C[C@H](CNC(=O)c1ccn2c[nH+]cc2c1)Cn1cccn1	ZINC000095432810	374934142	/nfs/dbraw/zinc/93/41/42/374934142.db2.gz	UISKQWNDUMPRBP-GFCCVEGCSA-N	1	0	283.335	1.597	50	0		CDAARO
CSCC1(C[N@@H+]2CC[C@H](NS(C)(=O)=O)C2)CCC1	ZINC000095435331	374936277	/nfs/dbraw/zinc/93/62/77/374936277.db2.gz	IXKCWTVGTHQDFJ-NSHDSACASA-N	1	0	292.470	1.143	50	0		CDAARO
Cc1nc(CNC(=O)NC[C@@H]2CCC[N@H+]2CC(C)C)no1	ZINC000095440272	374942618	/nfs/dbraw/zinc/94/26/18/374942618.db2.gz	SKSJFGOLIPKDNQ-LBPRGKRZSA-N	1	0	295.387	1.298	50	0		CDAARO
C[C@@H](CNC(=O)c1ccc(O)cc1)C[NH+]1CCN(C)CC1	ZINC000095451533	374951783	/nfs/dbraw/zinc/95/17/83/374951783.db2.gz	GXIPOPSHVMBGKX-ZDUSSCGKSA-N	1	0	291.395	1.006	50	0		CDAARO
Cn1cc(C[NH+]2CCC(OC[C@H]3CCCO3)CC2)cn1	ZINC000095409295	374911604	/nfs/dbraw/zinc/91/16/04/374911604.db2.gz	LWCNLJMBKDYXHU-OAHLLOKOSA-N	1	0	279.384	1.580	50	0		CDAARO
CC(=O)N1CC[C@@H]([N@@H+]2CCC[C@H](O)C2)c2ccccc2C1	ZINC000097165321	375153107	/nfs/dbraw/zinc/15/31/07/375153107.db2.gz	VZDSAFWZUINVFB-DOTOQJQBSA-N	1	0	288.391	1.937	50	0		CDAARO
CCCn1ccc(C(=O)N2CC[N@@H+]3CCC[C@@H]3C2)n1	ZINC000028244548	375219153	/nfs/dbraw/zinc/21/91/53/375219153.db2.gz	KKQJKLNNYYAAGC-GFCCVEGCSA-N	1	0	262.357	1.213	50	0		CDAARO
Cc1cc(N2CCC(c3cc[nH]n3)CC2)nc(N)[nH+]1	ZINC000058300270	375722088	/nfs/dbraw/zinc/72/20/88/375722088.db2.gz	LQUMWFMOMZDNBJ-UHFFFAOYSA-N	1	0	258.329	1.474	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)CCCc1cccs1	ZINC000036235976	375819261	/nfs/dbraw/zinc/81/92/61/375819261.db2.gz	QRMBMAUGADUTRC-RYUDHWBXSA-N	1	0	268.382	1.174	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCN(C(=O)/C=C\c2ccccn2)C1	ZINC000606441353	375823578	/nfs/dbraw/zinc/82/35/78/375823578.db2.gz	JDLGPTAELRLQNY-YHQHFJRFSA-N	1	0	259.353	1.681	50	0		CDAARO
Cn1c(CCC[NH2+][C@H]2CCOC2)nc2ccccc21	ZINC000176498960	375826357	/nfs/dbraw/zinc/82/63/57/375826357.db2.gz	RHXWEBRTDHXSOO-LBPRGKRZSA-N	1	0	259.353	1.884	50	0		CDAARO
CCC(=O)NCCC[N@@H+]1CCN(C)C[C@H]1c1ccccc1	ZINC000242100032	376021258	/nfs/dbraw/zinc/02/12/58/376021258.db2.gz	WDTWJXQOBOWZEW-INIZCTEOSA-N	1	0	289.423	1.891	50	0		CDAARO
COCc1ccc(CNC(=O)CC[C@@H]2CC[NH2+]C2)cc1	ZINC000261884677	190046077	/nfs/dbraw/zinc/04/60/77/190046077.db2.gz	UVYQEFBKQITOOV-CQSZACIVSA-N	1	0	276.380	1.839	50	0		CDAARO
Cc1ncc(C[N@@H+]2CC[C@H](CC(N)=O)C2)n1-c1ccccc1	ZINC000377852746	377106227	/nfs/dbraw/zinc/10/62/27/377106227.db2.gz	TVOJYHPGTKXBEL-CQSZACIVSA-N	1	0	298.390	1.878	50	0		CDAARO
OCC[C@@H]1CCC[N@H+](CCOC[C@H]2CCCO2)C1	ZINC000245343947	378073082	/nfs/dbraw/zinc/07/30/82/378073082.db2.gz	WPTLQIJXXNFCME-UONOGXRCSA-N	1	0	257.374	1.276	50	0		CDAARO
COCCn1cnnc1[C@@H](C)[NH2+]C1CCSCC1	ZINC000065493270	285194623	/nfs/dbraw/zinc/19/46/23/285194623.db2.gz	GXQNGAKRFRWORN-SNVBAGLBSA-N	1	0	270.402	1.471	50	0		CDAARO
C[C@@H]1CC[C@@H](C)N(C(=O)c2csc(CC[NH3+])n2)C1	ZINC000090957672	390521156	/nfs/dbraw/zinc/52/11/56/390521156.db2.gz	YAKONPXDDHMXPC-NXEZZACHSA-N	1	0	267.398	1.905	50	0		CDAARO
CCCc1nc2c(cnn2C)c(N2CC[NH2+][C@H](C)C2)n1	ZINC000072156236	390625338	/nfs/dbraw/zinc/62/53/38/390625338.db2.gz	WTXRXMXBYDKLRO-SNVBAGLBSA-N	1	0	274.372	1.114	50	0		CDAARO
Cc1cc(N2CCCN(C(=O)c3cn[nH]c3)CC2)cc[nH+]1	ZINC000215058261	390987313	/nfs/dbraw/zinc/98/73/13/390987313.db2.gz	OQAPYFSIRWFZLP-UHFFFAOYSA-N	1	0	285.351	1.466	50	0		CDAARO
COCCn1ccnc1C[N@H+](C)CC1CCOCC1	ZINC000216423333	391009408	/nfs/dbraw/zinc/00/94/08/391009408.db2.gz	FCSMQNMVSAWCPO-UHFFFAOYSA-N	1	0	267.373	1.388	50	0		CDAARO
CC[C@H](CO)[NH2+]C[C@@H](O)COc1cc(C)ccc1C	ZINC000026781351	391218012	/nfs/dbraw/zinc/21/80/12/391218012.db2.gz	HYEIYIKEUWTZCS-ZIAGYGMSSA-N	1	0	267.369	1.404	50	0		CDAARO
CC(C)n1ccc(C(=O)N2CCCC[C@H]2CC[NH3+])n1	ZINC000286017627	391558916	/nfs/dbraw/zinc/55/89/16/391558916.db2.gz	JPDXMLSATVCVCZ-LBPRGKRZSA-N	1	0	264.373	1.808	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)[C@@H]2Cc3cc(Cl)ccc3O2)C1	ZINC000269153225	132121900	/nfs/dbraw/zinc/12/19/00/132121900.db2.gz	WNUSLJSORVGAAR-YGRLFVJLSA-N	1	0	294.782	1.711	50	0		CDAARO
CC[C@](CO)([NH2+]CC(=O)N1CCCC1)c1ccccc1	ZINC000096410572	393182134	/nfs/dbraw/zinc/18/21/34/393182134.db2.gz	SCPLKHLSYKRTJN-MRXNPFEDSA-N	1	0	276.380	1.496	50	0		CDAARO
CNc1cc(C)[nH+]c(N2CC[C@@](O)(COC)C(C)(C)C2)n1	ZINC000091586135	135072042	/nfs/dbraw/zinc/07/20/42/135072042.db2.gz	OLXZQIWGRWUGAR-OAHLLOKOSA-N	1	0	294.399	1.441	50	0		CDAARO
CCn1ccnc1C1CCN(c2cc(C)[nH+]c(N)n2)CC1	ZINC000091650923	135072731	/nfs/dbraw/zinc/07/27/31/135072731.db2.gz	NDIBCUNPJIYKNO-UHFFFAOYSA-N	1	0	286.383	1.968	50	0		CDAARO
Cc1ccc(OCC(=O)N2CC[C@H](C[NH3+])C2)c(C)c1	ZINC000178566343	140005821	/nfs/dbraw/zinc/00/58/21/140005821.db2.gz	XXKBJMWSSGWPIP-CYBMUJFWSA-N	1	0	262.353	1.489	50	0		CDAARO
Cc1cc(C)n2ncc(-c3noc([C@@H]4CC[NH2+]C4)n3)c2n1	ZINC000261731021	140381752	/nfs/dbraw/zinc/38/17/52/140381752.db2.gz	KEPZDAMGMPMLFM-SNVBAGLBSA-N	1	0	284.323	1.473	50	0		CDAARO
Cn1nccc1C[NH2+][C@H]1CCCN(c2cccnc2)C1=O	ZINC000097106929	397605544	/nfs/dbraw/zinc/60/55/44/397605544.db2.gz	RRXKOAWTHDMDAV-AWEZNQCLSA-N	1	0	285.351	1.100	50	0		CDAARO
CC(C)c1nnc(NC(=O)NCC[NH+]2CC=CC2)s1	ZINC000101397274	397792577	/nfs/dbraw/zinc/79/25/77/397792577.db2.gz	QPICMSYDRZDTGJ-UHFFFAOYSA-N	1	0	281.385	1.655	50	0		CDAARO
CC[C@H]([NH2+]Cc1cc(=O)n2ccsc2n1)[C@H]1CCCO1	ZINC000182367863	148257295	/nfs/dbraw/zinc/25/72/95/148257295.db2.gz	BTFRYZFNYNMUND-NWDGAFQWSA-N	1	0	293.392	1.803	50	0		CDAARO
COC[C@H]([NH3+])C(=O)N[C@H](C)[C@H]1Oc2ccccc2[C@@H]1C	ZINC000262241328	149038504	/nfs/dbraw/zinc/03/85/04/149038504.db2.gz	HTDWWWVNLRPXHL-QPPBUOOMSA-N	1	0	278.352	1.030	50	0		CDAARO
[NH3+]CCN1C(=O)S/C(=C\c2cccs2)C1=O	ZINC000003215137	169868821	/nfs/dbraw/zinc/86/88/21/169868821.db2.gz	OIWQNIDSQBDLEN-VURMDHGXSA-N	1	0	254.336	1.743	50	0		CDAARO
C[NH+](C)CCCNS(=O)(=O)Cc1ccc(Cl)cc1	ZINC000004740525	170009044	/nfs/dbraw/zinc/00/90/44/170009044.db2.gz	NLZBLIUIIIELFZ-UHFFFAOYSA-N	1	0	290.816	1.711	50	0		CDAARO
COC(=O)c1cccc(NC(=O)c2cc[n+](C)cc2)c1	ZINC000005005885	170054269	/nfs/dbraw/zinc/05/42/69/170054269.db2.gz	PFYQTKKDWLKQIH-UHFFFAOYSA-O	1	0	271.296	1.550	50	0		CDAARO
Cn1nnnc1SCC[NH2+]C/C=C\c1ccccc1	ZINC000006174358	170180007	/nfs/dbraw/zinc/18/00/07/170180007.db2.gz	FCBGYDYUJWATKN-YVMONPNESA-N	1	0	275.381	1.605	50	0		CDAARO
CCN(CC[NH+](C)C)C(=O)c1noc2c1CCCC2	ZINC000007000257	170261553	/nfs/dbraw/zinc/26/15/53/170261553.db2.gz	VLGPUGRXPJUSTF-UHFFFAOYSA-N	1	0	265.357	1.577	50	0		CDAARO
C[C@@H]([NH2+]CCCN1CCOCC1)C(=O)Nc1ccccc1	ZINC000008076217	170317631	/nfs/dbraw/zinc/31/76/31/170317631.db2.gz	BMSXDJGHABBTMP-CQSZACIVSA-N	1	0	291.395	1.326	50	0		CDAARO
COc1cc(NC[C@@H](C(C)C)[NH+](C)C)nc(N)n1	ZINC000534659077	411829592	/nfs/dbraw/zinc/82/95/92/411829592.db2.gz	LBSSMDKORYSURC-VIFPVBQESA-N	1	0	253.350	1.066	50	0		CDAARO
COc1cc(CN2CC[NH+](C(C)C)CC2)cc(OC)c1O	ZINC000019447997	170803557	/nfs/dbraw/zinc/80/35/57/170803557.db2.gz	UFTQHTJRASCFBU-UHFFFAOYSA-N	1	0	294.395	1.935	50	0		CDAARO
CCOc1ccc(OCCN2CC[NH2+]CC2)cc1	ZINC000019728614	170845832	/nfs/dbraw/zinc/84/58/32/170845832.db2.gz	JOHYKLFGCKJLBE-UHFFFAOYSA-N	1	0	250.342	1.369	50	0		CDAARO
C[NH+]1CCN(CCCNC(=O)c2ccccc2)CC1	ZINC000020727104	171271055	/nfs/dbraw/zinc/27/10/55/171271055.db2.gz	LAPINTHBADXQIK-UHFFFAOYSA-N	1	0	261.369	1.054	50	0		CDAARO
COc1ccc(Cn2c(C[NH3+])nc3cccnc32)cc1	ZINC000021778357	171322162	/nfs/dbraw/zinc/32/21/62/171322162.db2.gz	AGQRNURLUFZJQI-UHFFFAOYSA-N	1	0	268.320	1.947	50	0		CDAARO
C[N@H+](Cc1ccc(OC(F)F)cc1)[C@@H]1COC[C@H]1O	ZINC000285664366	196359822	/nfs/dbraw/zinc/35/98/22/196359822.db2.gz	TUARNOGZRIDLBH-VXGBXAGGSA-N	1	0	273.279	1.480	50	0		CDAARO
COc1ccc(C[NH2+][C@H]2CCCCNC2=O)cc1F	ZINC000037502278	173239360	/nfs/dbraw/zinc/23/93/60/173239360.db2.gz	GDGQKQWISBBZTP-LBPRGKRZSA-N	1	0	266.316	1.593	50	0		CDAARO
COCc1nc(CNC2CCC3(CC[NH2+]CC3)CC2)no1	ZINC000071278615	176108411	/nfs/dbraw/zinc/10/84/11/176108411.db2.gz	UGPDYIHJVOPVQI-UHFFFAOYSA-N	1	0	294.399	1.618	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCCN(CCOc2ccc(F)cc2)C1	ZINC000072138782	176322800	/nfs/dbraw/zinc/32/28/00/176322800.db2.gz	XNIXDOJALFIERW-INIZCTEOSA-N	1	0	296.386	1.593	50	0		CDAARO
Nc1cc[nH+]cc1-c1cc(NCCO)nc2[nH]ccc21	ZINC000072157519	176329443	/nfs/dbraw/zinc/32/94/43/176329443.db2.gz	NJNAVAACYSYVHA-UHFFFAOYSA-N	1	0	269.308	1.611	50	0		CDAARO
CCCc1nc(C)c(CNC(=O)C[C@@H]2COCC[NH2+]2)s1	ZINC000072167126	176331872	/nfs/dbraw/zinc/33/18/72/176331872.db2.gz	YCVSBTIEBULDNM-LLVKDONJSA-N	1	0	297.424	1.399	50	0		CDAARO
O=C1NC2(CC[NH2+]CC2)C(=O)N1CCc1ccccc1F	ZINC000076536452	177035011	/nfs/dbraw/zinc/03/50/11/177035011.db2.gz	NKIBJXRAMWLRPP-UHFFFAOYSA-N	1	0	291.326	1.042	50	0		CDAARO
O=S(=O)(Cc1cccc(Cl)c1)NC[C@H]1CCC[NH2+]1	ZINC000518219156	260359107	/nfs/dbraw/zinc/35/91/07/260359107.db2.gz	ZHKQYSPRZZVEHH-GFCCVEGCSA-N	1	0	288.800	1.511	50	0		CDAARO
FC(F)(F)c1nc2nccc([C@H]3CCC[NH2+]C3)n2n1	ZINC000035605730	274908151	/nfs/dbraw/zinc/90/81/51/274908151.db2.gz	WHXSSDSWOIFQJL-ZETCQYMHSA-N	1	0	271.246	1.610	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(N2CC[C@H]([NH3+])C2)CC1	ZINC000026896583	277180938	/nfs/dbraw/zinc/18/09/38/277180938.db2.gz	AXSZRIFILNLUSR-NSHDSACASA-N	1	0	269.389	1.419	50	0		CDAARO
CC[N@H+](CC(=O)NC[C@@H]1COC2(CCCCC2)O1)C1CC1	ZINC000096493022	279055246	/nfs/dbraw/zinc/05/52/46/279055246.db2.gz	NFJIKPHSOOUFQX-CQSZACIVSA-N	1	0	296.411	1.663	50	0		CDAARO
C[C@@H]1CN(CC[N@@H+]2CCC[C@@H](c3nccn3C)C2)CCO1	ZINC000253398499	288170016	/nfs/dbraw/zinc/17/00/16/288170016.db2.gz	UKHJZGFHMQZQAB-HUUCEWRRSA-N	1	0	292.427	1.320	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)/C=C\c1ccc(-n2ccnc2)cc1	ZINC000254950661	289346872	/nfs/dbraw/zinc/34/68/72/289346872.db2.gz	NSQVXHDSSXLMRW-ZBKLQPJUSA-N	1	0	296.374	1.706	50	0		CDAARO
C[C@H]([NH2+][C@H](C(N)=O)c1ccc(F)cc1)[C@H]1CCCO1	ZINC000097374167	290034942	/nfs/dbraw/zinc/03/49/42/290034942.db2.gz	IJUHIDWPZOLMOQ-BIMULSAOSA-N	1	0	266.316	1.509	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@H]1CC(C)(C)OC1(C)C	ZINC000183840559	290346710	/nfs/dbraw/zinc/34/67/10/290346710.db2.gz	YTIMDUYUMKPAPT-JTQLQIEISA-N	1	0	256.390	1.694	50	0		CDAARO
Cc1nc(-c2nc3c(c(=O)[nH]2)CC[NH2+]CC3)cs1	ZINC000077010671	293146715	/nfs/dbraw/zinc/14/67/15/293146715.db2.gz	ZWCQBERKDSGURX-UHFFFAOYSA-N	1	0	262.338	1.302	50	0		CDAARO
O=C(CCCc1cccs1)N1C[C@@H]2[NH2+]CCO[C@H]2C1	ZINC000534577692	328310617	/nfs/dbraw/zinc/31/06/17/328310617.db2.gz	DCGCUTOARSGELD-STQMWFEESA-N	1	0	280.393	1.270	50	0		CDAARO
Cc1ccc(C2([NH2+][C@H](C)CN(C)CCO)CC2)cc1	ZINC000534588339	328316558	/nfs/dbraw/zinc/31/65/58/328316558.db2.gz	JWQSLEAMAYYIQZ-CQSZACIVSA-N	1	0	262.397	1.886	50	0		CDAARO
Cc1n[nH]c(C)c1CCCNC(=O)[C@H]1CCC[NH2+]CC1	ZINC000534590666	328317801	/nfs/dbraw/zinc/31/78/01/328317801.db2.gz	JVUOXIRPYJHCDF-ZDUSSCGKSA-N	1	0	278.400	1.465	50	0		CDAARO
CC[N@H+](C)C1(CNC(=O)[C@@H](O)CC(C)C)CCCC1	ZINC000534646431	328329471	/nfs/dbraw/zinc/32/94/71/328329471.db2.gz	LWYBPLXUMLDKOC-ZDUSSCGKSA-N	1	0	270.417	1.774	50	0		CDAARO
NC(=O)c1cccnc1NC[C@@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534643539	328329497	/nfs/dbraw/zinc/32/94/97/328329497.db2.gz	WDTLKMNYOLRUNM-LBPRGKRZSA-N	1	0	288.395	1.857	50	0		CDAARO
O[C@@]1(CNc2ncccc2C(F)(F)F)CCC[NH2+]C1	ZINC000534645506	328330929	/nfs/dbraw/zinc/33/09/29/328330929.db2.gz	ZGCCJZPLVBICOG-NSHDSACASA-N	1	0	275.274	1.627	50	0		CDAARO
O=C(COCC(F)(F)C(F)F)NCC1CC[NH2+]CC1	ZINC000534660310	328342510	/nfs/dbraw/zinc/34/25/10/328342510.db2.gz	YDEHYHYHBHFSGA-UHFFFAOYSA-N	1	0	286.269	1.019	50	0		CDAARO
c1cc2c(ncnc2N[C@H]2COC[C@@H]2[NH+]2CCCC2)s1	ZINC000534647890	328342987	/nfs/dbraw/zinc/34/29/87/328342987.db2.gz	CEGHEECVPPJEJJ-RYUDHWBXSA-N	1	0	290.392	1.966	50	0		CDAARO
Cn1c(Sc2ccc(F)cn2)nnc1C1CC[NH2+]CC1	ZINC000534656705	328340241	/nfs/dbraw/zinc/34/02/41/328340241.db2.gz	FXAQVPHHZODAKR-UHFFFAOYSA-N	1	0	293.371	1.967	50	0		CDAARO
[NH3+]CC[C@H]1CN(Cc2ccc3cc[nH]c3n2)CCO1	ZINC000534665549	328345008	/nfs/dbraw/zinc/34/50/08/328345008.db2.gz	HDSZFWLIGMJQTQ-ZDUSSCGKSA-N	1	0	260.341	1.113	50	0		CDAARO
Cc1nc(CN2C[C@@H]3CC[C@H]2C[NH2+]C3)sc1C	ZINC000534671619	328347787	/nfs/dbraw/zinc/34/77/87/328347787.db2.gz	YESNSDMHFCQCPR-NEPJUHHUSA-N	1	0	251.399	1.944	50	0		CDAARO
CN(Cc1ccccc1Cl)C(=O)NCC[N@H+](C)CCO	ZINC000534673841	328349030	/nfs/dbraw/zinc/34/90/30/328349030.db2.gz	PLYNTUIULVVSOS-UHFFFAOYSA-N	1	0	299.802	1.406	50	0		CDAARO
Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2[NH2+]CCO)cc1	ZINC000184890009	323376820	/nfs/dbraw/zinc/37/68/20/323376820.db2.gz	ZCOCACMOFVUOKA-GJZGRUSLSA-N	1	0	297.420	1.662	50	0		CDAARO
COC[C@H](O)CN1CCC([NH2+]Cc2cccc(C)c2)CC1	ZINC000089800814	327173579	/nfs/dbraw/zinc/17/35/79/327173579.db2.gz	QQWMSFRMJULHMO-QGZVFWFLSA-N	1	0	292.423	1.556	50	0		CDAARO
CN1CC2(CCC1=O)CCN([C@@H]1CCC[NH2+]C1)CC2	ZINC000091625664	482571894	/nfs/dbraw/zinc/57/18/94/482571894.db2.gz	ASHTVYCJWDJGHG-CYBMUJFWSA-N	1	0	265.401	1.073	50	0		CDAARO
O=c1ccccn1CCC[NH2+]C1CSCCSC1	ZINC000670435256	482973294	/nfs/dbraw/zinc/97/32/94/482973294.db2.gz	LDQBKZJUYRHQJU-UHFFFAOYSA-N	1	0	284.450	1.677	50	0		CDAARO
CC(C)(O)[C@H]1CC[N@@H+](C2CSCCSC2)C1	ZINC000670438902	482983398	/nfs/dbraw/zinc/98/33/98/482983398.db2.gz	IFFIBRHQKTZMGC-JTQLQIEISA-N	1	0	261.456	1.928	50	0		CDAARO
Cc1c[nH]c(C[N@H+](C)CCCn2cccn2)c(C)c1=O	ZINC000670449768	483009795	/nfs/dbraw/zinc/00/97/95/483009795.db2.gz	CMPFFMPMDUMCSQ-UHFFFAOYSA-N	1	0	274.368	1.710	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN(C(=O)c2cncc(Cl)c2)C1	ZINC000670456718	483036255	/nfs/dbraw/zinc/03/62/55/483036255.db2.gz	JRYVSXIDENKJOJ-LLVKDONJSA-N	1	0	297.786	1.385	50	0		CDAARO
O=C(C1CCC1)N1CCC([N@@H+]2CCC[C@@H](O)CC2)CC1	ZINC000670466908	483057546	/nfs/dbraw/zinc/05/75/46/483057546.db2.gz	NKWCNYRGJCQYMZ-OAHLLOKOSA-N	1	0	280.412	1.624	50	0		CDAARO
Cc1cc(C)n(CC[N@@H+](C)Cc2[nH]cc(C)c(=O)c2C)n1	ZINC000670472273	483079196	/nfs/dbraw/zinc/07/91/96/483079196.db2.gz	LOGSHPGGGMVPJR-UHFFFAOYSA-N	1	0	288.395	1.937	50	0		CDAARO
C[NH+]1CCC(NC(=S)N2CCO[C@H]3CCCC[C@H]32)CC1	ZINC000083877628	483216371	/nfs/dbraw/zinc/21/63/71/483216371.db2.gz	HIKKYDUIKONYIQ-KGLIPLIRSA-N	1	0	297.468	1.599	50	0		CDAARO
CCC[C@H]([NH3+])C(=O)Nc1c[nH]cc(Br)c1=O	ZINC000423761626	535679669	/nfs/dbraw/zinc/67/96/69/535679669.db2.gz	MIBGHAGXKXDUBQ-ZETCQYMHSA-N	1	0	288.145	1.203	50	0		CDAARO
O=C(c1nc[nH]n1)N1C[C@H]2CC[C@H](C[N@H+]2CC2CCC2)C1	ZINC000095360134	518202295	/nfs/dbraw/zinc/20/22/95/518202295.db2.gz	YBRJIDUMABBJRS-CHWSQXEVSA-N	1	0	289.383	1.141	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cccc(-n3cccn3)c2)C1	ZINC000178974232	522056319	/nfs/dbraw/zinc/05/63/19/522056319.db2.gz	NJUQNKOZGBSYQT-ZDUSSCGKSA-N	1	0	284.363	1.554	50	0		CDAARO
Cc1ccc(C[NH2+]CCCSc2nnnn2C)s1	ZINC000004993804	524575731	/nfs/dbraw/zinc/57/57/31/524575731.db2.gz	DJQZTGDQLZLRMH-UHFFFAOYSA-N	1	0	283.426	1.852	50	0		CDAARO
Cc1nn(C)cc1[C@H](C)NC(=O)[C@@H]1CCCC[NH2+]1	ZINC000096481200	534849037	/nfs/dbraw/zinc/84/90/37/534849037.db2.gz	SASKUWYYGOHGHE-CABZTGNLSA-N	1	0	250.346	1.048	50	0		CDAARO
C[C@@H]([NH2+][C@@H](C)C(=O)NC[C@H]1CCCO1)[C@H](C)n1cccn1	ZINC000241961352	525590524	/nfs/dbraw/zinc/59/05/24/525590524.db2.gz	URRVTEZRCXBMGK-ZOBORPQBSA-N	1	0	294.399	1.106	50	0		CDAARO
[NH3+][C@@H]1CC[C@H]2CN(C(=O)CCc3cscn3)C[C@@H]12	ZINC000185125798	527371054	/nfs/dbraw/zinc/37/10/54/527371054.db2.gz	BLVIOZXPUQQPNT-MVWJERBFSA-N	1	0	265.382	1.271	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)NCCOCc2ccccc2)C1	ZINC000215838419	538288249	/nfs/dbraw/zinc/28/82/49/538288249.db2.gz	ANCIRPZQDHSEJS-UONOGXRCSA-N	1	0	262.353	1.447	50	0		CDAARO
C[C@H](c1cccnc1)N1CC[NH+](CCC2OCCO2)CC1	ZINC000097161648	538438498	/nfs/dbraw/zinc/43/84/98/538438498.db2.gz	JKVGFGAHHMHYST-CQSZACIVSA-N	1	0	291.395	1.523	50	0		CDAARO
COCCC[NH+]1CCC(CNC(=O)[C@@H]2CC23CC3)CC1	ZINC000952982262	616883987	/nfs/dbraw/zinc/88/39/87/616883987.db2.gz	QYJJICNYLBNOGM-AWEZNQCLSA-N	1	0	280.412	1.651	50	0		CDAARO
C[NH2+]CC(=O)Nc1ccc(OC[C@H]2CCCCO2)cc1	ZINC000952968320	616937471	/nfs/dbraw/zinc/93/74/71/616937471.db2.gz	KVDNDIIRKHJZFX-CQSZACIVSA-N	1	0	278.352	1.792	50	0		CDAARO
Cc1cc(C)cc(NC(=O)N2C[C@@H]3C[NH2+]C[C@]3(CO)C2)c1	ZINC001772709353	1159444601	/nfs/dbraw/zinc/44/46/01/1159444601.db2.gz	IXBQSBIRTZGNKX-XJKSGUPXSA-N	1	0	289.379	1.349	50	0		CDAARO
CCc1[nH+]c(N)nc(N[C@H]2CC(=O)N(C(C)C)C2)c1C	ZINC001704309629	1177683176	/nfs/dbraw/zinc/68/31/76/1177683176.db2.gz	ZTLRJSQZVJXFRV-JTQLQIEISA-N	1	0	277.372	1.351	50	0		CDAARO
C[C@H](O)c1nc2cc(NC(=O)C(C)(C)[NH3+])ccc2[nH]1	ZINC000952985693	844020162	/nfs/dbraw/zinc/02/01/62/844020162.db2.gz	CJVUJEJQQLVDFR-ZETCQYMHSA-N	1	0	262.313	1.292	50	0		CDAARO
C[C@H](O)C[NH+]1CCC(CNC(=O)CCC2CCC2)CC1	ZINC000952968236	843870683	/nfs/dbraw/zinc/87/06/83/843870683.db2.gz	KVPYXNVHTPCENA-ZDUSSCGKSA-N	1	0	282.428	1.776	50	0		CDAARO
COc1ccc(C[C@H](C)[NH+]2CCC(C(N)=O)CC2)cc1	ZINC000023282800	844003035	/nfs/dbraw/zinc/00/30/35/844003035.db2.gz	IYVDVINPGQXXBD-LBPRGKRZSA-N	1	0	276.380	1.824	50	0		CDAARO
Cn1cncc1C(=O)NC[C@H]1CCCN(c2cc[nH+]cc2)C1	ZINC000952986631	844714034	/nfs/dbraw/zinc/71/40/34/844714034.db2.gz	MMWKKDXMCHMLGO-CYBMUJFWSA-N	1	0	299.378	1.462	50	0		CDAARO
Cc1ncn(CC[NH2+]CC(C)(C)CN2CCOCC2)c1C	ZINC000952986443	845799975	/nfs/dbraw/zinc/79/99/75/845799975.db2.gz	FSCZGVWMBJKFHW-UHFFFAOYSA-N	1	0	294.443	1.448	50	0		CDAARO
CNC(=O)c1nn(C)c2c1C[C@H]([NH+]1CCCCCC1)CC2	ZINC000014536373	847715368	/nfs/dbraw/zinc/71/53/68/847715368.db2.gz	JWRTYJKEMBENOZ-GFCCVEGCSA-N	1	0	290.411	1.513	50	0		CDAARO
[NH3+]CCN(Cc1ccccc1)C[C@@H](O)CC1(O)CCC1	ZINC000952877580	910434156	/nfs/dbraw/zinc/43/41/56/910434156.db2.gz	SGSCXBQKOCPOQK-HNNXBMFYSA-N	1	0	278.396	1.113	50	0		CDAARO
CC[C@@H](C(=O)N(C)Cc1cc(C)no1)[N@H+](C)CC	ZINC000822541618	925633678	/nfs/dbraw/zinc/63/36/78/925633678.db2.gz	LTLORLRSJXGAOK-LBPRGKRZSA-N	1	0	253.346	1.672	50	0		CDAARO
C[NH+](C)CCN1CC(=O)Nc2cc(Cl)ccc2C1=O	ZINC000823698199	925723636	/nfs/dbraw/zinc/72/36/36/925723636.db2.gz	WIHHUJUAWLOUGE-UHFFFAOYSA-N	1	0	281.743	1.296	50	0		CDAARO
CN(C[C@H]1CCCC[N@@H+]1C)S(=O)(=O)CC1CCCC1	ZINC000823777923	925727238	/nfs/dbraw/zinc/72/72/38/925727238.db2.gz	SQCQTTSXJQKXLR-CQSZACIVSA-N	1	0	288.457	1.923	50	0		CDAARO
CS[C@@H](C)C(=O)N1CCC(O)(C[NH+]2CCCC2)CC1	ZINC000824870953	925838224	/nfs/dbraw/zinc/83/82/24/925838224.db2.gz	HJZBETODBTVYRN-LBPRGKRZSA-N	1	0	286.441	1.187	50	0		CDAARO
Cc1cccc(C[C@@H](C)NC(=O)C[NH+]2CCCC2)n1	ZINC000240824946	937476285	/nfs/dbraw/zinc/47/62/85/937476285.db2.gz	QMNYMWSYEXJPSJ-CYBMUJFWSA-N	1	0	261.369	1.533	50	0		CDAARO
CC(C)=CCC[N@@H+](C)C[C@H]1CCCN(CCO)C1	ZINC001529173106	969002479	/nfs/dbraw/zinc/00/24/79/969002479.db2.gz	MIPHUECICBOAQU-OAHLLOKOSA-N	1	0	254.418	1.979	50	0		CDAARO
OC[C@@]1(Cc2ccccc2)CN(c2cc[nH+]cc2)CC[C@@H]1O	ZINC001529168084	969002802	/nfs/dbraw/zinc/00/28/02/969002802.db2.gz	VKRNAUZXEGHPHN-ZWKOTPCHSA-N	1	0	298.386	1.874	50	0		CDAARO
Cc1c[nH+]ccc1N1CCN(CCN2CCCC2=O)CC1	ZINC001506398642	975148838	/nfs/dbraw/zinc/14/88/38/975148838.db2.gz	OTZCYLTUURWTLG-UHFFFAOYSA-N	1	0	288.395	1.134	50	0		CDAARO
COc1nccnc1N(C)C[C@H]1CC[N@H+](C)C1(C)C	ZINC001506404047	975150135	/nfs/dbraw/zinc/15/01/35/975150135.db2.gz	FLIADSZIWYQIBB-LLVKDONJSA-N	1	0	264.373	1.652	50	0		CDAARO
C[C@H](CN(C)C(=O)c1cnc(N)s1)C[NH+]1CCCC1	ZINC001506406795	975151391	/nfs/dbraw/zinc/15/13/91/975151391.db2.gz	ORIZPRCJXYPNNJ-SNVBAGLBSA-N	1	0	282.413	1.529	50	0		CDAARO
COCc1cc(C[NH2+][C@@H](C)Cn2nc(C)cc2C)[nH]n1	ZINC001506411233	975154022	/nfs/dbraw/zinc/15/40/22/975154022.db2.gz	XMKSYCPFPKASAV-NSHDSACASA-N	1	0	277.372	1.548	50	0		CDAARO
Cc1cc(C)n(C2CN(C[C@H]3CCC[N@@H+](C)C3)C2)n1	ZINC001506426381	975160667	/nfs/dbraw/zinc/16/06/67/975160667.db2.gz	OJIHBABFWQMYCP-AWEZNQCLSA-N	1	0	262.401	1.698	50	0		CDAARO
Cc1cc(N2CC(=O)N[C@@H](C)C2)c2cc3c(cc2[nH+]1)OCO3	ZINC001506427382	975160908	/nfs/dbraw/zinc/16/09/08/975160908.db2.gz	IWMNOHDCZUNZTL-JTQLQIEISA-N	1	0	299.330	1.597	50	0		CDAARO
COc1cccc(OCC[N@H+](C)CCc2nccn2C)c1	ZINC001506429586	975161809	/nfs/dbraw/zinc/16/18/09/975161809.db2.gz	UUZJZAQETYCNFM-UHFFFAOYSA-N	1	0	289.379	1.982	50	0		CDAARO
C[NH+](C)CCOc1cc(C(=O)NC2CC=CC2)ccn1	ZINC000096500647	230384729	/nfs/dbraw/zinc/38/47/29/230384729.db2.gz	QINQVXUOFWGNCP-UHFFFAOYSA-N	1	0	275.352	1.470	50	0		CDAARO
COc1nc(NC[C@@H]2CC[N@@H+](C3CCCC3)C2)ncc1F	ZINC000584902292	341986763	/nfs/dbraw/zinc/98/67/63/341986763.db2.gz	MDSDRDBUTCQXCF-NSHDSACASA-N	1	0	294.374	1.723	50	0		CDAARO
CCO[C@H]1CN(C)C[C@@H]1n1cnc2c(C)csc2c1=O	ZINC000584902297	341986835	/nfs/dbraw/zinc/98/68/35/341986835.db2.gz	RGFIYXQSKTXWBY-QWRGUYRKSA-N	1	0	293.392	1.658	50	0		CDAARO
CC1(C(=O)N2CCC[N@@H+](C3CCCCC3)CC2)COC1	ZINC000584904130	341994086	/nfs/dbraw/zinc/99/40/86/341994086.db2.gz	YAFTZFUQBVYXMM-UHFFFAOYSA-N	1	0	280.412	1.890	50	0		CDAARO
C[C@@H](CS(C)(=O)=O)[NH2+]CCc1ccc(F)cc1F	ZINC000095985027	185054847	/nfs/dbraw/zinc/05/48/47/185054847.db2.gz	LVMZNIZROWJLSJ-VIFPVBQESA-N	1	0	277.336	1.530	50	0		CDAARO
CSCCN(C)c1cc([C@H]2C[C@@H](O)C2)[nH+]c(N)n1	ZINC000240228049	361747005	/nfs/dbraw/zinc/74/70/05/361747005.db2.gz	KFFRZAMZWPRQTM-DTORHVGOSA-N	1	0	268.386	1.096	50	0		CDAARO
O=C(N[C@@H]1CC[N@H+](CC2CC2)C1)N1CC[C@]2(CCOC2)C1	ZINC000089598166	539087497	/nfs/dbraw/zinc/08/74/97/539087497.db2.gz	FOSYVWHOJMLFFT-ZBFHGGJFSA-N	1	0	293.411	1.293	50	0		CDAARO
CC1(C(=O)NC[C@@H](CO)Cc2cccs2)CC[NH2+]CC1	ZINC000096141026	185106350	/nfs/dbraw/zinc/10/63/50/185106350.db2.gz	BBGZQYHVODLKDW-LBPRGKRZSA-N	1	0	296.436	1.405	50	0		CDAARO
C[N@H+](CCC(=O)Nc1nccs1)C[C@@H]1CCCCO1	ZINC000243893857	361829402	/nfs/dbraw/zinc/82/94/02/361829402.db2.gz	AUTCPUHZSBXRRC-NSHDSACASA-N	1	0	283.397	1.973	50	0		CDAARO
O=C1NC(=O)[C@@H](C2CC[NH+](Cc3ccccc3)CC2)N1	ZINC000096886867	185122357	/nfs/dbraw/zinc/12/23/57/185122357.db2.gz	KEQFPGGVSIYEGT-CYBMUJFWSA-N	1	0	273.336	1.107	50	0		CDAARO
Nc1nc(N2CCc3ccccc3C2)cc([C@H]2C[C@@H](O)C2)[nH+]1	ZINC000244874273	361867457	/nfs/dbraw/zinc/86/74/57/361867457.db2.gz	WXVKDOFJXIHLPI-OKILXGFUSA-N	1	0	296.374	1.860	50	0		CDAARO
CC(C)N(C(=O)CSc1nc(N)cc(N)[nH+]1)C(C)C	ZINC000000417998	361898199	/nfs/dbraw/zinc/89/81/99/361898199.db2.gz	BDTYPYYDTAKZMA-UHFFFAOYSA-N	1	0	283.401	1.379	50	0		CDAARO
CCOC[C@@H]1CCCN(C(=O)[C@@H]([NH3+])Cc2ccccc2)C1	ZINC000097019155	185153115	/nfs/dbraw/zinc/15/31/15/185153115.db2.gz	CJPYPVFMEDFVHQ-CVEARBPZSA-N	1	0	290.407	1.832	50	0		CDAARO
C[C@H]([NH2+][C@@H]1CCC(=O)N(C)C1)c1cccc(CO)c1	ZINC000097035122	185157570	/nfs/dbraw/zinc/15/75/70/185157570.db2.gz	YIFWYGUIGLDVPA-SMDDNHRTSA-N	1	0	262.353	1.450	50	0		CDAARO
O=C1OCC[C@H]1N1CC[C@H](CNc2ccccn2)C1	ZINC000097200606	342217078	/nfs/dbraw/zinc/21/70/78/342217078.db2.gz	FDMBSGRNRXRPPA-VXGBXAGGSA-N	1	0	261.325	1.131	50	0		CDAARO
CC(C)N1C(=O)N[C@]2(CC[N@H+](CC3CCCCC3)C2)C1=O	ZINC000084597330	342265207	/nfs/dbraw/zinc/26/52/07/342265207.db2.gz	PAWDPUAHERXSBD-INIZCTEOSA-N	1	0	293.411	1.971	50	0		CDAARO
CSCCC[N@@H+]1CC[C@@]2(C1)NC(=O)N(C(C)C)C2=O	ZINC000084597342	342265295	/nfs/dbraw/zinc/26/52/95/342265295.db2.gz	CWEPUBBDBKIVCR-ZDUSSCGKSA-N	1	0	285.413	1.144	50	0		CDAARO
Cc1cc(C(=O)Nc2cnn(CC[NH+](C)C)c2)ns1	ZINC000585079497	539103154	/nfs/dbraw/zinc/10/31/54/539103154.db2.gz	GELKPOQPBMFUIH-UHFFFAOYSA-N	1	0	279.369	1.462	50	0		CDAARO
CO[C@@H]1C[N@H+](Cc2ccc(F)cc2C)C[C@H]1c1c[nH]nn1	ZINC000585088460	362015577	/nfs/dbraw/zinc/01/55/77/362015577.db2.gz	KTLGOYHKQXPMCO-DZGCQCFKSA-N	1	0	290.342	1.867	50	0		CDAARO
C[NH+](C)CCc1ccc(NC(=O)[C@]2(C)CCNC2=O)cc1	ZINC000585121007	362040256	/nfs/dbraw/zinc/04/02/56/362040256.db2.gz	BOYXLHZFUFCUEW-MRXNPFEDSA-N	1	0	289.379	1.255	50	0		CDAARO
CSC[C@@H](C)C(=O)N1CCC([NH+]2CCOCC2)CC1	ZINC000585123961	362054361	/nfs/dbraw/zinc/05/43/61/362054361.db2.gz	TXVAHTSVFPFAAM-GFCCVEGCSA-N	1	0	286.441	1.309	50	0		CDAARO
C[C@H](O)[C@H]1CC[N@@H+]([C@@H]2CCN(c3ccccc3)C2=O)C1	ZINC000096002364	342431891	/nfs/dbraw/zinc/43/18/91/342431891.db2.gz	NYTFMPULJCINSJ-KCQAQPDRSA-N	1	0	274.364	1.495	50	0		CDAARO
Cc1noc(-c2ccccc2C(=O)N2CC[C@@H](C[NH3+])C2)n1	ZINC000178563203	362246846	/nfs/dbraw/zinc/24/68/46/362246846.db2.gz	CRYKCEVZWMHFML-NSHDSACASA-N	1	0	286.335	1.466	50	0		CDAARO
CN(C[C@H]1CC[N@H+](C)C1)C(=O)Cc1ccsc1	ZINC000223888799	529969989	/nfs/dbraw/zinc/96/99/89/529969989.db2.gz	CFXFKFCALAJIPC-LBPRGKRZSA-N	1	0	252.383	1.701	50	0		CDAARO
C[N@H+](CCC(=O)Nc1cccnc1)Cc1[nH]nc2c1CCC2	ZINC000252501281	362388364	/nfs/dbraw/zinc/38/83/64/362388364.db2.gz	UDJSCPALKPMDSZ-UHFFFAOYSA-N	1	0	299.378	1.754	50	0		CDAARO
CCOC(C[N@@H+]1CC[C@@H]2OCCC[C@H]2C1)OCC	ZINC000248613205	362606264	/nfs/dbraw/zinc/60/62/64/362606264.db2.gz	IZBKIDGVBJQLPA-STQMWFEESA-N	1	0	257.374	1.886	50	0		CDAARO
Cc1ccc(N2CCC[N@H+](CC[C@H]3CCCO3)CC2)nn1	ZINC000249282595	362633569	/nfs/dbraw/zinc/63/35/69/362633569.db2.gz	LCOLHPCLZAAKHF-OAHLLOKOSA-N	1	0	290.411	1.866	50	0		CDAARO
COc1ccccc1OCC[N@H+](C)C[C@H](O)COC(C)C	ZINC000097473400	185612539	/nfs/dbraw/zinc/61/25/39/185612539.db2.gz	CZSCMTURXVBBNA-AWEZNQCLSA-N	1	0	297.395	1.792	50	0		CDAARO
Cc1cccc(CN2CCN([C@H]3CC[NH2+]C3)C2=O)c1	ZINC000085347894	179029090	/nfs/dbraw/zinc/02/90/90/179029090.db2.gz	IJDGDURGAGKYCZ-AWEZNQCLSA-N	1	0	259.353	1.595	50	0		CDAARO
CN(CC1(CO)CCC1)C(=O)CC[C@@H]1CCCC[N@@H+]1C	ZINC000584896284	349357220	/nfs/dbraw/zinc/35/72/20/349357220.db2.gz	YXFNRAKCSMBLRP-AWEZNQCLSA-N	1	0	282.428	1.872	50	0		CDAARO
COC(C)(C)CCNC(=O)CC[C@H](C)[NH+]1CCN(C)CC1	ZINC000584886850	349345739	/nfs/dbraw/zinc/34/57/39/349345739.db2.gz	ZIQRDIRWLMRXFJ-AWEZNQCLSA-N	1	0	299.459	1.334	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)c2ccc(-c3cncc(=O)[nH]3)cc2)C1	ZINC000584892418	349352225	/nfs/dbraw/zinc/35/22/25/349352225.db2.gz	KGXUSYNZZLQZSE-NSHDSACASA-N	1	0	298.346	1.270	50	0		CDAARO
O=C(NCC1([NH+]2CCCCC2)CCCC1)C1(CO)CC1	ZINC000584893464	349353488	/nfs/dbraw/zinc/35/34/88/349353488.db2.gz	XUSOYJXDVHHDGN-UHFFFAOYSA-N	1	0	280.412	1.674	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]CCc2nc(CC)no2)CC1	ZINC000584893503	349353607	/nfs/dbraw/zinc/35/36/07/349353607.db2.gz	CYMFEUPAOQBALA-UHFFFAOYSA-N	1	0	296.371	1.385	50	0		CDAARO
Cc1nc(C(=O)N2C[C@H](O)[C@@H]([NH+]3CCCCC3)C2)cs1	ZINC000584897961	349360122	/nfs/dbraw/zinc/36/01/22/349360122.db2.gz	LRVXJUSTGLZXCY-STQMWFEESA-N	1	0	295.408	1.123	50	0		CDAARO
CC[C@@H](O)C1CCN(C(=O)CCC[NH+]2CCCC2)CC1	ZINC000584898158	349360144	/nfs/dbraw/zinc/36/01/44/349360144.db2.gz	KEPKBHSVCSTVBO-OAHLLOKOSA-N	1	0	282.428	1.872	50	0		CDAARO
CCC[C@H]1CN(C(=O)CCc2cccnc2)C[C@@H]1[NH3+]	ZINC000091365048	180142417	/nfs/dbraw/zinc/14/24/17/180142417.db2.gz	YVXQSGZEOOVEHK-KBPBESRZSA-N	1	0	261.369	1.600	50	0		CDAARO
CCNC(=O)N[C@H]1CC[N@H+](CCCOCC)C[C@H]1C	ZINC000110597190	350182591	/nfs/dbraw/zinc/18/25/91/350182591.db2.gz	MIXBMOITUKGJIA-OLZOCXBDSA-N	1	0	271.405	1.443	50	0		CDAARO
CCC[N@@H+]1C[C@H]2CC[C@@H]1CN(C(=O)c1ccc[nH]c1=O)C2	ZINC000091644638	180214614	/nfs/dbraw/zinc/21/46/14/180214614.db2.gz	GYGRLVZFESQTSV-CHWSQXEVSA-N	1	0	289.379	1.321	50	0		CDAARO
C1CC1c1nnc(N2CCC([NH+]3CCSCC3)CC2)o1	ZINC000091624542	180209255	/nfs/dbraw/zinc/20/92/55/180209255.db2.gz	OWLPCHYQHJPYMD-UHFFFAOYSA-N	1	0	294.424	1.965	50	0		CDAARO
COc1ccc2c(c1)OC[C@H](CNC(=O)C(C)(C)[NH3+])C2	ZINC000091943766	180289888	/nfs/dbraw/zinc/28/98/88/180289888.db2.gz	KYQJHDHKUNNORW-JTQLQIEISA-N	1	0	278.352	1.100	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)CCC(=O)c2ccccc2)C[C@@H]1C1CC1	ZINC000092002684	180304726	/nfs/dbraw/zinc/30/47/26/180304726.db2.gz	NEODYCPMQNMFTI-CABCVRRESA-N	1	0	286.375	1.845	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)[C@H](C)OCC(F)(F)F	ZINC000106068087	186100542	/nfs/dbraw/zinc/10/05/42/186100542.db2.gz	BKVUZJAFJHLQCK-UWVGGRQHSA-N	1	0	282.306	1.554	50	0		CDAARO
Cc1ccoc1C[NH2+][C@H]1CCN(S(C)(=O)=O)C[C@H]1C	ZINC000106918554	186151484	/nfs/dbraw/zinc/15/14/84/186151484.db2.gz	YXNPSEWFILOMGP-NEPJUHHUSA-N	1	0	286.397	1.348	50	0		CDAARO
Cc1c(Br)cccc1C[C@H](C[NH3+])CO	ZINC000107510815	186176713	/nfs/dbraw/zinc/17/67/13/186176713.db2.gz	ASGSFMPFGJRNGS-SECBINFHSA-N	1	0	258.159	1.867	50	0		CDAARO
COc1ncccc1C[N@H+](C)C1(CO)CCOCC1	ZINC000193579236	362964645	/nfs/dbraw/zinc/96/46/45/362964645.db2.gz	HMZFZQXDFUGVJV-UHFFFAOYSA-N	1	0	266.341	1.064	50	0		CDAARO
CNc1ncccc1C(=O)N1CCC2(CC[N@H+](C)C2)CC1	ZINC000065385273	362968367	/nfs/dbraw/zinc/96/83/67/362968367.db2.gz	PFRXUJIEZMHCCW-UHFFFAOYSA-N	1	0	288.395	1.681	50	0		CDAARO
C[C@@H]1CN(CCOc2ccc(CC[NH3+])cc2)C[C@@H](C)O1	ZINC000037049820	363331244	/nfs/dbraw/zinc/33/12/44/363331244.db2.gz	QLIRRHFEZCKROH-ZIAGYGMSSA-N	1	0	278.396	1.676	50	0		CDAARO
O=C(COc1ccccc1)O[C@@H]1C[NH+]2CCC1CC2	ZINC000000108883	355887108	/nfs/dbraw/zinc/88/71/08/355887108.db2.gz	MEMGOYZHMQABFZ-CQSZACIVSA-N	1	0	261.321	1.703	50	0		CDAARO
CN(C)c1cc[nH+]c(NC(=O)NCCc2ccccn2)c1	ZINC000097372901	356093594	/nfs/dbraw/zinc/09/35/94/356093594.db2.gz	TWFBBLBDCWGAPC-UHFFFAOYSA-N	1	0	285.351	1.907	50	0		CDAARO
C[NH+](C)CC[C@H]1CN(C(=O)CCc2cccs2)CCO1	ZINC000011817470	356280116	/nfs/dbraw/zinc/28/01/16/356280116.db2.gz	ARDYYLUWNWIDGC-ZDUSSCGKSA-N	1	0	296.436	1.860	50	0		CDAARO
[NH3+]CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000011849349	356280787	/nfs/dbraw/zinc/28/07/87/356280787.db2.gz	HBOXZVACISVYKX-UHFFFAOYSA-N	1	0	282.409	1.753	50	0		CDAARO
C[C@H]1CN(c2ccc(S(C)(=O)=O)cc2Cl)CC[NH2+]1	ZINC000015443301	356416487	/nfs/dbraw/zinc/41/64/87/356416487.db2.gz	ALKSWEZGUJBUAN-VIFPVBQESA-N	1	0	288.800	1.542	50	0		CDAARO
CCNC(=O)NC(=O)CN1CCC[C@@H](C(F)(F)F)C1	ZINC000016591161	356442046	/nfs/dbraw/zinc/44/20/46/356442046.db2.gz	ULLSXBACIRPJFE-MRVPVSSYSA-N	1	0	281.278	1.106	50	0		CDAARO
C[C@H]1CN(c2ccc(F)cc2S(C)(=O)=O)CC[NH2+]1	ZINC000019735946	356497570	/nfs/dbraw/zinc/49/75/70/356497570.db2.gz	CKYIECKMKVIFFO-VIFPVBQESA-N	1	0	272.345	1.027	50	0		CDAARO
C[NH+]1CCN(CCC(=O)Nc2ccccc2Cl)CC1	ZINC000019841543	356509139	/nfs/dbraw/zinc/50/91/39/356509139.db2.gz	VRCWKXMSEDATBW-UHFFFAOYSA-N	1	0	281.787	1.916	50	0		CDAARO
CN1CC[NH+](C2CCN(Cc3ccccn3)CC2)CC1	ZINC000019889855	356514130	/nfs/dbraw/zinc/51/41/30/356514130.db2.gz	UGLRLWLHIAIMSJ-UHFFFAOYSA-N	1	0	274.412	1.293	50	0		CDAARO
[NH3+]CC1(C(F)(F)F)CCN(S(=O)(=O)C2CC2)CC1	ZINC000725264710	538455637	/nfs/dbraw/zinc/45/56/37/538455637.db2.gz	LXRSFKMOYQDPIE-UHFFFAOYSA-N	1	0	286.319	1.082	50	0		CDAARO
C[NH+]1CCN(CCCOc2cccc(C=O)c2)CC1	ZINC000023094347	356627477	/nfs/dbraw/zinc/62/74/77/356627477.db2.gz	LCHQOCXCTXNIOS-UHFFFAOYSA-N	1	0	262.353	1.515	50	0		CDAARO
Cc1cc(C[N@@H+]2CCC[C@@H]2[C@H]2COCC[C@]2(C)O)on1	ZINC000328954267	202127931	/nfs/dbraw/zinc/12/79/31/202127931.db2.gz	IKTWEQWPPUGCLC-KFWWJZLASA-N	1	0	280.368	1.735	50	0		CDAARO
CC1(C)NC(=O)N(CC[NH+]2CCCCCC2)C1=O	ZINC000026807445	356700080	/nfs/dbraw/zinc/70/00/80/356700080.db2.gz	LEHKRPCSYPGUNC-UHFFFAOYSA-N	1	0	253.346	1.193	50	0		CDAARO
Cc1c(C)n(C[C@@H](O)C[NH2+]CCCO)c2ccc(C)cc12	ZINC000028297046	356719535	/nfs/dbraw/zinc/71/95/35/356719535.db2.gz	UWQHJPNDSPKRAF-HNNXBMFYSA-N	1	0	290.407	1.899	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]C[C@@H]2CCCO2)CC1	ZINC000000757663	356734469	/nfs/dbraw/zinc/73/44/69/356734469.db2.gz	UENAQCDMPDETAM-LBPRGKRZSA-N	1	0	256.346	1.376	50	0		CDAARO
CCOc1cc2c(cc1OCC)[C@@H](C(CO)CO)[NH2+]CC2	ZINC000032099029	356774288	/nfs/dbraw/zinc/77/42/88/356774288.db2.gz	DLPCTIQNIDHILA-MRXNPFEDSA-N	1	0	295.379	1.272	50	0		CDAARO
C[NH+](C)CCCn1cc(CC(N)=O)c2ccccc21	ZINC000034523431	356816650	/nfs/dbraw/zinc/81/66/50/356816650.db2.gz	UNNLNXFKHPMWOK-UHFFFAOYSA-N	1	0	259.353	1.621	50	0		CDAARO
CC(C)[NH+]1CCC(NC(=O)[C@H]2Cc3ccccc3O2)CC1	ZINC000032780979	356787632	/nfs/dbraw/zinc/78/76/32/356787632.db2.gz	SDJCCJBHKOYKSQ-MRXNPFEDSA-N	1	0	288.391	1.979	50	0		CDAARO
CN(Cc1cccnc1)C(=O)[C@@H]([NH3+])c1ccccc1	ZINC000036771586	356881074	/nfs/dbraw/zinc/88/10/74/356881074.db2.gz	NSDKCDBMQUKRPD-AWEZNQCLSA-N	1	0	255.321	1.740	50	0		CDAARO
Cc1cc(S(=O)(=O)N2CCN(C)CC2)c(C)c(C)c1C	ZINC000035993519	356853704	/nfs/dbraw/zinc/85/37/04/356853704.db2.gz	ZMGDGIYJKXDTHG-UHFFFAOYSA-N	1	0	296.436	1.856	50	0		CDAARO
[NH3+]CCN1C(=O)O[C@@H](Cc2cccc(Cl)c2)C1=O	ZINC000039320080	356972085	/nfs/dbraw/zinc/97/20/85/356972085.db2.gz	MPIMDVJJNDUJPU-JTQLQIEISA-N	1	0	268.700	1.189	50	0		CDAARO
Cc1ccccc1N1CCN(C(=O)[C@H]2CCC[NH2+]2)CC1	ZINC000040430500	356999461	/nfs/dbraw/zinc/99/94/61/356999461.db2.gz	LASBUAWLVBHKIZ-CQSZACIVSA-N	1	0	273.380	1.396	50	0		CDAARO
O=C(N[C@H](CCO)C1CC1)NC1CC[NH+](C2CC2)CC1	ZINC000095401077	357193263	/nfs/dbraw/zinc/19/32/63/357193263.db2.gz	ZZYVEMFBCLQBCM-CQSZACIVSA-N	1	0	281.400	1.073	50	0		CDAARO
C[C@@H]1Cc2cc(S(=O)(=O)NCC(C)(C)[NH3+])ccc2O1	ZINC000095432136	357516527	/nfs/dbraw/zinc/51/65/27/357516527.db2.gz	FHRLNFWRYFVCNL-SECBINFHSA-N	1	0	284.381	1.026	50	0		CDAARO
CCCOCC[NH+]1CCN(c2ncnc3[nH]ccc32)CC1	ZINC000065373947	357533349	/nfs/dbraw/zinc/53/33/49/357533349.db2.gz	WDLQIOQGRMAMEE-UHFFFAOYSA-N	1	0	289.383	1.507	50	0		CDAARO
C[C@H](Cn1cncn1)[NH2+]CCN1CCc2ccccc21	ZINC000065488034	357544810	/nfs/dbraw/zinc/54/48/10/357544810.db2.gz	MCZXHLWWWNNXPS-CYBMUJFWSA-N	1	0	271.368	1.319	50	0		CDAARO
CCc1cc(NC[C@@H]2COCCO2)nc(N2CCCC2)[nH+]1	ZINC000065501398	357545832	/nfs/dbraw/zinc/54/58/32/357545832.db2.gz	ZJPLHRAZJFMAIT-CYBMUJFWSA-N	1	0	292.383	1.467	50	0		CDAARO
COc1ccc(-n2cccn2)c([C@@H]2[NH2+]CCc3nc[nH]c32)c1	ZINC000065534464	357547725	/nfs/dbraw/zinc/54/77/25/357547725.db2.gz	QBCIUCANEFOKCX-HNNXBMFYSA-N	1	0	295.346	1.839	50	0		CDAARO
CS(=O)(=O)NC[C@@H]1CC[N@H+](CCCc2ccccc2)C1	ZINC000067654192	357616728	/nfs/dbraw/zinc/61/67/28/357616728.db2.gz	VGKKFXSJPRXWQG-HNNXBMFYSA-N	1	0	296.436	1.490	50	0		CDAARO
CCn1c(=O)n(CCSC(C)C)nc1[C@H]1CCC[NH2+]C1	ZINC000067675474	357617813	/nfs/dbraw/zinc/61/78/13/357617813.db2.gz	REFMVUBGWLUCRL-LBPRGKRZSA-N	1	0	298.456	1.673	50	0		CDAARO
OCC(CO)[N@@H+]1CCC[C@@H](c2nc3ccccc3[nH]2)C1	ZINC000067691665	357619337	/nfs/dbraw/zinc/61/93/37/357619337.db2.gz	QMIJRFVPDUGVLR-LLVKDONJSA-N	1	0	275.352	1.096	50	0		CDAARO
CC(C)c1nccc(CN2CCC[C@@](O)(C[NH+](C)C)C2)n1	ZINC000072426453	357835047	/nfs/dbraw/zinc/83/50/47/357835047.db2.gz	LUCRZHFPGAYSHQ-MRXNPFEDSA-N	1	0	292.427	1.489	50	0		CDAARO
COc1cccc2c1OCCCN(C[C@@]1(O)CC[NH2+]C1)C2	ZINC000077385455	358017399	/nfs/dbraw/zinc/01/73/99/358017399.db2.gz	VFAZAEVTTKZLSF-MRXNPFEDSA-N	1	0	292.379	1.004	50	0		CDAARO
C[C@H]([NH2+]CCNC(=O)c1ccn[nH]1)c1ccc(F)cc1	ZINC000097236297	358048732	/nfs/dbraw/zinc/04/87/32/358048732.db2.gz	QDGTYSYOJAKHOF-JTQLQIEISA-N	1	0	276.315	1.629	50	0		CDAARO
O=C(NCC[NH2+][C@@H]1CCCc2sccc21)c1ccn[nH]1	ZINC000097236316	358048905	/nfs/dbraw/zinc/04/89/05/358048905.db2.gz	CJYXWJIYIUEBFX-LLVKDONJSA-N	1	0	290.392	1.868	50	0		CDAARO
Cn1cc(N2CC[C@@H]([N@H+](C)CCc3ccncc3)C2=O)cn1	ZINC000097051177	358131244	/nfs/dbraw/zinc/13/12/44/358131244.db2.gz	CVGDDCUHQJTTEN-OAHLLOKOSA-N	1	0	299.378	1.095	50	0		CDAARO
CC(C)Cc1cc(C(=O)N2CC[C@@H](C[NH3+])C2)n(C)n1	ZINC000082091338	358146282	/nfs/dbraw/zinc/14/62/82/358146282.db2.gz	RXVPLMFOYBQTFB-NSHDSACASA-N	1	0	264.373	1.039	50	0		CDAARO
[NH3+][C@H]1CCCCN(C(=O)CCc2[nH]nc3c2CCCC3)C1	ZINC000082133448	358148621	/nfs/dbraw/zinc/14/86/21/358148621.db2.gz	CZOYWJZDJOHKOA-LBPRGKRZSA-N	1	0	290.411	1.561	50	0		CDAARO
CCNc1nc(N2CCN(C(=O)C(C)C)CC2)cc(C)[nH+]1	ZINC000082230210	358151159	/nfs/dbraw/zinc/15/11/59/358151159.db2.gz	YFRIPUJXDSTBRT-UHFFFAOYSA-N	1	0	291.399	1.521	50	0		CDAARO
COc1ccc(OCC[N@H+](C)C[C@@H](O)COC(C)C)cc1	ZINC000098076179	358380385	/nfs/dbraw/zinc/38/03/85/358380385.db2.gz	MTTLIUVSJKLZKY-CQSZACIVSA-N	1	0	297.395	1.792	50	0		CDAARO
CN(C)C(=O)c1ccc(C[N@H+](C)CCc2ccncc2)[nH]1	ZINC000195562041	358565737	/nfs/dbraw/zinc/56/57/37/358565737.db2.gz	MUVOGWRRVZAVJP-UHFFFAOYSA-N	1	0	286.379	1.786	50	0		CDAARO
CCc1nsc(SCCCN2CC[NH+](C)CC2)n1	ZINC000195568335	358566290	/nfs/dbraw/zinc/56/62/90/358566290.db2.gz	QOUWUWDDDAHNEF-UHFFFAOYSA-N	1	0	286.470	1.830	50	0		CDAARO
C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)NS(=O)(=O)C1CC1	ZINC000195574181	358567440	/nfs/dbraw/zinc/56/74/40/358567440.db2.gz	RCRFTSJBSAQOJU-MNOVXSKESA-N	1	0	260.403	1.189	50	0		CDAARO
Cc1ccc(C(=O)N2CC[N@@H+]3CCC[C@H]3C2)cc1N	ZINC000027932724	358612161	/nfs/dbraw/zinc/61/21/61/358612161.db2.gz	YZMUKZHCWRIACT-ZDUSSCGKSA-N	1	0	259.353	1.497	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1NCCCn1ccc(C)n1	ZINC000095359502	358684401	/nfs/dbraw/zinc/68/44/01/358684401.db2.gz	DKAYMHGGZOVYMV-UHFFFAOYSA-N	1	0	274.372	1.937	50	0		CDAARO
CCc1[nH+]c(N)nc(NCCc2nc(COC)no2)c1C	ZINC000095363496	358685334	/nfs/dbraw/zinc/68/53/34/358685334.db2.gz	JVODQSWKWDUUAX-UHFFFAOYSA-N	1	0	292.343	1.114	50	0		CDAARO
CCCc1nnc(N2CCC[C@@](O)(C[NH+](C)C)CC2)o1	ZINC000095367225	358686507	/nfs/dbraw/zinc/68/65/07/358686507.db2.gz	WVOPILKFDGCXKD-AWEZNQCLSA-N	1	0	282.388	1.305	50	0		CDAARO
CCC[C@H]1CN(S(=O)(=O)c2cc(C)cs2)C[C@@H]1[NH3+]	ZINC000095377007	358689579	/nfs/dbraw/zinc/68/95/79/358689579.db2.gz	OBJFCKLNSWVXCY-QWRGUYRKSA-N	1	0	288.438	1.804	50	0		CDAARO
C[N@H+](CCN1CCCCC1=O)Cc1cccc2nonc21	ZINC000097307609	358766493	/nfs/dbraw/zinc/76/64/93/358766493.db2.gz	MMJIGHYAPDAIGX-UHFFFAOYSA-N	1	0	288.351	1.667	50	0		CDAARO
Cc1ccc2c(c1)C[C@H](C(=O)N1CCc3[nH]cnc3C1)N2	ZINC000096163787	358711865	/nfs/dbraw/zinc/71/18/65/358711865.db2.gz	SGORDSSXYCQYOQ-CQSZACIVSA-N	1	0	282.347	1.640	50	0		CDAARO
Cc1noc(C)c1CCC(=O)N[C@H]1Cc2ccccc2[C@@H]1[NH3+]	ZINC000097601102	358787654	/nfs/dbraw/zinc/78/76/54/358787654.db2.gz	ZLJYHEVWSJVFMI-RDJZCZTQSA-N	1	0	299.374	1.965	50	0		CDAARO
CCn1ccnc1CNC1(CC(=O)OC)CC[NH+](C)CC1	ZINC000088744155	366495160	/nfs/dbraw/zinc/49/51/60/366495160.db2.gz	XNTJRDOGSVDVCS-UHFFFAOYSA-N	1	0	294.399	1.020	50	0		CDAARO
CN(C)c1ncc(C[N@H+](C)CCC[C@@H]2CCCO2)cn1	ZINC000215045965	358870586	/nfs/dbraw/zinc/87/05/86/358870586.db2.gz	FIVDTHFZOIZXED-CQSZACIVSA-N	1	0	278.400	1.934	50	0		CDAARO
Cc1cccc(OC2CN(C(=O)[C@H]3[C@@H]4C[NH2+]C[C@@H]43)C2)c1	ZINC000102626280	358884837	/nfs/dbraw/zinc/88/48/37/358884837.db2.gz	MZSATIOUPQJUQY-FICVDOATSA-N	1	0	272.348	1.050	50	0		CDAARO
Cc1nc(C2CC([NH3+])C2)cc(N(C)CCn2cccn2)n1	ZINC000218961938	359072814	/nfs/dbraw/zinc/07/28/14/359072814.db2.gz	YPLNRPOCZYYIIO-UHFFFAOYSA-N	1	0	286.383	1.323	50	0		CDAARO
CCO[C@H]1C[N@H+](Cc2cc3c(cc2OC)CCC3)C[C@@H]1O	ZINC000220098158	359148754	/nfs/dbraw/zinc/14/87/54/359148754.db2.gz	MZSFAMFLMAFUIF-RDJZCZTQSA-N	1	0	291.391	1.766	50	0		CDAARO
C[C@@H]1CN(C(=O)C[C@H]([NH3+])c2ccccc2)[C@@H](C)CO1	ZINC000035787161	359150150	/nfs/dbraw/zinc/15/01/50/359150150.db2.gz	WHRCRHBGKIDIMY-SCRDCRAPSA-N	1	0	262.353	1.712	50	0		CDAARO
CC[N@H+](C1CN(C(=O)C2CCCC2)C1)C1CCOCC1	ZINC000257179780	359174305	/nfs/dbraw/zinc/17/43/05/359174305.db2.gz	JKRBCWNDQZKSJW-UHFFFAOYSA-N	1	0	280.412	1.888	50	0		CDAARO
c1ccc(C[NH+]2CCOCCOCCOCC2)cc1	ZINC000000242350	359385216	/nfs/dbraw/zinc/38/52/16/359385216.db2.gz	JPSAXKRUQAICFV-UHFFFAOYSA-N	1	0	265.353	1.552	50	0		CDAARO
C[NH+](C)Cc1cccc(C(=O)N[C@H]2C[C@@H]3OCC[C@H]23)c1	ZINC000223783495	359455948	/nfs/dbraw/zinc/45/59/48/359455948.db2.gz	PMKYMMNXOIIDDW-ILXRZTDVSA-N	1	0	274.364	1.655	50	0		CDAARO
Cc1cc(C[NH+]2CCC3(CC2)C[C@H](O)CCO3)n(C)n1	ZINC000257190288	359538003	/nfs/dbraw/zinc/53/80/03/359538003.db2.gz	MCQBVNAYQVAVDA-CQSZACIVSA-N	1	0	279.384	1.234	50	0		CDAARO
C[C@@]1(O)CCOC2(CC[NH+](Cc3ccncc3)CC2)C1	ZINC000257187247	359529297	/nfs/dbraw/zinc/52/92/97/359529297.db2.gz	AHGGRUZCPCMUJA-OAHLLOKOSA-N	1	0	276.380	1.978	50	0		CDAARO
C[C@H]([NH3+])CC(=O)N1CCc2c(cnn2-c2ccccc2)C1	ZINC000261867863	359571175	/nfs/dbraw/zinc/57/11/75/359571175.db2.gz	QILHLYHIUPMGPD-LBPRGKRZSA-N	1	0	284.363	1.494	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OC[C@H]1CCCOC1	ZINC000408525692	359935745	/nfs/dbraw/zinc/93/57/45/359935745.db2.gz	UFMMJAYUTVQJBJ-STQMWFEESA-N	1	0	257.374	1.967	50	0		CDAARO
Nc1cc[nH+]cc1-c1cccc(C(=O)N[C@@H]2CCOC2)c1	ZINC000426567190	360684041	/nfs/dbraw/zinc/68/40/41/360684041.db2.gz	ZPTQQHKKRIOTMK-CYBMUJFWSA-N	1	0	283.331	1.680	50	0		CDAARO
Cc1nn(-c2nn[nH]n2)c(C)c1-c1ccc(C[NH+](C)C)cc1	ZINC000426563154	360684313	/nfs/dbraw/zinc/68/43/13/360684313.db2.gz	LAUXEPVYIASHJX-UHFFFAOYSA-N	1	0	297.366	1.731	50	0		CDAARO
CCOCCSc1nnc(C[NH3+])n1-c1ccc(F)cc1	ZINC000426597284	360687524	/nfs/dbraw/zinc/68/75/24/360687524.db2.gz	UJVPZFQTPVLTRY-UHFFFAOYSA-N	1	0	296.371	1.994	50	0		CDAARO
O=C(NCCn1cccn1)N1CC[C@@H]([NH+]2CCCCC2)C1	ZINC000426359360	360658555	/nfs/dbraw/zinc/65/85/55/360658555.db2.gz	BGLYAUKSAPGFEN-CQSZACIVSA-N	1	0	291.399	1.153	50	0		CDAARO
Cc1c(C(=O)N2C[C@H]3CCC[C@@H](C2)[N@H+](C)C3)ccn1C	ZINC000426406085	360665828	/nfs/dbraw/zinc/66/58/28/360665828.db2.gz	KDAOIJHCAKFUQR-KBPBESRZSA-N	1	0	275.396	1.890	50	0		CDAARO
C[NH+]1CCC(C)(C(=O)N2CCC(c3cc[nH]n3)CC2)CC1	ZINC000426484924	360675686	/nfs/dbraw/zinc/67/56/86/360675686.db2.gz	WEXQJSFVNAUAAY-UHFFFAOYSA-N	1	0	290.411	1.848	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F)[C@H]1CC[NH2+]C1	ZINC000179075361	189167076	/nfs/dbraw/zinc/16/70/76/189167076.db2.gz	ZXPWLZIIQYCWHW-GARJFASQSA-N	1	0	280.318	1.889	50	0		CDAARO
Cc1c(C(=O)N(C)[C@@H]2CC[NH2+]C2)cnn1Cc1ccccc1	ZINC000179111736	189170651	/nfs/dbraw/zinc/17/06/51/189170651.db2.gz	GSOBUOZONHXTCJ-OAHLLOKOSA-N	1	0	298.390	1.674	50	0		CDAARO
Cc1ccccc1[C@@H]1C[C@H]1C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000246568988	360884229	/nfs/dbraw/zinc/88/42/29/360884229.db2.gz	BHEQMCGDGXCKAM-AEGPPILISA-N	1	0	258.365	1.906	50	0		CDAARO
O=C(NCC[C@@H]1CCC[NH2+]1)c1ccc2nccnc2c1	ZINC000097619674	361015012	/nfs/dbraw/zinc/01/50/12/361015012.db2.gz	XAQQLTSJMBLSEW-LBPRGKRZSA-N	1	0	270.336	1.502	50	0		CDAARO
CCN1CCC[C@H]1C[NH2+]C[C@H](O)COc1cccc(C)c1	ZINC000019371464	361452082	/nfs/dbraw/zinc/45/20/82/361452082.db2.gz	IMTNEWYWNBRNEN-HOTGVXAUSA-N	1	0	292.423	1.809	50	0		CDAARO
COc1cccc(CCNC(=O)[C@H]2CC23CC[NH2+]CC3)c1	ZINC000231327156	361599400	/nfs/dbraw/zinc/59/94/00/361599400.db2.gz	INXNBZVBZYGLRJ-OAHLLOKOSA-N	1	0	288.391	1.744	50	0		CDAARO
COc1ccc(C(=O)O[C@H]2CCC[N@H+](C)C2)cc1OC	ZINC000000487028	365049018	/nfs/dbraw/zinc/04/90/18/365049018.db2.gz	SXZSTOYRBQKQOM-LBPRGKRZSA-N	1	0	279.336	1.955	50	0	biogenic	CDAARO
CC[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)c1c[nH]cn1	ZINC000249688649	365161447	/nfs/dbraw/zinc/16/14/47/365161447.db2.gz	IILQGTCZUSMBLT-QWHCGFSZSA-N	1	0	262.357	1.499	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CC[NH2+][C@H](C)C2)cc1F	ZINC000606441671	366868412	/nfs/dbraw/zinc/86/84/12/366868412.db2.gz	KIWSBWNAOZKURM-VLWUPBBWSA-N	1	0	278.327	1.668	50	0		CDAARO
c1cnc(N2CC[NH+](CC[C@@H]3CCCO3)CC2)cn1	ZINC000188895818	365457726	/nfs/dbraw/zinc/45/77/26/365457726.db2.gz	NWJCYRWEBXORDY-ZDUSSCGKSA-N	1	0	262.357	1.168	50	0		CDAARO
Cc1ccccc1OCC[N@@H+]1CCC[C@H]1CS(N)(=O)=O	ZINC000089696786	366912505	/nfs/dbraw/zinc/91/25/05/366912505.db2.gz	RWSXOZUUTRFJBQ-ZDUSSCGKSA-N	1	0	298.408	1.127	50	0		CDAARO
C[C@H]([NH2+]C[C@H]1CCCC[C@H]1O)C(=O)NC1CCCC1	ZINC000240555840	367273879	/nfs/dbraw/zinc/27/38/79/367273879.db2.gz	GXSYBPZPJKRURR-OUCADQQQSA-N	1	0	268.401	1.574	50	0		CDAARO
C[C@H](c1ccc(S(N)(=O)=O)cc1)[N@H+](C)[C@H]1CCO[C@H]1C	ZINC000252477350	367545485	/nfs/dbraw/zinc/54/54/85/367545485.db2.gz	MNSWCOFXSXDSFR-SUNKGSAMSA-N	1	0	298.408	1.504	50	0		CDAARO
O=C(NCC[N@@H+]1CCCOCC1)N1CCc2ccccc21	ZINC000252536964	367793693	/nfs/dbraw/zinc/79/36/93/367793693.db2.gz	JZAPNICALKBWCB-UHFFFAOYSA-N	1	0	289.379	1.481	50	0		CDAARO
Cc1cccc2[nH]c(CNC(=O)[C@H](C)[NH+]3CCCC3)nc21	ZINC000299763678	372748654	/nfs/dbraw/zinc/74/86/54/372748654.db2.gz	ZHYWWQWHLXIMEY-LBPRGKRZSA-N	1	0	286.379	1.972	50	0		CDAARO
O=C(C[C@H]1CC[NH2+]C1)N1CC(Oc2ccc(F)cc2)C1	ZINC000299776060	372754794	/nfs/dbraw/zinc/75/47/94/372754794.db2.gz	NBYGJFOYHUCSRI-LLVKDONJSA-N	1	0	278.327	1.415	50	0		CDAARO
Cn1nc(-c2ccccc2)cc1NC(=O)NCC[NH+](C)C	ZINC000299779030	372757473	/nfs/dbraw/zinc/75/74/73/372757473.db2.gz	SAJGKHLZVRRUHZ-UHFFFAOYSA-N	1	0	287.367	1.770	50	0		CDAARO
Cc1cccnc1C[C@H](C)[N@H+](C)CCC(=O)NC1CC1	ZINC000299787385	372762680	/nfs/dbraw/zinc/76/26/80/372762680.db2.gz	WHCABHJMAALQHO-ZDUSSCGKSA-N	1	0	275.396	1.922	50	0		CDAARO
COc1cc(NC(=O)N2CCC[C@@H]([NH3+])C2)ccc1C	ZINC000299797807	372770108	/nfs/dbraw/zinc/77/01/08/372770108.db2.gz	OKNHEMSPXISPDU-LLVKDONJSA-N	1	0	263.341	1.959	50	0		CDAARO
C[C@@H]1OC(=O)[C@H]2[C@@H]1[N@@H+]1CCc3ccccc3[C@H]1C[C@H]2O	ZINC000252694574	373120186	/nfs/dbraw/zinc/12/01/86/373120186.db2.gz	MPEJFJFZVUSBET-JZLHEVAFSA-N	1	0	273.332	1.281	50	0	biogenic	CDAARO
[NH3+][C@H]1C[C@@H](c2cc(NCCN3CCCCC3=O)ncn2)C1	ZINC000244873359	189914633	/nfs/dbraw/zinc/91/46/33/189914633.db2.gz	WOVMQAGEHJAMAD-TXEJJXNPSA-N	1	0	289.383	1.106	50	0		CDAARO
O=C(c1ccc(F)c(F)c1)N1CCN([C@H]2CC[NH2+]C2)CC1	ZINC000244900150	189915474	/nfs/dbraw/zinc/91/54/74/189915474.db2.gz	ZWXAQZMPZVBKJN-LBPRGKRZSA-N	1	0	295.333	1.085	50	0		CDAARO
Cc1noc(C)c1CN(C)C(=O)[C@@H]1CCCC[NH2+]1	ZINC000037819124	373419713	/nfs/dbraw/zinc/41/97/13/373419713.db2.gz	RTFCUTQDAWWTEG-LBPRGKRZSA-N	1	0	251.330	1.392	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1CCNC(=O)c1cncn1C	ZINC000253408399	373710919	/nfs/dbraw/zinc/71/09/19/373710919.db2.gz	KRGJAZPEFIHFAG-UHFFFAOYSA-N	1	0	273.340	1.232	50	0		CDAARO
CN(C[C@@H]1CCC[N@@H+]([C@H]2C=CCCC2)C1)S(C)(=O)=O	ZINC000253417339	373725661	/nfs/dbraw/zinc/72/56/61/373725661.db2.gz	XDRNTGIBIUYOCI-KBPBESRZSA-N	1	0	286.441	1.699	50	0		CDAARO
O=C(NCC1CC[NH2+]CC1)c1ccc2c(c1)OCO2	ZINC000019275286	374708242	/nfs/dbraw/zinc/70/82/42/374708242.db2.gz	AIULISPIJKZXMV-UHFFFAOYSA-N	1	0	262.309	1.145	50	0		CDAARO
CC[C@@H](C)C[NH2+]CC1(S(C)(=O)=O)CCOCC1	ZINC000093076355	374731257	/nfs/dbraw/zinc/73/12/57/374731257.db2.gz	FSPCLBFVALMICQ-LLVKDONJSA-N	1	0	263.403	1.216	50	0		CDAARO
NC(=O)C[NH+]1CCC(Cc2ccccc2F)CC1	ZINC000095395108	374901714	/nfs/dbraw/zinc/90/17/14/374901714.db2.gz	GEJSLULAXICZQI-UHFFFAOYSA-N	1	0	250.317	1.566	50	0		CDAARO
Cc1ccc(CCC(=O)NCCN2CC[NH2+]CC2)c(C)c1	ZINC000095389788	374899958	/nfs/dbraw/zinc/89/99/58/374899958.db2.gz	AKIDSEMCGSWQJW-UHFFFAOYSA-N	1	0	289.423	1.257	50	0		CDAARO
Cc1cc(S(=O)(=O)NC(C)(C)C[NH3+])c(F)cc1F	ZINC000095432019	374932739	/nfs/dbraw/zinc/93/27/39/374932739.db2.gz	SDVGQLSFCPGOPK-UHFFFAOYSA-N	1	0	278.324	1.289	50	0		CDAARO
C[C@@H](CCc1ccccc1)C[NH2+]CCS(C)(=O)=O	ZINC000095450151	374950366	/nfs/dbraw/zinc/95/03/66/374950366.db2.gz	BPPSMZKQQKVGNA-ZDUSSCGKSA-N	1	0	269.410	1.890	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CC(=O)NC(=O)NCc1ccccc1	ZINC000003583357	375755161	/nfs/dbraw/zinc/75/51/61/375755161.db2.gz	OUULZDBZOMTEJV-CYBMUJFWSA-N	1	0	289.379	1.887	50	0		CDAARO
C[C@@]1(C(=O)NCCCOC2CCCC2)CCC[NH2+]C1	ZINC000119091354	375826059	/nfs/dbraw/zinc/82/60/59/375826059.db2.gz	NODIXEXRCFSCGU-OAHLLOKOSA-N	1	0	268.401	1.842	50	0		CDAARO
C/C=C\c1ccc(OCC(=O)N2CC[C@@H]([NH3+])C2)c(OC)c1	ZINC000429065741	247411435	/nfs/dbraw/zinc/41/14/35/247411435.db2.gz	QCZLSQHUICZEON-DHCBQETCSA-N	1	0	290.363	1.667	50	0		CDAARO
CC(C)NC(=O)c1cc(N2CC[N@@H+]3CCC[C@H]3C2)ccn1	ZINC000243885753	376022874	/nfs/dbraw/zinc/02/28/74/376022874.db2.gz	ABWCISJBAWJTSB-AWEZNQCLSA-N	1	0	288.395	1.504	50	0		CDAARO
O=C([C@H]1[NH2+]Cc2ccccc21)N1C[C@@H]2[C@H]3CC[C@H](O3)[C@@H]2C1	ZINC000071751384	284593395	/nfs/dbraw/zinc/59/33/95/284593395.db2.gz	YITSFMJBJGVKPU-OTJKEOIZSA-N	1	0	284.359	1.467	50	0		CDAARO
C[C@H](C[N@@H+]1CCC[C@H](C)C1)NS(=O)(=O)c1cccnc1	ZINC000189149928	377196592	/nfs/dbraw/zinc/19/65/92/377196592.db2.gz	ZHHNCXTZCOTKBL-QWHCGFSZSA-N	1	0	297.424	1.480	50	0		CDAARO
CCC1=NO[C@H](C[NH+]2CCC(n3cnnc3)CC2)C1	ZINC000244742008	377796206	/nfs/dbraw/zinc/79/62/06/377796206.db2.gz	OALAVKOXXNUOLQ-ZDUSSCGKSA-N	1	0	263.345	1.470	50	0		CDAARO
CCC[N@@H+]1CCCN(C(=O)[C@H]2CCC[C@H]2C(=O)OC)CC1	ZINC000245339390	378071853	/nfs/dbraw/zinc/07/18/53/378071853.db2.gz	SKKNDFREVVBXMM-UONOGXRCSA-N	1	0	296.411	1.520	50	0		CDAARO
C1=CC[C@@H](C[NH+]2CCN(C[C@@H]3CCOC3)CC2)CC1	ZINC000093817400	184725851	/nfs/dbraw/zinc/72/58/51/184725851.db2.gz	KWJQEXKWAWKWLI-CVEARBPZSA-N	1	0	264.413	1.997	50	0		CDAARO
C[C@H](O)C[NH+](Cc1ccc(Cl)cc1)C[C@H](C)O	ZINC000000279197	390135669	/nfs/dbraw/zinc/13/56/69/390135669.db2.gz	DOJAOHHKXIRUFD-QWRGUYRKSA-N	1	0	257.761	1.904	50	0		CDAARO
COC(=O)c1ccccc1OC(=O)c1cc[n+](C)cc1	ZINC000001464924	169707748	/nfs/dbraw/zinc/70/77/48/169707748.db2.gz	YVSRCPFESPDEEX-UHFFFAOYSA-N	1	0	272.280	1.517	50	0		CDAARO
C[C@H](C(=O)N(C)CCC(=O)NC1CC1)[NH+]1CCCCCC1	ZINC000095404291	390464153	/nfs/dbraw/zinc/46/41/53/390464153.db2.gz	LPMYPUAJWMEKOU-CYBMUJFWSA-N	1	0	295.427	1.378	50	0		CDAARO
CNc1ccc(C(=O)N2CC[C@@]3(C2)CCC[NH2+]C3)cc1	ZINC000067741265	390575853	/nfs/dbraw/zinc/57/58/53/390575853.db2.gz	XEAOVDSVYDQJQE-INIZCTEOSA-N	1	0	273.380	1.944	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N2CCc3n[nH]cc3C2)c1C	ZINC000067886625	390576700	/nfs/dbraw/zinc/57/67/00/390576700.db2.gz	RBORLTYPJSEPGL-UHFFFAOYSA-N	1	0	272.356	1.445	50	0		CDAARO
C[C@H]([NH2+]Cc1nncn1C)[C@H]1COc2ccccc21	ZINC000097112621	390796037	/nfs/dbraw/zinc/79/60/37/390796037.db2.gz	RFXIUKTYHAAVOH-CMPLNLGQSA-N	1	0	258.325	1.469	50	0		CDAARO
Fc1ccc([C@H]2C[NH2+]CCN2)c(Br)c1	ZINC000083313974	390845916	/nfs/dbraw/zinc/84/59/16/390845916.db2.gz	NMHXUWAUDUUCBM-SNVBAGLBSA-N	1	0	259.122	1.822	50	0		CDAARO
CCCC[N@H+](CCO)CC(=O)N1[C@H](C)CCC[C@H]1C	ZINC000248237550	390919352	/nfs/dbraw/zinc/91/93/52/390919352.db2.gz	NCZKIPHDIBTCJM-ZIAGYGMSSA-N	1	0	270.417	1.870	50	0		CDAARO
CS(=O)(=O)N1CCC([NH2+]Cc2cccc(F)c2)CC1	ZINC000030656293	390959612	/nfs/dbraw/zinc/95/96/12/390959612.db2.gz	HYLJHNWKPFOIPY-UHFFFAOYSA-N	1	0	286.372	1.339	50	0		CDAARO
COCCN1CCC[C@@]2(CC[N@H+](Cc3ccoc3)C2)C1=O	ZINC000012303185	391007289	/nfs/dbraw/zinc/00/72/89/391007289.db2.gz	GWSDUQJXXPFGRX-INIZCTEOSA-N	1	0	292.379	1.741	50	0		CDAARO
COc1cc(C(=O)NCCSC)ccc1OCC[NH3+]	ZINC000426701661	533534242	/nfs/dbraw/zinc/53/42/42/533534242.db2.gz	RONIHYXBLFRSLG-UHFFFAOYSA-N	1	0	284.381	1.126	50	0		CDAARO
CO[C@H](C[N@@H+]1C[C@@H](O)C[C@H]1CO)c1ccc(Cl)cc1	ZINC000241383454	391333184	/nfs/dbraw/zinc/33/31/84/391333184.db2.gz	MVLKNDFMRJKBSU-MELADBBJSA-N	1	0	285.771	1.455	50	0		CDAARO
CC(C)N(C)C(=O)[C@@H]1CCC[N@@H+]1C1CCOCC1	ZINC000192940171	391457277	/nfs/dbraw/zinc/45/72/77/391457277.db2.gz	CTVOFHCQACHAKX-ZDUSSCGKSA-N	1	0	254.374	1.497	50	0		CDAARO
CCCc1cc(CN(C)C[C@H]2CCC[N@@H+]2C)[nH]n1	ZINC000252509445	391608661	/nfs/dbraw/zinc/60/86/61/391608661.db2.gz	YNZBJBAAIKXLEL-CQSZACIVSA-N	1	0	250.390	1.888	50	0		CDAARO
CC(C)[N@H+](C)Cc1ccccc1CNS(C)(=O)=O	ZINC000036392854	392248067	/nfs/dbraw/zinc/24/80/67/392248067.db2.gz	ZTQDAVJLLLRGBI-UHFFFAOYSA-N	1	0	270.398	1.576	50	0		CDAARO
CC[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2)C[C@H]1O	ZINC000252512145	131135873	/nfs/dbraw/zinc/13/58/73/131135873.db2.gz	NFQZBSHZLRFEQB-UMVBOHGHSA-N	1	0	265.353	1.129	50	0		CDAARO
C[C@H]([NH2+][C@H]1CCCC1(C)C)C(=O)NC[C@@H]1CCCO1	ZINC000249107320	392454344	/nfs/dbraw/zinc/45/43/44/392454344.db2.gz	XGDGAEZWESZAQU-AVGNSLFASA-N	1	0	268.401	1.838	50	0		CDAARO
CC(C)CN1CCO[C@H](C[NH2+][C@@H](C)C2CCOCC2)C1	ZINC000089840205	392512312	/nfs/dbraw/zinc/51/23/12/392512312.db2.gz	WVFMHTWNODRJPM-GOEBONIOSA-N	1	0	284.444	1.748	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@@H]2Cc3cc(Cl)ccc3O2)C1	ZINC000269171705	132124604	/nfs/dbraw/zinc/12/46/04/132124604.db2.gz	VHGFLNGIVDEPJT-ZANVPECISA-N	1	0	280.755	1.451	50	0		CDAARO
c1cnc(N2CC[NH+](C[C@@H]3CC=CCC3)CC2)nc1	ZINC000000217806	285546517	/nfs/dbraw/zinc/54/65/17/285546517.db2.gz	VHDFZDXXWMVDMW-CQSZACIVSA-N	1	0	258.369	1.955	50	0		CDAARO
O=C(N[C@@H]1C=C[C@H](CO)C1)[C@H]1CC[N@@H+](C2CCCCC2)C1	ZINC000178296133	140003885	/nfs/dbraw/zinc/00/38/85/140003885.db2.gz	LOMRIGMMSSFTBF-SOUVJXGZSA-N	1	0	292.423	1.694	50	0		CDAARO
O=S(=O)([C@H]1CC[N@H+](C[C@@H]2CC=CCC2)C1)N1CCCC1	ZINC000245689672	140275222	/nfs/dbraw/zinc/27/52/22/140275222.db2.gz	APUHFHMEHYJPQZ-CABCVRRESA-N	1	0	298.452	1.843	50	0		CDAARO
CC(C)(C)OC(=O)N[C@H]1C[C@H]2COC[C@@H](C1)[C@@H]2[NH3+]	ZINC000238855426	397601024	/nfs/dbraw/zinc/60/10/24/397601024.db2.gz	RSUOYMZSXZUASP-DTIDVZRVSA-N	1	0	256.346	1.263	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@@H]1CCC[NH2+]C1	ZINC000037377082	292124039	/nfs/dbraw/zinc/12/40/39/292124039.db2.gz	QMBWFTLDKWWGEU-LLVKDONJSA-N	1	0	272.345	1.164	50	0		CDAARO
c1coc(-c2nc3c(c(N4CC=CC4)n2)CC[NH2+]CC3)c1	ZINC000101171058	397776626	/nfs/dbraw/zinc/77/66/26/397776626.db2.gz	OEXBFOHJWMOZHN-UHFFFAOYSA-N	1	0	282.347	1.801	50	0		CDAARO
C[N@H+](CCN1CCOC1=O)[C@@H]1Cc2ccccc2[C@@H]1O	ZINC000097034130	398006052	/nfs/dbraw/zinc/00/60/52/398006052.db2.gz	PFKVXLHPNBMHBA-KGLIPLIRSA-N	1	0	276.336	1.029	50	0		CDAARO
COc1ccc(OCC(=O)NCCC[NH+](C)C)cc1	ZINC000002824421	169835333	/nfs/dbraw/zinc/83/53/33/169835333.db2.gz	MZUZSKYXOKDYDD-UHFFFAOYSA-N	1	0	266.341	1.142	50	0		CDAARO
CC[NH+]1CCC(NCc2ccc3c(c2)OCO3)CC1	ZINC000004989487	170050264	/nfs/dbraw/zinc/05/02/64/170050264.db2.gz	QFEAWYUHUIPEQP-UHFFFAOYSA-N	1	0	262.353	1.989	50	0		CDAARO
C[NH+](C)CCNS(=O)(=O)c1ccccc1Cl	ZINC000005156577	170071828	/nfs/dbraw/zinc/07/18/28/170071828.db2.gz	WJORABOFRBLSPH-UHFFFAOYSA-N	1	0	262.762	1.180	50	0		CDAARO
Cc1[nH+]c(N)nc(N)c1C=CC(=O)OC(C)(C)C	ZINC000005818107	170143750	/nfs/dbraw/zinc/14/37/50/170143750.db2.gz	RGAPTGAQYJBCLX-AATRIKPKSA-N	1	0	250.302	1.135	50	0		CDAARO
Cc1c(C=O)c2ccccc2n1C[C@H](O)C[NH+](C)C	ZINC000006678110	170225247	/nfs/dbraw/zinc/22/52/47/170225247.db2.gz	ZOEFLNBBNQFDDX-GFCCVEGCSA-N	1	0	260.337	1.685	50	0		CDAARO
C[C@@H](C(=O)Nc1ccc(C(N)=O)cc1)[N@@H+]1CCC[C@@H](C)C1	ZINC000007384232	170281823	/nfs/dbraw/zinc/28/18/23/170281823.db2.gz	VFWKLJMZWUBNTP-NEPJUHHUSA-N	1	0	289.379	1.844	50	0		CDAARO
COC(=O)[C@H]1C[NH2+]C[C@@H]1c1ccc(Br)cc1	ZINC000008699275	170346437	/nfs/dbraw/zinc/34/64/37/170346437.db2.gz	OHYNFAGOLZTLOM-MNOVXSKESA-N	1	0	284.153	1.925	50	0		CDAARO
CC(C)[C@@H](NC(=O)CC[NH3+])c1nc2ccccc2[nH]1	ZINC000008992944	170361136	/nfs/dbraw/zinc/36/11/36/170361136.db2.gz	BHRPPZWANRLVHM-CYBMUJFWSA-N	1	0	260.341	1.725	50	0		CDAARO
NC(=O)c1ccc[n+](Cc2ccc(Br)cc2)c1	ZINC000013137538	170535656	/nfs/dbraw/zinc/53/56/56/170535656.db2.gz	VCQWNRLYQCSACW-UHFFFAOYSA-O	1	0	292.156	1.884	50	0		CDAARO
CC[C@@H](CNC(=O)Cc1c(C)nn(C)c1C)[NH+]1CCCC1	ZINC000032659985	171743692	/nfs/dbraw/zinc/74/36/92/171743692.db2.gz	OTVQTGFMICQRBM-AWEZNQCLSA-N	1	0	292.427	1.570	50	0		CDAARO
NC(=O)N1CCC([NH2+]Cc2ccccc2F)CC1	ZINC000037212007	173033735	/nfs/dbraw/zinc/03/37/35/173033735.db2.gz	NXRFQNYLEHNIFG-UHFFFAOYSA-N	1	0	251.305	1.458	50	0		CDAARO
Brc1ccc(C[C@@H]2Cn3nncc3C[NH2+]2)cc1	ZINC000038518580	174143452	/nfs/dbraw/zinc/14/34/52/174143452.db2.gz	JUZMMISYADLHAH-LLVKDONJSA-N	1	0	293.168	1.755	50	0		CDAARO
CC[C@@H]1CCCCN1C(=O)[C@@H](C)[NH+]1CCC(O)CC1	ZINC000043302520	175002286	/nfs/dbraw/zinc/00/22/86/175002286.db2.gz	OHODJYRRCHOAHZ-CHWSQXEVSA-N	1	0	268.401	1.623	50	0		CDAARO
CCn1nc(C)c(C(=O)N[C@@H]2CC[C@@H]([NH3+])C2)c1C	ZINC000067806006	175794447	/nfs/dbraw/zinc/79/44/47/175794447.db2.gz	IXMSVYHZXVVNOK-GHMZBOCLSA-N	1	0	250.346	1.129	50	0		CDAARO
CCn1nc(C)c(C(=O)NCC[C@@H]2CCC[N@H+](C)C2)c1C	ZINC000067847763	175796586	/nfs/dbraw/zinc/79/65/86/175796586.db2.gz	FGHCYDQKLBNICD-AWEZNQCLSA-N	1	0	292.427	1.982	50	0		CDAARO
Ic1cnn(CC2CC[NH2+]CC2)c1	ZINC000070677695	176001180	/nfs/dbraw/zinc/00/11/80/176001180.db2.gz	PAHPCZHUWIWJKP-UHFFFAOYSA-N	1	0	291.136	1.487	50	0		CDAARO
CO[C@H]1CN(C(=O)c2cnc(C(C)C)nc2C)CC[C@H]1[NH3+]	ZINC000071763890	176261830	/nfs/dbraw/zinc/26/18/30/176261830.db2.gz	QWDPDKQXBYZBJZ-OLZOCXBDSA-N	1	0	292.383	1.097	50	0		CDAARO
O=C(C[C@@H]1COCC[NH2+]1)Nc1cccc2c1CCCC2	ZINC000072152204	176327434	/nfs/dbraw/zinc/32/74/34/176327434.db2.gz	NYMWAGOWUHBKBR-CYBMUJFWSA-N	1	0	274.364	1.882	50	0		CDAARO
O=C(C[C@@H]1COCC[NH2+]1)NCc1csc2c1CCCC2	ZINC000072166913	176331665	/nfs/dbraw/zinc/33/16/65/176331665.db2.gz	QEJUMANLVCKNPF-GFCCVEGCSA-N	1	0	294.420	1.622	50	0		CDAARO
COc1cc(C(=O)N2CCC[C@H]([NH+](C)C)CC2)ccc1O	ZINC000072168991	176332572	/nfs/dbraw/zinc/33/25/72/176332572.db2.gz	AXDHJEJKVJBZQX-ZDUSSCGKSA-N	1	0	292.379	1.957	50	0		CDAARO
Cc1cc(Nc2cnccn2)nc([C@@H]2CCC[NH2+]C2)n1	ZINC000072356446	176375460	/nfs/dbraw/zinc/37/54/60/176375460.db2.gz	UORBETJLMLCWHN-LLVKDONJSA-N	1	0	270.340	1.786	50	0		CDAARO
Cc1nn2c(nc(C)cc2N(C)CC[NH+](C)C)c1C	ZINC000072407135	176397885	/nfs/dbraw/zinc/39/78/85/176397885.db2.gz	APIUGPPOWFFUFR-UHFFFAOYSA-N	1	0	261.373	1.652	50	0		CDAARO
Cc1ccc(C)c(N2CCN(C[C@@]3(O)CC[NH2+]C3)CC2)c1	ZINC000077301545	177250375	/nfs/dbraw/zinc/25/03/75/177250375.db2.gz	UYZJQWNRTXBEQF-QGZVFWFLSA-N	1	0	289.423	1.150	50	0		CDAARO
Nc1ncccc1CN1CCC[C@](O)(C[NH+]2CCCC2)C1	ZINC000077406084	177263878	/nfs/dbraw/zinc/26/38/78/177263878.db2.gz	IOEMTTWALLKRJD-INIZCTEOSA-N	1	0	290.411	1.087	50	0		CDAARO
CC(=O)c1[nH]c(C)c(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1C	ZINC000077505554	177276390	/nfs/dbraw/zinc/27/63/90/177276390.db2.gz	XJCKMIQQOUUDAL-QWHCGFSZSA-N	1	0	289.379	1.610	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1ccc(OC)cc1	ZINC000002842865	260010365	/nfs/dbraw/zinc/01/03/65/260010365.db2.gz	QSJQTOVLCUKUDW-UHFFFAOYSA-N	1	0	250.342	1.767	50	0		CDAARO
C[C@@H]1C[NH+](C[C@@H](O)COC2CCCC2)C[C@@H](C)O1	ZINC000012419911	424377139	/nfs/dbraw/zinc/37/71/39/424377139.db2.gz	VKESFLWTZYJZIP-JHJVBQTASA-N	1	0	257.374	1.416	50	0		CDAARO
Clc1cnc(N2CC[NH+](C3CCC3)CC2)nc1	ZINC000244975043	274884902	/nfs/dbraw/zinc/88/49/02/274884902.db2.gz	HZIWPLOBQZIVHH-UHFFFAOYSA-N	1	0	252.749	1.805	50	0		CDAARO
Cc1cc2c(c(-c3cnc(N)cn3)c1)O[C@H](C[NH3+])C2	ZINC000067756095	274725457	/nfs/dbraw/zinc/72/54/57/274725457.db2.gz	MNFZTJQAEKUSIP-JTQLQIEISA-N	1	0	256.309	1.296	50	0		CDAARO
NC(=O)C1CC[NH+](C[C@H]2CCOc3ccccc3C2)CC1	ZINC000095507522	274933929	/nfs/dbraw/zinc/93/39/29/274933929.db2.gz	AOCXBGPUKJCENR-ZDUSSCGKSA-N	1	0	288.391	1.825	50	0		CDAARO
CC(C)[C@]1(O)CN(C(=O)C[N@H+](C)C2CCCC2)C[C@H]1C	ZINC000091593167	276039469	/nfs/dbraw/zinc/03/94/69/276039469.db2.gz	RSADJRPINWDFDH-CZUORRHYSA-N	1	0	282.428	1.726	50	0		CDAARO
CC(=O)NC1CCC([NH2+][C@H]2Cc3ccccc3[C@@H]2O)CC1	ZINC000187214634	277025590	/nfs/dbraw/zinc/02/55/90/277025590.db2.gz	DWBNMOFOBQCEQQ-LCSXWQTCSA-N	1	0	288.391	1.682	50	0		CDAARO
COC1CC[NH+](CC(=O)N2C[C@H](C)C[C@@H](C)C2)CC1	ZINC000053906863	277194497	/nfs/dbraw/zinc/19/44/97/277194497.db2.gz	IAWWWIKHPZCYJN-CHWSQXEVSA-N	1	0	268.401	1.602	50	0		CDAARO
CC(C)(C)n1nc(C(=O)N2CC[C@H]([NH3+])C2)cc1C1CC1	ZINC000097019546	277286140	/nfs/dbraw/zinc/28/61/40/277286140.db2.gz	BQTZWCZLEGOQOH-NSHDSACASA-N	1	0	276.384	1.689	50	0		CDAARO
COC(=O)C[C@@H]1[NH2+]CCc2cc(OC)c(OC)cc21	ZINC000019892510	277327624	/nfs/dbraw/zinc/32/76/24/277327624.db2.gz	NVXHORURRXLOGZ-NSHDSACASA-N	1	0	265.309	1.454	50	0		CDAARO
CC1(C)CCC[C@H](C[NH2+]CCNS(C)(=O)=O)C1	ZINC000096483692	278240403	/nfs/dbraw/zinc/24/04/03/278240403.db2.gz	CEBSEMBPUSKQQZ-NSHDSACASA-N	1	0	262.419	1.342	50	0		CDAARO
C[C@H](C(=O)N1CCCn2cncc2C1)[N@@H+]1CCC[C@@H](C)C1	ZINC000107014595	279197610	/nfs/dbraw/zinc/19/76/10/279197610.db2.gz	WRVXAEMEHRWOKH-ZIAGYGMSSA-N	1	0	290.411	1.736	50	0		CDAARO
CC[N@@H+]1CCC[C@H](N2CC[C@@H](N(C)C(C)=O)C2)C1	ZINC000032529870	279316857	/nfs/dbraw/zinc/31/68/57/279316857.db2.gz	DJBJOHJIEJVGFU-KGLIPLIRSA-N	1	0	253.390	1.023	50	0		CDAARO
CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1[NH2+]CC1CC1	ZINC000095402525	280432691	/nfs/dbraw/zinc/43/26/91/280432691.db2.gz	HJAPPOWOESWXFX-NEPJUHHUSA-N	1	0	260.403	1.046	50	0		CDAARO
CN1C(=O)OC2(CC(C)(C)[NH2+]C(C)(C)C2)[C@]1(C)O	ZINC000000036886	289856008	/nfs/dbraw/zinc/85/60/08/289856008.db2.gz	SVBLLSQZYQNSJW-LBPRGKRZSA-N	1	0	256.346	1.456	50	0		CDAARO
[NH3+]C[C@@H]1CCCN1c1nc(C(F)(F)F)nc2nc[nH]c21	ZINC000557300204	290340117	/nfs/dbraw/zinc/34/01/17/290340117.db2.gz	LIAZLHMXLQOCFE-LURJTMIESA-N	1	0	286.261	1.299	50	0		CDAARO
C[C@@H](N=c1nc(N(C)C)[nH]s1)C1CC[NH+](C)CC1	ZINC000534591703	328318372	/nfs/dbraw/zinc/31/83/72/328318372.db2.gz	WICDVJIRJAWVMO-SECBINFHSA-N	1	0	269.418	1.168	50	0		CDAARO
O=C(COCC(F)(F)C(F)F)N1C[C@@H]2CC[C@H]1C[NH2+]C2	ZINC000534588884	328317129	/nfs/dbraw/zinc/31/71/29/328317129.db2.gz	GTTWONTZWUPDPM-BDAKNGLRSA-N	1	0	298.280	1.114	50	0		CDAARO
O=C(NC1CCN(c2ccccc2F)CC1)[C@H]1C=CC[NH2+]1	ZINC000534642762	328329038	/nfs/dbraw/zinc/32/90/38/328329038.db2.gz	HTDDCAAQRQAWPI-CQSZACIVSA-N	1	0	289.354	1.439	50	0		CDAARO
Cc1ccc(CC2([NH2+][C@H](C)CN(C)CCO)CC2)cc1	ZINC000534659610	328342231	/nfs/dbraw/zinc/34/22/31/328342231.db2.gz	QIPPXIDOQKFTKS-OAHLLOKOSA-N	1	0	276.424	1.972	50	0		CDAARO
CC[C@H](C[NH+](C)C)NC(=O)N(C)Cc1ccnc(C)c1	ZINC000534647368	328342853	/nfs/dbraw/zinc/34/28/53/328342853.db2.gz	ZEMPURSZHWRVKW-CQSZACIVSA-N	1	0	278.400	1.872	50	0		CDAARO
Cc1c[nH]c(C[NH2+][C@@H]2CCCSC2)c(C)c1=O	ZINC000534656866	328340733	/nfs/dbraw/zinc/34/07/33/328340733.db2.gz	FXMUIDUHFNDZIR-LLVKDONJSA-N	1	0	252.383	1.977	50	0		CDAARO
O=C(CCC(F)(F)F)N1C[C@H]2CC[C@@H](C1)[NH2+]C2	ZINC000534670125	328346905	/nfs/dbraw/zinc/34/69/05/328346905.db2.gz	QMYOSTXRTLTTPX-IUCAKERBSA-N	1	0	250.264	1.539	50	0		CDAARO
CC(C)C(=O)N[C@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000011704925	329289468	/nfs/dbraw/zinc/28/94/68/329289468.db2.gz	JHCDNRYHGMNMLE-ZDUSSCGKSA-N	1	0	267.417	1.317	50	0		CDAARO
FC(F)(F)[C@]1(c2nc(-c3cccnc3)no2)CC[NH2+]C1	ZINC000111240727	330381727	/nfs/dbraw/zinc/38/17/27/330381727.db2.gz	ACRAXFFIQIOMOR-LLVKDONJSA-N	1	0	284.241	1.925	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2SCCc3ccccc32)CC[NH2+]1	ZINC000188457990	482447540	/nfs/dbraw/zinc/44/75/40/482447540.db2.gz	AGPBSNXADRLMBO-RISCZKNCSA-N	1	0	276.405	1.837	50	0		CDAARO
CCn1ncc(C(=O)N(C)[C@H]2CC[NH2+]C2)c1C(F)(F)F	ZINC000299739545	482447822	/nfs/dbraw/zinc/44/78/22/482447822.db2.gz	PWXHJOZRZBAEQN-QMMMGPOBSA-N	1	0	290.289	1.356	50	0		CDAARO
C[C@@H]1C[N@H+](C[C@H]2CCCCO2)CCN1Cc1nccn1C	ZINC000248131541	482498949	/nfs/dbraw/zinc/49/89/49/482498949.db2.gz	NIAXHGPKRGJJAJ-HUUCEWRRSA-N	1	0	292.427	1.495	50	0		CDAARO
C[N@H+](CCO)C1CCN(Cc2cnccc2Cl)CC1	ZINC000670438495	482981440	/nfs/dbraw/zinc/98/14/40/482981440.db2.gz	TZQSSUPATJGRQZ-UHFFFAOYSA-N	1	0	283.803	1.624	50	0		CDAARO
CNC(=O)C[C@@H]1CC[N@H+](Cc2ccc3c(c2)OCCO3)C1	ZINC000670447827	483002568	/nfs/dbraw/zinc/00/25/68/483002568.db2.gz	VSYDAVLOTWOOSG-ZDUSSCGKSA-N	1	0	290.363	1.416	50	0		CDAARO
CCC1=NO[C@H](CN2CC[N@@H+](CC)C(C)(C)C2)C1	ZINC000670449567	483005545	/nfs/dbraw/zinc/00/55/45/483005545.db2.gz	FTUGXPMAXXPVQL-ZDUSSCGKSA-N	1	0	253.390	1.957	50	0		CDAARO
c1cnn(CCC[N@@H+]2CCC[C@@H](c3nnc[nH]3)C2)c1	ZINC000670449844	483009654	/nfs/dbraw/zinc/00/96/54/483009654.db2.gz	AJLYTSZEDBDCAV-GFCCVEGCSA-N	1	0	260.345	1.271	50	0		CDAARO
Cc1nn(C)cc1C[N@H+](C)CCn1cc(Cl)cn1	ZINC000670451739	483014592	/nfs/dbraw/zinc/01/45/92/483014592.db2.gz	FZEIEVBCFXWYME-UHFFFAOYSA-N	1	0	267.764	1.710	50	0		CDAARO
Cc1cc(CN(C)C[C@H]2CC[N@H+](C)C2(C)C)[nH]n1	ZINC000670455414	483028418	/nfs/dbraw/zinc/02/84/18/483028418.db2.gz	IWIVPJHXZVGUGY-GFCCVEGCSA-N	1	0	250.390	1.880	50	0		CDAARO
CC(C)c1nccc(CN2C[C@H](O)[C@@H]([NH+]3CCCC3)C2)n1	ZINC000670456703	483036305	/nfs/dbraw/zinc/03/63/05/483036305.db2.gz	GCPQVJRTJAIITI-GJZGRUSLSA-N	1	0	290.411	1.241	50	0		CDAARO
Cc1cccc(OC2C[NH+]([C@H]3CCNC(=O)CC3)C2)c1	ZINC000670457669	483037179	/nfs/dbraw/zinc/03/71/79/483037179.db2.gz	IBDSIDYDWLXVMT-CYBMUJFWSA-N	1	0	274.364	1.727	50	0		CDAARO
Cc1ncn(C)c1C(=O)N1CC[C@H]([NH+]2CCCCC2)C1	ZINC000670461976	483051020	/nfs/dbraw/zinc/05/10/20/483051020.db2.gz	VZWSTMGGNCNDBF-ZDUSSCGKSA-N	1	0	276.384	1.429	50	0		CDAARO
Cc1ccc2[nH]c(CNC(=O)CC3C[NH2+]C3)nc2c1	ZINC000670466082	483056997	/nfs/dbraw/zinc/05/69/97/483056997.db2.gz	GEWAPRCXFUTKIO-UHFFFAOYSA-N	1	0	258.325	1.097	50	0		CDAARO
COc1ccc2ncn(CC[C@@H]3CCC[NH2+]3)c(=O)c2c1	ZINC000670467471	483058846	/nfs/dbraw/zinc/05/88/46/483058846.db2.gz	SXGMFFWHZYRWQZ-NSHDSACASA-N	1	0	273.336	1.547	50	0		CDAARO
C[C@@H](C(=O)N1CCCC1)N1CC[C@H](C[NH+]2CCCC2)C1	ZINC000083888644	483217457	/nfs/dbraw/zinc/21/74/57/483217457.db2.gz	PVMAIUVXOSIZLQ-LSDHHAIUSA-N	1	0	279.428	1.415	50	0		CDAARO
Cc1cc([C@H]2CCC[N@H+](CCN3CCOCC3)C2)[nH]n1	ZINC000084111206	483247236	/nfs/dbraw/zinc/24/72/36/483247236.db2.gz	SRJHJBJVCVEPSH-AWEZNQCLSA-N	1	0	278.400	1.230	50	0		CDAARO
C[C@H]([NH2+]CC(=O)NCc1cccnc1)C1CCOCC1	ZINC000096492020	533825034	/nfs/dbraw/zinc/82/50/34/533825034.db2.gz	PCLSYFRPPCIFCC-LBPRGKRZSA-N	1	0	277.368	1.103	50	0		CDAARO
C[C@H]([NH2+]Cc1cnn(C)c1)[C@@H](O)c1ccc(F)c(F)c1	ZINC000096452788	533938903	/nfs/dbraw/zinc/93/89/03/533938903.db2.gz	UGYCVKWRRINOCN-LKFCYVNXSA-N	1	0	281.306	1.910	50	0		CDAARO
CN1CCOc2ccc(NC(=O)[C@@H]3CC[C@@H]([NH3+])C3)cc21	ZINC000246176257	523954451	/nfs/dbraw/zinc/95/44/51/523954451.db2.gz	BOVITEVHHRWNJX-GHMZBOCLSA-N	1	0	275.352	1.581	50	0		CDAARO
O=c1n(CCC[NH+]2CCCCC2)nnn1-c1ccccc1	ZINC000187673849	527493984	/nfs/dbraw/zinc/49/39/84/527493984.db2.gz	VHTAGDHPEGPUKQ-UHFFFAOYSA-N	1	0	287.367	1.305	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@@H](CNc2cccc(F)n2)C1	ZINC000096453235	528014046	/nfs/dbraw/zinc/01/40/46/528014046.db2.gz	DURNBUSLVYZJEA-LBPRGKRZSA-N	1	0	267.348	1.989	50	0		CDAARO
CC(C)c1cc(CSc2nnc(CC[NH3+])n2C)on1	ZINC000426698457	528042534	/nfs/dbraw/zinc/04/25/34/528042534.db2.gz	PRLQMZNOTJVWJO-UHFFFAOYSA-N	1	0	281.385	1.720	50	0		CDAARO
CCC[N@@H+]1CCCN(C(=O)[C@@H]2CCC[C@@H]2C(=O)OC)CC1	ZINC000096497083	528215473	/nfs/dbraw/zinc/21/54/73/528215473.db2.gz	SKKNDFREVVBXMM-KGLIPLIRSA-N	1	0	296.411	1.520	50	0		CDAARO
CCc1cc(N[C@@H]2CC[NH2+]C2)n2nc(C)c(C)c2n1	ZINC000072408948	567902478	/nfs/dbraw/zinc/90/24/78/567902478.db2.gz	GGAYBYOQPRKERW-GFCCVEGCSA-N	1	0	259.357	1.682	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@@H](CN(C)Cc2cncnc2)C1	ZINC000952972979	614103503	/nfs/dbraw/zinc/10/35/03/614103503.db2.gz	QWBBMUNAEJBJOW-AWEZNQCLSA-N	1	0	262.401	1.886	50	0		CDAARO
CC1(C[NH2+]CCN2CCCC[C@H]2CO)CCOCC1	ZINC000952980103	614902888	/nfs/dbraw/zinc/90/28/88/614902888.db2.gz	CLERRZFGRHJKHK-AWEZNQCLSA-N	1	0	270.417	1.240	50	0		CDAARO
CCOc1cc(N2C[C@@H]3CC[N@H+](C)C[C@H]3C2)ncn1	ZINC000952991648	615508337	/nfs/dbraw/zinc/50/83/37/615508337.db2.gz	FUOIOFQEIDEHDL-RYUDHWBXSA-N	1	0	262.357	1.263	50	0		CDAARO
CC[C@H](C(=O)NC1(COC)CCCC1)[N@H+](C)CC	ZINC000952985131	615605848	/nfs/dbraw/zinc/60/58/48/615605848.db2.gz	CGDSLDGATOGCQD-GFCCVEGCSA-N	1	0	256.390	1.792	50	0		CDAARO
[NH3+][C@@H]1CCCCCC[C@H]1C(=O)N1CCC(O)CC1	ZINC000888096021	617757545	/nfs/dbraw/zinc/75/75/45/617757545.db2.gz	HPJWYAXGCHUHCP-CHWSQXEVSA-N	1	0	254.374	1.267	50	0		CDAARO
O=c1cc([C@H]2CCC[NH2+]C2)nc(Cc2cccs2)[nH]1	ZINC000023338237	1159425776	/nfs/dbraw/zinc/42/57/76/1159425776.db2.gz	AIQDTWAKQZHYPK-JTQLQIEISA-N	1	0	275.377	1.889	50	0		CDAARO
COc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2[NH2+]3)c(O)c1	ZINC001772704119	1159439937	/nfs/dbraw/zinc/43/99/37/1159439937.db2.gz	KDRNFVSGNWSXRS-ZHAHWJHGSA-N	1	0	262.309	1.024	50	0		CDAARO
CCCc1cnc(C)nc1NC[C@H](O)C[NH+](C)C	ZINC001704316154	1177685878	/nfs/dbraw/zinc/68/58/78/1177685878.db2.gz	XUIVQKMBZWWCTC-LBPRGKRZSA-N	1	0	252.362	1.072	50	0		CDAARO
Cc1ccc(C[N@@H+](C)CCc2c[nH]c(=O)n(C)c2=O)o1	ZINC001704350243	1177696601	/nfs/dbraw/zinc/69/66/01/1177696601.db2.gz	HEBUJDQUGPLQCU-UHFFFAOYSA-N	1	0	277.324	1.062	50	0		CDAARO
O=C(Cc1ccncc1)N1CCC[C@H](C[NH+]2CCCC2)C1	ZINC000020868373	698007543	/nfs/dbraw/zinc/00/75/43/698007543.db2.gz	SIORAWNUZQIBSW-MRXNPFEDSA-N	1	0	287.407	1.959	50	0		CDAARO
Cc1cc(C)c(OCC(=O)N2CCC[C@H]([NH3+])C2)c(C)c1	ZINC000195109387	698104894	/nfs/dbraw/zinc/10/48/94/698104894.db2.gz	XJAWSXSNAOSRGX-AWEZNQCLSA-N	1	0	276.380	1.940	50	0		CDAARO
Cc1ccc2nc(CNc3cc(CC[NH3+])nc(C)n3)cn2c1	ZINC000067756344	698342848	/nfs/dbraw/zinc/34/28/48/698342848.db2.gz	CFCWYKZNYITJAZ-UHFFFAOYSA-N	1	0	296.378	1.854	50	0		CDAARO
O=C(NC1CCCC1)c1cccc(N2CC[NH2+]CC2)c1	ZINC000020221063	698509536	/nfs/dbraw/zinc/50/95/36/698509536.db2.gz	COBJUDCSOZITEV-UHFFFAOYSA-N	1	0	273.380	1.769	50	0		CDAARO
C[C@H]1CCC[N@H+](CCc2nc(-c3cn(C)cn3)no2)C1	ZINC000020450090	698867837	/nfs/dbraw/zinc/86/78/37/698867837.db2.gz	FZFHZMJBKRYTIN-NSHDSACASA-N	1	0	275.356	1.745	50	0		CDAARO
Cn1ccnc1[C@H](O)C1CC[NH+](CCc2cn[nH]c2)CC1	ZINC000244774035	848488157	/nfs/dbraw/zinc/48/81/57/848488157.db2.gz	PMWKUIFSUMLLIX-CQSZACIVSA-N	1	0	289.383	1.131	50	0		CDAARO
COc1cccc2c1OC[C@@H]([NH2+]CCc1cnccn1)C2	ZINC000012090149	849982686	/nfs/dbraw/zinc/98/26/86/849982686.db2.gz	LMBQNYNSEACCEJ-AWEZNQCLSA-N	1	0	285.347	1.621	50	0		CDAARO
Cc1ccc2c(c1)ncn(CC[N@@H+]1CCC[C@@H](O)C1)c2=O	ZINC000032540587	912770106	/nfs/dbraw/zinc/77/01/06/912770106.db2.gz	VNYYULOPTJECGY-CYBMUJFWSA-N	1	0	287.363	1.162	50	0		CDAARO
C[C@@H](O)c1nc2cc(NC(=O)C(C)(C)[NH3+])ccc2[nH]1	ZINC000952985690	910550420	/nfs/dbraw/zinc/55/04/20/910550420.db2.gz	CJVUJEJQQLVDFR-SSDOTTSWSA-N	1	0	262.313	1.292	50	0		CDAARO
CC[C@H](CNC(=O)N1CC[NH2+]CC1)Cc1ccccc1	ZINC000822620670	925642087	/nfs/dbraw/zinc/64/20/87/925642087.db2.gz	KWCNCCMPDFKGRL-AWEZNQCLSA-N	1	0	275.396	1.870	50	0		CDAARO
Cc1cnc(CN(C)C[C@@H]2CC[N@H+](C)C2(C)C)cn1	ZINC000823690293	925722074	/nfs/dbraw/zinc/72/20/74/925722074.db2.gz	UJUANCQCHAFVCK-ZDUSSCGKSA-N	1	0	262.401	1.947	50	0		CDAARO
O=S(=O)(C1CC1)N1CCC[N@@H+](C2CCCCC2)CC1	ZINC000828388774	926118509	/nfs/dbraw/zinc/11/85/09/926118509.db2.gz	FODBGDJLVIHRBT-UHFFFAOYSA-N	1	0	286.441	1.819	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)N1[C@@H]2CC[C@H]1C[C@@H](O)C2	ZINC000828869908	926197648	/nfs/dbraw/zinc/19/76/48/926197648.db2.gz	AEJXBYKWBKULIH-WDNDVIMCSA-N	1	0	266.385	1.377	50	0		CDAARO
C[NH+](C)CCc1nnc(NC(=O)C2(C)CC2)s1	ZINC001529114983	968986772	/nfs/dbraw/zinc/98/67/72/968986772.db2.gz	WOGSSTJEWHUWPB-UHFFFAOYSA-N	1	0	254.359	1.381	50	0		CDAARO
CCc1nn(C)c(NC(=O)[C@H]([NH3+])c2ccccc2)c1C	ZINC001529189372	969009387	/nfs/dbraw/zinc/00/93/87/969009387.db2.gz	NOAOITBSJFLCBF-CYBMUJFWSA-N	1	0	272.352	1.929	50	0		CDAARO
C[C@H](CN(C)CCO)[NH2+]Cc1ccc(F)c(Cl)c1	ZINC001506415683	975152659	/nfs/dbraw/zinc/15/26/59/975152659.db2.gz	BIFCKSIWWZJJHV-SNVBAGLBSA-N	1	0	274.767	1.881	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CCCn2ccnc2)n1	ZINC001506416664	975156216	/nfs/dbraw/zinc/15/62/16/975156216.db2.gz	KLMBRDKOHTWFQS-ZDUSSCGKSA-N	1	0	261.373	1.765	50	0		CDAARO
CN1C(=O)N=NC1CC[NH2+][C@H]1CC2C[C@@H]3CC1C[C@H](C2)C3	ZINC001506426953	975160874	/nfs/dbraw/zinc/16/08/74/975160874.db2.gz	UJROBALLRBBFRR-OESUJAFSSA-N	1	0	290.411	1.868	50	0		CDAARO
COc1ccc(CC(=O)N2CC[NH2+]C[C@H]2C)c(Cl)c1	ZINC000124335606	187133268	/nfs/dbraw/zinc/13/32/68/187133268.db2.gz	SXMBWOCKCAPCHZ-SNVBAGLBSA-N	1	0	282.771	1.711	50	0		CDAARO
Cn1cc(C[NH2+]Cc2ccc(N3CCOC3=O)cc2)cn1	ZINC000096501570	230384924	/nfs/dbraw/zinc/38/49/24/230384924.db2.gz	KCYDWTCULIDBEO-UHFFFAOYSA-N	1	0	286.335	1.667	50	0		CDAARO
Cn1ccnc1C[C@@H]1CCC[N@H+](Cc2ccc(CO)o2)C1	ZINC000097377012	342002969	/nfs/dbraw/zinc/00/29/69/342002969.db2.gz	JXRBIXRNEYYGPF-ZDUSSCGKSA-N	1	0	289.379	1.960	50	0		CDAARO
COC(=O)C1(C[NH2+]C2CCN(C)CC2)CCCCC1	ZINC000097378085	342003187	/nfs/dbraw/zinc/00/31/87/342003187.db2.gz	NQDMQEAVHKYJNR-UHFFFAOYSA-N	1	0	268.401	1.794	50	0		CDAARO
C[C@@H](C(=O)NCCOCC1CC1)[NH+]1CCCCCC1	ZINC000095962385	185045006	/nfs/dbraw/zinc/04/50/06/185045006.db2.gz	HKXZOZVGKKUISU-ZDUSSCGKSA-N	1	0	268.401	1.794	50	0		CDAARO
C[C@H](CC(=O)N1CCCCCC1)[NH2+][C@H]1CCCCNC1=O	ZINC000095967271	185047086	/nfs/dbraw/zinc/04/70/86/185047086.db2.gz	GXAJYDHZPVDVKV-KGLIPLIRSA-N	1	0	295.427	1.426	50	0		CDAARO
C[NH+](C)CCNC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000005072255	282103760	/nfs/dbraw/zinc/10/37/60/282103760.db2.gz	HXHDVAGIOMBRDW-UHFFFAOYSA-N	1	0	265.401	1.816	50	0		CDAARO
CCS(=O)(=O)NCC[NH2+]C(C)(C)c1cccc(F)c1	ZINC000095985273	185055047	/nfs/dbraw/zinc/05/50/47/185055047.db2.gz	JYQJQFZHUMBOEJ-UHFFFAOYSA-N	1	0	288.388	1.590	50	0		CDAARO
CCC[N@H+](CC(N)=O)[C@H](C)CC(=O)Nc1ccccc1	ZINC000241923322	361754780	/nfs/dbraw/zinc/75/47/80/361754780.db2.gz	UEZUUSDLBFYWFH-GFCCVEGCSA-N	1	0	277.368	1.601	50	0		CDAARO
COc1ccc(-n2nc(C)nc2[C@H]2CC[NH2+]C2)cc1	ZINC000096140056	185105610	/nfs/dbraw/zinc/10/56/10/185105610.db2.gz	NUYKVAXRKHWSOJ-NSHDSACASA-N	1	0	258.325	1.661	50	0		CDAARO
[NH3+][C@H](C(=O)N1CCOC[C@@H]1C1CC1)c1ccccc1	ZINC000195554886	342626166	/nfs/dbraw/zinc/62/61/66/342626166.db2.gz	DZLINGUKWWFQNQ-KGLIPLIRSA-N	1	0	260.337	1.324	50	0		CDAARO
CN(C(=O)[C@@H]([NH3+])C(C)(C)C)c1ccc2c(c1)CCO2	ZINC000195543671	342626698	/nfs/dbraw/zinc/62/66/98/342626698.db2.gz	WFTZBYMWJGQGDW-CYBMUJFWSA-N	1	0	262.353	1.958	50	0		CDAARO
COC(C)(C)[C@@H](C)[NH2+]CC(=O)N(C)CC(F)(F)F	ZINC000252492290	361847170	/nfs/dbraw/zinc/84/71/70/361847170.db2.gz	MHKKHRPBANGVQR-MRVPVSSYSA-N	1	0	270.295	1.410	50	0		CDAARO
Cc1nc(CNC(=O)[C@@H](C)[NH+]2CCCCCC2)cc(=O)[nH]1	ZINC000244758174	361862198	/nfs/dbraw/zinc/86/21/98/361862198.db2.gz	OTNKUWFUSACFOK-LLVKDONJSA-N	1	0	292.383	1.371	50	0		CDAARO
Cc1nc(NCCCn2ccnn2)cc([C@H]2C[C@H]([NH3+])C2)n1	ZINC000244778728	361863769	/nfs/dbraw/zinc/86/37/69/361863769.db2.gz	PVKHKYBGHUHZFQ-HAQNSBGRSA-N	1	0	287.371	1.083	50	0		CDAARO
C[NH2+][C@@H](C)C(=O)NCc1c(C)ccc2ncccc21	ZINC000244866647	361866451	/nfs/dbraw/zinc/86/64/51/361866451.db2.gz	VZUCBNYNJKYDBG-NSHDSACASA-N	1	0	257.337	1.767	50	0		CDAARO
CC(C)(C)c1ccccc1S(=O)(=O)NCCC[NH3+]	ZINC000097229276	342204870	/nfs/dbraw/zinc/20/48/70/342204870.db2.gz	RKCSVVQTQNRDCM-UHFFFAOYSA-N	1	0	270.398	1.611	50	0		CDAARO
CO[C@@H]1CC[C@@H]2OCC[N@H+](CCCCCO)[C@@H]2C1	ZINC000097021420	185153685	/nfs/dbraw/zinc/15/36/85/185153685.db2.gz	DSRCOAFQYOTZAX-MCIONIFRSA-N	1	0	257.374	1.417	50	0		CDAARO
C[C@H]1CN(C(=O)C2CC2)CC[C@@H]1[NH2+]Cc1cccnc1	ZINC000084714966	342267951	/nfs/dbraw/zinc/26/79/51/342267951.db2.gz	PWVVJGQIMULXIL-WFASDCNBSA-N	1	0	273.380	1.818	50	0		CDAARO
CC[C@@H](O)C[NH2+][C@H](C)C1(N2CCOCC2)CCCC1	ZINC000125846196	187202212	/nfs/dbraw/zinc/20/22/12/187202212.db2.gz	UMMFRXUHMMWUAD-ZIAGYGMSSA-N	1	0	270.417	1.380	50	0		CDAARO
CC(C)Oc1ccccc1CC(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178531097	362245578	/nfs/dbraw/zinc/24/55/78/362245578.db2.gz	LEWGQLZEWTUHDY-ZDUSSCGKSA-N	1	0	276.380	1.824	50	0		CDAARO
CNC(=O)NC(=O)C[NH2+][C@@H](C)c1ccc(F)c(Cl)c1	ZINC000096491153	529879971	/nfs/dbraw/zinc/87/99/71/529879971.db2.gz	AFJGRVLKPGPMPC-ZETCQYMHSA-N	1	0	287.722	1.585	50	0		CDAARO
C[C@H]1CN(C(=O)COc2cccc(F)c2)C[C@H](C)[NH2+]1	ZINC000179163497	362253527	/nfs/dbraw/zinc/25/35/27/362253527.db2.gz	AXWHKRUYDLJJCE-QWRGUYRKSA-N	1	0	266.316	1.413	50	0		CDAARO
O=C(Nc1nncs1)N1CCN(Cc2ccco2)CC1	ZINC000084432978	362264133	/nfs/dbraw/zinc/26/41/33/362264133.db2.gz	QWNHBYJAJWACQH-UHFFFAOYSA-N	1	0	293.352	1.481	50	0		CDAARO
CCO[C@@H]1C[C@H]([N@H+](C)CCC(=O)N2CCOCC2)C1(C)C	ZINC000084800718	362275294	/nfs/dbraw/zinc/27/52/94/362275294.db2.gz	SHVFYLOFFRRNDC-UONOGXRCSA-N	1	0	298.427	1.371	50	0		CDAARO
C[C@@H](NC(=O)c1csnn1)C(C)(C)C[NH+](C)C	ZINC000085290743	179006399	/nfs/dbraw/zinc/00/63/99/179006399.db2.gz	LOXMAMFLZARAAO-MRVPVSSYSA-N	1	0	256.375	1.244	50	0		CDAARO
[NH3+][C@@H]1CC[C@H]2CN(S(=O)(=O)c3ccccc3)C[C@@H]12	ZINC000248617621	362681893	/nfs/dbraw/zinc/68/18/93/362681893.db2.gz	MGNHTLZJKIBVTL-CYZMBNFOSA-N	1	0	266.366	1.044	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN1C(=O)CCCc1ccccc1	ZINC000085470046	179075217	/nfs/dbraw/zinc/07/52/17/179075217.db2.gz	JBYKJAWMTFGVRY-MRXNPFEDSA-N	1	0	290.407	1.798	50	0		CDAARO
COc1ccccc1NC(=S)N(C)N1CCN(C)CC1	ZINC000013577442	365939740	/nfs/dbraw/zinc/93/97/40/365939740.db2.gz	MDPCCOHYAWJEDC-UHFFFAOYSA-N	1	0	294.424	1.486	50	0		CDAARO
COc1cccc2ncn(CC[C@@H](C)[NH+](C)C)c(=O)c21	ZINC000584895979	349357362	/nfs/dbraw/zinc/35/73/62/349357362.db2.gz	KJNIPVBDVCSKFK-LLVKDONJSA-N	1	0	275.352	1.745	50	0		CDAARO
CC/C=C/CC(=O)N1CCC[C@H](C[NH+]2CCOCC2)C1	ZINC000584885301	349343459	/nfs/dbraw/zinc/34/34/59/349343459.db2.gz	AEKNHSCSMDROEL-NHZBNJEXSA-N	1	0	280.412	1.914	50	0		CDAARO
Cc1cccc2c1ncn(C[C@@H]1COCC[N@@H+](C)C1)c2=O	ZINC000584889059	349347950	/nfs/dbraw/zinc/34/79/50/349347950.db2.gz	AKTKRCFNINPOTO-CYBMUJFWSA-N	1	0	287.363	1.283	50	0		CDAARO
CCC[N@@H+]1CCCN(C(=O)COC[C@@H]2CCCCO2)CC1	ZINC000584889461	349348069	/nfs/dbraw/zinc/34/80/69/349348069.db2.gz	ZWEOCGPEPDGIOH-HNNXBMFYSA-N	1	0	298.427	1.516	50	0		CDAARO
CC(C)(C[NH+]1CCCC1)NC(=O)[C@H]1CC[C@@H](O)CC1	ZINC000584889404	349348121	/nfs/dbraw/zinc/34/81/21/349348121.db2.gz	RKDARFUVNUTIFJ-BETUJISGSA-N	1	0	268.401	1.528	50	0		CDAARO
CC(C)[C@@H](CNc1nccc(N(C)C)n1)[NH+](C)C	ZINC000584891544	349350337	/nfs/dbraw/zinc/35/03/37/349350337.db2.gz	JRQOTVKYXRPGJJ-LLVKDONJSA-N	1	0	251.378	1.541	50	0		CDAARO
CCOC(=O)N1CC[C@@H]([N@H+](C)Cc2c[nH]nc2C)C1	ZINC000584895775	349356817	/nfs/dbraw/zinc/35/68/17/349356817.db2.gz	MBGLHNHJVKYQRV-GFCCVEGCSA-N	1	0	266.345	1.381	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CNc2ncnc(C)c2C)C1	ZINC000091526568	180179151	/nfs/dbraw/zinc/17/91/51/180179151.db2.gz	FNQGJCIOAKTPOQ-CYBMUJFWSA-N	1	0	264.373	1.474	50	0		CDAARO
Cc1ccc2[nH]c(C[NH2+][C@@H](C)Cn3cncn3)cc(=O)c2c1	ZINC000091713677	180230984	/nfs/dbraw/zinc/23/09/84/180230984.db2.gz	VDNZDMXNMRLIFN-LBPRGKRZSA-N	1	0	297.362	1.606	50	0		CDAARO
Cn1ccnc1C[N@@H+]1CC[C@@H](Cc2cccc(CO)c2)C1	ZINC000091624779	180209364	/nfs/dbraw/zinc/20/93/64/180209364.db2.gz	VEBSNVKUAGULII-HNNXBMFYSA-N	1	0	285.391	1.977	50	0		CDAARO
CC(C)Cc1cc(C(=O)N2CC[C@@H]([NH+](C)C)C2)n(C)n1	ZINC000091756752	180247390	/nfs/dbraw/zinc/24/73/90/180247390.db2.gz	NMFWTGHSBPNNQT-CYBMUJFWSA-N	1	0	278.400	1.395	50	0		CDAARO
COCC[C@]1(CO)CCC[N@H+](Cc2[nH]cnc2C)C1	ZINC000091973883	180296798	/nfs/dbraw/zinc/29/67/98/180296798.db2.gz	TUALKOSEZRURSO-CQSZACIVSA-N	1	0	267.373	1.329	50	0		CDAARO
CC[C@@H]1C[N@H+](CC2CCCC2)CCN1C[C@H](C)O	ZINC000106906858	186149408	/nfs/dbraw/zinc/14/94/08/186149408.db2.gz	ZBHDKEDOHYEUTA-DZGCQCFKSA-N	1	0	254.418	1.954	50	0		CDAARO
NC(=O)c1ccc(-c2nc([C@@H]3CCCCCN3)no2)o1	ZINC000096001568	351469016	/nfs/dbraw/zinc/46/90/16/351469016.db2.gz	XFGSMIFXLUKLNW-QMMMGPOBSA-N	1	0	276.296	1.633	50	0		CDAARO
COCC1(C(=O)N[C@H]2C[NH+]3CCC2CC3)CCC1	ZINC000065407263	363100445	/nfs/dbraw/zinc/10/04/45/363100445.db2.gz	YIWPHURPBYMMOG-LBPRGKRZSA-N	1	0	252.358	1.014	50	0		CDAARO
O=S(=O)(c1ccc2ccccc2c1)N1CCC[NH2+]CC1	ZINC000034225473	363126831	/nfs/dbraw/zinc/12/68/31/363126831.db2.gz	VMGJYXNHLXSTTD-UHFFFAOYSA-N	1	0	290.388	1.824	50	0		CDAARO
CC(C)Oc1ccccc1CN1C[C@H](O)[C@@H]([NH+](C)C)C1	ZINC000516699126	363190202	/nfs/dbraw/zinc/19/02/02/363190202.db2.gz	ZRBCRSSXFMGGOB-GJZGRUSLSA-N	1	0	278.396	1.581	50	0		CDAARO
COc1ccc(NC(=O)CSC2=[NH+]CCN2)cc1	ZINC000000141881	355890458	/nfs/dbraw/zinc/89/04/58/355890458.db2.gz	AQWFCAOIKADLPX-UHFFFAOYSA-N	1	0	265.338	1.326	50	0		CDAARO
Cn1c[n+](C[C@H](O)COc2ccccc2)c2ccccc21	ZINC000000273018	355901506	/nfs/dbraw/zinc/90/15/06/355901506.db2.gz	FYOHUQBEVOXBNL-AWEZNQCLSA-N	1	0	283.351	1.906	50	0		CDAARO
COc1cc([C@@H]2[NH2+]CCc3nc[nH]c32)cc(OC)c1OC	ZINC000003182917	355996318	/nfs/dbraw/zinc/99/63/18/355996318.db2.gz	VYKDKBZUOBCVTK-ZDUSSCGKSA-N	1	0	289.335	1.671	50	0	biogenic	CDAARO
CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1S(=O)(=O)c1cccnc1	ZINC000246878782	356082203	/nfs/dbraw/zinc/08/22/03/356082203.db2.gz	GMAGAYSUHSJNRA-OLZOCXBDSA-N	1	0	295.408	1.329	50	0		CDAARO
C[C@H]1CN(C)CCN1C(=O)[C@H]1Cc2ccccc2S1	ZINC000336317298	356142400	/nfs/dbraw/zinc/14/24/00/356142400.db2.gz	FPCSHEJUYNDZKS-SMDDNHRTSA-N	1	0	276.405	1.866	50	0		CDAARO
[NH2+]=C1Nc2nc3ccccc3n2[C@H](c2ccncc2)N1	ZINC000008973735	356182378	/nfs/dbraw/zinc/18/23/78/356182378.db2.gz	ZJBYTXKKYSOWRW-GFCCVEGCSA-N	1	0	264.292	1.528	50	0		CDAARO
CNC(=O)NC(=O)C[NH2+][C@H](c1ccc(F)cc1)C(C)C	ZINC000012798553	356325171	/nfs/dbraw/zinc/32/51/71/356325171.db2.gz	FATMIGAMZCVCSU-ZDUSSCGKSA-N	1	0	281.331	1.568	50	0		CDAARO
COCC[NH2+]CC[C@H]1CCC(=O)N1CCC(C)C	ZINC000014967201	356402711	/nfs/dbraw/zinc/40/27/11/356402711.db2.gz	AJJUPKDVXIWFEI-CYBMUJFWSA-N	1	0	256.390	1.650	50	0		CDAARO
Cc1cc(OCCOCCNCC[NH3+])ccc1Cl	ZINC000019772609	356502010	/nfs/dbraw/zinc/50/20/10/356502010.db2.gz	OWUMPZGKMXNKQU-UHFFFAOYSA-N	1	0	272.776	1.592	50	0		CDAARO
O=C(Nc1nccnn1)c1ccc([C@H]2CCC[NH2+]2)s1	ZINC000023339257	356640582	/nfs/dbraw/zinc/64/05/82/356640582.db2.gz	WJCRHODYFPOGHP-MRVPVSSYSA-N	1	0	275.337	1.610	50	0		CDAARO
c1ccc2c(c1)CCN(Cc1nnnn1C1CC1)C2	ZINC000029922391	356745744	/nfs/dbraw/zinc/74/57/44/356745744.db2.gz	GASWKGHPLLYFDC-UHFFFAOYSA-N	1	0	255.325	1.566	50	0		CDAARO
C[C@@H]1C[C@H]1C(=O)NCC[N@@H+]1CCc2ccccc2C1	ZINC000030363245	356749353	/nfs/dbraw/zinc/74/93/53/356749353.db2.gz	HRWDPCVTBZSRBY-IUODEOHRSA-N	1	0	258.365	1.817	50	0		CDAARO
C[C@H]1C[C@H]1C(=O)NCC[N@@H+]1CCc2ccccc2C1	ZINC000030363248	356749396	/nfs/dbraw/zinc/74/93/96/356749396.db2.gz	HRWDPCVTBZSRBY-SWLSCSKDSA-N	1	0	258.365	1.817	50	0		CDAARO
CC1(C)CC(=O)[C@H](C[NH+]2CCN(N=O)CC2)C(C)(C)N1O	ZINC000100708548	356807343	/nfs/dbraw/zinc/80/73/43/356807343.db2.gz	DXQPQBLTMFAUFH-NSHDSACASA-N	1	0	297.379	1.079	50	0		CDAARO
Cc1cccn2c(=O)cc(C[NH+]3CCCCC3)nc12	ZINC000032510340	356781885	/nfs/dbraw/zinc/78/18/85/356781885.db2.gz	BXFWYZPOKVYMNF-UHFFFAOYSA-N	1	0	257.337	1.989	50	0		CDAARO
COC(=O)c1ccc(C[NH+]2CCC(CO)CC2)cc1	ZINC000037010347	356895549	/nfs/dbraw/zinc/89/55/49/356895549.db2.gz	PYBPXBBOZFWVOY-UHFFFAOYSA-N	1	0	263.337	1.678	50	0		CDAARO
[NH3+]C[C@@H](CO)Cc1ccc(F)c(Br)c1	ZINC000063065179	357502559	/nfs/dbraw/zinc/50/25/59/357502559.db2.gz	ISGGGXAZUODMDG-QMMMGPOBSA-N	1	0	262.122	1.698	50	0		CDAARO
C[C@@H](c1n[nH]c(=O)n1Cc1ccccc1)[NH+]1CCCC1	ZINC000065396663	357536604	/nfs/dbraw/zinc/53/66/04/357536604.db2.gz	PDMDNIAGAPPHCF-LBPRGKRZSA-N	1	0	272.352	1.777	50	0		CDAARO
C[N@@H+](Cc1cc2cc(F)ccc2[nH]1)C[C@@H](O)CO	ZINC000067755174	357625062	/nfs/dbraw/zinc/62/50/62/357625062.db2.gz	YULXZWKDLGIUBZ-GFCCVEGCSA-N	1	0	252.289	1.092	50	0		CDAARO
S=C1NC2(CC[NH2+]CC2)N=C1c1cccs1	ZINC000067172542	357597388	/nfs/dbraw/zinc/59/73/88/357597388.db2.gz	CRZSDDIBQGWBRF-UHFFFAOYSA-N	1	0	251.380	1.959	50	0		CDAARO
CCCn1nccc1C(=O)NC[C@H]1CCC[N@H+](CC)C1	ZINC000067673219	357618135	/nfs/dbraw/zinc/61/81/35/357618135.db2.gz	BUMNZRLQQAFOFZ-CYBMUJFWSA-N	1	0	278.400	1.755	50	0		CDAARO
OCCN1CCc2onc(-c3cccc(F)c3)c2C1	ZINC000067820863	357630501	/nfs/dbraw/zinc/63/05/01/357630501.db2.gz	QXAIGWAUMIEYCY-UHFFFAOYSA-N	1	0	262.284	1.831	50	0		CDAARO
COC(=O)CC[NH+]1CCC(C2CCOCC2)CC1	ZINC000095434331	357657579	/nfs/dbraw/zinc/65/75/79/357657579.db2.gz	CHPYLYOCCBPVCZ-UHFFFAOYSA-N	1	0	255.358	1.688	50	0		CDAARO
COc1cccc(CCC(=O)N2CC[NH2+][C@H](C)C2)c1	ZINC000188479273	357698030	/nfs/dbraw/zinc/69/80/30/357698030.db2.gz	AXPBKBNRVSPZOH-GFCCVEGCSA-N	1	0	262.353	1.448	50	0		CDAARO
C[C@@H](Cc1ccc(F)cc1)[NH+]1CCN(C=O)CC1	ZINC000071928229	357796791	/nfs/dbraw/zinc/79/67/91/357796791.db2.gz	YAKXGSARPXQQFE-LBPRGKRZSA-N	1	0	250.317	1.531	50	0		CDAARO
CC(C)c1ccc(CCCNC(=O)[C@H]2C[NH2+]CCO2)cc1	ZINC000187746934	357802493	/nfs/dbraw/zinc/80/24/93/357802493.db2.gz	CMOIQGJGHMLGIA-MRXNPFEDSA-N	1	0	290.407	1.847	50	0		CDAARO
c1ccc2c(c1)CCN(c1ncnc3c1CC[NH2+]CC3)C2	ZINC000072473492	357837700	/nfs/dbraw/zinc/83/77/00/357837700.db2.gz	VZECUDCAGOJOTM-UHFFFAOYSA-N	1	0	280.375	1.728	50	0		CDAARO
CC(C)Cc1noc(CN(C)C(=O)[C@H]2CC[C@@H]([NH3+])C2)n1	ZINC000072481371	357838989	/nfs/dbraw/zinc/83/89/89/357838989.db2.gz	DPJCGGNNSRFQJU-WDEREUQCSA-N	1	0	280.372	1.354	50	0		CDAARO
COc1ccc(CN(C)Cc2ccnc(N(C)C)n2)cn1	ZINC000097080456	357944027	/nfs/dbraw/zinc/94/40/27/357944027.db2.gz	BSFJQJKOIGPPFV-UHFFFAOYSA-N	1	0	287.367	1.578	50	0		CDAARO
CCn1cc(C[N@@H+]2CCC[C@H](C3(C)OCCO3)C2)cn1	ZINC000097108674	357984237	/nfs/dbraw/zinc/98/42/37/357984237.db2.gz	HYFRUNUMIQBEKU-AWEZNQCLSA-N	1	0	279.384	1.878	50	0		CDAARO
CC[C@H](NCC(N)=O)c1nc(C(F)(F)F)cs1	ZINC000097111015	357987118	/nfs/dbraw/zinc/98/71/18/357987118.db2.gz	DGEBXORGYPZIKV-YFKPBYRVSA-N	1	0	267.276	1.688	50	0		CDAARO
[NH3+]CCNS(=O)(=O)Cc1cccc(C(F)(F)F)c1	ZINC000097229249	358043125	/nfs/dbraw/zinc/04/31/25/358043125.db2.gz	BPMVNOMUSSNPEQ-UHFFFAOYSA-N	1	0	282.287	1.084	50	0		CDAARO
CNC(=O)C[NH2+]Cc1cn(C)nc1-c1cc2ccccc2o1	ZINC000097159727	358186966	/nfs/dbraw/zinc/18/69/66/358186966.db2.gz	SYUXBZQHVFLZQA-UHFFFAOYSA-N	1	0	298.346	1.669	50	0		CDAARO
CCC[C@@H]([NH3+])C(=O)N(C)Cc1cn(C)nc1C(F)(F)F	ZINC000097234128	358191871	/nfs/dbraw/zinc/19/18/71/358191871.db2.gz	BLFSDCGDEZFCSC-SECBINFHSA-N	1	0	292.305	1.525	50	0		CDAARO
COCc1ccccc1C(=O)N1C[C@H]2C[NH2+]C[C@H]2C1	ZINC000195228803	358420295	/nfs/dbraw/zinc/42/02/95/358420295.db2.gz	NPSILPYGBLRBRP-BETUJISGSA-N	1	0	260.337	1.124	50	0		CDAARO
CCc1cnc(N)nc1NCC[C@H](C)[N@@H+](C)CC	ZINC000095355665	358683246	/nfs/dbraw/zinc/68/32/46/358683246.db2.gz	JFDWDDSUVPEWMO-JTQLQIEISA-N	1	0	251.378	1.763	50	0		CDAARO
c1cn(CC2(c3nnc(C4CCOCC4)[nH]3)CC2)cn1	ZINC000097288689	358764906	/nfs/dbraw/zinc/76/49/06/358764906.db2.gz	DRKZWYYWURLKPI-UHFFFAOYSA-N	1	0	273.340	1.627	50	0		CDAARO
[NH3+][C@@H]1CC[C@H]2CN(C(=O)c3ccc(Br)o3)C[C@@H]12	ZINC000184990161	358771556	/nfs/dbraw/zinc/77/15/56/358771556.db2.gz	FXOWRZULMKWGHY-DJLDLDEBSA-N	1	0	299.168	1.851	50	0		CDAARO
Cc1nn(C)c2nc(N3C[C@@H]4CC[N@H+](C)[C@@H]4C3)sc12	ZINC000096164814	358711804	/nfs/dbraw/zinc/71/18/04/358711804.db2.gz	FUWDYKWCEHQXPA-VHSXEESVSA-N	1	0	277.397	1.479	50	0		CDAARO
O[C@H]1CN(Cc2ccoc2)C[C@@H]1[NH+]1CCCCC1	ZINC000097654205	358790733	/nfs/dbraw/zinc/79/07/33/358790733.db2.gz	JBWWSPVWFYCCNE-KBPBESRZSA-N	1	0	250.342	1.311	50	0		CDAARO
O=C(NC1c2ccccc2-c2ccccc21)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000097713510	358794580	/nfs/dbraw/zinc/79/45/80/358794580.db2.gz	UZWZZXYTYGCREY-BDJLRTHQSA-N	1	0	294.354	1.595	50	0		CDAARO
O[C@H]1CN(CCc2ccccc2)C[C@@H]1[NH+]1CCCCC1	ZINC000097729807	358794779	/nfs/dbraw/zinc/79/47/79/358794779.db2.gz	GVELTJKIWOBOOS-IRXDYDNUSA-N	1	0	274.408	1.760	50	0		CDAARO
[NH3+][C@H]1[C@H]2CCO[C@H]2[C@@H]1NC(=O)CCc1c[nH]c2ccccc12	ZINC000218882702	359069188	/nfs/dbraw/zinc/06/91/88/359069188.db2.gz	LOEMEIJICGLTFY-VJUNAUMWSA-N	1	0	299.374	1.331	50	0		CDAARO
Cc1cccc(C[N@H+]2C[C@@H]3C(=O)N(C)C(=O)[C@@H]3C2)c1	ZINC000257178850	359155127	/nfs/dbraw/zinc/15/51/27/359155127.db2.gz	HHLFHRZWFORKQS-BETUJISGSA-N	1	0	258.321	1.042	50	0		CDAARO
COc1ccc(C(=O)N(C)C[C@@H]2CC[N@H+](C)C2)c(OC)n1	ZINC000222643939	359361532	/nfs/dbraw/zinc/36/15/32/359361532.db2.gz	CLLQUYXCEWWTOJ-LLVKDONJSA-N	1	0	293.367	1.123	50	0		CDAARO
CNC(=O)CN1CCC([NH2+]Cc2c(F)cccc2F)CC1	ZINC000030905534	359633880	/nfs/dbraw/zinc/63/38/80/359633880.db2.gz	AWTYWJUJAJHMFR-UHFFFAOYSA-N	1	0	297.349	1.265	50	0		CDAARO
CC[NH+](CC)CCn1nnc2c1c1ccccc1oc2=O	ZINC000004902851	359785984	/nfs/dbraw/zinc/78/59/84/359785984.db2.gz	IYKURIOGTBMJSX-UHFFFAOYSA-N	1	0	286.335	1.880	50	0	biogenic	CDAARO
C[C@@H]1CCCC[C@H]1OCC[NH2+]C[C@H]1CN(C)CCO1	ZINC000257365350	359945318	/nfs/dbraw/zinc/94/53/18/359945318.db2.gz	NZNOSVYHHYTYOL-QLFBSQMISA-N	1	0	270.417	1.502	50	0		CDAARO
C[C@@H]1Cc2ccccc2N1C(=O)C[C@@H]1COCC[NH2+]1	ZINC000128829120	360053885	/nfs/dbraw/zinc/05/38/85/360053885.db2.gz	GDVFNIIRGXBQLY-DGCLKSJQSA-N	1	0	260.337	1.343	50	0		CDAARO
Cc1cc(C(=O)N2CC[C@@H](n3c(C)c[nH+]c3C)C2)n(C)n1	ZINC000409420725	360224844	/nfs/dbraw/zinc/22/48/44/360224844.db2.gz	NPPJAOWLMDIFHW-CYBMUJFWSA-N	1	0	287.367	1.629	50	0		CDAARO
CC[N@@H+]1CC[C@H](CNC(=O)Nc2cccc(C)n2)C1	ZINC000360894709	360350371	/nfs/dbraw/zinc/35/03/71/360350371.db2.gz	DHIODEJEOSDAPH-GFCCVEGCSA-N	1	0	262.357	1.853	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](NC(=O)N(C)Cc2nc(C)c[nH]2)C1	ZINC000426701320	360697940	/nfs/dbraw/zinc/69/79/40/360697940.db2.gz	ALDLWZOMYHDHTG-CYBMUJFWSA-N	1	0	293.415	1.734	50	0		CDAARO
NC(=O)CC[NH+]1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000032514571	360968757	/nfs/dbraw/zinc/96/87/57/360968757.db2.gz	PCONXZZOEGUYAQ-UHFFFAOYSA-N	1	0	281.787	1.333	50	0		CDAARO
CC(C)[N@@H+]1CC[C@H](CN(C)C(=O)CCCn2cccn2)C1	ZINC000299771433	200865952	/nfs/dbraw/zinc/86/59/52/200865952.db2.gz	WWBXUJOKUZIIMT-OAHLLOKOSA-N	1	0	292.427	1.852	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC(C[NH3+])CC2)cc1F	ZINC000036296759	361460948	/nfs/dbraw/zinc/46/09/48/361460948.db2.gz	HXAREHFLSNRICK-UHFFFAOYSA-N	1	0	286.372	1.494	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N2CCC[C@@H]([NH3+])C2)c1	ZINC000036297067	361462360	/nfs/dbraw/zinc/46/23/60/361462360.db2.gz	PJXBOYZPPKAYDS-SNVBAGLBSA-N	1	0	272.345	1.246	50	0		CDAARO
COC(=O)[C@@H](c1ccccc1Cl)N1CC[NH2+]CC1	ZINC000020268631	291291287	/nfs/dbraw/zinc/29/12/87/291291287.db2.gz	GYRDXASVBKXBHG-GFCCVEGCSA-N	1	0	268.744	1.459	50	0		CDAARO
O=C(NCC1CC[NH+]([C@H]2CCOC2)CC1)C1CCOCC1	ZINC000618256529	364037722	/nfs/dbraw/zinc/03/77/22/364037722.db2.gz	UCZSUAKXTRPUEB-HNNXBMFYSA-N	1	0	296.411	1.030	50	0		CDAARO
O=C(CCC1CC[NH2+]CC1)Nc1nc2c(s1)COCC2	ZINC000179783864	283775357	/nfs/dbraw/zinc/77/53/57/283775357.db2.gz	KMQIQOBFUDEILT-UHFFFAOYSA-N	1	0	295.408	1.934	50	0		CDAARO
Cn1nccc1CCC(=O)N1CCN(c2cc[nH+]cc2)CC1	ZINC000163660469	364751910	/nfs/dbraw/zinc/75/19/10/364751910.db2.gz	IWGLZCUSKJGWMK-UHFFFAOYSA-N	1	0	299.378	1.097	50	0		CDAARO
Cc1ccc(N2C(=O)C[C@@H](NCc3ccncc3)C2=O)cc1	ZINC000018008770	364870906	/nfs/dbraw/zinc/87/09/06/364870906.db2.gz	BJQIDGDRGJTAAD-OAHLLOKOSA-N	1	0	295.342	1.812	50	0		CDAARO
C[C@@H]([NH2+]C[C@@]1(O)CCOC1)c1ccc(Br)o1	ZINC000193050164	189634151	/nfs/dbraw/zinc/63/41/51/189634151.db2.gz	HWZLLKWHWZIIAF-KCJUWKMLSA-N	1	0	290.157	1.844	50	0		CDAARO
CCCN(C(=O)c1ncncc1Cl)[C@@H]1CC[NH2+]C1	ZINC000178887384	364957074	/nfs/dbraw/zinc/95/70/74/364957074.db2.gz	DEPHKCKVTUSSLD-SECBINFHSA-N	1	0	268.748	1.344	50	0		CDAARO
CCC(=O)N1CC[C@@H]([NH2+]Cc2ccc(CO)o2)[C@@H](CC)C1	ZINC000089948956	366977161	/nfs/dbraw/zinc/97/71/61/366977161.db2.gz	CSVUMQVHCZBYBH-SWLSCSKDSA-N	1	0	294.395	1.899	50	0		CDAARO
CCCC[NH2+][C@@H]1CS(=O)(=O)C[C@H]1N1CCCCC1	ZINC000089954770	366982479	/nfs/dbraw/zinc/98/24/79/366982479.db2.gz	BQAZSENWMDYWCG-CHWSQXEVSA-N	1	0	274.430	1.028	50	0		CDAARO
C[C@@H]1C[C@H]1c1ccc(CN(CC(N)=O)C[C@H]2CCCO2)o1	ZINC000252498235	367648080	/nfs/dbraw/zinc/64/80/80/367648080.db2.gz	UHFAWLXFHUMFLW-YRGRVCCFSA-N	1	0	292.379	1.869	50	0		CDAARO
CC[C@@H]1C[N@@H+]([C@@H]2C[C@@H](C)O[C@@H](C)C2)CCN1C[C@@H](C)O	ZINC000252517743	367742038	/nfs/dbraw/zinc/74/20/38/367742038.db2.gz	QGMZKBYZLRBSRP-IBEHDNSVSA-N	1	0	284.444	1.719	50	0		CDAARO
COc1ccccc1C[C@@H](C)[NH2+][C@H]1CCS(=O)(=O)C1	ZINC000037509969	368879120	/nfs/dbraw/zinc/87/91/20/368879120.db2.gz	KGYVVSVHOHKTCK-YPMHNXCESA-N	1	0	283.393	1.403	50	0		CDAARO
[NH3+]C[C@H]1CCCC[C@H]1NS(=O)(=O)CCc1ccccc1	ZINC000089108078	368997907	/nfs/dbraw/zinc/99/79/07/368997907.db2.gz	KSGFQRYBDVEAHW-HUUCEWRRSA-N	1	0	296.436	1.666	50	0		CDAARO
Cc1ccccc1C1(C(=O)N(C)[C@H]2CC[NH2+]C2)CC1	ZINC000179053707	372240271	/nfs/dbraw/zinc/24/02/71/372240271.db2.gz	RFEAUHBWTFBPIP-ZDUSSCGKSA-N	1	0	258.365	1.847	50	0		CDAARO
COc1ccccc1OCCCCN1CC[NH2+]CC1	ZINC000019831606	372353261	/nfs/dbraw/zinc/35/32/61/372353261.db2.gz	VMFZYUGFRNICGB-UHFFFAOYSA-N	1	0	264.369	1.759	50	0		CDAARO
[NH3+]CCCOc1ccc(F)cc1C(=O)NCC(F)(F)F	ZINC000299762991	372748951	/nfs/dbraw/zinc/74/89/51/372748951.db2.gz	XUEFGNVWPNIFBG-UHFFFAOYSA-N	1	0	294.248	1.845	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN(C(=O)CCC(F)(F)F)C1	ZINC000670446512	482998044	/nfs/dbraw/zinc/99/80/44/482998044.db2.gz	PRCDWGUALDPNGR-JTQLQIEISA-N	1	0	282.306	1.366	50	0		CDAARO
Cc1cc(=O)cc(C(=O)NC2(C[NH+]3CCCCC3)CC2)[nH]1	ZINC000299767651	372750229	/nfs/dbraw/zinc/75/02/29/372750229.db2.gz	IQEPRFIGSNSGKE-UHFFFAOYSA-N	1	0	289.379	1.844	50	0		CDAARO
c1nnn2c1CO[C@H]1CC[N@@H+](Cc3ccncc3)C[C@@H]12	ZINC000299775033	372751782	/nfs/dbraw/zinc/75/17/82/372751782.db2.gz	KGZHEVGIMBFJTL-KBPBESRZSA-N	1	0	271.324	1.019	50	0		CDAARO
Cc1cc(C(=O)NCC[N@@H+]2CCC[C@H](CO)C2)cc(C)n1	ZINC000299781809	372757180	/nfs/dbraw/zinc/75/71/80/372757180.db2.gz	WSYOMOALYUAFMD-AWEZNQCLSA-N	1	0	291.395	1.133	50	0		CDAARO
CSc1cccc(NC(=O)N[C@@H]2C[NH2+]CC[C@H]2O)c1	ZINC000299799578	372771323	/nfs/dbraw/zinc/77/13/23/372771323.db2.gz	SLTWHEZSMWBSIF-VXGBXAGGSA-N	1	0	281.381	1.253	50	0		CDAARO
CCC[C@H](NC(=O)c1[nH]nnc1C)c1nccn1C	ZINC000299801653	372771391	/nfs/dbraw/zinc/77/13/91/372771391.db2.gz	ZVDVEVMZGHGCHR-VIFPVBQESA-N	1	0	262.317	1.118	50	0		CDAARO
O=C([C@H]1C[C@@H](O)C[NH2+]1)N1CCC(c2ccccc2)CC1	ZINC000037804559	373354353	/nfs/dbraw/zinc/35/43/53/373354353.db2.gz	QYCAPEGBMQZOHB-HUUCEWRRSA-N	1	0	274.364	1.115	50	0		CDAARO
CC(C)[N@@H+]1C[C@@H](CO)[C@H](c2nc(-c3cccnc3)no2)C1	ZINC000253403018	373690689	/nfs/dbraw/zinc/69/06/89/373690689.db2.gz	GWFSJYWUZATAFQ-QWHCGFSZSA-N	1	0	288.351	1.548	50	0		CDAARO
Cn1cncc1CNCC1([NH+]2CCCCC2)CCOCC1	ZINC000111403482	374189545	/nfs/dbraw/zinc/18/95/45/374189545.db2.gz	WEHHRRWFMKDLKU-UHFFFAOYSA-N	1	0	292.427	1.545	50	0		CDAARO
COC(=O)[C@@]12CCC[C@H]1C[N@H+](CC(=O)NC(C)(C)C)C2	ZINC000108466450	412828593	/nfs/dbraw/zinc/82/85/93/412828593.db2.gz	VTNIGDBHHYLXSJ-XHDPSFHLSA-N	1	0	282.384	1.176	50	0		CDAARO
CC[C@H](O)C[N@H+](C)C1CCN(c2ncccn2)CC1	ZINC000095415759	374918096	/nfs/dbraw/zinc/91/80/96/374918096.db2.gz	FSEGWHVQRDQYKU-ZDUSSCGKSA-N	1	0	264.373	1.148	50	0		CDAARO
CC[C@H](CO)[NH+]1CCN(C(=O)CCC(F)(F)F)CC1	ZINC000095443520	374944916	/nfs/dbraw/zinc/94/49/16/374944916.db2.gz	OUYWQMVHWVWFAZ-SNVBAGLBSA-N	1	0	282.306	1.244	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)/C=C\c2cccnc2)CC1	ZINC000096400759	375094664	/nfs/dbraw/zinc/09/46/64/375094664.db2.gz	YFKWTPVXKLJXAX-PLNGDYQASA-N	1	0	289.379	1.322	50	0		CDAARO
COc1ccc(C[N@@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)nn1	ZINC000282627803	375096771	/nfs/dbraw/zinc/09/67/71/375096771.db2.gz	AQBSAJVZXLCSMP-JSGCOSHPSA-N	1	0	287.367	1.765	50	0		CDAARO
CC(C)=CCC[C@H](C)[NH2+]CC(=O)N1CCOCC1	ZINC000095988825	375048016	/nfs/dbraw/zinc/04/80/16/375048016.db2.gz	QKTRJUKFYINVTN-ZDUSSCGKSA-N	1	0	254.374	1.570	50	0		CDAARO
COc1ccc(CN(C)C(=O)[C@]2(F)CC[NH2+]C2)cc1F	ZINC000299740409	375201280	/nfs/dbraw/zinc/20/12/80/375201280.db2.gz	ZJHPHGNIMUBDSN-AWEZNQCLSA-N	1	0	284.306	1.494	50	0		CDAARO
C[C@@H]1C[C@@H]([NH2+]Cc2nncn2-c2ccccc2)[C@@H](C)O1	ZINC000296284619	375368772	/nfs/dbraw/zinc/36/87/72/375368772.db2.gz	FKHXGCFFTVXXMQ-YRGRVCCFSA-N	1	0	272.352	1.923	50	0		CDAARO
CC[NH+](CC)[C@@H](CNC(=O)c1ccc(=O)[nH]n1)C(C)C	ZINC000031378993	375784806	/nfs/dbraw/zinc/78/48/06/375784806.db2.gz	RJFFKNJYTDMKTD-LBPRGKRZSA-N	1	0	280.372	1.278	50	0		CDAARO
CC(=O)N1CCC([NH2+][C@@H](C(C)C)[C@H](CO)C(C)C)CC1	ZINC000449513612	375898254	/nfs/dbraw/zinc/89/82/54/375898254.db2.gz	TXVPNJBCEVWDGW-CVEARBPZSA-N	1	0	284.444	1.876	50	0		CDAARO
CCOC1CC2(C1)CCN(C(=O)C[N@H+](CC)C1CC1)C2	ZINC000377159031	376907579	/nfs/dbraw/zinc/90/75/79/376907579.db2.gz	VCOIPXGFCZVLGH-UHFFFAOYSA-N	1	0	280.412	1.888	50	0		CDAARO
Cc1cc2c(c(-c3ncc(F)cn3)c1)O[C@@H](C[NH3+])C2	ZINC000067954837	377330813	/nfs/dbraw/zinc/33/08/13/377330813.db2.gz	UNXLOUUENRETMI-LLVKDONJSA-N	1	0	259.284	1.853	50	0		CDAARO
O=C([C@@H]1CCCO1)N1CCCN(Cc2ccncc2)CC1	ZINC000077440014	377573146	/nfs/dbraw/zinc/57/31/46/377573146.db2.gz	ODPUNVBOVSYZIS-HNNXBMFYSA-N	1	0	289.379	1.295	50	0		CDAARO
COCCc1ccccc1OC[C@@H](O)C[NH2+]C(C)C	ZINC000065747779	184569110	/nfs/dbraw/zinc/56/91/10/184569110.db2.gz	RQZBCLSVVDPFIC-AWEZNQCLSA-N	1	0	267.369	1.613	50	0	in-vitro	CDAARO
O=C1c2ccccc2-c2c1[n+](=O)c1c(n2O)CCCC1	ZINC000334157347	285018126	/nfs/dbraw/zinc/01/81/26/285018126.db2.gz	MCSSZKRUGHTRPA-UHFFFAOYSA-N	1	0	269.280	1.730	50	0		CDAARO
COc1cc(OC)c(C(=O)NCCC[NH+](C)C)cc1OC	ZINC000002845692	533043110	/nfs/dbraw/zinc/04/31/10/533043110.db2.gz	REVHDKOYKQFJSZ-UHFFFAOYSA-N	1	0	296.367	1.394	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)/C=C\c1cnc(C)s1	ZINC000493778189	253553367	/nfs/dbraw/zinc/55/33/67/253553367.db2.gz	LZYJJYKWGVQIEN-GZTOBOFZSA-N	1	0	265.382	1.675	50	0		CDAARO
Cc1ccc(C)c(CC(=O)N[C@@H]2CC[NH2+]C[C@@H]2C)c1	ZINC000094345411	184786632	/nfs/dbraw/zinc/78/66/32/184786632.db2.gz	IOJPQDWJWCMNEZ-DZGCQCFKSA-N	1	0	260.381	1.960	50	0		CDAARO
C[NH+]1C(C)(C)CC(NC(=O)c2ccn[nH]2)CC1(C)C	ZINC000000973914	169683580	/nfs/dbraw/zinc/68/35/80/169683580.db2.gz	GTWKVMVNBOZCIN-UHFFFAOYSA-N	1	0	264.373	1.791	50	0		CDAARO
CC(C)(C[NH2+][C@@H]1CCc2ccc(F)cc21)C(N)=O	ZINC000097371017	390176492	/nfs/dbraw/zinc/17/64/92/390176492.db2.gz	HXHSHFHGVSAVGH-GFCCVEGCSA-N	1	0	250.317	1.914	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC2(C[NH3+])CCCC2)c(F)c1	ZINC000095432065	184981917	/nfs/dbraw/zinc/98/19/17/184981917.db2.gz	WCZAAFPYKPSERK-UHFFFAOYSA-N	1	0	286.372	1.684	50	0		CDAARO
O=C1CCCN1C[C@@H](O)C[NH2+]Cc1cccc(Cl)c1	ZINC000001391343	169699434	/nfs/dbraw/zinc/69/94/34/169699434.db2.gz	LBQDUJBASLSXDF-ZDUSSCGKSA-N	1	0	282.771	1.413	50	0		CDAARO
CC(C)CCS(=O)(=O)NC[C@@H]1CC[N@@H+](C2CC2)C1	ZINC000096427708	390517486	/nfs/dbraw/zinc/51/74/86/390517486.db2.gz	BGNWAYOMORCDNV-LBPRGKRZSA-N	1	0	274.430	1.436	50	0		CDAARO
CC(C)[N@H+](CCOC[C@H]1CCCO1)Cc1cnn(C)c1	ZINC000096421076	390514166	/nfs/dbraw/zinc/51/41/66/390514166.db2.gz	SPVCSTGHUUQVOA-OAHLLOKOSA-N	1	0	281.400	1.826	50	0		CDAARO
Cc1c(F)cccc1S(=O)(=O)N[C@H]1CCC[C@@H]1C[NH3+]	ZINC000095432106	390527545	/nfs/dbraw/zinc/52/75/45/390527545.db2.gz	DEDJRXGHXFHHGX-PWSUYJOCSA-N	1	0	286.372	1.540	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@H](CNC(=O)N2C[C@@H](C)O[C@@H](C)C2)C1	ZINC000180341366	390667764	/nfs/dbraw/zinc/66/77/64/390667764.db2.gz	AYTGLUPFDHSUPD-QLFBSQMISA-N	1	0	297.443	1.926	50	0		CDAARO
CC(C)[C@@H](CO)[NH2+]CC(=O)N[C@H]1CCC[C@@H](C)[C@H]1C	ZINC000097082209	390840131	/nfs/dbraw/zinc/84/01/31/390840131.db2.gz	NVUJHFTZFMPWQP-YIYPIFLZSA-N	1	0	270.417	1.534	50	0		CDAARO
C[C@H]1CN(C(=O)[C@H]2CCOc3ccccc32)CC[NH2+]1	ZINC000088059131	390947525	/nfs/dbraw/zinc/94/75/25/390947525.db2.gz	FKNNEELFNGPQKF-AAEUAGOBSA-N	1	0	260.337	1.373	50	0		CDAARO
CCCCNC(=O)[C@H]1CC[C@H](C)[N@H+](Cc2cnc[nH]2)C1	ZINC000092400532	390920597	/nfs/dbraw/zinc/92/05/97/390920597.db2.gz	UIFUJGYWAHLGKQ-STQMWFEESA-N	1	0	278.400	1.927	50	0		CDAARO
c1ccc(CC[N@@H+]2CC[C@H](CN3CCOCC3)C2)nc1	ZINC000096424592	390957368	/nfs/dbraw/zinc/95/73/68/390957368.db2.gz	DFVMJSPZJMBIEE-HNNXBMFYSA-N	1	0	275.396	1.278	50	0		CDAARO
CC[C@H]1CCCCN1C(=O)[C@@H](C)[N@@H+]1C[C@@H](C)[C@H](C(N)=O)C1	ZINC000408048182	391161898	/nfs/dbraw/zinc/16/18/98/391161898.db2.gz	LQVIFGSXPVRSBB-YIYPIFLZSA-N	1	0	295.427	1.219	50	0		CDAARO
CCc1nc(CN2CC[C@H](C[NH+]3CCOCC3)C2)cs1	ZINC000129455577	391324300	/nfs/dbraw/zinc/32/43/00/391324300.db2.gz	HLSJMXFTAGUYOC-CYBMUJFWSA-N	1	0	295.452	1.860	50	0		CDAARO
CC(C)[C@H]([NH2+][C@@H]1CCCC[C@@H]1C)C(=O)NC(N)=O	ZINC000006085217	391650913	/nfs/dbraw/zinc/65/09/13/391650913.db2.gz	FZFSRBWGDBJSTF-AXFHLTTASA-N	1	0	255.362	1.374	50	0		CDAARO
CN(C)c1nccnc1-c1cccc2c1O[C@H](C[NH3+])C2	ZINC000067883493	391964037	/nfs/dbraw/zinc/96/40/37/391964037.db2.gz	PQKRIDBPHJDWQD-NSHDSACASA-N	1	0	270.336	1.472	50	0		CDAARO
CCOC(=O)[C@H](C)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1	ZINC000246822320	392019410	/nfs/dbraw/zinc/01/94/10/392019410.db2.gz	NUAGYNOMYKZNEN-KCQAQPDRSA-N	1	0	280.412	1.887	50	0		CDAARO
C[C@@H]1COC[C@H](C)N1C(=O)C[C@H]([NH3+])c1ccccc1	ZINC000262935873	131275015	/nfs/dbraw/zinc/27/50/15/131275015.db2.gz	TYOUAIBVGDAFRF-SCRDCRAPSA-N	1	0	262.353	1.712	50	0		CDAARO
COCC1(C[NH2+][C@@H](C)CS(C)(=O)=O)CCCC1	ZINC000449741517	392893186	/nfs/dbraw/zinc/89/31/86/392893186.db2.gz	KNQHRBKMEQPBDK-NSHDSACASA-N	1	0	263.403	1.216	50	0		CDAARO
CC(C)OCCC[N@@H+]1CCCN(C(=O)C(C)C)CC1	ZINC000095349680	393144861	/nfs/dbraw/zinc/14/48/61/393144861.db2.gz	VFMSGGRULHEASI-UHFFFAOYSA-N	1	0	270.417	1.992	50	0		CDAARO
CC[NH+]1CCN(c2ccc(-c3cccc(N)c3)nn2)CC1	ZINC000011567970	134675035	/nfs/dbraw/zinc/67/50/35/134675035.db2.gz	SJPKXWXKHDUJTM-UHFFFAOYSA-N	1	0	283.379	1.868	50	0		CDAARO
Cc1nc(N2CCC(O)(c3ccccc3)CC2)cc(N)[nH+]1	ZINC000091585980	135072037	/nfs/dbraw/zinc/07/20/37/135072037.db2.gz	UBPLXHWMBFOLSU-UHFFFAOYSA-N	1	0	284.363	1.855	50	0		CDAARO
Cn1ncnc1-c1ccc(N2CC[NH+](C)CC2)cc1	ZINC000091643799	135072783	/nfs/dbraw/zinc/07/27/83/135072783.db2.gz	UEUGUPDIUCQTJO-UHFFFAOYSA-N	1	0	257.341	1.234	50	0		CDAARO
CC1(C)[C@H]([NH2+]C[C@@H](O)Cn2ccnn2)[C@@H]2CCC[C@@H]21	ZINC000658035938	413145909	/nfs/dbraw/zinc/14/59/09/413145909.db2.gz	SOZVOPLAWFBJEP-FVCCEPFGSA-N	1	0	264.373	1.053	50	0		CDAARO
C[C@H](O)C1CC[NH+](CC(=O)N2CCCC[C@H]2C)CC1	ZINC000095395336	147113083	/nfs/dbraw/zinc/11/30/83/147113083.db2.gz	BOHGLRUBKNUXRI-OLZOCXBDSA-N	1	0	268.401	1.480	50	0		CDAARO
Cc1cc(=O)n(C)c(=O)n1CCCC[NH+]1CCCCC1	ZINC000002381325	169789305	/nfs/dbraw/zinc/78/93/05/169789305.db2.gz	RZJGCPBVQYMRFY-UHFFFAOYSA-N	1	0	279.384	1.122	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCCC[NH+](C)C)c(C)c1F	ZINC000003170833	169863666	/nfs/dbraw/zinc/86/36/66/169863666.db2.gz	MNPWAJPNKSIPOH-UHFFFAOYSA-N	1	0	288.388	1.673	50	0		CDAARO
CC(C)(C)[C@H](O)C[C@H](CO)[NH2+]Cc1ccsc1	ZINC000284204362	196002189	/nfs/dbraw/zinc/00/21/89/196002189.db2.gz	ZDKFDPMVXWPBPU-VXGBXAGGSA-N	1	0	257.399	1.996	50	0		CDAARO
Cc1ccc(C)c(S(=O)(=O)NC2CC[NH+](C)CC2)c1	ZINC000006551657	170212725	/nfs/dbraw/zinc/21/27/25/170212725.db2.gz	YGFUNGIUJVEGDD-UHFFFAOYSA-N	1	0	282.409	1.676	50	0		CDAARO
COc1cccc(C(=O)N2CCC[N@H+](C)CC2)c1OC	ZINC000006725751	170232729	/nfs/dbraw/zinc/23/27/29/170232729.db2.gz	ATKGLOHQPDWZOR-UHFFFAOYSA-N	1	0	278.352	1.482	50	0		CDAARO
C[C@@H]1C[C@@H](C)C[NH+](CC(=O)Nc2ccccc2C(N)=O)C1	ZINC000006725559	170232904	/nfs/dbraw/zinc/23/29/04/170232904.db2.gz	UEIASVUCIDAPRA-VXGBXAGGSA-N	1	0	289.379	1.702	50	0		CDAARO
Cc1cc(=O)n2nc(C[NH+]3C[C@H](C)C[C@@H](C)C3)sc2n1	ZINC000008307372	170329916	/nfs/dbraw/zinc/32/99/16/170329916.db2.gz	WYKAKGWKDYWRJP-NXEZZACHSA-N	1	0	292.408	1.937	50	0		CDAARO
CC(C)(C)[NH2+]CC(=O)Nc1ccc2c(c1)OCO2	ZINC000008428908	170335977	/nfs/dbraw/zinc/33/59/77/170335977.db2.gz	DMBOXKODULHQDG-UHFFFAOYSA-N	1	0	250.298	1.742	50	0		CDAARO
CCOC(=O)c1ccc2c(c1)[n+](CCO)c(C)n2CC	ZINC000013116408	170532906	/nfs/dbraw/zinc/53/29/06/170532906.db2.gz	XFPRFLNSKPNNLS-UHFFFAOYSA-N	1	0	277.344	1.426	50	0		CDAARO
CC(C)CC[N@@H+]1CCN(Cc2cc[nH]n2)C[C@@H]1CCO	ZINC000020454772	171207972	/nfs/dbraw/zinc/20/79/72/171207972.db2.gz	AJWMXLCPEMPDQS-HNNXBMFYSA-N	1	0	280.416	1.324	50	0		CDAARO
CO[C@@]1(C)C[C@H](NC(=O)C2([NH+](C)C)CCC2)C1(C)C	ZINC000119492397	412106569	/nfs/dbraw/zinc/10/65/69/412106569.db2.gz	SNOAXNGKAPAXDL-FZMZJTMJSA-N	1	0	268.401	1.791	50	0		CDAARO
CC(C)(C)n1cc(C[NH2+][C@H]2CCCCNC2=O)cn1	ZINC000037282875	173090215	/nfs/dbraw/zinc/09/02/15/173090215.db2.gz	XZPPODDMXGDIPO-LBPRGKRZSA-N	1	0	264.373	1.396	50	0		CDAARO
c1ccc(-n2nnnc2SC[C@@H]2CCCC[NH2+]2)cc1	ZINC000043495190	175058238	/nfs/dbraw/zinc/05/82/38/175058238.db2.gz	UVDOYOIPAFBNIJ-NSHDSACASA-N	1	0	275.381	1.897	50	0		CDAARO
CS(=O)(=O)c1ccc(O[C@H]2CCC[NH2+]C2)cc1	ZINC000043501530	175058666	/nfs/dbraw/zinc/05/86/66/175058666.db2.gz	XBWVNYQDOCXFRG-NSHDSACASA-N	1	0	255.339	1.221	50	0		CDAARO
CC(C)(C)C(=O)N1CCC(n2cc(C(C)(C)[NH3+])nn2)CC1	ZINC000048307215	175426316	/nfs/dbraw/zinc/42/63/16/175426316.db2.gz	IEYNDECCDRQLKH-UHFFFAOYSA-N	1	0	293.415	1.682	50	0		CDAARO
COC[C@H]([NH3+])C(=O)N(C)CCCOc1c(C)cccc1C	ZINC000065529303	175747688	/nfs/dbraw/zinc/74/76/88/175747688.db2.gz	BGRIXWBCKPYWFA-AWEZNQCLSA-N	1	0	294.395	1.504	50	0		CDAARO
CC(C)C[C@@H]([NH3+])C(=O)NCc1noc(C2CCCC2)n1	ZINC000071764222	176262020	/nfs/dbraw/zinc/26/20/20/176262020.db2.gz	VGXCRVYKEOSDAK-LLVKDONJSA-N	1	0	280.372	1.717	50	0		CDAARO
C[C@@H](CCC(=O)N1CCCn2cncc2C1)[NH+]1CCCC1	ZINC000072134712	176322224	/nfs/dbraw/zinc/32/22/24/176322224.db2.gz	DFAQCQIUAYXZEQ-AWEZNQCLSA-N	1	0	290.411	1.880	50	0		CDAARO
CC(=O)c1cccc(C[N@@H+]2CCC[C@](O)(CO)CC2)c1	ZINC000072140349	176323284	/nfs/dbraw/zinc/32/32/84/176323284.db2.gz	FRLQZZSQTGSIRM-MRXNPFEDSA-N	1	0	277.364	1.599	50	0		CDAARO
Cc1ccc(C[N@@H+]2CCN[C@@H](C(=O)NC3CC3)C2)cc1C	ZINC000072162355	176329767	/nfs/dbraw/zinc/32/97/67/176329767.db2.gz	BUFULMBHTROTJG-MRXNPFEDSA-N	1	0	287.407	1.356	50	0		CDAARO
C[NH+]1CCN(CCCNc2ccc(Cl)nn2)CC1	ZINC000072220547	176342852	/nfs/dbraw/zinc/34/28/52/176342852.db2.gz	ZXTQGRCMNKSNIR-UHFFFAOYSA-N	1	0	269.780	1.179	50	0		CDAARO
CCn1cc(C(=O)N2CCC[N@H+](CC3CC3)CC2)c(C)n1	ZINC000072252835	176350024	/nfs/dbraw/zinc/35/00/24/176350024.db2.gz	FTUICAIUJYAAMM-UHFFFAOYSA-N	1	0	290.411	1.769	50	0		CDAARO
CN(C)C(=O)C1(CCCc2cnccn2)CC[NH2+]CC1	ZINC000072343812	176372257	/nfs/dbraw/zinc/37/22/57/176372257.db2.gz	WZBHVVMWCCLZQS-UHFFFAOYSA-N	1	0	276.384	1.257	50	0		CDAARO
CCCc1oncc1C(=O)N1C[C@@H]2CC[N@H+](C)[C@@H]2C1	ZINC000077485511	177274061	/nfs/dbraw/zinc/27/40/61/177274061.db2.gz	YFWKROCJGCTFCM-CMPLNLGQSA-N	1	0	263.341	1.403	50	0		CDAARO
CC1(C)Cc2cccc(C[N@@H+]3CCOC[C@@H](CO)C3)c2O1	ZINC000077555995	177280492	/nfs/dbraw/zinc/28/04/92/177280492.db2.gz	GXYWFZPQIRLKAS-CYBMUJFWSA-N	1	0	291.391	1.841	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCC2CC[NH+](C)CC2)c(C)c1	ZINC000022999732	262351388	/nfs/dbraw/zinc/35/13/88/262351388.db2.gz	HJIURRPGLNQZDO-UHFFFAOYSA-N	1	0	296.436	1.924	50	0		CDAARO
CC[NH+](CC)[C@@H](C)CNC(=O)N[C@@H]1CCCSC1	ZINC000096452320	262515780	/nfs/dbraw/zinc/51/57/80/262515780.db2.gz	JLMYIMPARLBPPZ-NWDGAFQWSA-N	1	0	273.446	1.912	50	0		CDAARO
CCc1cc(N2CCC([NH3+])CC2)n2nc(C)c(C)c2n1	ZINC000072430508	273767820	/nfs/dbraw/zinc/76/78/20/273767820.db2.gz	LUCUTELTGKNSPJ-UHFFFAOYSA-N	1	0	273.384	1.836	50	0		CDAARO
O[C@H](C[N@@H+]1CCCN(c2ncccn2)CC1)c1ccccc1	ZINC000244758103	275056872	/nfs/dbraw/zinc/05/68/72/275056872.db2.gz	OSKPNSQTTVMOSD-MRXNPFEDSA-N	1	0	298.390	1.722	50	0		CDAARO
C(CN1CCOC[C@H]1C1CC1)C[N@@H+]1CCOC[C@H]1C1CC1	ZINC000245792976	275392427	/nfs/dbraw/zinc/39/24/27/275392427.db2.gz	OBQUJAPAAQFGOA-IRXDYDNUSA-N	1	0	294.439	1.598	50	0		CDAARO
CNC(=O)c1nc(-c2ccc([C@H](C)[NH+](C)C)cc2)n[nH]1	ZINC000426523309	277019482	/nfs/dbraw/zinc/01/94/82/277019482.db2.gz	BHGPASKKOGWOBW-VIFPVBQESA-N	1	0	273.340	1.454	50	0		CDAARO
COc1cc2ncnc(N3CC[NH2+]CC3)c2cc1OC	ZINC000002541360	277858652	/nfs/dbraw/zinc/85/86/52/277858652.db2.gz	HGQPTOFRZXUHHS-UHFFFAOYSA-N	1	0	274.324	1.057	50	0		CDAARO
C[C@@H](C(=O)N1C[C@@H](C)OC[C@H]1C)[C@@H]([NH3+])c1ccccc1	ZINC000251669629	278198283	/nfs/dbraw/zinc/19/82/83/278198283.db2.gz	LLEMMCFEIVBBHL-RGCMKSIDSA-N	1	0	276.380	1.958	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)c1ccc2nccn2c1	ZINC000262758807	278317069	/nfs/dbraw/zinc/31/70/69/278317069.db2.gz	PVXXYQHDFPBGBJ-DGCLKSJQSA-N	1	0	272.352	1.676	50	0		CDAARO
CC[C@H](O)C[N@@H+]1CCN(C(=O)OC(C)(C)C)[C@H](C)C1	ZINC000084733427	288108894	/nfs/dbraw/zinc/10/88/94/288108894.db2.gz	AVYBDDYSJFCLEG-NEPJUHHUSA-N	1	0	272.389	1.699	50	0		CDAARO
Cc1nnc2n1CCC[C@H]2NC1CC[NH+](CC2CC2)CC1	ZINC000095969046	279237606	/nfs/dbraw/zinc/23/76/06/279237606.db2.gz	MNROROXRKKNCSH-OAHLLOKOSA-N	1	0	289.427	1.885	50	0		CDAARO
Cn1ncc2c1ncnc2N1CC[N@@H+]2CCCC[C@H]2C1	ZINC000248749738	280379518	/nfs/dbraw/zinc/37/95/18/280379518.db2.gz	GKMBZMJWCYLGJD-NSHDSACASA-N	1	0	272.356	1.038	50	0		CDAARO
CC[C@]1(C(=O)N[C@H](C)c2cn(C)nc2C)CCC[NH2+]1	ZINC000184102921	281303986	/nfs/dbraw/zinc/30/39/86/281303986.db2.gz	UBPBFPJBDAWGKB-QMTHXVAHSA-N	1	0	264.373	1.438	50	0		CDAARO
CCc1ccc([C@H]([NH2+]CC(=O)NC(=O)NC)C(C)(C)C)o1	ZINC000095985195	288563440	/nfs/dbraw/zinc/56/34/40/288563440.db2.gz	HNPOOLPIUIOURV-ZDUSSCGKSA-N	1	0	295.383	1.974	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)/C=C\c2cncc(F)c2)C1	ZINC000255328215	289366424	/nfs/dbraw/zinc/36/64/24/289366424.db2.gz	DLTKTBQPEBUIHO-DLGQBQFBSA-N	1	0	263.316	1.302	50	0		CDAARO
CO[C@@]1(C)C[C@@H](NC(=O)[C@@H]2CCCC[NH2+]2)C1(C)C	ZINC000121681692	294149861	/nfs/dbraw/zinc/14/98/61/294149861.db2.gz	ZXOAFLJOGGXRMQ-WDMOLILDSA-N	1	0	254.374	1.448	50	0		CDAARO
CC[N@@H+]1C[C@H](Nc2ncc(Cl)cn2)[C@@H](OC)C1	ZINC000534631113	328331331	/nfs/dbraw/zinc/33/13/31/328331331.db2.gz	ICMZTJDFHJJKJM-UWVGGRQHSA-N	1	0	256.737	1.261	50	0		CDAARO
CCN(Cc1noc(C2CC2)n1)C(=O)NC[C@H](C)[NH+](C)C	ZINC000534632494	328332101	/nfs/dbraw/zinc/33/21/01/328332101.db2.gz	LOXUZDKXPMITJR-JTQLQIEISA-N	1	0	295.387	1.429	50	0		CDAARO
Cc1ccn2nc(C(=O)N3CCC[NH2+]CC3)cc2c1	ZINC000534653029	328338161	/nfs/dbraw/zinc/33/81/61/328338161.db2.gz	AXHBDUSQFOHEPN-UHFFFAOYSA-N	1	0	258.325	1.078	50	0		CDAARO
COCC1(NC(=O)[C@H]2CC23CC[NH2+]CC3)CCCC1	ZINC000534658762	328341371	/nfs/dbraw/zinc/34/13/71/328341371.db2.gz	XGLZRFNPVBICSL-GFCCVEGCSA-N	1	0	266.385	1.452	50	0		CDAARO
CC(C)NC(=O)c1cc(N2CC[N@@H+]3CCC[C@@H]3C2)ccn1	ZINC000072145140	482451447	/nfs/dbraw/zinc/45/14/47/482451447.db2.gz	ABWCISJBAWJTSB-CQSZACIVSA-N	1	0	288.395	1.504	50	0		CDAARO
C[C@H]1C[N@H+](C[C@H]2CCCCO2)CCN1Cc1nccn1C	ZINC000248131544	482498959	/nfs/dbraw/zinc/49/89/59/482498959.db2.gz	NIAXHGPKRGJJAJ-LSDHHAIUSA-N	1	0	292.427	1.495	50	0		CDAARO
COc1ccc(CN(C)C(=O)[C@H]2CC[C@H]([NH3+])C2)cc1F	ZINC000091540226	482569651	/nfs/dbraw/zinc/56/96/51/482569651.db2.gz	TUTUUSPWKFPXDU-RYUDHWBXSA-N	1	0	280.343	1.920	50	0		CDAARO
C[NH+](C)[C@@H]1CC[C@H](NC(=O)Cc2noc3ccccc23)C1	ZINC000092473139	482623359	/nfs/dbraw/zinc/62/33/59/482623359.db2.gz	RMSXXYQVXKDJNY-NWDGAFQWSA-N	1	0	287.363	1.969	50	0		CDAARO
O=C1C[C@H](C[N@H+]2CCC[C@H](CC(F)(F)F)C2)CN1	ZINC000585094497	482829572	/nfs/dbraw/zinc/82/95/72/482829572.db2.gz	RNWVYRUULWSLRB-ZJUUUORDSA-N	1	0	264.291	1.787	50	0		CDAARO
COc1coc(C[N@H+](C)CC2(CO)CCCC2)cc1=O	ZINC000670472272	483079277	/nfs/dbraw/zinc/07/92/77/483079277.db2.gz	JXJHQVZEORNVIM-UHFFFAOYSA-N	1	0	281.352	1.633	50	0		CDAARO
CC[C@H](O)[C@H]1CCCC[N@@H+]1CCS(=O)(=O)C(C)C	ZINC000084727066	483318747	/nfs/dbraw/zinc/31/87/47/483318747.db2.gz	OUPGIODOULTFSY-OLZOCXBDSA-N	1	0	277.430	1.435	50	0		CDAARO
C[C@H]1C[NH+](CCCCNC(=O)c2csnn2)C[C@H](C)O1	ZINC000096461213	533927823	/nfs/dbraw/zinc/92/78/23/533927823.db2.gz	GUTHTLHFECRGQZ-QWRGUYRKSA-N	1	0	298.412	1.157	50	0		CDAARO
Cc1cccc(C(=O)N2C[C@H](O)[C@@H]([NH+]3CCCCC3)C2)n1	ZINC000220565059	534599221	/nfs/dbraw/zinc/59/92/21/534599221.db2.gz	USZRWRZDCVXAHG-GJZGRUSLSA-N	1	0	289.379	1.061	50	0		CDAARO
Cc1cccc(CNC(=O)CN2CCC[N@@H+](C)CC2)c1	ZINC000297775849	534714003	/nfs/dbraw/zinc/71/40/03/534714003.db2.gz	GJLBGTPWBKSWGA-UHFFFAOYSA-N	1	0	275.396	1.249	50	0		CDAARO
Cc1nn(C)cc1[C@@H](C)NC(=O)[C@H]1CCCC[NH2+]1	ZINC000096481202	534840417	/nfs/dbraw/zinc/84/04/17/534840417.db2.gz	SASKUWYYGOHGHE-BXKDBHETSA-N	1	0	250.346	1.048	50	0		CDAARO
COc1cccc(C[NH2+]CCCSc2nnnn2C)c1	ZINC000004993815	526012822	/nfs/dbraw/zinc/01/28/22/526012822.db2.gz	RZMRGLCUVIIFGT-UHFFFAOYSA-N	1	0	293.396	1.491	50	0		CDAARO
COc1cccc(C[NH2+]CCN2CCOCC2)c1	ZINC000019871948	526016322	/nfs/dbraw/zinc/01/63/22/526016322.db2.gz	CNZCIWOXFRGYQL-UHFFFAOYSA-N	1	0	250.342	1.117	50	0		CDAARO
CC1CCC(O)(C[NH+]2CCN(C[C@H]3CCOC3)CC2)CC1	ZINC000096455414	528202173	/nfs/dbraw/zinc/20/21/73/528202173.db2.gz	JKRHRFXKPCBZML-AQFXKWCLSA-N	1	0	296.455	1.582	50	0		CDAARO
C[NH2+][C@@H](C)CNC(=O)c1ccc(-c2n[nH]c(C)n2)cc1	ZINC000261661691	536342433	/nfs/dbraw/zinc/34/24/33/536342433.db2.gz	GAFLSTRYXKSNLT-VIFPVBQESA-N	1	0	273.340	1.118	50	0		CDAARO
COc1cc(C(=O)NC[C@@H]2CC[N@H+](C)C2)c2ccccc2n1	ZINC000067723729	538299742	/nfs/dbraw/zinc/29/97/42/538299742.db2.gz	LAPNYWFIDLSUFR-LBPRGKRZSA-N	1	0	299.374	1.925	50	0		CDAARO
CC(C)NS(=O)(=O)CC[NH2+][C@H](C)Cc1ccccc1	ZINC000223815205	538804302	/nfs/dbraw/zinc/80/43/02/538804302.db2.gz	WIKDALKFFZUYLI-CYBMUJFWSA-N	1	0	284.425	1.535	50	0		CDAARO
C[C@H](c1cnccn1)N1C[C@@H]2C[N@@H+]3CCCC[C@@H]3[C@@H]2C1	ZINC000097094882	567904248	/nfs/dbraw/zinc/90/42/48/567904248.db2.gz	RGQIXNORXCMUOF-HLPPOEQASA-N	1	0	272.396	1.954	50	0		CDAARO
O[C@@H]1C[NH2+][C@@H](C(O)(c2ccccc2)c2ccccc2)C1	ZINC000199251626	570379424	/nfs/dbraw/zinc/37/94/24/570379424.db2.gz	LQXUSYSMWPQALN-JKSUJKDBSA-N	1	0	269.344	1.645	50	0		CDAARO
COc1ccc(O)cc1CNCC[N@@H+]1CCC[C@@H](CO)C1	ZINC000952970852	617274666	/nfs/dbraw/zinc/27/46/66/617274666.db2.gz	QPGZCQDXWSWIJB-CYBMUJFWSA-N	1	0	294.395	1.195	50	0		CDAARO
CCCN1C[C@@H]([NH2+]Cc2ccnn2-c2ccccc2)CC1=O	ZINC000952981345	614786249	/nfs/dbraw/zinc/78/62/49/614786249.db2.gz	WEDFISWDPIXBNJ-AWEZNQCLSA-N	1	0	298.390	1.973	50	0		CDAARO
CCOc1cc(N2C[C@@H]3C[N@@H+](C)CC[C@@H]3C2)ncn1	ZINC000952991643	615508294	/nfs/dbraw/zinc/50/82/94/615508294.db2.gz	FUOIOFQEIDEHDL-NEPJUHHUSA-N	1	0	262.357	1.263	50	0		CDAARO
F[C@@H](c1nc(-c2ccc3c(c2)CCO3)no1)C1C[NH2+]C1	ZINC000888096718	617759344	/nfs/dbraw/zinc/75/93/44/617759344.db2.gz	JYLHTQCHPHYPPY-GFCCVEGCSA-N	1	0	275.283	1.902	50	0		CDAARO
Cc1ncc(Cl)c(NCC[N@@H+]2CCCC[C@H]2CO)n1	ZINC001772707058	1159441114	/nfs/dbraw/zinc/44/11/14/1159441114.db2.gz	PCNCMQMMQINUPP-NSHDSACASA-N	1	0	284.791	1.697	50	0		CDAARO
CCc1ccc(C[N@H+](C)[C@H]2C[C@H]3CNC(=O)C[C@H]3C2)nc1	ZINC001704338032	1177693437	/nfs/dbraw/zinc/69/34/37/1177693437.db2.gz	JCSFCPUZHAMGJP-IJEWVQPXSA-N	1	0	287.407	1.991	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](CCCCCCO)C[C@@H]2O)on1	ZINC001704341498	1177694898	/nfs/dbraw/zinc/69/48/98/1177694898.db2.gz	UUJLNTMFOJYQGH-HIFRSBDPSA-N	1	0	282.384	1.371	50	0		CDAARO
COc1cc(CN2CCC(=O)NC[C@H]2C)cc2c1OCO2	ZINC000065395022	705388515	/nfs/dbraw/zinc/38/85/15/705388515.db2.gz	QRWYMICFWBYELW-SNVBAGLBSA-N	1	0	292.335	1.134	50	0		CDAARO
CC[NH+]1CCN(CC[N@@H+]2CCc3ccccc3C2)CC1	ZINC000020909515	705684540	/nfs/dbraw/zinc/68/45/40/705684540.db2.gz	AXDTVLZFFNROJA-UHFFFAOYSA-N	1	0	273.424	1.682	50	0		CDAARO
[NH3+]C[C@H]1CCCN(S(=O)(=O)CC2CCCC2)C1	ZINC000262028578	705751458	/nfs/dbraw/zinc/75/14/58/705751458.db2.gz	JKSXBZAWBLSXIF-GFCCVEGCSA-N	1	0	260.403	1.177	50	0		CDAARO
CSCC[NH+]1CCC(NC(=O)[C@@H]2CC2(C)C)CC1	ZINC000952978272	706118541	/nfs/dbraw/zinc/11/85/41/706118541.db2.gz	YCLYDXSSUXPGAA-LBPRGKRZSA-N	1	0	270.442	1.976	50	0		CDAARO
COc1ccc(OCCOCC[N@H+](C)CCO)cc1	ZINC000002981149	711618198	/nfs/dbraw/zinc/61/81/98/711618198.db2.gz	YHUFXDWVLFXSMY-UHFFFAOYSA-N	1	0	269.341	1.015	50	0		CDAARO
OC[C@H]1CCCN(CC[NH2+]Cc2ccc(F)c(F)c2)C1	ZINC000952972056	711716192	/nfs/dbraw/zinc/71/61/92/711716192.db2.gz	YZHRQAOLHDVIDN-ZDUSSCGKSA-N	1	0	284.350	1.759	50	0		CDAARO
COCC(=O)Nc1ccc2c(c1)C[N@@H+](CC1CC1)CCO2	ZINC000581789311	898353803	/nfs/dbraw/zinc/35/38/03/898353803.db2.gz	UTLIHRHNDKRJFY-UHFFFAOYSA-N	1	0	290.363	1.876	50	0		CDAARO
Cc1nnc([C@H]2CC[N@@H+](CCCO)CCN2CC(C)C)[nH]1	ZINC000675014205	899871266	/nfs/dbraw/zinc/87/12/66/899871266.db2.gz	TXSIMCQAWQCVNJ-CQSZACIVSA-N	1	0	295.431	1.200	50	0		CDAARO
Cc1c[nH+]ccc1N1CCCN(C(=O)Cn2cccc2)CC1	ZINC000952868697	910415575	/nfs/dbraw/zinc/41/55/75/910415575.db2.gz	CVMWEMAPVRJXGV-UHFFFAOYSA-N	1	0	298.390	1.930	50	0		CDAARO
O=S(=O)(CCO)c1ccc(C[NH2+]C2CC3(CC3)C2)cc1	ZINC000952876980	910436293	/nfs/dbraw/zinc/43/62/93/910436293.db2.gz	JTVSGNLQVKUWSV-UHFFFAOYSA-N	1	0	295.404	1.485	50	0		CDAARO
CCn1nnc(C)c1CN1CC[C@@]2(CCC[N@@H+]2C)C1	ZINC000952879885	910438017	/nfs/dbraw/zinc/43/80/17/910438017.db2.gz	AFSMXKPGDMFKRI-AWEZNQCLSA-N	1	0	263.389	1.277	50	0		CDAARO
C[C@@H]([NH2+]C1Cc2ccccc2C1)c1nnc(N)s1	ZINC000822280888	925614739	/nfs/dbraw/zinc/61/47/39/925614739.db2.gz	CBCKTFPQSDKBQP-MRVPVSSYSA-N	1	0	260.366	1.938	50	0		CDAARO
C[N@H+](Cc1cccc(OCC(N)=O)c1)CC1(C)COC1	ZINC000823683772	925720287	/nfs/dbraw/zinc/72/02/87/925720287.db2.gz	VFLUYVDQPIRCKJ-UHFFFAOYSA-N	1	0	278.352	1.019	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H](O)C[N@@H+]1[C@H]1CCc2ccccc2C1	ZINC000824121230	925803662	/nfs/dbraw/zinc/80/36/62/925803662.db2.gz	JJUSZKLMMMKTBK-ZNMIVQPWSA-N	1	0	275.348	1.152	50	0		CDAARO
COc1ncc(C[N@@H+]2CC[C@@H](O)CC(C)(C)C2)cn1	ZINC000824852229	925840534	/nfs/dbraw/zinc/84/05/34/925840534.db2.gz	XOXYGXOZQHPUOC-GFCCVEGCSA-N	1	0	265.357	1.468	50	0		CDAARO
COCC(=O)N1CC([N@@H+](Cc2ccncc2)CC2CC2)C1	ZINC000581776270	927195032	/nfs/dbraw/zinc/19/50/32/927195032.db2.gz	NYWJXRJINYRZBJ-UHFFFAOYSA-N	1	0	289.379	1.151	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1CCNC(=O)c1cnccn1	ZINC000581813077	927203362	/nfs/dbraw/zinc/20/33/62/927203362.db2.gz	VLJFPFJWGGOESY-UHFFFAOYSA-N	1	0	271.324	1.289	50	0		CDAARO
Cc1ccc(N2CCC([N@@H+]3CCC[C@H](O)C3)CC2)nc1	ZINC000200514407	929253805	/nfs/dbraw/zinc/25/38/05/929253805.db2.gz	FUVKTZLGOASCRJ-HNNXBMFYSA-N	1	0	275.396	1.816	50	0		CDAARO
CO[C@@H](C[N@@H+]1CCN(C)[C@H](c2nc(C)no2)C1)C(C)C	ZINC000585089072	930912272	/nfs/dbraw/zinc/91/22/72/930912272.db2.gz	APIITUJQVSOVPJ-STQMWFEESA-N	1	0	282.388	1.338	50	0		CDAARO
O=c1c2ccsc2ncn1CC[N@H+]1CCCC[C@H]1CO	ZINC000043144638	932221103	/nfs/dbraw/zinc/22/11/03/932221103.db2.gz	FDXZFQVQXGKFHF-NSHDSACASA-N	1	0	293.392	1.305	50	0		CDAARO
CCn1ncc(C)c1NC(=O)[C@H]1CCC[N@H+](CCOC)C1	ZINC001529099915	968980723	/nfs/dbraw/zinc/98/07/23/968980723.db2.gz	HMKSXSDYXRQGBU-ZDUSSCGKSA-N	1	0	294.399	1.508	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CCCn2ccnn2)n1	ZINC001529113223	968983548	/nfs/dbraw/zinc/98/35/48/968983548.db2.gz	CNYLJVBDINVVTO-LBPRGKRZSA-N	1	0	262.361	1.160	50	0		CDAARO
CNc1nc(N(C)CC[N@H+](C)C2CCCC2)ncc1F	ZINC001529151159	968994043	/nfs/dbraw/zinc/99/40/43/968994043.db2.gz	GONNUMLUDPDNPV-UHFFFAOYSA-N	1	0	281.379	1.968	50	0		CDAARO
Cn1ccnc1CC[NH+]1CCN(c2cccc(O)c2)CC1	ZINC001506397477	975147909	/nfs/dbraw/zinc/14/79/09/975147909.db2.gz	RZGROSSRNOEVPY-UHFFFAOYSA-N	1	0	286.379	1.490	50	0		CDAARO
Cc1nncn1CC[N@H+](CC1CC1)C[C@@H]1CCCO1	ZINC001506397334	975148071	/nfs/dbraw/zinc/14/80/71/975148071.db2.gz	RVWBFXJCRLRONE-AWEZNQCLSA-N	1	0	264.373	1.478	50	0		CDAARO
Cc1cnc(N2CCC([NH+](C)C)CC2)nc1N(C)C	ZINC001506396233	975148282	/nfs/dbraw/zinc/14/82/82/975148282.db2.gz	QLERBDYBCWFABD-UHFFFAOYSA-N	1	0	263.389	1.381	50	0		CDAARO
Cc1cnc(CN2CC[N@H+](CC3CC3)[C@H](CCO)C2)cn1	ZINC001506400131	975148824	/nfs/dbraw/zinc/14/88/24/975148824.db2.gz	IFNPUEXEJVIQHM-MRXNPFEDSA-N	1	0	290.411	1.064	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]Cc2cc(=O)[nH]c(C)n2)n1	ZINC001506416218	975155486	/nfs/dbraw/zinc/15/54/86/975155486.db2.gz	FEKXSUBEUSSJOK-JTQLQIEISA-N	1	0	275.356	1.482	50	0		CDAARO
CO[C@H]1CCCN(C(=O)CCC[NH+]2CCCC2)C1	ZINC001506422806	975159869	/nfs/dbraw/zinc/15/98/69/975159869.db2.gz	DNUGQKGRVQHPCT-ZDUSSCGKSA-N	1	0	254.374	1.500	50	0		CDAARO
CCCNC(=O)N1CC[N@H+](CC(C)C)[C@H](CCO)C1	ZINC001506426433	975160623	/nfs/dbraw/zinc/16/06/23/975160623.db2.gz	OOJGIJQQTVSGBN-CYBMUJFWSA-N	1	0	271.405	1.131	50	0		CDAARO
Cc1ccccc1[C@@H]1C[C@@H]1C(=O)N1CC[NH2+]C[C@H]1C	ZINC000124346092	187133909	/nfs/dbraw/zinc/13/39/09/187133909.db2.gz	GDUAESQXMLIFOG-SNPRPXQTSA-N	1	0	258.365	1.919	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)CCSCc2ccccc2)C[C@H]1O	ZINC000082098742	177920964	/nfs/dbraw/zinc/92/09/64/177920964.db2.gz	SDJFPMLCJWILQV-ZIAGYGMSSA-N	1	0	294.420	1.230	50	0		CDAARO
CC[C@H]1C[N@H+](CC2(O)CCCCC2)CCN1C[C@H](C)O	ZINC000107320821	398139639	/nfs/dbraw/zinc/13/96/39/398139639.db2.gz	VAUXIGXURRWGEN-GJZGRUSLSA-N	1	0	284.444	1.459	50	0		CDAARO
C[C@H](Oc1ccccc1Cl)C(=O)N1CC[NH2+]C[C@H]1C	ZINC000124648365	187147207	/nfs/dbraw/zinc/14/72/07/187147207.db2.gz	YMKZAHPEWDCTOY-MNOVXSKESA-N	1	0	282.771	1.928	50	0		CDAARO
O=C1C[C@H]([NH2+]C[C@H]2CCCO2)C(=O)N1c1ccccc1	ZINC000095952491	185040909	/nfs/dbraw/zinc/04/09/09/185040909.db2.gz	OMZNHAYDKPVXQO-OLZOCXBDSA-N	1	0	274.320	1.087	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)N1CCC[C@@H](C)C1)C1CCOCC1	ZINC000095985398	185054690	/nfs/dbraw/zinc/05/46/90/185054690.db2.gz	YYRTWGYDLFDMRU-CHWSQXEVSA-N	1	0	268.401	1.650	50	0		CDAARO
CCNC(=O)N1CCC([NH2+][C@H](C)CN(CC)CC)CC1	ZINC000095986446	185056420	/nfs/dbraw/zinc/05/64/20/185056420.db2.gz	GPQGYKCBTFHDHK-CYBMUJFWSA-N	1	0	284.448	1.500	50	0		CDAARO
O=C(NC1CC1)[C@H](Cc1ccccc1)[NH2+]C1CCOCC1	ZINC000095991230	185058200	/nfs/dbraw/zinc/05/82/00/185058200.db2.gz	RORJVCFNTRXNFW-INIZCTEOSA-N	1	0	288.391	1.645	50	0		CDAARO
C[C@H]1C[NH+](CCCNC(=O)c2cccc(O)c2)C[C@H](C)O1	ZINC000096003499	185062229	/nfs/dbraw/zinc/06/22/29/185062229.db2.gz	ORUFUIDSBGHBPF-STQMWFEESA-N	1	0	292.379	1.621	50	0		CDAARO
CN(CCc1cccc2ccccc21)C(=O)[C@H]1C[C@H](O)C[NH2+]1	ZINC000239722529	361746229	/nfs/dbraw/zinc/74/62/29/361746229.db2.gz	CDDYEFDSBDEFEM-DOTOQJQBSA-N	1	0	298.386	1.564	50	0		CDAARO
C[C@H](c1ccncn1)[N@H+](C)CCC(=O)Nc1nccs1	ZINC000240517125	361747535	/nfs/dbraw/zinc/74/75/35/361747535.db2.gz	NVHSCKSLFOEQEF-SNVBAGLBSA-N	1	0	291.380	1.955	50	0		CDAARO
C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cncn1C	ZINC000241701731	361752680	/nfs/dbraw/zinc/75/26/80/361752680.db2.gz	QKTOZYVMRAOSBX-DZGCQCFKSA-N	1	0	298.390	1.670	50	0		CDAARO
CCOC(=O)c1csc(CC2CC[NH2+]CC2)n1	ZINC000116156788	342043959	/nfs/dbraw/zinc/04/39/59/342043959.db2.gz	OPFYZNASYZUMTK-UHFFFAOYSA-N	1	0	254.355	1.862	50	0		CDAARO
CC(=O)O[C@H](CN1CC[NH+](C)CC1)c1ccccc1	ZINC000019360372	342089007	/nfs/dbraw/zinc/08/90/07/342089007.db2.gz	FRWDVKRXQFHYPY-OAHLLOKOSA-N	1	0	262.353	1.538	50	0		CDAARO
COc1cc(F)c(C(=O)N2CC[NH2+]C[C@H]2C)cc1OC	ZINC000125176274	187173046	/nfs/dbraw/zinc/17/30/46/187173046.db2.gz	OHSTWHSKDJORFP-SECBINFHSA-N	1	0	282.315	1.277	50	0		CDAARO
CCc1cc(C(=O)N2CCC[N@@H+](C3CC3)CC2)[nH]n1	ZINC000195411966	342623898	/nfs/dbraw/zinc/62/38/98/342623898.db2.gz	WAWQJYXFMJOOJB-UHFFFAOYSA-N	1	0	262.357	1.282	50	0		CDAARO
COc1cc(CCNC(=O)[C@@]2(C)CCC[NH2+]C2)ccc1F	ZINC000195555080	342626121	/nfs/dbraw/zinc/62/61/21/342626121.db2.gz	QFGOYTSMAAZEES-INIZCTEOSA-N	1	0	294.370	1.883	50	0		CDAARO
CCc1nn(C)cc1C[NH2+][C@H]1CCCC[C@@H]1C(N)=O	ZINC000195562086	342628594	/nfs/dbraw/zinc/62/85/94/342628594.db2.gz	AOCJHKJULSZKFI-AAEUAGOBSA-N	1	0	264.373	1.116	50	0		CDAARO
[NH3+][C@H]1C[C@@H](c2cc(NCC3CCOCC3)ncn2)C1	ZINC000244602103	361853442	/nfs/dbraw/zinc/85/34/42/361853442.db2.gz	DXMVLCWPGJNVJZ-TXEJJXNPSA-N	1	0	262.357	1.520	50	0		CDAARO
C[C@H](O)C1CCN(C(=O)[C@@H]2C[C@H]3CCCC[C@H]3[NH2+]2)CC1	ZINC000252585393	361857992	/nfs/dbraw/zinc/85/79/92/361857992.db2.gz	IGHSFRYLJWTOAE-MYPMTAMASA-N	1	0	280.412	1.527	50	0		CDAARO
O=c1[nH]ccn1CC[N@@H+]1CCCC2(CCOCC2)C1	ZINC000244723604	361858082	/nfs/dbraw/zinc/85/80/82/361858082.db2.gz	MEIWPUCUFNIBSQ-UHFFFAOYSA-N	1	0	265.357	1.069	50	0		CDAARO
Cc1c[nH]c(C(=O)N(C)C[C@H]2CC[N@@H+](CC(C)C)C2)n1	ZINC000244873354	361867885	/nfs/dbraw/zinc/86/78/85/361867885.db2.gz	WOTIQBKAMDGEJF-CYBMUJFWSA-N	1	0	278.400	1.768	50	0		CDAARO
CON1CCC(CC(=O)N[C@@H]2[C@@H](C)CC[NH2+][C@H]2C)CC1	ZINC000585136381	342216022	/nfs/dbraw/zinc/21/60/22/342216022.db2.gz	CXXPKADGVQXVNS-SLEUVZQESA-N	1	0	283.416	1.153	50	0		CDAARO
Cc1cc(N2CC[NH2+][C@H](c3ccccc3)C2)ncn1	ZINC000685945047	539046136	/nfs/dbraw/zinc/04/61/36/539046136.db2.gz	QKNASVCWSGQZFC-AWEZNQCLSA-N	1	0	254.337	1.936	50	0		CDAARO
CCCCNC(=O)[C@H](C)N1CC[N@H+](C)[C@@H](C(C)(C)C)C1	ZINC000585116450	362044602	/nfs/dbraw/zinc/04/46/02/362044602.db2.gz	WMWCWEWXKATMGF-UONOGXRCSA-N	1	0	283.460	1.953	50	0		CDAARO
C[C@@H]1C[C@@H](C)C[NH+](CCNC(=O)c2cc(C3CC3)n[nH]2)C1	ZINC000036394390	362060252	/nfs/dbraw/zinc/06/02/52/362060252.db2.gz	ORHHEFURZAZZFW-VXGBXAGGSA-N	1	0	290.411	1.995	50	0		CDAARO
CCCCNc1cc(C)[nH+]c(N2CCOCC2)n1	ZINC000002252300	136393593	/nfs/dbraw/zinc/39/35/93/136393593.db2.gz	YWDWBTOWHFMDQW-UHFFFAOYSA-N	1	0	250.346	1.834	50	0		CDAARO
O=C(N[C@H]1C[NH2+]C[C@@H](F)C1)OCc1ccccc1	ZINC000110915976	343762251	/nfs/dbraw/zinc/76/22/51/343762251.db2.gz	ABEYDAZZAVWOEL-NWDGAFQWSA-N	1	0	252.289	1.613	50	0		CDAARO
COC[C@@H]1CC[N@H+](CC(=O)NCc2ccccc2C)C1	ZINC000252503902	362389958	/nfs/dbraw/zinc/38/99/58/362389958.db2.gz	VHAUNBPEIBGVRH-CQSZACIVSA-N	1	0	276.380	1.580	50	0		CDAARO
CCCn1ncc(C[N@H+](C)CCC(=O)NC)c1C	ZINC000252505808	362390340	/nfs/dbraw/zinc/39/03/40/362390340.db2.gz	VTWBQCUUBTYMLL-UHFFFAOYSA-N	1	0	252.362	1.169	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)c2cc(C(C)C)nn2C)C1	ZINC000096482479	530001391	/nfs/dbraw/zinc/00/13/91/530001391.db2.gz	JEERVJLIPMFYAC-GFCCVEGCSA-N	1	0	278.400	1.615	50	0		CDAARO
COc1c(CN[C@H]2CC[N@@H+]3CCCC[C@@H]23)c(C)nn1C	ZINC000226327231	362528353	/nfs/dbraw/zinc/52/83/53/362528353.db2.gz	AICHSUINHAWPNB-KBPBESRZSA-N	1	0	278.400	1.454	50	0		CDAARO
CC(=O)OC[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1O	ZINC000242688549	345179718	/nfs/dbraw/zinc/17/97/18/345179718.db2.gz	VSGFDXSAMDSNKW-LSDHHAIUSA-N	1	0	263.337	1.433	50	0		CDAARO
[NH3+]C[C@H]1CN(Cc2c(Cl)cncc2Cl)CCO1	ZINC000097594934	185634614	/nfs/dbraw/zinc/63/46/14/185634614.db2.gz	URQLRGXPHIFXMJ-QMMMGPOBSA-N	1	0	276.167	1.548	50	0		CDAARO
O=C([C@H]1CC12CC[NH2+]CC2)N1CCN(c2ccccc2)CC1	ZINC000237993136	136537496	/nfs/dbraw/zinc/53/74/96/136537496.db2.gz	FHJABIYTSFOHBN-MRXNPFEDSA-N	1	0	299.418	1.725	50	0		CDAARO
CC(=O)OCc1c(C(C)=O)[n+](=O)c2ccccc2n1O	ZINC000135938655	348750811	/nfs/dbraw/zinc/75/08/11/348750811.db2.gz	LLPRNHUXGRUCHN-UHFFFAOYSA-N	1	0	277.256	1.059	50	0		CDAARO
COc1cc(CN2CCN3CC[N@H+](C)C[C@H]3C2)ccc1F	ZINC000216470070	348755841	/nfs/dbraw/zinc/75/58/41/348755841.db2.gz	GZQKBJPYCYYOKG-AWEZNQCLSA-N	1	0	293.386	1.266	50	0		CDAARO
CC(C)n1ccc(C(=O)N2CCCC[C@H]2[C@H](C)[NH3+])n1	ZINC000269188268	535081762	/nfs/dbraw/zinc/08/17/62/535081762.db2.gz	NYVYOWMQKYUZQK-AAEUAGOBSA-N	1	0	264.373	1.806	50	0		CDAARO
CC(C)n1cnnc1CC[NH2+][C@@H](C)Cn1ccnc1	ZINC000584896297	349357673	/nfs/dbraw/zinc/35/76/73/349357673.db2.gz	NOTYGBYORXJJII-LBPRGKRZSA-N	1	0	262.361	1.276	50	0		CDAARO
CCOC(=O)N1CC[C@@H]([NH2+]CCn2ccnc2C)C1	ZINC000584888073	349346429	/nfs/dbraw/zinc/34/64/29/349346429.db2.gz	XYBWXCHDSGRXRX-GFCCVEGCSA-N	1	0	266.345	1.012	50	0		CDAARO
COCCCC1CCN(C(=O)C[N@@H+]2CCC[C@H](O)C2)CC1	ZINC000584890490	349349382	/nfs/dbraw/zinc/34/93/82/349349382.db2.gz	JHRYKDWCFFKRHB-HNNXBMFYSA-N	1	0	298.427	1.108	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C(=O)C[C@@H]1CCOC1	ZINC000584894458	349354215	/nfs/dbraw/zinc/35/42/15/349354215.db2.gz	ZUJQOCZXMLZVAE-ZDUSSCGKSA-N	1	0	268.401	1.746	50	0		CDAARO
Cc1cccc(C)c1C[NH2+]C[C@](C)(O)CN1CCOCC1	ZINC000091061100	180092989	/nfs/dbraw/zinc/09/29/89/180092989.db2.gz	ATVGXXUTFFBCRV-KRWDZBQOSA-N	1	0	292.423	1.476	50	0		CDAARO
CC(C)c1nccc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)n1	ZINC000091440545	180156914	/nfs/dbraw/zinc/15/69/14/180156914.db2.gz	XHTYCEAONPFIPR-NEPJUHHUSA-N	1	0	274.368	1.409	50	0		CDAARO
Cc1nc(C)c(C)c(NCCC[N@@H+]2CCC[C@@H](CO)C2)n1	ZINC000091782396	180254114	/nfs/dbraw/zinc/25/41/14/180254114.db2.gz	MGDBDEZDMWGGEJ-OAHLLOKOSA-N	1	0	292.427	1.908	50	0		CDAARO
Fc1ccc(C[NH2+]C[C@@H]2CN(C3CC3)CCO2)c(F)c1	ZINC000106380767	186111250	/nfs/dbraw/zinc/11/12/50/186111250.db2.gz	HMPGRELXENHBLV-CQSZACIVSA-N	1	0	282.334	1.918	50	0		CDAARO
COc1ccc(CC[NH2+][C@H]2CCOC2)cc1OC	ZINC000109429184	186251868	/nfs/dbraw/zinc/25/18/68/186251868.db2.gz	QJWFPNIJOOLWOO-LBPRGKRZSA-N	1	0	251.326	1.625	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CCC[C@@H]1c1cccc(N(C)C)c1	ZINC000110641298	186307141	/nfs/dbraw/zinc/30/71/41/186307141.db2.gz	OOBDHEYVBWJEML-HZPDHXFCSA-N	1	0	278.396	1.897	50	0		CDAARO
C[NH+](C)[C@@H]1CCN([C@H]2CCCN(CC(C)(C)C)C2=O)C1	ZINC000583650932	366007136	/nfs/dbraw/zinc/00/71/36/366007136.db2.gz	CYZVTJOBSLETAL-KGLIPLIRSA-N	1	0	281.444	1.659	50	0		CDAARO
c1ccc(CN2CC[NH+](C[C@H]3CCCO3)CC2)cc1	ZINC000034429391	363346013	/nfs/dbraw/zinc/34/60/13/363346013.db2.gz	BQBFXTWAJHPMLZ-MRXNPFEDSA-N	1	0	260.381	1.983	50	0		CDAARO
O=C(C1CC[NH2+]CC1)N1CCN(Cc2ccccc2)CC1	ZINC000004253237	356023810	/nfs/dbraw/zinc/02/38/10/356023810.db2.gz	NGOVHDBEXKOVET-UHFFFAOYSA-N	1	0	287.407	1.330	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H](C)c1ccc([S@](C)=O)cc1	ZINC000097373430	356094709	/nfs/dbraw/zinc/09/47/09/356094709.db2.gz	NTLNYBMBBNLTFL-PRWKNARSSA-N	1	0	296.436	1.847	50	0		CDAARO
CC[N@H+](CC(=O)NCCc1cccc(OC)c1)C1CC1	ZINC000097478314	356164825	/nfs/dbraw/zinc/16/48/25/356164825.db2.gz	ILEPRSLEDGBBJT-UHFFFAOYSA-N	1	0	276.380	1.838	50	0		CDAARO
Nc1c(Cl)ncnc1NCCCn1ccnc1	ZINC000013814766	356358722	/nfs/dbraw/zinc/35/87/22/356358722.db2.gz	IWVDBRPKPMAROV-UHFFFAOYSA-N	1	0	252.709	1.411	50	0		CDAARO
CSc1ccc(C[NH2+]CCSc2nnnn2C)cc1	ZINC000004488548	356363795	/nfs/dbraw/zinc/36/37/95/356363795.db2.gz	ZKNOYIUPIAJWSJ-UHFFFAOYSA-N	1	0	295.437	1.814	50	0		CDAARO
CC[NH+]1CCN(CCNC(=O)c2ccc(Cl)cc2)CC1	ZINC000032819278	356384463	/nfs/dbraw/zinc/38/44/63/356384463.db2.gz	MABRUFURUZFYIA-UHFFFAOYSA-N	1	0	295.814	1.707	50	0		CDAARO
COc1c(Cl)cc(Cl)cc1CNCC[NH2+]CCO	ZINC000019370685	356483349	/nfs/dbraw/zinc/48/33/49/356483349.db2.gz	LFHXKJHQSINNIN-UHFFFAOYSA-N	1	0	293.194	1.674	50	0		CDAARO
CNc1ccc(C(=O)NCC[C@H]2CCCC[N@@H+]2C)cn1	ZINC000019148958	356476473	/nfs/dbraw/zinc/47/64/73/356476473.db2.gz	DJRCUTQNHGVPRA-CYBMUJFWSA-N	1	0	276.384	1.728	50	0		CDAARO
Cc1ccccc1C(=O)O[C@@H](C)CN1CC[NH+](C)CC1	ZINC000019236899	356477972	/nfs/dbraw/zinc/47/79/72/356477972.db2.gz	UKAOAYWIJJXODB-AWEZNQCLSA-N	1	0	276.380	1.788	50	0		CDAARO
CC[NH+]1CCN(Cc2cc3c(c(OC)c2)OCO3)CC1	ZINC000019607040	356493293	/nfs/dbraw/zinc/49/32/93/356493293.db2.gz	LJBJRSATTGTZHF-UHFFFAOYSA-N	1	0	278.352	1.561	50	0		CDAARO
Fc1cccc(F)c1C[NH2+]CCN1CCOCC1	ZINC000019953905	356520018	/nfs/dbraw/zinc/52/00/18/356520018.db2.gz	ZEXJWPFZBFSBQE-UHFFFAOYSA-N	1	0	256.296	1.387	50	0		CDAARO
COc1cccc(OC)c1OCCCN1CC[NH2+]CC1	ZINC000022942772	356624829	/nfs/dbraw/zinc/62/48/29/356624829.db2.gz	WSZXZWFPDQPVKP-UHFFFAOYSA-N	1	0	280.368	1.378	50	0		CDAARO
CC(C)[NH+](CCNC(=O)c1ccc[nH]c1=O)C(C)C	ZINC000027458253	356708681	/nfs/dbraw/zinc/70/86/81/356708681.db2.gz	ZYFLTNGPRCCSMP-UHFFFAOYSA-N	1	0	265.357	1.224	50	0		CDAARO
COC(=O)[C@@H](CC(C)C)NC(=O)C[NH2+]Cc1ccccc1	ZINC000071782577	356919964	/nfs/dbraw/zinc/91/99/64/356919964.db2.gz	MUUIBHPGLLKBLJ-CQSZACIVSA-N	1	0	292.379	1.480	50	0		CDAARO
[NH3+]Cc1cn(-c2ccccc2Br)nn1	ZINC000047843883	357166467	/nfs/dbraw/zinc/16/64/67/357166467.db2.gz	HGWZYRGDGYEZSM-UHFFFAOYSA-N	1	0	253.103	1.489	50	0		CDAARO
CCC1(CC)[C@H]([NH2+][C@@H]2CCN(C)C2=O)C[C@@H]1OC	ZINC000095419470	357320825	/nfs/dbraw/zinc/32/08/25/357320825.db2.gz	JUUQWCUWCHJGIM-UTUOFQBUSA-N	1	0	254.374	1.400	50	0		CDAARO
COc1ccc(CNC(=O)C[C@H]2CC[NH2+]C2)c(OC)c1	ZINC000089748250	357503303	/nfs/dbraw/zinc/50/33/03/357503303.db2.gz	HGVLXSHVEUUFSP-LLVKDONJSA-N	1	0	278.352	1.320	50	0		CDAARO
CS[C@H]1CC[C@H]([N@H+](C)CCS(C)(=O)=O)C1	ZINC000096441615	357472855	/nfs/dbraw/zinc/47/28/55/357472855.db2.gz	BGHRXVUIZYPYNM-UWVGGRQHSA-N	1	0	251.417	1.247	50	0		CDAARO
Cc1cc(-n2nc(C3CC3)nc2[C@H]2COCCO2)cc[nH+]1	ZINC000065508194	357547195	/nfs/dbraw/zinc/54/71/95/357547195.db2.gz	IOJXZQPLINVYLC-CYBMUJFWSA-N	1	0	286.335	1.936	50	0		CDAARO
C[NH2+]CCc1noc(COc2ccc(F)cc2F)n1	ZINC000066323521	357561972	/nfs/dbraw/zinc/56/19/72/357561972.db2.gz	CWFPHAGHJMWFJB-UHFFFAOYSA-N	1	0	269.251	1.689	50	0		CDAARO
O=C(CO)NCC[C@H]1CCC[N@H+](Cc2cccc(O)c2)C1	ZINC000067803831	357628887	/nfs/dbraw/zinc/62/88/87/357628887.db2.gz	AEPFIHJGCUHVDO-CYBMUJFWSA-N	1	0	292.379	1.103	50	0		CDAARO
CC(C)(C)[C@H](O)C[C@@H](CO)[NH2+]Cc1cccs1	ZINC000283897454	357609265	/nfs/dbraw/zinc/60/92/65/357609265.db2.gz	HSHABHJEJDPIQO-CMPLNLGQSA-N	1	0	257.399	1.996	50	0		CDAARO
Cn1cc(CC(=O)NC[C@H]2CC[N@H+](C)C2)c2ccccc21	ZINC000067489616	357610236	/nfs/dbraw/zinc/61/02/36/357610236.db2.gz	YJQMJWXUPBFFTC-CYBMUJFWSA-N	1	0	285.391	1.789	50	0		CDAARO
CCN(Cc1cnn(C)c1)C(=O)[C@H]1Cc2ccccc2C[NH2+]1	ZINC000067713958	357620077	/nfs/dbraw/zinc/62/00/77/357620077.db2.gz	OSMSTZCFHUDFOG-MRXNPFEDSA-N	1	0	298.390	1.483	50	0		CDAARO
C[C@H](C1CCN(Cc2ncc[nH]2)CC1)[NH+]1CCOCC1	ZINC000072474382	357838182	/nfs/dbraw/zinc/83/81/82/357838182.db2.gz	SXXZNGRNXDTNAN-CYBMUJFWSA-N	1	0	278.400	1.342	50	0		CDAARO
Cc1ccccc1N1CCN(C(=O)Cn2ccnc2)[C@H](C)C1	ZINC000077440396	358019228	/nfs/dbraw/zinc/01/92/28/358019228.db2.gz	CHKJGWOKNLMJTC-OAHLLOKOSA-N	1	0	298.390	1.929	50	0		CDAARO
CCC(CC)(C[NH3+])NS(=O)(=O)c1cnn(C(C)C)c1	ZINC000097229428	358043499	/nfs/dbraw/zinc/04/34/99/358043499.db2.gz	UYXOKMJFPKLUBC-UHFFFAOYSA-N	1	0	288.417	1.260	50	0		CDAARO
C[NH+]1CCN(Cc2ccnc(Br)c2[O-])CC1	ZINC000019798573	358142880	/nfs/dbraw/zinc/14/28/80/358142880.db2.gz	QLQQCQCKAKNBQT-UHFFFAOYSA-N	1	0	286.173	1.297	50	0		CDAARO
NC(=O)COc1ccc(C[NH2+]Cc2ccccc2)cc1	ZINC000019899463	358213787	/nfs/dbraw/zinc/21/37/87/358213787.db2.gz	JKTGRZLDCFSYLG-UHFFFAOYSA-N	1	0	270.332	1.841	50	0		CDAARO
CCc1nccn1CCNC(=O)CC[C@@H]1CCCC[N@@H+]1C	ZINC000095359307	358684237	/nfs/dbraw/zinc/68/42/37/358684237.db2.gz	QZJXSBNOSDWUAF-AWEZNQCLSA-N	1	0	292.427	1.826	50	0		CDAARO
CCC[NH+]1CCC(CC(=O)NCc2cc(C)nn2C)CC1	ZINC000095366668	358686834	/nfs/dbraw/zinc/68/68/34/358686834.db2.gz	RMBMCZXAXPQOTC-UHFFFAOYSA-N	1	0	292.427	1.857	50	0		CDAARO
CN(Cc1[nH]nc2c1CCC2)c1nc(N)[nH+]c2c1CCCC2	ZINC000095372924	358688431	/nfs/dbraw/zinc/68/84/31/358688431.db2.gz	KZJNBLLCUUGPNW-UHFFFAOYSA-N	1	0	298.394	1.786	50	0		CDAARO
O=C(NCCCSCc1ccco1)[C@@H]1C[NH2+]CCO1	ZINC000097307073	358765839	/nfs/dbraw/zinc/76/58/39/358765839.db2.gz	BGJWZCFEBIQANV-LBPRGKRZSA-N	1	0	284.381	1.008	50	0		CDAARO
Cc1c2ccccc2[nH]c1CN1CCN2CC[N@@H+](C)C[C@@H]2C1	ZINC000215008176	358868405	/nfs/dbraw/zinc/86/84/05/358868405.db2.gz	WGDLXMRJUIWEJG-OAHLLOKOSA-N	1	0	298.434	1.908	50	0		CDAARO
CN(C)c1ncc(C[N@H+](C)CCC[C@H]2CCCO2)cn1	ZINC000215046019	358870331	/nfs/dbraw/zinc/87/03/31/358870331.db2.gz	FIVDTHFZOIZXED-AWEZNQCLSA-N	1	0	278.400	1.934	50	0		CDAARO
Cn1cc(CC[N@H+](C)Cc2cccc3nonc32)cn1	ZINC000215727859	358900429	/nfs/dbraw/zinc/90/04/29/358900429.db2.gz	FDRDDRPDMJTQTA-UHFFFAOYSA-N	1	0	271.324	1.631	50	0		CDAARO
CN(Cc1ccc2c(c1)C[N@@H+](C)C2)C(=O)c1cn[nH]c1	ZINC000216103448	358924939	/nfs/dbraw/zinc/92/49/39/358924939.db2.gz	SNEKOYATIRBOSQ-UHFFFAOYSA-N	1	0	270.336	1.627	50	0		CDAARO
COc1ccc(NC(C)=O)cc1NC(=O)C[NH2+]C(C)(C)C	ZINC000014116167	366531208	/nfs/dbraw/zinc/53/12/08/366531208.db2.gz	YKLZXFGTXNNKGS-UHFFFAOYSA-N	1	0	293.367	1.980	50	0		CDAARO
O=C(NCC1CC1)[C@H]1CCC[N@@H+]([C@H]2CCOC2)C1	ZINC000108101846	358956037	/nfs/dbraw/zinc/95/60/37/358956037.db2.gz	HWBVEDWMDFFTOQ-STQMWFEESA-N	1	0	252.358	1.014	50	0		CDAARO
Cc1ccc(OC[C@@H](O)CN2CC[NH+](C)CC2)c(C)c1	ZINC000022027228	359014222	/nfs/dbraw/zinc/01/42/22/359014222.db2.gz	DSPCKQXDWMAMSS-HNNXBMFYSA-N	1	0	278.396	1.291	50	0		CDAARO
C[NH+]1CCC(O)(CCNC(=O)c2ccc(O)c(F)c2)CC1	ZINC000222836999	359377820	/nfs/dbraw/zinc/37/78/20/359377820.db2.gz	ABNCKXXFSZYBEX-UHFFFAOYSA-N	1	0	296.342	1.108	50	0		CDAARO
COC[C@@H](NC(=O)CC[NH+]1CCCC1)c1ccccn1	ZINC000223911829	359471135	/nfs/dbraw/zinc/47/11/35/359471135.db2.gz	KLQCMZSIGFJFLW-CQSZACIVSA-N	1	0	277.368	1.371	50	0		CDAARO
CC(C)c1noc([C@H]2CCC[NH2+]CCC(=O)NCC2)n1	ZINC000257185058	359505055	/nfs/dbraw/zinc/50/50/55/359505055.db2.gz	VWTXZACZIODTCC-NSHDSACASA-N	1	0	280.372	1.556	50	0		CDAARO
Cn1cc(C[NH+]2CCC3(CC2)C[C@](C)(O)CCO3)cn1	ZINC000257192519	359592609	/nfs/dbraw/zinc/59/26/09/359592609.db2.gz	USKYMKYXHQPOKP-CQSZACIVSA-N	1	0	279.384	1.316	50	0		CDAARO
C[C@@H](c1cccnc1)[N@@H+]1CCC[C@H]1Cn1cncn1	ZINC000257365774	359946772	/nfs/dbraw/zinc/94/67/72/359946772.db2.gz	LZTUOJFDLLVRJU-JSGCOSHPSA-N	1	0	257.341	1.899	50	0		CDAARO
CCC(=O)N1CCC2(C[N@@H+](C3CCC3)C[C@H]2CO)CC1	ZINC000409419826	360226870	/nfs/dbraw/zinc/22/68/70/360226870.db2.gz	SJICMASGQSVODM-ZDUSSCGKSA-N	1	0	280.412	1.482	50	0		CDAARO
Cc1cnn(CCC(=O)N2CC(n3ccnc3C)C2)c1	ZINC000409420951	360229337	/nfs/dbraw/zinc/22/93/37/360229337.db2.gz	KTLLZGOBBRFGRQ-UHFFFAOYSA-N	1	0	273.340	1.170	50	0		CDAARO
COCC1(NC(=O)[C@@H](C)n2ccnc2)CCCC1	ZINC000426534014	360680983	/nfs/dbraw/zinc/68/09/83/360680983.db2.gz	GXFFYUVQUOAUBL-LLVKDONJSA-N	1	0	251.330	1.520	50	0		CDAARO
COc1cc(C(=O)N2CCC2)cc(OC)c1OCCC[NH3+]	ZINC000426379742	360661649	/nfs/dbraw/zinc/66/16/49/360661649.db2.gz	MZYZGMPFBHVBEQ-UHFFFAOYSA-N	1	0	294.351	1.277	50	0		CDAARO
C[C@@H](CCC(=O)NCc1cnn(C)c1)[NH+]1CCCC1	ZINC000426662265	360694420	/nfs/dbraw/zinc/69/44/20/360694420.db2.gz	OFPVWAKHAZBVRO-LBPRGKRZSA-N	1	0	264.373	1.301	50	0		CDAARO
CSCCNC(=O)Cc1ccc(OCC[NH3+])cc1	ZINC000426497204	360676657	/nfs/dbraw/zinc/67/66/57/360676657.db2.gz	JLGORDOYQBJIMK-UHFFFAOYSA-N	1	0	268.382	1.046	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)Cc2cc(F)ccc2F)C1	ZINC000178547195	189126027	/nfs/dbraw/zinc/12/60/27/189126027.db2.gz	DPMQVYAKRPTMHZ-VIFPVBQESA-N	1	0	254.280	1.315	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)COc2ccccc2F)C1	ZINC000178556566	189126461	/nfs/dbraw/zinc/12/64/61/189126461.db2.gz	QSSWKSDBBDWJSH-JTQLQIEISA-N	1	0	252.289	1.012	50	0		CDAARO
Cc1cc(OCC(=O)N2CC[C@@H](C[NH3+])C2)ccc1Cl	ZINC000178555928	189126692	/nfs/dbraw/zinc/12/66/92/189126692.db2.gz	VFWPNLSRXKXZEN-NSHDSACASA-N	1	0	282.771	1.834	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)COc2ccccc2Cl)C1	ZINC000178555837	189126707	/nfs/dbraw/zinc/12/67/07/189126707.db2.gz	SXDXRCSLGUSJHY-SNVBAGLBSA-N	1	0	268.744	1.526	50	0		CDAARO
Cc1cc(C)c(OCC(=O)N2CC[C@@H](C[NH3+])C2)c(C)c1	ZINC000178566053	189127357	/nfs/dbraw/zinc/12/73/57/189127357.db2.gz	OWKQMLGOBQSHSQ-AWEZNQCLSA-N	1	0	276.380	1.798	50	0		CDAARO
Cc1nc(CNC(=O)C[C@@H]2CCCC[N@@H+]2C)n(C)c1C	ZINC000426726747	360699594	/nfs/dbraw/zinc/69/95/94/360699594.db2.gz	JOCCITCORKYRDC-ZDUSSCGKSA-N	1	0	278.400	1.528	50	0		CDAARO
CCc1ccccc1OCC(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178524009	189123902	/nfs/dbraw/zinc/12/39/02/189123902.db2.gz	UACIZDJYLONTGG-LBPRGKRZSA-N	1	0	262.353	1.435	50	0		CDAARO
CCc1noc2ncc(C(=O)N3CC[C@@H](C[NH2+]C)C3)cc12	ZINC000178966579	189157680	/nfs/dbraw/zinc/15/76/80/189157680.db2.gz	NUKBOCHCRKFVFO-JTQLQIEISA-N	1	0	288.351	1.467	50	0		CDAARO
COC(=O)c1ccc(-c2cccc3c2O[C@H](C[NH3+])C3)nc1	ZINC000299801951	200879435	/nfs/dbraw/zinc/87/94/35/200879435.db2.gz	ZEUBQAZTYVKHJM-LBPRGKRZSA-N	1	0	284.315	1.797	50	0		CDAARO
COc1ccccc1CC[NH2+]C1CCN(C(C)=O)CC1	ZINC000000217698	364094827	/nfs/dbraw/zinc/09/48/27/364094827.db2.gz	FBBNDFXGPFFITM-UHFFFAOYSA-N	1	0	276.380	1.838	50	0		CDAARO
CN(C(=O)/C=C/c1c(F)cccc1F)[C@@H]1CC[NH2+]C1	ZINC000179068990	364981478	/nfs/dbraw/zinc/98/14/78/364981478.db2.gz	NGDGWNCYBZPCJT-BRAIEQGRSA-N	1	0	266.291	1.798	50	0		CDAARO
Cc1cn2c(n1)[C@@H](C[NH2+]Cc1c[nH]nc1C)CCC2	ZINC000089702109	366914606	/nfs/dbraw/zinc/91/46/06/366914606.db2.gz	FEBBGUYBAJVAFQ-GFCCVEGCSA-N	1	0	259.357	1.890	50	0		CDAARO
O=C(NC[C@@]1(O)CCOC1)[C@@H]1CCCC[N@@H+]1C1CCCC1	ZINC000252481730	367565934	/nfs/dbraw/zinc/56/59/34/367565934.db2.gz	CRAMCAPGZSYHPZ-HOCLYGCPSA-N	1	0	296.411	1.051	50	0		CDAARO
Cc1c(F)cccc1S(=O)(=O)N[C@H]1CCC[NH2+]C1	ZINC000193351106	368068817	/nfs/dbraw/zinc/06/88/17/368068817.db2.gz	RRCYVYBLFSAAKW-JTQLQIEISA-N	1	0	272.345	1.164	50	0		CDAARO
COc1ccc(C(=O)NCCC[NH+](C)C)cc1OC	ZINC000003210675	368541636	/nfs/dbraw/zinc/54/16/36/368541636.db2.gz	TYZFWAWSYYZRFP-UHFFFAOYSA-N	1	0	266.341	1.385	50	0	biogenic	CDAARO
CS[C@H]1C[N@H+](CCc2ccncc2C)C[C@@H]1N(C)C	ZINC000573840012	371677532	/nfs/dbraw/zinc/67/75/32/371677532.db2.gz	KKXQVLSEONDSJO-GJZGRUSLSA-N	1	0	279.453	1.910	50	0		CDAARO
CN(C)C(=O)c1ccc(Cl)cc1OCCC[NH3+]	ZINC000299790002	372764705	/nfs/dbraw/zinc/76/47/05/372764705.db2.gz	AIVHZAVENOPAQD-UHFFFAOYSA-N	1	0	256.733	1.769	50	0		CDAARO
C[C@H](C[N@@H+]1CCc2ccccc2C1)NC(=O)c1cn(C)cn1	ZINC000299782945	372758924	/nfs/dbraw/zinc/75/89/24/372758924.db2.gz	GSQQIAVOBYGZIQ-CYBMUJFWSA-N	1	0	298.390	1.597	50	0		CDAARO
CC(C)[C@@H]([NH3+])C(=O)Nc1cnn(-c2ccccn2)c1	ZINC000581073103	372815858	/nfs/dbraw/zinc/81/58/58/372815858.db2.gz	APJLZGHMQZXZFU-GFCCVEGCSA-N	1	0	259.313	1.189	50	0		CDAARO
OC[C@@H]1C[N@H+](Cc2cccnc2)C[C@H]1c1ccccn1	ZINC000253409056	373716758	/nfs/dbraw/zinc/71/67/58/373716758.db2.gz	LIOICDNKSMPQEC-LSDHHAIUSA-N	1	0	269.348	1.685	50	0		CDAARO
COc1cccc(CC2([NH3+])CCS(=O)(=O)CC2)c1	ZINC000255188427	374265111	/nfs/dbraw/zinc/26/51/11/374265111.db2.gz	JUDFEPJDVSQLQK-UHFFFAOYSA-N	1	0	269.366	1.144	50	0		CDAARO
C[C@H]1C[N@H+](CC(C)(C)O)CCN1C(=O)N[C@@H]1C=CCCC1	ZINC000249132250	189959088	/nfs/dbraw/zinc/95/90/88/189959088.db2.gz	STDZHEPWMFWTBY-UONOGXRCSA-N	1	0	295.427	1.582	50	0		CDAARO
Cc1nnc(CN2CC[NH+](C(C)C)CC2)n1C1CC1	ZINC000095393601	374899215	/nfs/dbraw/zinc/89/92/15/374899215.db2.gz	SQHVXGBUOXZHHA-UHFFFAOYSA-N	1	0	263.389	1.447	50	0		CDAARO
COc1ccc(C[N@H+](CC(N)=O)C(C)C)cc1OC	ZINC000095389766	374899729	/nfs/dbraw/zinc/89/97/29/374899729.db2.gz	FVJREGSKIQILRO-UHFFFAOYSA-N	1	0	266.341	1.400	50	0		CDAARO
c1ccc2c(c1)CC[C@H]([NH2+]CCc1nnc3n1CCC3)C2	ZINC000095419903	374922138	/nfs/dbraw/zinc/92/21/38/374922138.db2.gz	IFDLSXGKIWLXJA-HNNXBMFYSA-N	1	0	282.391	1.914	50	0		CDAARO
CCCCCNC(=O)N(C)CC1CC[NH+](C[C@@H](C)O)CC1	ZINC000095461026	374957125	/nfs/dbraw/zinc/95/71/25/374957125.db2.gz	DECUWUDGAGNUAW-CQSZACIVSA-N	1	0	299.459	1.911	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCN(c2cc(C)ccc2C)CC1	ZINC000095466851	374961730	/nfs/dbraw/zinc/96/17/30/374961730.db2.gz	OLLKBBSQTMTCOE-AWEZNQCLSA-N	1	0	275.396	1.689	50	0		CDAARO
c1ccc(C[C@@H](CN2CCOCC2)[NH2+][C@H]2CCOC2)cc1	ZINC000095967901	375044634	/nfs/dbraw/zinc/04/46/34/375044634.db2.gz	YLGIGSOWUQYDQL-IRXDYDNUSA-N	1	0	290.407	1.308	50	0		CDAARO
O=S(=O)(CC[NH2+][C@@H]1CCCSC1)NCC1CCC1	ZINC000097084595	375146378	/nfs/dbraw/zinc/14/63/78/375146378.db2.gz	OHHBLRNCMVSMFW-GFCCVEGCSA-N	1	0	292.470	1.191	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C[C@@H](O)CO[C@H](C)c1ccccc1	ZINC000097160008	375150516	/nfs/dbraw/zinc/15/05/16/375150516.db2.gz	QGUQJSCGBZWWNI-CZUORRHYSA-N	1	0	289.379	1.946	50	0		CDAARO
C[C@@H]1C[C@@H]([NH3+])CCN1C(=O)/C=C\c1ccc(C(N)=O)cc1	ZINC000493502035	375459084	/nfs/dbraw/zinc/45/90/84/375459084.db2.gz	VLJOGGSTPRKVJY-QDDUCLRZSA-N	1	0	287.363	1.137	50	0		CDAARO
C[C@@H]1CCCN(C(=O)/C=C\C2CCOCC2)[C@H]1C[NH3+]	ZINC000606441873	375823338	/nfs/dbraw/zinc/82/33/38/375823338.db2.gz	PVXPDIPTOKQNQN-QDSCNLCFSA-N	1	0	266.385	1.555	50	0		CDAARO
CCN(CC)C(=O)[C@@H]1C[C@@H]([NH3+])CN1CC1CCCC1	ZINC000067457714	377087129	/nfs/dbraw/zinc/08/71/29/377087129.db2.gz	QUDMRSUXXWJICY-KGLIPLIRSA-N	1	0	267.417	1.447	50	0		CDAARO
Cn1ncc(N2CCC[N@@H+]3CCC[C@H]3C2)c(Cl)c1=O	ZINC000245339151	378072109	/nfs/dbraw/zinc/07/21/09/378072109.db2.gz	QVUILQNTZZYOBE-JTQLQIEISA-N	1	0	282.775	1.108	50	0		CDAARO
Cc1nn(C)c(C)c1C[NH2+][C@H]([C@@H](CO)C1CC1)C1CC1	ZINC000449498943	250880164	/nfs/dbraw/zinc/88/01/64/250880164.db2.gz	BVDMEIBAEOZKKX-HOTGVXAUSA-N	1	0	277.412	1.924	50	0		CDAARO
O=C1OCC[C@H]1C1(O)CC[NH+](Cc2ccccc2)CC1	ZINC000004794408	284953650	/nfs/dbraw/zinc/95/36/50/284953650.db2.gz	LSABJPIDIAERGU-CQSZACIVSA-N	1	0	275.348	1.577	50	0		CDAARO
C[NH2+][C@@H]1CCN(C(=O)c2cccc(F)c2Cl)C1	ZINC000096482490	532968598	/nfs/dbraw/zinc/96/85/98/532968598.db2.gz	JYEZOOUSKMPQKE-MRVPVSSYSA-N	1	0	256.708	1.913	50	0		CDAARO
COCCN1CCC[C@@H]1C[NH2+][C@@H]1[C@H]2CCCO[C@H]2C1(C)C	ZINC000242284651	285029225	/nfs/dbraw/zinc/02/92/25/285029225.db2.gz	YIOJOBYLYDHOJH-KLHDSHLOSA-N	1	0	296.455	1.890	50	0		CDAARO
O=S(=O)(N[C@H]1CC[N@@H+]2CCCC[C@H]12)c1ccccc1	ZINC000046036413	285043634	/nfs/dbraw/zinc/04/36/34/285043634.db2.gz	CCJULNHRHTZKFT-UONOGXRCSA-N	1	0	280.393	1.592	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CN(CCO)Cc1nccs1	ZINC000244763990	285251035	/nfs/dbraw/zinc/25/10/35/285251035.db2.gz	OZGANXDOUYJDLH-GFCCVEGCSA-N	1	0	269.414	1.422	50	0		CDAARO
O=c1cc(CN[C@H]2CCC[NH2+]C2)[nH]c2c(F)cccc12	ZINC000095382983	184961019	/nfs/dbraw/zinc/96/10/19/184961019.db2.gz	PKSONTYVEYJVPS-JTQLQIEISA-N	1	0	275.327	1.509	50	0		CDAARO
[NH3+][C@H]1CCCC[C@@H]1NC(=O)c1cccnc1Cl	ZINC000079440095	390422689	/nfs/dbraw/zinc/42/26/89/390422689.db2.gz	FQRIPXUPVIYTSF-UWVGGRQHSA-N	1	0	253.733	1.735	50	0		CDAARO
COc1ccccc1S(=O)(=O)C1CCC([NH3+])CC1	ZINC000055143938	390488147	/nfs/dbraw/zinc/48/81/47/390488147.db2.gz	FSSQHMPSVLXPDB-UHFFFAOYSA-N	1	0	269.366	1.739	50	0		CDAARO
CC(C)C[C@@](C)([NH2+]CC(=O)N1CCC(C)CC1)C(N)=O	ZINC000096419585	390513157	/nfs/dbraw/zinc/51/31/57/390513157.db2.gz	CUKAPPHTTQEUKN-OAHLLOKOSA-N	1	0	283.416	1.125	50	0		CDAARO
CCOCC[N@@H+]1CCCN(c2ncccn2)CC1	ZINC000096421128	390514197	/nfs/dbraw/zinc/51/41/97/390514197.db2.gz	SWZWUDPDBPRABJ-UHFFFAOYSA-N	1	0	250.346	1.025	50	0		CDAARO
Cc1cccnc1[C@@H]([NH2+]CCNS(C)(=O)=O)C(C)C	ZINC000096424376	390516459	/nfs/dbraw/zinc/51/64/59/390516459.db2.gz	KWRPDVSVLYAZKJ-LBPRGKRZSA-N	1	0	285.413	1.226	50	0		CDAARO
C[NH+](C)CC(C)(C)c1nc2c([nH]1)C(=O)NCC(C)(C)C2	ZINC000065525832	390551056	/nfs/dbraw/zinc/55/10/56/390551056.db2.gz	VSZDZDUTRJLBON-UHFFFAOYSA-N	1	0	278.400	1.561	50	0		CDAARO
CCOCCN1CC[NH+](CC[C@@H]2CCCO2)CC1	ZINC000097105174	390791760	/nfs/dbraw/zinc/79/17/60/390791760.db2.gz	IVHRPJSOCQYQQZ-AWEZNQCLSA-N	1	0	256.390	1.210	50	0		CDAARO
C[C@H]1CCCN(C(=O)c2ccc3nccn3c2)[C@H]1C[NH3+]	ZINC000179223520	390945831	/nfs/dbraw/zinc/94/58/31/390945831.db2.gz	MXNUFPGUPSUPEG-AAEUAGOBSA-N	1	0	272.352	1.534	50	0		CDAARO
CS(=O)(=O)[C@H]1CCC[C@@H]([NH2+]Cc2ccns2)C1	ZINC000404273477	390958760	/nfs/dbraw/zinc/95/87/60/390958760.db2.gz	MDWLWJHWGAYBSA-KOLCDFICSA-N	1	0	274.411	1.589	50	0		CDAARO
CN(C)C(=O)C[N@H+](C[C@H]1CCCO1)[C@H]1CCSC1	ZINC000240321547	391328504	/nfs/dbraw/zinc/32/85/04/391328504.db2.gz	FAHFQLNBRUAZLC-NWDGAFQWSA-N	1	0	272.414	1.061	50	0		CDAARO
Nc1cc(CC[C@H]2COc3ccccc3O2)[nH+]c(N)n1	ZINC000252504232	391608814	/nfs/dbraw/zinc/60/88/14/391608814.db2.gz	VIOGSCNRWRLFAP-JTQLQIEISA-N	1	0	272.308	1.414	50	0		CDAARO
C[NH+](C)CCN1C(=O)[C@@H]2CC(Cl)=CC[C@@H]2C1=O	ZINC000003900200	391670873	/nfs/dbraw/zinc/67/08/73/391670873.db2.gz	ZDJWLMQGBPGACF-VHSXEESVSA-N	1	0	256.733	1.066	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCNC(=O)c2ccc(C(N)=O)cc2)C1	ZINC000458195118	391849751	/nfs/dbraw/zinc/84/97/51/391849751.db2.gz	QPBMHEJERPXTOM-LBPRGKRZSA-N	1	0	289.379	1.247	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2[C@H]3CCO[C@H]3[C@@H]2[NH+](C)C)cc(C)n1	ZINC000223223795	391921549	/nfs/dbraw/zinc/92/15/49/391921549.db2.gz	QHFUSLPNYYCCTE-LXTVHRRPSA-N	1	0	289.379	1.146	50	0		CDAARO
c1ccc2[nH]c(C3C[NH+](C[C@@H]4COCCO4)C3)nc2c1	ZINC000243892329	131083279	/nfs/dbraw/zinc/08/32/79/131083279.db2.gz	AGDDPMDXVZCRAN-GFCCVEGCSA-N	1	0	273.336	1.378	50	0		CDAARO
CO[C@H](C[NH3+])CC(=O)N(C)Cc1cc2ccccc2o1	ZINC000262937718	131274997	/nfs/dbraw/zinc/27/49/97/131274997.db2.gz	UEBHXNXGLMQFEO-LBPRGKRZSA-N	1	0	276.336	1.755	50	0		CDAARO
CS(=O)(=O)NCC1CC[NH+](CCc2ccccc2)CC1	ZINC000263672161	131306008	/nfs/dbraw/zinc/30/60/08/131306008.db2.gz	CUHROTDXTIFNJM-UHFFFAOYSA-N	1	0	296.436	1.490	50	0		CDAARO
COc1ccc(CC(=O)O[C@H]2CCC[N@H+](C)C2)cc1	ZINC000000250416	392725649	/nfs/dbraw/zinc/72/56/49/392725649.db2.gz	LQYCBEYRAHDIRD-AWEZNQCLSA-N	1	0	263.337	1.875	50	0	biogenic	CDAARO
CC(C)[N@@H+]1CCCC[C@H]1C(=O)NCCOCC1CC1	ZINC000096421705	393185096	/nfs/dbraw/zinc/18/50/96/393185096.db2.gz	VXRCWQDLXZWXSN-AWEZNQCLSA-N	1	0	268.401	1.792	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1CC[C@@H](N(C)C(=O)OC(C)(C)C)C1	ZINC000195535102	393275260	/nfs/dbraw/zinc/27/52/60/393275260.db2.gz	NINIPMHHPVAVGG-VXGBXAGGSA-N	1	0	272.389	1.699	50	0		CDAARO
OC[C@H]1CCC[N@@H+]1CCN1CCCc2ccccc21	ZINC000090520129	135063442	/nfs/dbraw/zinc/06/34/42/135063442.db2.gz	DVTQONHIQXJKBR-OAHLLOKOSA-N	1	0	260.381	1.896	50	0		CDAARO
Cc1c[nH+]ccc1N1CCC[C@@H](C(=O)N2CCOCC2)C1	ZINC000195343200	140154471	/nfs/dbraw/zinc/15/44/71/140154471.db2.gz	RXZGBAFVWCCHEU-CQSZACIVSA-N	1	0	289.379	1.465	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N[C@H]2CCC[C@@H]2C[NH3+])c1	ZINC000089091970	292119612	/nfs/dbraw/zinc/11/96/12/292119612.db2.gz	JSCNBGUWLKZFAG-PWSUYJOCSA-N	1	0	286.372	1.540	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N1CCC[C@@H]1C[NH2+]C	ZINC000193300337	148620369	/nfs/dbraw/zinc/62/03/69/148620369.db2.gz	CNKLJTMDHWAYSX-CYBMUJFWSA-N	1	0	282.409	1.622	50	0		CDAARO
C[C@@H]1C[C@@H](C[NH3+])CN1C(=O)c1cccc2cn[nH]c21	ZINC000262070639	149008310	/nfs/dbraw/zinc/00/83/10/149008310.db2.gz	WUXBFPXEJRFMIB-ZJUUUORDSA-N	1	0	258.325	1.372	50	0		CDAARO
COCCC[N@@H+]1C[C@H]2CCCC[C@@]2(C(=O)OC)C1	ZINC000239667623	292355084	/nfs/dbraw/zinc/35/50/84/292355084.db2.gz	BQWVMSWGCGRTDC-TZMCWYRMSA-N	1	0	255.358	1.688	50	0		CDAARO
O=C(Nc1ccc2ccccc2c1)[C@@H]1C[C@@H](O)C[NH2+]1	ZINC000004899558	170038011	/nfs/dbraw/zinc/03/80/11/170038011.db2.gz	RPDYJTXWIGUABB-KGLIPLIRSA-N	1	0	256.305	1.501	50	0	in-vitro	CDAARO
COc1ccc(OC)c(C[N@@H+]2CCC[C@H](CO)C2)c1	ZINC000004948779	170044579	/nfs/dbraw/zinc/04/45/79/170044579.db2.gz	SKJLZHXVXSIVQB-LBPRGKRZSA-N	1	0	265.353	1.908	50	0		CDAARO
COc1cccc(C[NH2+]C(C)(C)C)c1OCC(N)=O	ZINC000006747638	170239665	/nfs/dbraw/zinc/23/96/65/170239665.db2.gz	ZFRSPQNSICJYKL-UHFFFAOYSA-N	1	0	266.341	1.447	50	0		CDAARO
Cc1cccc(OCC(=O)NCC[NH+](C)C)c1C	ZINC000009907327	170389261	/nfs/dbraw/zinc/38/92/61/170389261.db2.gz	MWNBASAKHDBXED-UHFFFAOYSA-N	1	0	250.342	1.360	50	0		CDAARO
O=C(CC[NH+]1CCC(O)CC1)N1CCc2ccccc21	ZINC000012985058	170526141	/nfs/dbraw/zinc/52/61/41/170526141.db2.gz	DFMYSBBPIWQLRJ-UHFFFAOYSA-N	1	0	274.364	1.423	50	0		CDAARO
Cc1ccc(COC[C@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1	ZINC000016579252	170702696	/nfs/dbraw/zinc/70/26/96/170702696.db2.gz	NAFHMESIBRXAPD-BFYDXBDKSA-N	1	0	293.407	1.982	50	0		CDAARO
Cc1ccc(OCCN2CC[NH2+]CC2)c(Cl)c1	ZINC000020272359	171127543	/nfs/dbraw/zinc/12/75/43/171127543.db2.gz	TYKGULJCVLCVEP-UHFFFAOYSA-N	1	0	254.761	1.932	50	0		CDAARO
CC[N@@H+]1CCCN(C(=O)CSc2ncccn2)CC1	ZINC000020600659	171266270	/nfs/dbraw/zinc/26/62/70/171266270.db2.gz	PSHVWUMQKMBOAM-UHFFFAOYSA-N	1	0	280.397	1.123	50	0		CDAARO
OCC1CC[NH+]([C@@H]2CCCN(Cc3cccnc3)C2)CC1	ZINC000020919708	171280114	/nfs/dbraw/zinc/28/01/14/171280114.db2.gz	DXFLTAOKRCOCQY-QGZVFWFLSA-N	1	0	289.423	1.750	50	0		CDAARO
OCC[C@@H]1CN(Cc2cccnc2)CC[N@@H+]1C1CCCC1	ZINC000020992010	171283751	/nfs/dbraw/zinc/28/37/51/171283751.db2.gz	XDRGHQBVNRUVNP-QGZVFWFLSA-N	1	0	289.423	1.893	50	0		CDAARO
COC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCC[NH2+]C1	ZINC000022013891	171349371	/nfs/dbraw/zinc/34/93/71/171349371.db2.gz	HKYHGXQKYQHGFW-ZJUUUORDSA-N	1	0	272.345	1.052	50	0		CDAARO
COC(=O)[C@@H](C)C[NH+]1CCN(Cc2ccccc2)CC1	ZINC000022038909	171350402	/nfs/dbraw/zinc/35/04/02/171350402.db2.gz	TYEGCTFOVYJSIJ-AWEZNQCLSA-N	1	0	276.380	1.613	50	0		CDAARO
COc1ccc(OC)c(CN(C)CC[NH+](C)C)c1	ZINC000022454740	171388037	/nfs/dbraw/zinc/38/80/37/171388037.db2.gz	OBSDSTHCZKQASY-UHFFFAOYSA-N	1	0	252.358	1.697	50	0		CDAARO
OCC[NH2+]CCNCc1cccc(Cl)c1Cl	ZINC000023255776	171418218	/nfs/dbraw/zinc/41/82/18/171418218.db2.gz	QPRJYZUZDWFEPD-UHFFFAOYSA-N	1	0	263.168	1.665	50	0		CDAARO
CC(=O)N1CCC([NH2+][C@@H](C)CCCC(C)(C)O)CC1	ZINC000032507889	171730461	/nfs/dbraw/zinc/73/04/61/171730461.db2.gz	QTAQABKQKLQNPF-LBPRGKRZSA-N	1	0	270.417	1.917	50	0		CDAARO
COc1cc2nc(C)nc(NCC[NH3+])c2cc1OC	ZINC000035287640	172105794	/nfs/dbraw/zinc/10/57/94/172105794.db2.gz	ZYIKNFATWRSUMX-UHFFFAOYSA-N	1	0	262.313	1.326	50	0		CDAARO
CN(C)C(=O)CN1CCC([NH2+]Cc2ccccc2F)CC1	ZINC000037211943	173033540	/nfs/dbraw/zinc/03/35/40/173033540.db2.gz	ACPYESGWVLTYMB-UHFFFAOYSA-N	1	0	293.386	1.468	50	0		CDAARO
CCOc1ccccc1CN1CC[NH2+]C[C@H]1CCO	ZINC000038534369	174144854	/nfs/dbraw/zinc/14/48/54/174144854.db2.gz	YEGMTPFFDQKLQF-CQSZACIVSA-N	1	0	264.369	1.242	50	0		CDAARO
CC(C)Oc1ccc([C@H](O)CN2CC[NH+](C)CC2)cc1	ZINC000044116654	175141532	/nfs/dbraw/zinc/14/15/32/175141532.db2.gz	JJRCHJVVHPEAKH-MRXNPFEDSA-N	1	0	278.396	1.755	50	0		CDAARO
O=c1c2ccccc2cnn1CC[NH2+][C@H]1CCSC1	ZINC000065491255	175743121	/nfs/dbraw/zinc/74/31/21/175743121.db2.gz	RCXVQUPIVFZBMO-LBPRGKRZSA-N	1	0	275.377	1.492	50	0		CDAARO
C[NH2+]CCc1noc(COc2ccc3c(c2)CCC3)n1	ZINC000066323490	175756938	/nfs/dbraw/zinc/75/69/38/175756938.db2.gz	NIVIMLOMXYPYBJ-UHFFFAOYSA-N	1	0	273.336	1.899	50	0		CDAARO
CCCc1noc(-c2cccnc2N2CCC[NH2+]CC2)n1	ZINC000070457946	175940927	/nfs/dbraw/zinc/94/09/27/175940927.db2.gz	DHXUDBNGKPOLNC-UHFFFAOYSA-N	1	0	287.367	1.884	50	0		CDAARO
COCC[NH+]1CCC(c2nccn2[C@H](C)CO)CC1	ZINC000071497725	176191987	/nfs/dbraw/zinc/19/19/87/176191987.db2.gz	IOTKGXPRGVGMLR-GFCCVEGCSA-N	1	0	267.373	1.262	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(C(=O)c2cc(C3CC3)n[nH]2)CC1	ZINC000072147726	176325876	/nfs/dbraw/zinc/32/58/76/176325876.db2.gz	QRDOIOWRQSMEDB-GFCCVEGCSA-N	1	0	276.384	1.843	50	0		CDAARO
NC(=O)CC[N@@H+]1CCC[C@H](Nc2ccc(F)cc2)C1	ZINC000072163024	176330274	/nfs/dbraw/zinc/33/02/74/176330274.db2.gz	JBKYCQRUHWQNRM-ZDUSSCGKSA-N	1	0	265.332	1.577	50	0		CDAARO
Cc1noc(C)c1C[N@@H+]1CCC[C@@](O)(CO)CC1	ZINC000072166752	176331593	/nfs/dbraw/zinc/33/15/93/176331593.db2.gz	VVHJZVSIMAJSJK-ZDUSSCGKSA-N	1	0	254.330	1.001	50	0		CDAARO
Cc1n[nH]c(CCC(=O)N2CCC[C@@H]([NH+](C)C)CC2)c1C	ZINC000072173774	176333822	/nfs/dbraw/zinc/33/38/22/176333822.db2.gz	LYMUFHQRFWUWJM-CQSZACIVSA-N	1	0	292.427	1.902	50	0		CDAARO
CCCc1cnc(C)nc1N1C[C@@H]2CC[N@H+](C)[C@@H]2C1	ZINC000077456559	177270837	/nfs/dbraw/zinc/27/08/37/177270837.db2.gz	OIPJLCXGSAAHOB-UONOGXRCSA-N	1	0	260.385	1.878	50	0		CDAARO
CCC[NH+]1CCN(c2nn3nnnc3c3ccccc32)CC1	ZINC000021777493	273614505	/nfs/dbraw/zinc/61/45/05/273614505.db2.gz	XQOJJLADWWRRNW-UHFFFAOYSA-N	1	0	297.366	1.205	50	0		CDAARO
C[NH+]1CCC(Oc2ccccc2-n2cnnc2)CC1	ZINC000065386646	273870927	/nfs/dbraw/zinc/87/09/27/273870927.db2.gz	FBKBYPZSMIIVGD-UHFFFAOYSA-N	1	0	258.325	1.740	50	0		CDAARO
COc1ccc(-c2cc(F)cc3c2O[C@H](C[NH3+])C3)nn1	ZINC000299799133	274103730	/nfs/dbraw/zinc/10/37/30/274103730.db2.gz	VHRHVKPLCIIYGH-JTQLQIEISA-N	1	0	275.283	1.554	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@H](C)CC(=O)N1CCCCCC1	ZINC000096492702	276995963	/nfs/dbraw/zinc/99/59/63/276995963.db2.gz	GOISWYGXEHTHLM-CYBMUJFWSA-N	1	0	297.443	1.529	50	0		CDAARO
CC1(C)CCC[C@@H]([NH2+][C@H]2COC[C@H]2n2ccnn2)C1	ZINC000299745024	278228212	/nfs/dbraw/zinc/22/82/12/278228212.db2.gz	QUIGKMOUTDCXST-FRRDWIJNSA-N	1	0	264.373	1.776	50	0		CDAARO
CC1(C)Cc2nc(N3CCC(O)CC3)ncc2[C@@H]([NH3+])C1	ZINC000091305568	278398326	/nfs/dbraw/zinc/39/83/26/278398326.db2.gz	MFDXXQBPWWTBPD-LBPRGKRZSA-N	1	0	276.384	1.410	50	0		CDAARO
Cc1c[nH+]ccc1N1CCN(Cc2ncc[nH]2)CC1	ZINC000097743087	279027680	/nfs/dbraw/zinc/02/76/80/279027680.db2.gz	DQKKHYHOGNYOFQ-UHFFFAOYSA-N	1	0	257.341	1.435	50	0		CDAARO
Clc1nnc2c([C@H]3[NH2+]CCc4nc[nH]c43)c[nH]cc1-2	ZINC000065371947	279298121	/nfs/dbraw/zinc/29/81/21/279298121.db2.gz	WPGRMEQFHIVMEK-SNVBAGLBSA-N	1	0	274.715	1.570	50	0		CDAARO
C[C@H]1CCCN(C(=O)C2CCSCC2)[C@@H]1C[NH3+]	ZINC000299739872	279659776	/nfs/dbraw/zinc/65/97/76/279659776.db2.gz	SOXPZDJAUARDJX-CMPLNLGQSA-N	1	0	256.415	1.715	50	0		CDAARO
Cc1ccc(N2C(=O)C[C@@H]([NH+]3CCCC3)C2=O)cc1	ZINC000005112708	280859271	/nfs/dbraw/zinc/85/92/71/280859271.db2.gz	QXHGQUSYOJLVCB-CYBMUJFWSA-N	1	0	258.321	1.723	50	0		CDAARO
Nc1cc(C[N@@H+]2CC3(CCOCC3)CC[C@H]2CO)ccn1	ZINC000528643961	281264938	/nfs/dbraw/zinc/26/49/38/281264938.db2.gz	IHTQNOKPNKBUCF-AWEZNQCLSA-N	1	0	291.395	1.248	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1ccc(N2CCCC2)nc1	ZINC000124724562	288319216	/nfs/dbraw/zinc/31/92/16/288319216.db2.gz	DORJCEMBFZVSNF-GFCCVEGCSA-N	1	0	274.368	1.116	50	0		CDAARO
C[C@H](C(=O)NC(=O)NC1CC1)[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000027356612	289332436	/nfs/dbraw/zinc/33/24/36/289332436.db2.gz	YKSYXOUHZNRPLC-FRRDWIJNSA-N	1	0	293.411	1.875	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C\C(=O)N1CC[N@@H+](C)C[C@H]1C	ZINC000254557017	289345341	/nfs/dbraw/zinc/34/53/41/289345341.db2.gz	AWTWCPHJYBPIHE-WWQCOOJYSA-N	1	0	296.802	1.558	50	0		CDAARO
C[C@H]1CN(C(=O)/C=C\c2ccc(-n3ccnc3)cc2)CC[NH2+]1	ZINC000254956025	289346725	/nfs/dbraw/zinc/34/67/25/289346725.db2.gz	ZMZFMPKMHBFPGQ-ZBKLQPJUSA-N	1	0	296.374	1.706	50	0		CDAARO
COc1cc([C@H](C)[NH2+][C@@H]2CCCN(C)C2=O)ccn1	ZINC000558149283	290381719	/nfs/dbraw/zinc/38/17/19/290381719.db2.gz	WDUHOCTWJYPJQA-CMPLNLGQSA-N	1	0	263.341	1.362	50	0		CDAARO
Nc1cc[nH+]cc1C(=O)N1CCO[C@@H]2CCCC[C@@H]21	ZINC000127555125	295365558	/nfs/dbraw/zinc/36/55/58/295365558.db2.gz	SXXKBZWDRFXKDD-QWHCGFSZSA-N	1	0	261.325	1.447	50	0		CDAARO
C[C@H]1CN(C)c2ccccc2N(C(=O)[C@H]2C[NH2+]CCO2)C1	ZINC000187452751	300230053	/nfs/dbraw/zinc/23/00/53/300230053.db2.gz	SYCKUWLRKNRUSW-SWLSCSKDSA-N	1	0	289.379	1.094	50	0		CDAARO
Clc1cnn(CC[N@@H+]2CCc3nc[nH]c3C2)c1	ZINC000252510279	328105943	/nfs/dbraw/zinc/10/59/43/328105943.db2.gz	ZGBBNGVPJCGPPT-UHFFFAOYSA-N	1	0	251.721	1.318	50	0		CDAARO
CC(C)[C@H](CNC(=O)c1ccc(F)c(O)c1)[NH+](C)C	ZINC000534637909	328334670	/nfs/dbraw/zinc/33/46/70/328334670.db2.gz	XLCXVNIWXRBVDI-LBPRGKRZSA-N	1	0	268.332	1.847	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CCN2CCC(CO)CC2)n1	ZINC000534656851	328340730	/nfs/dbraw/zinc/34/07/30/328340730.db2.gz	IDIHESPLDHINHH-AWEZNQCLSA-N	1	0	294.443	1.182	50	0		CDAARO
Cc1ncc(Cl)c(C(=O)N2C[C@H](C)[C@H]([NH+](C)C)C2)n1	ZINC000084290497	323207301	/nfs/dbraw/zinc/20/73/01/323207301.db2.gz	VSTPFKOBNNCBHT-GZMMTYOYSA-N	1	0	282.775	1.461	50	0		CDAARO
C[C@H]([NH2+][C@@H](C)C1CCOCC1)C(=O)NC[C@H]1CCCO1	ZINC000252486256	323575232	/nfs/dbraw/zinc/57/52/32/323575232.db2.gz	HDPGLGYLVYQNEE-SGMGOOAPSA-N	1	0	284.400	1.075	50	0		CDAARO
CCCC[NH+]1CCC(CNc2nnc(CN)o2)CC1	ZINC001772709342	1159443688	/nfs/dbraw/zinc/44/36/88/1159443688.db2.gz	FVVORXBHIOSSDH-UHFFFAOYSA-N	1	0	267.377	1.452	50	0		CDAARO
[NH3+]Cc1ccc(CS(=O)(=O)N2CCCCC2)cc1	ZINC000020022290	1159594959	/nfs/dbraw/zinc/59/49/59/1159594959.db2.gz	OYXKNMUWTZQUCG-UHFFFAOYSA-N	1	0	268.382	1.461	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](C(=O)N2CCOc3ccccc3C2)C1	ZINC000091543758	482570539	/nfs/dbraw/zinc/57/05/39/482570539.db2.gz	VNARBPZONBSUDR-DGCLKSJQSA-N	1	0	260.337	1.535	50	0		CDAARO
OC[C@H]([NH2+]C1CCN([C@@H]2CCOC2)CC1)c1ccsc1	ZINC000585091224	482825612	/nfs/dbraw/zinc/82/56/12/482825612.db2.gz	NUZLOAZZZJXJEW-CABCVRRESA-N	1	0	296.436	1.624	50	0		CDAARO
Cc1nn(CCO)c(C)c1C[N@@H+]1CC[C@H](O)CC(C)(C)C1	ZINC000670441044	482985555	/nfs/dbraw/zinc/98/55/55/482985555.db2.gz	PDFYIXHOFVHSBW-AWEZNQCLSA-N	1	0	295.427	1.475	50	0		CDAARO
CC[N@@H+]1CC[C@H](CN(C)Cc2c(C)nn(CCO)c2C)C1	ZINC000670446520	482998168	/nfs/dbraw/zinc/99/81/68/482998168.db2.gz	ZOUORGPCVSBCPM-OAHLLOKOSA-N	1	0	294.443	1.266	50	0		CDAARO
CSCCC(=O)N1C[C@H]2CCC[C@@H](C1)[N@H+](C)C2	ZINC000670447700	483001349	/nfs/dbraw/zinc/00/13/49/483001349.db2.gz	JQLBMIKCTFJAJC-RYUDHWBXSA-N	1	0	256.415	1.682	50	0		CDAARO
Cc1nncn1CC[N@@H+]1CC[C@H](O)CC(C)(C)C1	ZINC000670456072	483032407	/nfs/dbraw/zinc/03/24/07/483032407.db2.gz	XHTKIKMAESTZCX-LBPRGKRZSA-N	1	0	252.362	1.069	50	0		CDAARO
Cc1cccc(OC2C[NH+]([C@@H]3CCNC(=O)CC3)C2)c1	ZINC000670457670	483036827	/nfs/dbraw/zinc/03/68/27/483036827.db2.gz	IBDSIDYDWLXVMT-ZDUSSCGKSA-N	1	0	274.364	1.727	50	0		CDAARO
O=C(N[C@H]1CC[N@H+](CC2CC2)C1)N1CC[C@@]2(CCOC2)C1	ZINC000674924368	483189049	/nfs/dbraw/zinc/18/90/49/483189049.db2.gz	FOSYVWHOJMLFFT-GOEBONIOSA-N	1	0	293.411	1.293	50	0		CDAARO
CCC[C@@]1(C)NC(=O)N(CC[C@H]2CCCC[N@@H+]2C)C1=O	ZINC000084740531	483322389	/nfs/dbraw/zinc/32/23/89/483322389.db2.gz	OPOXHXKECXOTKQ-IUODEOHRSA-N	1	0	281.400	1.971	50	0		CDAARO
Cc1cnccc1CNC(=O)CSCC[NH+]1CCCC1	ZINC000223683905	526230857	/nfs/dbraw/zinc/23/08/57/526230857.db2.gz	UWEXTQYCDBCRKS-UHFFFAOYSA-N	1	0	293.436	1.835	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N[C@@H]1CC[NH2+]C[C@@H]1C	ZINC000262811707	535975095	/nfs/dbraw/zinc/97/50/95/535975095.db2.gz	YFUYOUUCPCWPGO-WCQYABFASA-N	1	0	282.409	1.525	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]Cc1cccc(Cn2cncn2)c1	ZINC000097159310	567905018	/nfs/dbraw/zinc/90/50/18/567905018.db2.gz	GLRRRCDEMQXGNS-UHFFFAOYSA-N	1	0	282.351	1.648	50	0		CDAARO
CCCO[C@H]1CCCN(C(=O)CN2CCC[N@H+](C)CC2)C1	ZINC000952963246	614951799	/nfs/dbraw/zinc/95/17/99/614951799.db2.gz	GOVHRNBCMSAVMI-HNNXBMFYSA-N	1	0	297.443	1.042	50	0		CDAARO
C[C@@H]([NH3+])CONC(=O)c1ccc(Br)s1	ZINC000888094363	617754210	/nfs/dbraw/zinc/75/42/10/617754210.db2.gz	LZQUVFQQZKCSPK-RXMQYKEDSA-N	1	0	279.159	1.519	50	0		CDAARO
CC(C)[C@@H](O)C[N@@H+]1CC[C@@](CO)(c2cccc(F)c2)C1	ZINC000888101429	617766868	/nfs/dbraw/zinc/76/68/68/617766868.db2.gz	VJJSBVPODGPLCP-JKSUJKDBSA-N	1	0	281.371	1.778	50	0		CDAARO
COc1ccnc(C[N@H+]2C[C@@H](Cc3ccncc3)[C@H](O)C2)c1	ZINC001704338009	1177693139	/nfs/dbraw/zinc/69/31/39/1177693139.db2.gz	KAJIAPVXHQGISS-RHSMWYFYSA-N	1	0	299.374	1.521	50	0		CDAARO
CCCO[C@H]1CCC[N@H+](CCn2c(=O)cc(C)[nH]c2=O)C1	ZINC001704356255	1177701172	/nfs/dbraw/zinc/70/11/72/1177701172.db2.gz	FRBRMXDDOPJZBM-ZDUSSCGKSA-N	1	0	295.383	1.148	50	0		CDAARO
Cc1cc(C(=O)N2CC([N@H+]3CCCC[C@@H]3C)C2)nc(C)n1	ZINC000952989553	711907797	/nfs/dbraw/zinc/90/77/97/711907797.db2.gz	QZDONZAMNOKSRZ-LBPRGKRZSA-N	1	0	288.395	1.792	50	0		CDAARO
COc1ccc2c(c1)ncn([C@H]1CCC[NH2+]C1)c2=O	ZINC000258073520	712315585	/nfs/dbraw/zinc/31/55/85/712315585.db2.gz	FJZJVJRPTVKISD-JTQLQIEISA-N	1	0	259.309	1.330	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)N[C@H](CO)Cc1ccccc1	ZINC000065492389	1164489463	/nfs/dbraw/zinc/48/94/63/1164489463.db2.gz	NBOYMZFTHHVRPZ-INIZCTEOSA-N	1	0	290.407	1.582	50	0		CDAARO
Cc1nc[nH]c1CNC(=O)[C@@H](C)[NH+]1CCCCC1	ZINC000426424206	902562907	/nfs/dbraw/zinc/56/29/07/902562907.db2.gz	GJWOETOZVPYHCX-LLVKDONJSA-N	1	0	250.346	1.209	50	0		CDAARO
C[C@@H](O)c1ncc(CNc2cnn(CC[NH+](C)C)c2)s1	ZINC000809613940	909374536	/nfs/dbraw/zinc/37/45/36/909374536.db2.gz	DDNNMWZYPNFKLD-SNVBAGLBSA-N	1	0	295.412	1.567	50	0		CDAARO
CCc1nc(CNC(=O)[C@H]2CC(=O)N(CC(C)C)C2)c[nH]1	ZINC000952884366	910459719	/nfs/dbraw/zinc/45/97/19/910459719.db2.gz	ZCGILZQUPPEGOE-NSHDSACASA-N	1	0	292.383	1.093	50	0		CDAARO
C[C@@H](CC(N)=O)[N@H+](C)Cc1ccnn1-c1ccccc1	ZINC000952971196	910512742	/nfs/dbraw/zinc/51/27/42/910512742.db2.gz	FWQHJFLCAIPDAN-LBPRGKRZSA-N	1	0	272.352	1.568	50	0		CDAARO
Cc1nccn1CC[C@H](C)[NH2+]Cc1nncn1C(C)C	ZINC000821182131	925567283	/nfs/dbraw/zinc/56/72/83/925567283.db2.gz	YTDMRVFJRIUCDR-LBPRGKRZSA-N	1	0	276.388	1.932	50	0		CDAARO
CN(Cc1ncon1)C1CC[NH+](Cc2ccco2)CC1	ZINC000823664808	925719711	/nfs/dbraw/zinc/71/97/11/925719711.db2.gz	XUPYEIZQXRMNSI-UHFFFAOYSA-N	1	0	276.340	1.759	50	0		CDAARO
C[C@H]1CN(C(=O)CCC[NH+]2CCCC2)CCN1C	ZINC000823795803	925732919	/nfs/dbraw/zinc/73/29/19/925732919.db2.gz	WMZFMNRDVLKEMA-ZDUSSCGKSA-N	1	0	253.390	1.025	50	0		CDAARO
CCn1nc(-c2c[nH]c3ccccc23)nc1CC[NH3+]	ZINC000827421785	925940670	/nfs/dbraw/zinc/94/06/70/925940670.db2.gz	ZUCYIHFQNYOHTK-UHFFFAOYSA-N	1	0	255.325	1.948	50	0		CDAARO
Cc1ccc(C(=O)NCCNc2cc[nH+]cc2C)cc1O	ZINC000828152599	926057251	/nfs/dbraw/zinc/05/72/51/926057251.db2.gz	YVAMFGWLGKLJDO-UHFFFAOYSA-N	1	0	285.347	1.668	50	0		CDAARO
O=C(NCC[N@H+]1CCCC[C@H]1CO)c1ccc(F)c(O)c1	ZINC000828710772	926169685	/nfs/dbraw/zinc/16/96/85/926169685.db2.gz	CMGDBIBOXHCTSX-LBPRGKRZSA-N	1	0	296.342	1.108	50	0		CDAARO
CC(C)CCc1nc([C@@H]([NH3+])CO)n(Cc2ccccc2)n1	ZINC000828784121	926181879	/nfs/dbraw/zinc/18/18/79/926181879.db2.gz	XVNUHWDAXSJBSY-AWEZNQCLSA-N	1	0	288.395	1.907	50	0		CDAARO
CCc1cnc(C)nc1NC[C@H]1CCC[N@H+](CCO)C1	ZINC000828760365	926186061	/nfs/dbraw/zinc/18/60/61/926186061.db2.gz	AKTFENLGPSUBHI-CYBMUJFWSA-N	1	0	278.400	1.464	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)CCC2CCCC2)CC[C@@H]1CO	ZINC000581798508	927199005	/nfs/dbraw/zinc/19/90/05/927199005.db2.gz	OMNALJYVPFKBEY-HUUCEWRRSA-N	1	0	282.428	1.728	50	0		CDAARO
COC[C@@H]1[C@H](C(=O)NCc2ccccc2)CCC[N@@H+]1C	ZINC000581813232	927203443	/nfs/dbraw/zinc/20/34/43/927203443.db2.gz	NDAKTVOAFHBLRS-HUUCEWRRSA-N	1	0	276.380	1.660	50	0		CDAARO
O=C(NCCCCO)[C@@H]1CC[N@H+](Cc2ccc(F)cc2)C1	ZINC000585091086	930927357	/nfs/dbraw/zinc/92/73/57/930927357.db2.gz	VQMOEXTVDCRTDG-CQSZACIVSA-N	1	0	294.370	1.536	50	0		CDAARO
CC[N@H+](C[C@H](O)CO)[C@@H](C)c1cccc(OC)c1	ZINC000585116910	930969730	/nfs/dbraw/zinc/96/97/30/930969730.db2.gz	MEPKPWALRDHPQQ-AAEUAGOBSA-N	1	0	253.342	1.431	50	0		CDAARO
C=CC(=O)N1CCO[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]21	ZINC000404184079	940956411	/nfs/dbraw/zinc/95/64/11/940956411.db2.gz	ACFWICWWQPPDNO-JKSUJKDBSA-N	1	0	286.375	1.674	50	0		CDAARO
CNC(=O)c1cccnc1NC[C@@H]1CCCC[N@@H+]1C	ZINC001529142441	968993535	/nfs/dbraw/zinc/99/35/35/968993535.db2.gz	OFRWZXZVVAFHHS-NSHDSACASA-N	1	0	262.357	1.337	50	0		CDAARO
COCCC1CC[NH+](CCc2nccn2C)CC1	ZINC001529172504	969002627	/nfs/dbraw/zinc/00/26/27/969002627.db2.gz	NELVILGSLAPMMW-UHFFFAOYSA-N	1	0	251.374	1.711	50	0		CDAARO
C[N@H+](CC1(C)COC1)[C@@H]1CCC(=O)N(CC2CC2)CC1	ZINC001506398337	975147751	/nfs/dbraw/zinc/14/77/51/975147751.db2.gz	YQOBMVBBVHEGFG-CQSZACIVSA-N	1	0	280.412	1.746	50	0		CDAARO
CCn1cnnc1CC[NH2+][C@@H](C)Cn1nc(C)cc1C	ZINC001506398958	975149231	/nfs/dbraw/zinc/14/92/31/975149231.db2.gz	IHGBAJDGVLMWOB-LBPRGKRZSA-N	1	0	276.388	1.332	50	0		CDAARO
CCc1ncnc(NC[C@H]2CCC[N@H+](CCOC)C2)c1F	ZINC001506405596	975151787	/nfs/dbraw/zinc/15/17/87/975151787.db2.gz	VQAOMWWDBXEWBJ-GFCCVEGCSA-N	1	0	296.390	1.948	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]CCCn1ccnc1	ZINC001506413756	975154136	/nfs/dbraw/zinc/15/41/36/975154136.db2.gz	KKWRHICEODDXPV-CYBMUJFWSA-N	1	0	261.373	1.710	50	0		CDAARO
CC(=O)NC(C)(C)C[C@H](C)[NH2+]Cc1cnc(C)cn1	ZINC001506425032	975159621	/nfs/dbraw/zinc/15/96/21/975159621.db2.gz	BTNZUXZHGOVJLD-JTQLQIEISA-N	1	0	264.373	1.568	50	0		CDAARO
CC[NH+](CC)CCCN1C(=O)N[C@H](C(C)C)C1=O	ZINC000008475411	342455305	/nfs/dbraw/zinc/45/53/05/342455305.db2.gz	NEVMEDXZZOWLCL-LLVKDONJSA-N	1	0	255.362	1.295	50	0		CDAARO
Cc1cc([C@@H](C)[NH2+]CCCNS(C)(=O)=O)c(C)s1	ZINC000096476471	230379828	/nfs/dbraw/zinc/37/98/28/230379828.db2.gz	IYOXIIIWHIMYGK-SNVBAGLBSA-N	1	0	290.454	1.955	50	0		CDAARO
COc1ccc(CC(=O)N2CC[NH2+]C[C@H]2C)cc1F	ZINC000124418001	187136828	/nfs/dbraw/zinc/13/68/28/187136828.db2.gz	BKWQZNDSKBYRND-SNVBAGLBSA-N	1	0	266.316	1.197	50	0		CDAARO
Cc1cc(C[NH2+][C@H](C)CS(C)(=O)=O)cnc1C	ZINC000584903857	341994038	/nfs/dbraw/zinc/99/40/38/341994038.db2.gz	MCFABEOCCZNMLV-SNVBAGLBSA-N	1	0	256.371	1.221	50	0		CDAARO
CCCS(=O)(=O)NC[C@@H](C)[NH2+]Cc1cnc(C)c(C)c1	ZINC000584903966	341994137	/nfs/dbraw/zinc/99/41/37/341994137.db2.gz	WZIYRIAQQAUESA-GFCCVEGCSA-N	1	0	299.440	1.506	50	0		CDAARO
COC(=O)C1(C[NH2+]Cc2ccnn2C)CCCCC1	ZINC000097373157	342002673	/nfs/dbraw/zinc/00/26/73/342002673.db2.gz	JOQPRELGVBJKAY-UHFFFAOYSA-N	1	0	265.357	1.633	50	0		CDAARO
Cc1cc([C@H](C)[NH2+]CCN(C)S(C)(=O)=O)c(C)s1	ZINC000097373649	342002704	/nfs/dbraw/zinc/00/27/04/342002704.db2.gz	GCJKEMAYAXTRAW-JTQLQIEISA-N	1	0	290.454	1.907	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1cncc(OCCO)n1	ZINC000095941842	185036713	/nfs/dbraw/zinc/03/67/13/185036713.db2.gz	ZXCNEROZZQRXKG-LBPRGKRZSA-N	1	0	280.372	1.134	50	0		CDAARO
CCCn1ccnc1CNC(=O)c1ccc(CC[NH3+])cc1	ZINC000395417521	342089935	/nfs/dbraw/zinc/08/99/35/342089935.db2.gz	XWSPMEDMHJSDCZ-UHFFFAOYSA-N	1	0	286.379	1.724	50	0		CDAARO
Cc1nsc(C(=O)NCCCC[NH+]2CCCC2)n1	ZINC000096098503	185097030	/nfs/dbraw/zinc/09/70/30/185097030.db2.gz	JSOIBHRWAVQVJS-UHFFFAOYSA-N	1	0	268.386	1.452	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CNC(=O)Nc2cncc(F)c2)C1	ZINC000096140242	185105831	/nfs/dbraw/zinc/10/58/31/185105831.db2.gz	XDKXQRSDCUBFOA-LLVKDONJSA-N	1	0	296.346	1.311	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)C1CCC(C)(C)CC1	ZINC000195554059	342625781	/nfs/dbraw/zinc/62/57/81/342625781.db2.gz	PSOYFMXWNFSRPQ-NEPJUHHUSA-N	1	0	254.374	1.306	50	0		CDAARO
COc1cc(CCNC(=O)[C@]2(C)CCC[NH2+]C2)ccc1F	ZINC000195555082	342626218	/nfs/dbraw/zinc/62/62/18/342626218.db2.gz	QFGOYTSMAAZEES-MRXNPFEDSA-N	1	0	294.370	1.883	50	0		CDAARO
CO[C@H]1CCN(C(=O)COC2CCCCC2)[C@@H](C[NH3+])C1	ZINC000195557587	342626820	/nfs/dbraw/zinc/62/68/20/342626820.db2.gz	PWGRXQNIWJDVPK-OCCSQVGLSA-N	1	0	284.400	1.300	50	0		CDAARO
OCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H](O)COCc1cccs1	ZINC000252519094	361850196	/nfs/dbraw/zinc/85/01/96/361850196.db2.gz	AXKQRLCTBDAOBJ-GZBFAFLISA-N	1	0	299.436	1.766	50	0		CDAARO
CCn1ccc(CN2CC([N@@H+]3CCCC[C@H]3C)C2)n1	ZINC000244652078	361855040	/nfs/dbraw/zinc/85/50/40/361855040.db2.gz	GZKAUEOOJPYJLU-CYBMUJFWSA-N	1	0	262.401	1.962	50	0		CDAARO
O=C(N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(C2CC2)on1	ZINC000252527966	361858386	/nfs/dbraw/zinc/85/83/86/361858386.db2.gz	DVQNAUDUYWZIEJ-NWDGAFQWSA-N	1	0	275.352	1.909	50	0		CDAARO
CCNC(=O)NC(=O)[C@@H](C)[NH+](CC(C)C)CC(C)C	ZINC000096969035	185143169	/nfs/dbraw/zinc/14/31/69/185143169.db2.gz	XOFHDVBCKQDOSJ-GFCCVEGCSA-N	1	0	271.405	1.835	50	0		CDAARO
CC[C@H](O)C[NH+]1CCC(Nc2ncc(Cl)cn2)CC1	ZINC000097033932	185156496	/nfs/dbraw/zinc/15/64/96/185156496.db2.gz	UUSRIFKHMSPRMV-LBPRGKRZSA-N	1	0	284.791	1.777	50	0		CDAARO
CC(C)(C[N@@H+]1CC[C@H](C(N)=O)C1)Oc1ccccc1	ZINC000585116605	362045101	/nfs/dbraw/zinc/04/51/01/362045101.db2.gz	CLEPCMPVHBCKFT-LBPRGKRZSA-N	1	0	262.353	1.651	50	0		CDAARO
Cc1c(CNC(=O)C23CCC[NH+](CCC2)C3)cnn1C	ZINC000585131855	362056924	/nfs/dbraw/zinc/05/69/24/362056924.db2.gz	IBHWOXWZJRSSFZ-UHFFFAOYSA-N	1	0	276.384	1.221	50	0		CDAARO
CNC(=O)CC1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1	ZINC000089907623	342394293	/nfs/dbraw/zinc/39/42/93/342394293.db2.gz	CFGNGTQDDKPSCG-CHWSQXEVSA-N	1	0	254.374	1.138	50	0		CDAARO
O=C(COC1CC[NH2+]CC1)N[C@H]1C[C@H]1c1ccccc1	ZINC000111797103	365755080	/nfs/dbraw/zinc/75/50/80/365755080.db2.gz	ZJLRJVUUOZSKCQ-GJZGRUSLSA-N	1	0	274.364	1.427	50	0		CDAARO
CO[C@H](C)c1nc(C)c(C(=O)N(C)[C@@H]2CC[NH2+]C2)s1	ZINC000179095172	362253812	/nfs/dbraw/zinc/25/38/12/362253812.db2.gz	DEXPCHCGWXVCFY-NXEZZACHSA-N	1	0	283.397	1.593	50	0		CDAARO
COC(=O)[C@H](c1cccnc1)N1CC[NH+](CC(C)C)CC1	ZINC000084544272	362266503	/nfs/dbraw/zinc/26/65/03/362266503.db2.gz	DBYVPVFKTSCNQO-HNNXBMFYSA-N	1	0	291.395	1.569	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C1(C(=O)NCC2CC2)CCCC1	ZINC000185717227	344270236	/nfs/dbraw/zinc/27/02/36/344270236.db2.gz	KOHPFPRGYYTMDI-UHFFFAOYSA-N	1	0	276.384	1.647	50	0		CDAARO
CC(C)C[N@H+](CCn1cncn1)Cc1cnn(C)c1	ZINC000252499234	362388601	/nfs/dbraw/zinc/38/86/01/362388601.db2.gz	RXOYBGHKDMXWPY-UHFFFAOYSA-N	1	0	262.361	1.170	50	0		CDAARO
Cc1ccc2[nH]c(CN3CC[C@@H]([NH3+])C3)cc(=O)c2c1	ZINC000253537073	362435664	/nfs/dbraw/zinc/43/56/64/362435664.db2.gz	WLZZFAOODZBALR-LLVKDONJSA-N	1	0	257.337	1.782	50	0		CDAARO
[NH3+]C[C@H]1CCN(Cc2cc(=O)c3cc(F)ccc3[nH]2)C1	ZINC000253537315	362437078	/nfs/dbraw/zinc/43/70/78/362437078.db2.gz	LXVFUDHAUXOMKH-SNVBAGLBSA-N	1	0	275.327	1.860	50	0		CDAARO
C[C@H](CS(C)(=O)=O)[NH2+]Cc1ccc2[nH]cnc2c1	ZINC000603517068	344816094	/nfs/dbraw/zinc/81/60/94/344816094.db2.gz	QVIDJGASSNCMPC-SECBINFHSA-N	1	0	267.354	1.086	50	0		CDAARO
Cc1cc(C[N@@H+](C)CC(C)(C)CN2CCOCC2)ncn1	ZINC000293267029	362551182	/nfs/dbraw/zinc/55/11/82/362551182.db2.gz	SIFSGDRQVVNJNF-UHFFFAOYSA-N	1	0	292.427	1.575	50	0		CDAARO
OCC1(C[NH2+]C2CCN(c3nccs3)CC2)CC1	ZINC000097081068	185523215	/nfs/dbraw/zinc/52/32/15/185523215.db2.gz	PAZRRMCTAPKUNC-UHFFFAOYSA-N	1	0	267.398	1.474	50	0		CDAARO
Cc1cnn([C@H](C)CNC(=O)Cn2ccnc2C)c1	ZINC000534661252	345510492	/nfs/dbraw/zinc/51/04/92/345510492.db2.gz	OHAOQGBKNUBYMB-LLVKDONJSA-N	1	0	261.329	1.074	50	0		CDAARO
C[C@@H](NC(=O)N1CCC[C@@H](CO)C1)C(C)(C)C[NH+](C)C	ZINC000085424021	179059645	/nfs/dbraw/zinc/05/96/45/179059645.db2.gz	UOXYRYRHJIZLRN-CHWSQXEVSA-N	1	0	285.432	1.377	50	0		CDAARO
CCC[C@@H](C)[NH+]1CCN(Cc2nc(COC)no2)CC1	ZINC000192839200	362713701	/nfs/dbraw/zinc/71/37/01/362713701.db2.gz	UNUULERUYANHEA-GFCCVEGCSA-N	1	0	282.388	1.522	50	0		CDAARO
CN(CC[NH+]1CCN(c2cnn(C)c2)CC1)c1ccccc1	ZINC000085824254	179183727	/nfs/dbraw/zinc/18/37/27/179183727.db2.gz	PLUIKZMGYFHDFE-UHFFFAOYSA-N	1	0	299.422	1.679	50	0		CDAARO
CC(C)NS(=O)(=O)CC[NH2+][C@@H]1CC(C)(C)C[C@H]1C	ZINC000193131050	362830126	/nfs/dbraw/zinc/83/01/26/362830126.db2.gz	UJNUMLWWYNECJS-VXGBXAGGSA-N	1	0	276.446	1.729	50	0		CDAARO
Cc1cnc(CN2CC[NH2+]C[C@@H]2c2ccccc2)cn1	ZINC000086177743	179246793	/nfs/dbraw/zinc/24/67/93/179246793.db2.gz	SCJHXVQPKRXPJR-MRXNPFEDSA-N	1	0	268.364	1.932	50	0		CDAARO
C[NH2+]CCN1CCN(c2cccc(Cl)c2)C1=O	ZINC000215103514	348744655	/nfs/dbraw/zinc/74/46/55/348744655.db2.gz	OVQHLJDCYLEUEZ-UHFFFAOYSA-N	1	0	253.733	1.801	50	0		CDAARO
O=C(NCC1CCOCC1)[C@H]1Cc2ccccc2C[NH2+]1	ZINC000111174283	349221950	/nfs/dbraw/zinc/22/19/50/349221950.db2.gz	CZAMLULGKGXBNU-OAHLLOKOSA-N	1	0	274.364	1.244	50	0		CDAARO
CCOc1ccc(C[N@H+](C)C[C@H]2CCOC2)cn1	ZINC000584887730	349346619	/nfs/dbraw/zinc/34/66/19/349346619.db2.gz	UJILXRUVEKLPFF-CYBMUJFWSA-N	1	0	250.342	1.949	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C(=O)Cc1cccnc1	ZINC000584891318	349350136	/nfs/dbraw/zinc/35/01/36/349350136.db2.gz	CROYVIFRUDSAJI-UHFFFAOYSA-N	1	0	275.396	1.957	50	0		CDAARO
O=C(C[C@H]1CCOC1)N1CC[NH+](CC2CCCC2)CC1	ZINC000584891570	349350424	/nfs/dbraw/zinc/35/04/24/349350424.db2.gz	ZPGKUAOVZPZFRM-OAHLLOKOSA-N	1	0	280.412	1.747	50	0		CDAARO
C[C@@H](CCC(=O)N1CCc2nocc2C1)[NH+]1CCOCC1	ZINC000584894099	349354450	/nfs/dbraw/zinc/35/44/50/349354450.db2.gz	IXAHWMOZKKMLNI-LBPRGKRZSA-N	1	0	293.367	1.060	50	0		CDAARO
CCOCC(=O)NC1(C[NH+]2CCCC2)CCCCC1	ZINC000584897274	349359214	/nfs/dbraw/zinc/35/92/14/349359214.db2.gz	BEJBICSHKRQZNJ-UHFFFAOYSA-N	1	0	268.401	1.938	50	0		CDAARO
C[C@@H]1CC[C@H](C)N(C(=O)c2csc(CC[NH3+])n2)C1	ZINC000090957670	180075137	/nfs/dbraw/zinc/07/51/37/180075137.db2.gz	YAKONPXDDHMXPC-ZJUUUORDSA-N	1	0	267.398	1.905	50	0		CDAARO
COc1ccccc1OCC(=O)N1C[C@H]([NH3+])[C@@H](C2CC2)C1	ZINC000091486904	180167974	/nfs/dbraw/zinc/16/79/74/180167974.db2.gz	HRJDNHAIFXNJAN-OLZOCXBDSA-N	1	0	290.363	1.270	50	0		CDAARO
CCCOC[C@@H]1CCN(c2cc(C)[nH+]c(N)n2)C1	ZINC000091551263	180188739	/nfs/dbraw/zinc/18/87/39/180188739.db2.gz	MOTWRVDLUMCZJA-LLVKDONJSA-N	1	0	250.346	1.620	50	0		CDAARO
COCC[N@@H+]1C[C@H]2CC[C@@H]1CN(Cc1scnc1C)C2	ZINC000091695326	180228971	/nfs/dbraw/zinc/22/89/71/180228971.db2.gz	VGVINJJQUPVPQH-UONOGXRCSA-N	1	0	295.452	1.994	50	0		CDAARO
Cc1cc(C(=O)N2C[C@H](CO)[C@H](C[NH+](C)C)C2)cs1	ZINC000091906821	180283899	/nfs/dbraw/zinc/28/38/99/180283899.db2.gz	DRXXPYHMQYYSCP-CHWSQXEVSA-N	1	0	282.409	1.299	50	0		CDAARO
Cc1cc(NCCc2nc3c(c(C)n2)CCC3)nc(N)[nH+]1	ZINC000092062206	180315706	/nfs/dbraw/zinc/31/57/06/180315706.db2.gz	UTLJIWSAXVEPGE-UHFFFAOYSA-N	1	0	284.367	1.609	50	0		CDAARO
COCCC[C@]1(CO)CCC[N@H+](Cc2cncnc2)C1	ZINC000091997286	180303285	/nfs/dbraw/zinc/30/32/85/180303285.db2.gz	MFKINGQAKQCGHD-OAHLLOKOSA-N	1	0	279.384	1.478	50	0		CDAARO
CCCC[C@H]([NH2+][C@@H](C)[C@H](C)n1cccn1)C(N)=O	ZINC000106790405	186135447	/nfs/dbraw/zinc/13/54/47/186135447.db2.gz	CKMWRMFYBLTZPM-SRVKXCTJSA-N	1	0	252.362	1.466	50	0		CDAARO
CCCc1ccccc1NC(=O)C[NH2+]CCOC	ZINC000092495387	180396936	/nfs/dbraw/zinc/39/69/36/180396936.db2.gz	KVWKPLXBDIBWOF-UHFFFAOYSA-N	1	0	250.342	1.814	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCC[C@H]2CC[NH2+]C2)cc1C	ZINC000110797083	186325834	/nfs/dbraw/zinc/32/58/34/186325834.db2.gz	SFEDNLCLIYAKMK-CYBMUJFWSA-N	1	0	282.409	1.581	50	0		CDAARO
COC(=O)[C@]1(C[NH3+])C[C@@]12CCN(C(=O)OC(C)(C)C)C2	ZINC000260106111	351202385	/nfs/dbraw/zinc/20/23/85/351202385.db2.gz	GXIZSJFUUBKNJU-ZIAGYGMSSA-N	1	0	284.356	1.135	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CN(C(=O)c2ccc(F)cc2Cl)CCO1	ZINC000122886406	187057665	/nfs/dbraw/zinc/05/76/65/187057665.db2.gz	CCYDMVGBYIUFGG-QPUJVOFHSA-N	1	0	286.734	1.667	50	0		CDAARO
CCO[C@@H]1C[C@@H]([N@H+](C)CC(=O)NC[C@H]2CCCO2)C1(C)C	ZINC000247312235	358474050	/nfs/dbraw/zinc/47/40/50/358474050.db2.gz	WBPCDOZWOBPXHX-MGPQQGTHSA-N	1	0	298.427	1.417	50	0		CDAARO
CC[NH2+]Cc1c(C)nn(-c2ccccc2)c1-n1cncn1	ZINC000034825225	355911599	/nfs/dbraw/zinc/91/15/99/355911599.db2.gz	LTCQSMKBFAAKIW-UHFFFAOYSA-N	1	0	282.351	1.871	50	0		CDAARO
[NH3+][C@H](CO)CCCCNC(=O)OCc1ccccc1	ZINC000002567347	355975112	/nfs/dbraw/zinc/97/51/12/355975112.db2.gz	VCIWOXCDTQASKH-ZDUSSCGKSA-N	1	0	266.341	1.403	50	0		CDAARO
CC[NH2+]CC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000003284900	355998153	/nfs/dbraw/zinc/99/81/53/355998153.db2.gz	YACYERLLOAKNEZ-UHFFFAOYSA-N	1	0	263.341	1.071	50	0		CDAARO
C[C@H]([NH2+][C@@H]1CCN(c2ccccc2)C1=O)[C@H]1CCCO1	ZINC000097373179	356093734	/nfs/dbraw/zinc/09/37/34/356093734.db2.gz	IDYYTJXAGAFCHE-NWANDNLSSA-N	1	0	274.364	1.949	50	0		CDAARO
COCC[NH2+]CC[C@H]1CCC(=O)N1CCc1cccs1	ZINC000012037874	356286583	/nfs/dbraw/zinc/28/65/83/356286583.db2.gz	AICMEHLJNZZTJL-CYBMUJFWSA-N	1	0	296.436	1.908	50	0		CDAARO
C[C@H]([NH2+]C1CCCC1)c1nc(N)nc(N(C)C)n1	ZINC000014184999	356378347	/nfs/dbraw/zinc/37/83/47/356378347.db2.gz	PAPPXJGNNHBQJW-QMMMGPOBSA-N	1	0	250.350	1.113	50	0		CDAARO
COc1ccc(-c2noc(CN(C)[C@@H]3CCOC3)n2)cc1	ZINC000015063864	356405203	/nfs/dbraw/zinc/40/52/03/356405203.db2.gz	APELBHHSYZIPIT-GFCCVEGCSA-N	1	0	289.335	1.966	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F)[C@H]1CC[NH2+]C1	ZINC000246901588	356434345	/nfs/dbraw/zinc/43/43/45/356434345.db2.gz	JSVRXNAALNFYKK-GMXVVIOVSA-N	1	0	280.318	1.889	50	0		CDAARO
CCc1ccc(OCC(=O)NC2CC[NH+](C)CC2)cc1	ZINC000016580017	356442006	/nfs/dbraw/zinc/44/20/06/356442006.db2.gz	IOCKMGJLVIYAJI-UHFFFAOYSA-N	1	0	276.380	1.838	50	0		CDAARO
CCOc1ccc(C[NH2+][C@@H]2CCS(=O)(=O)C2)cc1	ZINC000016807775	356447643	/nfs/dbraw/zinc/44/76/43/356447643.db2.gz	YPGBEPGWCKYQNL-GFCCVEGCSA-N	1	0	269.366	1.362	50	0		CDAARO
Cc1ccc(C[NH+]2CCN(CCOCCO)CC2)c(C)c1	ZINC000019606493	356493336	/nfs/dbraw/zinc/49/33/36/356493336.db2.gz	XDLNRMXIJLWUDE-UHFFFAOYSA-N	1	0	292.423	1.430	50	0		CDAARO
Cc1nonc1-c1nc(-c2c(C)ncc3c2CC[NH2+]C3)no1	ZINC000020119823	356526373	/nfs/dbraw/zinc/52/63/73/356526373.db2.gz	ZPRCAJLJJHIXCK-UHFFFAOYSA-N	1	0	298.306	1.444	50	0		CDAARO
C(C[NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCC2)CO[C@H]1CCOC1	ZINC000194077402	358506074	/nfs/dbraw/zinc/50/60/74/358506074.db2.gz	RFMRMUZNNZFYAS-GBJTYRQASA-N	1	0	281.396	1.729	50	0		CDAARO
COc1cc(OC)c(OC)cc1C[N@@H+]1CCC[C@H](CO)C1	ZINC000023114815	356628647	/nfs/dbraw/zinc/62/86/47/356628647.db2.gz	DGWARBXGZCGBBG-LBPRGKRZSA-N	1	0	295.379	1.917	50	0		CDAARO
C[C@H](C(N)=O)N1CCN([C@H](C)c2ccccc2Cl)CC1	ZINC000029686028	356741623	/nfs/dbraw/zinc/74/16/23/356741623.db2.gz	WYMYQGIADAEYED-VXGBXAGGSA-N	1	0	295.814	1.892	50	0		CDAARO
CCOC(=O)c1[nH]c2cnc(OC)cc2c1C[NH+](C)C	ZINC000030678211	356751996	/nfs/dbraw/zinc/75/19/96/356751996.db2.gz	PLIHMLFFBBBIQQ-UHFFFAOYSA-N	1	0	277.324	1.810	50	0		CDAARO
Cc1cccc(-c2ccc(N3CC[NH2+]CC3)nn2)c1	ZINC000032918546	356790290	/nfs/dbraw/zinc/79/02/90/356790290.db2.gz	KZWYGBMCLGTNCJ-UHFFFAOYSA-N	1	0	254.337	1.862	50	0		CDAARO
CC(C)(C)OC(=O)NCC([NH3+])CNC(=O)OC(C)(C)C	ZINC000034494183	356815691	/nfs/dbraw/zinc/81/56/91/356815691.db2.gz	QYVFEFFJTQKDTK-UHFFFAOYSA-N	1	0	289.376	1.363	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)NC1CC1)c1ccc2c(c1)OCO2	ZINC000036075821	356858793	/nfs/dbraw/zinc/85/87/93/356858793.db2.gz	QDNNWRHLWDTEGE-LBPRGKRZSA-N	1	0	291.351	1.480	50	0		CDAARO
Cc1cc(CN(C)C(=O)[C@H]([NH3+])c2ccccc2)no1	ZINC000036200372	356865335	/nfs/dbraw/zinc/86/53/35/356865335.db2.gz	QRJKTENJUDTKGU-CYBMUJFWSA-N	1	0	259.309	1.641	50	0		CDAARO
COCCn1cc(C[NH2+]C[C@@H]2CCCn3ccnc32)cn1	ZINC000083912248	357110837	/nfs/dbraw/zinc/11/08/37/357110837.db2.gz	AJTZSZKCEUGLNT-AWEZNQCLSA-N	1	0	289.383	1.393	50	0		CDAARO
O=C(OC[C@H]1CCC[NH2+]C1)c1cc(Cl)ccn1	ZINC000042768362	357079142	/nfs/dbraw/zinc/07/91/42/357079142.db2.gz	UTKLRUIYCNFSRV-VIFPVBQESA-N	1	0	254.717	1.891	50	0		CDAARO
C[NH+]1CCC(NC(=O)CCc2ccc3c(c2)OCO3)CC1	ZINC000047615822	357161342	/nfs/dbraw/zinc/16/13/42/357161342.db2.gz	MHZUHBZXDLLTDP-UHFFFAOYSA-N	1	0	290.363	1.558	50	0		CDAARO
Cc1nc(C)n(C[C@H]2CCC[N@@H+](Cc3cnn(C)c3)C2)n1	ZINC000084280399	357121546	/nfs/dbraw/zinc/12/15/46/357121546.db2.gz	IVFBKVKXJDLPSZ-AWEZNQCLSA-N	1	0	288.399	1.541	50	0		CDAARO
COc1ccc(Cc2noc(C3C[NH2+]C3)n2)cc1OC	ZINC000048981073	357202243	/nfs/dbraw/zinc/20/22/43/357202243.db2.gz	CKPDEAUNKHVHGU-UHFFFAOYSA-N	1	0	275.308	1.364	50	0		CDAARO
Fc1cc(CN2CC[NH2+]CC2)ccc1Br	ZINC000052860999	357279208	/nfs/dbraw/zinc/27/92/08/357279208.db2.gz	ACSSGWMCEDEMSM-UHFFFAOYSA-N	1	0	273.149	1.993	50	0		CDAARO
COC[C@H](Cc1ccccc1)[NH2+]C[C@@H]1CCS(=O)(=O)C1	ZINC000095419616	357333863	/nfs/dbraw/zinc/33/38/63/357333863.db2.gz	HBUPBNBOXGQNEM-GJZGRUSLSA-N	1	0	297.420	1.268	50	0		CDAARO
CCNC(=O)N1CCN(c2nc(C)nc3[nH]ccc32)CC1	ZINC000095429639	357442763	/nfs/dbraw/zinc/44/27/63/357442763.db2.gz	JXXOKLIRNYCEOP-UHFFFAOYSA-N	1	0	288.355	1.118	50	0		CDAARO
CNC(=O)C[C@@H](C)[N@H+](C)Cc1cccc2nonc21	ZINC000065394649	357535667	/nfs/dbraw/zinc/53/56/67/357535667.db2.gz	LJSSDCJNDVKSPM-SECBINFHSA-N	1	0	262.313	1.179	50	0		CDAARO
C[C@H](c1n[nH]c(=O)n1Cc1ccccc1)[NH+]1CCCC1	ZINC000065396664	357536285	/nfs/dbraw/zinc/53/62/85/357536285.db2.gz	PDMDNIAGAPPHCF-GFCCVEGCSA-N	1	0	272.352	1.777	50	0		CDAARO
OCCn1cc(C2=CC[N@H+](CCn3cccc3)CC2)cn1	ZINC000065407019	357539224	/nfs/dbraw/zinc/53/92/24/357539224.db2.gz	CFJIHOSZPCTKSB-UHFFFAOYSA-N	1	0	286.379	1.466	50	0		CDAARO
CO[C@@H](C)[C@H](C)NC(=O)N[C@@H]1CC[N@H+](CC2CCCC2)C1	ZINC000188207455	357601650	/nfs/dbraw/zinc/60/16/50/357601650.db2.gz	BFIVBXCDDGYCJB-KCQAQPDRSA-N	1	0	297.443	1.974	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](NC(=O)c2[nH]cnc2-c2ccccc2)C1	ZINC000067934451	357638580	/nfs/dbraw/zinc/63/85/80/357638580.db2.gz	JPTDMYNGQPRFRE-VXGBXAGGSA-N	1	0	270.336	1.686	50	0		CDAARO
Cc1[nH][nH]c(=O)c1CC(=O)N[C@H]1CC[C@H]1[NH2+]C1CCCC1	ZINC000072429784	357835003	/nfs/dbraw/zinc/83/50/03/357835003.db2.gz	FQPBFFLXBWJDNN-OLZOCXBDSA-N	1	0	292.383	1.146	50	0		CDAARO
c1cn([C@@H]2CCSC2)c(-c2cc3n(n2)CC[NH2+]C3)n1	ZINC000072476527	357838025	/nfs/dbraw/zinc/83/80/25/357838025.db2.gz	OYRHLVIOQDGJPD-SNVBAGLBSA-N	1	0	275.381	1.528	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]C[C@@H](Cc1ccc(F)cc1)C(N)=O	ZINC000097113577	357982884	/nfs/dbraw/zinc/98/28/84/357982884.db2.gz	ZNBZYMSYQCWOQK-SUHUHFCYSA-N	1	0	280.343	1.237	50	0		CDAARO
CCn1cc(C[NH+]2CCC(OC[C@H]3CCOC3)CC2)cn1	ZINC000097108585	357983583	/nfs/dbraw/zinc/98/35/83/357983583.db2.gz	SWEDSXNVYVMJQT-AWEZNQCLSA-N	1	0	293.411	1.921	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@@H](C)c1ccc(C)o1	ZINC000097111302	357986941	/nfs/dbraw/zinc/98/69/41/357986941.db2.gz	FHHSFXBDEZGMJX-JTQLQIEISA-N	1	0	260.359	1.178	50	0		CDAARO
[NH3+][C@@H]1CCCCN(C(=O)c2ccc(Cn3cccn3)o2)C1	ZINC000082086919	358146187	/nfs/dbraw/zinc/14/61/87/358146187.db2.gz	UAXOWIIYNGVLQH-GFCCVEGCSA-N	1	0	288.351	1.478	50	0		CDAARO
CC[C@@H](C)C(=O)NCc1ccccc1C[N@@H+]1CC[C@H](O)C1	ZINC000097081790	358165052	/nfs/dbraw/zinc/16/50/52/358165052.db2.gz	CADNHSZFMDAXMG-CJNGLKHVSA-N	1	0	290.407	1.916	50	0		CDAARO
C[N@@H+]1CC[C@@H](CNC(=O)CCOc2ccccc2)C1	ZINC000067679330	358330435	/nfs/dbraw/zinc/33/04/35/358330435.db2.gz	QFPOATFZKJGJND-ZDUSSCGKSA-N	1	0	262.353	1.523	50	0		CDAARO
CC[N@H+](C[C@H]1CCOC1)[C@@H]1CCN(C(C)C)C1=O	ZINC000095442083	358434668	/nfs/dbraw/zinc/43/46/68/358434668.db2.gz	SBWYTIXEQAKAIP-CHWSQXEVSA-N	1	0	254.374	1.354	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@H](O)C2)cc1OC	ZINC000003684385	358554322	/nfs/dbraw/zinc/55/43/22/358554322.db2.gz	GNPRZUFJSPOMEM-LBPRGKRZSA-N	1	0	251.326	1.661	50	0		CDAARO
CCc1cnc(N)nc1N1CC[NH2+][C@H](c2ccccc2)C1	ZINC000095361519	358685864	/nfs/dbraw/zinc/68/58/64/358685864.db2.gz	CXEPNUJECLFIOD-AWEZNQCLSA-N	1	0	283.379	1.772	50	0		CDAARO
Cc1nn(C)c2nc(N3CC[C@@H]([NH+](C)C)C3)sc12	ZINC000095497386	358694910	/nfs/dbraw/zinc/69/49/10/358694910.db2.gz	MYLYUYIMCUGKBO-SECBINFHSA-N	1	0	265.386	1.479	50	0		CDAARO
CC(=O)N1CC[NH+](C[C@@H]2CCOc3ccccc3C2)CC1	ZINC000095522219	358696212	/nfs/dbraw/zinc/69/62/12/358696212.db2.gz	COSYVXTYONABNR-OAHLLOKOSA-N	1	0	288.391	1.792	50	0		CDAARO
NNc1nc(Nc2cccc3ccccc32)nc(NN)[nH+]1	ZINC000000098455	358760702	/nfs/dbraw/zinc/76/07/02/358760702.db2.gz	ZZFYQNCORQVGLN-UHFFFAOYSA-N	1	0	282.311	1.340	50	0		CDAARO
C[NH+]1CCC(O)(C(=O)NCCCCc2ccccc2)CC1	ZINC000097797642	358800035	/nfs/dbraw/zinc/80/00/35/358800035.db2.gz	NMNAPJVNPNQERY-UHFFFAOYSA-N	1	0	290.407	1.582	50	0		CDAARO
COc1ccc(CC(=O)NCCc2c[nH]cn2)cc1	ZINC000013593176	366484380	/nfs/dbraw/zinc/48/43/80/366484380.db2.gz	IKCWOHBYQKMPNE-UHFFFAOYSA-N	1	0	259.309	1.320	50	0		CDAARO
Cc1ccccc1CC1(NC(=O)C[NH2+]C2CC2)CC1	ZINC000215917871	358909688	/nfs/dbraw/zinc/90/96/88/358909688.db2.gz	UPRBQOLBPCHSRY-UHFFFAOYSA-N	1	0	258.365	1.938	50	0		CDAARO
O=c1cc([C@@H]2CCC[NH2+]C2)nc(Cc2ccsc2)[nH]1	ZINC000023339266	359093607	/nfs/dbraw/zinc/09/36/07/359093607.db2.gz	RMPDXLZSVRNDSO-LLVKDONJSA-N	1	0	275.377	1.889	50	0		CDAARO
Cn1ccc2ccc(C[N@@H+]3CCC[C@H]3C(N)=O)cc21	ZINC000222549553	359354293	/nfs/dbraw/zinc/35/42/93/359354293.db2.gz	SMKLGXISKXNJDK-ZDUSSCGKSA-N	1	0	257.337	1.628	50	0		CDAARO
CC(C)SCC[N@@H+]1CCCn2nc([C@@H](O)CO)cc2C1	ZINC000222381219	359339322	/nfs/dbraw/zinc/33/93/22/359339322.db2.gz	VSLHWLIWOTZRCJ-AWEZNQCLSA-N	1	0	299.440	1.256	50	0		CDAARO
Nc1cc(N)[nH+]c(SCC(=O)Nc2ccccc2)n1	ZINC000000287609	359432437	/nfs/dbraw/zinc/43/24/37/359432437.db2.gz	IRGSJMYDZBSVTR-UHFFFAOYSA-N	1	0	275.337	1.372	50	0		CDAARO
COc1ccc2[nH]cc(CN3CC[NH+](C)CC3)c2c1	ZINC000114898597	359508466	/nfs/dbraw/zinc/50/84/66/359508466.db2.gz	LBQPYBWHUQEKBA-UHFFFAOYSA-N	1	0	259.353	1.924	50	0		CDAARO
COC(=O)N1CCC[C@@H]([NH2+][C@H](C)CCn2cccn2)C1	ZINC000097049726	291185032	/nfs/dbraw/zinc/18/50/32/291185032.db2.gz	VFKWOTXCTXWHKI-CHWSQXEVSA-N	1	0	280.372	1.482	50	0		CDAARO
O=C(N1CC[C@]2(CC[NH2+]C2)C1)C1(c2ccccc2)CC1	ZINC000033426416	359668223	/nfs/dbraw/zinc/66/82/23/359668223.db2.gz	PWHDBQDTOSBXFH-INIZCTEOSA-N	1	0	270.376	1.930	50	0		CDAARO
C[C@H]([NH2+]CC(=O)N1CCOCC1)c1ccccc1N(C)C	ZINC000095988827	359724188	/nfs/dbraw/zinc/72/41/88/359724188.db2.gz	OCBSMSSYABUXJL-ZDUSSCGKSA-N	1	0	291.395	1.262	50	0		CDAARO
O=C(NC[C@@H]1CCCOC1)C1C[NH+](C2CCCCC2)C1	ZINC000408520175	359907694	/nfs/dbraw/zinc/90/76/94/359907694.db2.gz	PGKSFCFATRYTLQ-ZDUSSCGKSA-N	1	0	280.412	1.794	50	0		CDAARO
CCOC[C@@H](O)CN1CCC[C@H]1c1noc(C(C)C)n1	ZINC000257365432	359944949	/nfs/dbraw/zinc/94/49/49/359944949.db2.gz	LUOPUHVKELKBLT-RYUDHWBXSA-N	1	0	283.372	1.727	50	0		CDAARO
c1ccc2nc(N3CC[C@H]4CC[C@@H](C3)[NH2+]4)cnc2c1	ZINC000065422082	360094736	/nfs/dbraw/zinc/09/47/36/360094736.db2.gz	JEQARBXFVRICAG-NEPJUHHUSA-N	1	0	254.337	1.961	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)C[C@H](C)OC	ZINC000248143585	360404541	/nfs/dbraw/zinc/40/45/41/360404541.db2.gz	CVIZYKPQJFKNKM-BFHYXJOUSA-N	1	0	268.401	1.887	50	0		CDAARO
CC[C@](C)(O)C[NH2+]C1CCN(Cc2ccccn2)CC1	ZINC000177959325	189081969	/nfs/dbraw/zinc/08/19/69/189081969.db2.gz	FIGSSOKTJWIHNX-INIZCTEOSA-N	1	0	277.412	1.797	50	0		CDAARO
COCc1nc(C)c(CNC(=O)[C@H](C)[NH+](C)C)s1	ZINC000426383691	360660841	/nfs/dbraw/zinc/66/08/41/360660841.db2.gz	AJSIHJCLDGNFTB-VIFPVBQESA-N	1	0	271.386	1.164	50	0		CDAARO
O=C(C1CCC1)N1CCC(N2C[C@H]3CC[C@@H](C2)[NH2+]C3)CC1	ZINC000426383992	360662559	/nfs/dbraw/zinc/66/25/59/360662559.db2.gz	VENBSDFUAYVXTR-ZFWWWQNUSA-N	1	0	291.439	1.461	50	0		CDAARO
C[NH2+]Cc1nnc(SCCO)n1-c1cccc(OC)c1	ZINC000426478005	360674591	/nfs/dbraw/zinc/67/45/91/360674591.db2.gz	MEUWVQLYZNSYJV-UHFFFAOYSA-N	1	0	294.380	1.080	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)/C=C/c2c(F)cccc2F)C1	ZINC000178538942	189125496	/nfs/dbraw/zinc/12/54/96/189125496.db2.gz	VNGMZBHCFYBFKI-YEZKRMTDSA-N	1	0	266.291	1.785	50	0		CDAARO
CN(C)[C@@H](C(=O)N1CC[C@@H](C[NH3+])C1)c1ccccc1	ZINC000178551750	189126094	/nfs/dbraw/zinc/12/60/94/189126094.db2.gz	LDNNGYPSMAVLIK-GXTWGEPZSA-N	1	0	261.369	1.097	50	0		CDAARO
Cc1nc(CSc2nnc(C[NH3+])n2C)c(C)s1	ZINC000426691189	360696759	/nfs/dbraw/zinc/69/67/59/360696759.db2.gz	MLGHVRPVSOCUFN-UHFFFAOYSA-N	1	0	269.399	1.639	50	0		CDAARO
c1cc(C[N@@H+]2CC[C@H](N3CCOCC3)C2)cs1	ZINC000121083862	360790957	/nfs/dbraw/zinc/79/09/57/360790957.db2.gz	AIIFNEPVKVWJHU-ZDUSSCGKSA-N	1	0	252.383	1.655	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)Cc2c(OC)cccc2OC)C1	ZINC000179002590	189160989	/nfs/dbraw/zinc/16/09/89/189160989.db2.gz	GWSIEJNJVSQELF-GFCCVEGCSA-N	1	0	292.379	1.314	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)/C=C/c2cccc(F)c2)C1	ZINC000179011543	189161392	/nfs/dbraw/zinc/16/13/92/189161392.db2.gz	TVRAPDFLXCCHHK-URWSZGRFSA-N	1	0	262.328	1.907	50	0		CDAARO
CC(C)Cn1c(C[NH3+])nnc1Sc1ccncc1	ZINC000426536551	361007216	/nfs/dbraw/zinc/00/72/16/361007216.db2.gz	SUGCFEVYRFMRHZ-UHFFFAOYSA-N	1	0	263.370	1.939	50	0		CDAARO
COc1cccc([C@H](CNC(=O)c2cn[nH]c2)[NH+](C)C)c1	ZINC000036165169	361185724	/nfs/dbraw/zinc/18/57/24/361185724.db2.gz	AWUVTZYQANQKKR-AWEZNQCLSA-N	1	0	288.351	1.451	50	0		CDAARO
O[C@H](COc1ccc2c(c1)OCO2)C[NH+]1CCCC1	ZINC000002686872	364636522	/nfs/dbraw/zinc/63/65/22/364636522.db2.gz	BZPFFNAHPRWJCJ-NSHDSACASA-N	1	0	265.309	1.251	50	0		CDAARO
O=C([C@H]1CC=CCC1)N1CC[NH+](C[C@H]2CCOC2)CC1	ZINC000098018731	364972396	/nfs/dbraw/zinc/97/23/96/364972396.db2.gz	JUZYFJBEPNTDDF-CABCVRRESA-N	1	0	278.396	1.523	50	0		CDAARO
Clc1ccc(OCc2noc(C3C[NH2+]C3)n2)cc1	ZINC000169676225	365044048	/nfs/dbraw/zinc/04/40/48/365044048.db2.gz	GRAPAZOMLGNJFN-UHFFFAOYSA-N	1	0	265.700	1.989	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)c1ccc[nH]c1=O	ZINC000249688792	365161343	/nfs/dbraw/zinc/16/13/43/365161343.db2.gz	ISHUTIKLFBYREX-UONOGXRCSA-N	1	0	289.379	1.876	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)[C@H]1CCOC1	ZINC000249693586	365191855	/nfs/dbraw/zinc/19/18/55/365191855.db2.gz	ODFDPLPWLPUJLF-BFHYXJOUSA-N	1	0	266.385	1.498	50	0		CDAARO
CC[C@@H](CNC(=O)NCc1cc[nH]n1)[NH+]1CCCC1	ZINC000089943409	366975363	/nfs/dbraw/zinc/97/53/63/366975363.db2.gz	MQPMAVFNBRACIS-LBPRGKRZSA-N	1	0	265.361	1.083	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)COCc1ccccc1Cl	ZINC000125334437	367266575	/nfs/dbraw/zinc/26/65/75/367266575.db2.gz	IBTIXTIXUPDNOV-LLVKDONJSA-N	1	0	282.771	1.677	50	0		CDAARO
C[C@@H]1C[N@H+](C[C@@H]2CCCO2)CC[C@H]1NC(=O)NC(C)(C)C	ZINC000252477249	367545839	/nfs/dbraw/zinc/54/58/39/367545839.db2.gz	KVWQMJHJSBYUBJ-HZSPNIEDSA-N	1	0	297.443	1.974	50	0		CDAARO
COCCOCC(=O)N1CCC(n2c(C)c[nH+]c2C)CC1	ZINC000575548810	369109622	/nfs/dbraw/zinc/10/96/22/369109622.db2.gz	HMABZHKXSXHYQB-UHFFFAOYSA-N	1	0	295.383	1.326	50	0		CDAARO
COc1ccc(CN(C)C(=O)C2CC[NH2+]CC2)cc1F	ZINC000037758206	370060611	/nfs/dbraw/zinc/06/06/11/370060611.db2.gz	SWGNQXKMOPPEQH-UHFFFAOYSA-N	1	0	280.343	1.792	50	0		CDAARO
CCOCC(=O)N1CCC[C@@H](Oc2ccncc2)C1	ZINC000575608120	370624865	/nfs/dbraw/zinc/62/48/65/370624865.db2.gz	WPKGGMLDICWCLW-CYBMUJFWSA-N	1	0	264.325	1.488	50	0		CDAARO
CNC(=O)[C@@H]1C[N@H+](CCCCc2ccccc2)CCO1	ZINC000187468088	371016452	/nfs/dbraw/zinc/01/64/52/371016452.db2.gz	UBIDDPVBQMEOAG-HNNXBMFYSA-N	1	0	276.380	1.456	50	0		CDAARO
[NH3+]CCCOc1ccc(C(=O)NCCF)cc1Cl	ZINC000299772134	372750309	/nfs/dbraw/zinc/75/03/09/372750309.db2.gz	ZVSSJHTWFQFNBT-UHFFFAOYSA-N	1	0	274.723	1.767	50	0		CDAARO
Cc1c(Cl)cncc1NC(=O)NC[C@H]1C[NH2+]CCCO1	ZINC000333279501	205179198	/nfs/dbraw/zinc/17/91/98/205179198.db2.gz	HIRNINACFRUQER-SNVBAGLBSA-N	1	0	298.774	1.543	50	0		CDAARO
O=C(N[C@@H]([C@H]1C[C@H](O)C1)C1CC[NH2+]CC1)C1CC=CC1	ZINC000244840283	189913274	/nfs/dbraw/zinc/91/32/74/189913274.db2.gz	UKJZTIVVNBKJFG-RBSFLKMASA-N	1	0	278.396	1.208	50	0		CDAARO
[NH3+]C[C@H]1CN(c2cccc(C(F)(F)F)c2)C(=O)O1	ZINC000084612628	374062381	/nfs/dbraw/zinc/06/23/81/374062381.db2.gz	KWWWRVVZSFNUIC-VIFPVBQESA-N	1	0	260.215	1.989	50	0		CDAARO
Cc1nn(C)c(C)c1C[NH2+]CC1(O)CCCCC1	ZINC000111356729	374185637	/nfs/dbraw/zinc/18/56/37/374185637.db2.gz	TVXXTWDZJXTDNB-UHFFFAOYSA-N	1	0	251.374	1.822	50	0		CDAARO
CC(=O)N1Cc2ccccc2OC2(CC[NH+](C)CC2)C1	ZINC000257178459	374418427	/nfs/dbraw/zinc/41/84/27/374418427.db2.gz	GJGDHDPHJUINIM-UHFFFAOYSA-N	1	0	274.364	1.892	50	0		CDAARO
COC(=O)[C@@]12CCC[C@@H]1C[N@H+](Cc1nc(C)ccc1O)C2	ZINC000108333162	412824361	/nfs/dbraw/zinc/82/43/61/412824361.db2.gz	UKOURTZGXNRNRN-MLGOLLRUSA-N	1	0	290.363	1.871	50	0		CDAARO
CN(Cc1ccon1)CC(C)(C)CN1CCOCC1	ZINC000124171042	374765788	/nfs/dbraw/zinc/76/57/88/374765788.db2.gz	RYWPUOWCZKXOSK-UHFFFAOYSA-N	1	0	267.373	1.465	50	0		CDAARO
Cc1ncoc1C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000019782108	374787339	/nfs/dbraw/zinc/78/73/39/374787339.db2.gz	GUUYCEXGEGUTDO-AWEZNQCLSA-N	1	0	285.347	1.987	50	0		CDAARO
CNC(=O)CN1CCC([NH2+][C@H](C)CCC=C(C)C)CC1	ZINC000095420132	374921860	/nfs/dbraw/zinc/92/18/60/374921860.db2.gz	FTXBNHBJIQAWOU-CQSZACIVSA-N	1	0	281.444	1.921	50	0		CDAARO
Cn1cc(C[NH2+][C@@H]2C=C[C@H](CO)C2)c(-c2cccnc2)n1	ZINC000095420684	374924050	/nfs/dbraw/zinc/92/40/50/374924050.db2.gz	HBEDRFVOQMASGF-SWLSCSKDSA-N	1	0	284.363	1.509	50	0		CDAARO
CCCS(=O)(=O)CCN(C)[C@@H]1CC[N@H+](CC)C[C@@H]1C	ZINC000095432186	374932623	/nfs/dbraw/zinc/93/26/23/374932623.db2.gz	GHMCJYAQJCAXNM-UONOGXRCSA-N	1	0	290.473	1.473	50	0		CDAARO
C[NH+](C)Cc1ccc(-c2nc([C@H]3CCOC3)no2)o1	ZINC000096161845	375060426	/nfs/dbraw/zinc/06/04/26/375060426.db2.gz	GQDSJLCMEVPULA-VIFPVBQESA-N	1	0	263.297	1.895	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1n[nH]c2c1CCCCC2	ZINC000096232420	375065475	/nfs/dbraw/zinc/06/54/75/375065475.db2.gz	HIWMYSYXJQDMCB-GFCCVEGCSA-N	1	0	290.411	1.893	50	0		CDAARO
NC(=O)[C@@H]([NH2+][C@H]1CCCSC1)c1ccccc1	ZINC000097084458	375145021	/nfs/dbraw/zinc/14/50/21/375145021.db2.gz	LVMRZUFBZDGSGW-RYUDHWBXSA-N	1	0	250.367	1.698	50	0		CDAARO
CC(C)(C)c1n[nH]cc1CNC[C@H](O)C[NH+]1CCCCC1	ZINC000097160066	375150988	/nfs/dbraw/zinc/15/09/88/375150988.db2.gz	HFZPMEJSTYTXST-AWEZNQCLSA-N	1	0	294.443	1.644	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCN(C(=O)c2ccnc(C3CC3)n2)C1	ZINC000299739377	375199766	/nfs/dbraw/zinc/19/97/66/375199766.db2.gz	NTUPSDCATRFZFZ-JQWIXIFHSA-N	1	0	274.368	1.553	50	0		CDAARO
O[C@@H]1CN(CCC(F)(F)F)CC[C@H]1Nc1ncccn1	ZINC000299788132	375213329	/nfs/dbraw/zinc/21/33/29/375213329.db2.gz	VNFLRLDUXQYSRJ-NXEZZACHSA-N	1	0	290.289	1.276	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)/C=C\c2csc(C)n2)C1	ZINC000606441688	375823354	/nfs/dbraw/zinc/82/33/54/375823354.db2.gz	NXIBKLITLBFQFJ-ISALQUGTSA-N	1	0	265.382	1.675	50	0		CDAARO
C/C=C\C[C@H](CO)[NH2+]C1CCN(c2nnc(C)s2)CC1	ZINC000606442159	375823540	/nfs/dbraw/zinc/82/35/40/375823540.db2.gz	ZYJNVOXOUARWRI-DHCBQETCSA-N	1	0	296.440	1.732	50	0		CDAARO
O=C(CCC(F)(F)F)NCC[C@H]1CCCC[NH2+]1	ZINC000088832994	375824574	/nfs/dbraw/zinc/82/45/74/375824574.db2.gz	ICBPPVVLVIBPSX-SECBINFHSA-N	1	0	252.280	1.977	50	0		CDAARO
CCc1noc(CN2CCC[N@H+](C[C@H]3CCCO3)CC2)n1	ZINC000239722351	376016895	/nfs/dbraw/zinc/01/68/95/376016895.db2.gz	CCJOUASAMLYNDN-CYBMUJFWSA-N	1	0	294.399	1.319	50	0		CDAARO
Cc1n[nH]c(C)c1Cc1nc(CC2CC[NH+](C)CC2)no1	ZINC000067649982	377194840	/nfs/dbraw/zinc/19/48/40/377194840.db2.gz	BGBNUCVJMHRADE-UHFFFAOYSA-N	1	0	289.383	1.885	50	0		CDAARO
O=C1CCCN1C[C@H](O)C[NH2+]Cc1ccc(Cl)cc1	ZINC000001391317	296320307	/nfs/dbraw/zinc/32/03/07/296320307.db2.gz	PXTWJOJJTKNJBO-CYBMUJFWSA-N	1	0	282.771	1.413	50	0		CDAARO
COc1ccc(/C=C/C(=O)NOC[C@H](C)[NH3+])cc1OC	ZINC000493133998	253379374	/nfs/dbraw/zinc/37/93/74/253379374.db2.gz	UMTLKQVFCRAMIA-STUBTGCMSA-N	1	0	280.324	1.112	50	0		CDAARO
C[C@@H]1C[C@H]([NH3+])CCN1C(=O)/C=C\c1ccc(C(N)=O)cc1	ZINC000493502037	253478781	/nfs/dbraw/zinc/47/87/81/253478781.db2.gz	VLJOGGSTPRKVJY-QRWLWRBWSA-N	1	0	287.363	1.137	50	0		CDAARO
COC(=O)[C@H](c1ccc(Cl)cc1)N1CC[NH2+]CC1	ZINC000020282885	171132769	/nfs/dbraw/zinc/13/27/69/171132769.db2.gz	IEHFYAQJHKFHTJ-LBPRGKRZSA-N	1	0	268.744	1.459	50	0		CDAARO
Cc1noc(C)c1C[C@@H](C)NC(=O)NCC[N@H+](C)C(C)C	ZINC000096415456	390512165	/nfs/dbraw/zinc/51/21/65/390512165.db2.gz	PNMUKMQNCHXDTG-LLVKDONJSA-N	1	0	296.415	1.862	50	0		CDAARO
CN(C)C(=O)CN1CCC[N@H+](CCC2CCCC2)CC1	ZINC000096424150	390515840	/nfs/dbraw/zinc/51/58/40/390515840.db2.gz	QHZGPMIFNAKYDP-UHFFFAOYSA-N	1	0	281.444	1.663	50	0		CDAARO
O=C1OCCN1CC[N@@H+](CCO)[C@H]1CCc2ccccc21	ZINC000096455343	390522261	/nfs/dbraw/zinc/52/22/61/390522261.db2.gz	VBHLTVSXPBOXPP-HNNXBMFYSA-N	1	0	290.363	1.420	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1F)[C@@H]1CC[NH2+]C1	ZINC000179095583	390942079	/nfs/dbraw/zinc/94/20/79/390942079.db2.gz	WHYYFXQITIXYID-RAIGVLPGSA-N	1	0	280.318	1.889	50	0		CDAARO
O=C(NC1CCN(Cc2nccn2C(F)F)CC1)C1CC1	ZINC000030287364	390949930	/nfs/dbraw/zinc/94/99/30/390949930.db2.gz	AOWPFQAPUWXLGI-UHFFFAOYSA-N	1	0	298.337	1.769	50	0		CDAARO
O=C1N(Cc2ccncc2)CCCN1C1CC[NH2+]CC1	ZINC000526056081	391172219	/nfs/dbraw/zinc/17/22/19/391172219.db2.gz	PYLLHKVULHBHMP-UHFFFAOYSA-N	1	0	274.368	1.461	50	0		CDAARO
Cc1ccc(C(C)(C)C[N@H+](C)CC(=O)NC(N)=O)cc1	ZINC000096441548	533626407	/nfs/dbraw/zinc/62/64/07/533626407.db2.gz	KTVNSZMUFINNGR-UHFFFAOYSA-N	1	0	277.368	1.399	50	0		CDAARO
Nc1cc(N)[nH+]c(SCC(=O)OCc2ccccc2)n1	ZINC000000988948	391633532	/nfs/dbraw/zinc/63/35/32/391633532.db2.gz	ISHCSWFTBVEUAL-UHFFFAOYSA-N	1	0	290.348	1.477	50	0		CDAARO
COCCNC(=O)N1CCC[N@@H+](C2CCCC2)CC1	ZINC000096416055	393184018	/nfs/dbraw/zinc/18/40/18/393184018.db2.gz	KCYXYZUFDRRNCG-UHFFFAOYSA-N	1	0	269.389	1.293	50	0		CDAARO
CC[NH+](CC)[C@@H](C)CNC(=O)N[C@H]1CCCSC1	ZINC000096452322	393187037	/nfs/dbraw/zinc/18/70/37/393187037.db2.gz	JLMYIMPARLBPPZ-RYUDHWBXSA-N	1	0	273.446	1.912	50	0		CDAARO
[NH3+][C@H]1CCC[C@H](CNS(=O)(=O)CCC2CCC2)C1	ZINC000261590669	140358709	/nfs/dbraw/zinc/35/87/09/140358709.db2.gz	XBYLMXXFOKGFKS-STQMWFEESA-N	1	0	274.430	1.614	50	0		CDAARO
COc1ccc(C(=S)N2CCN(C)CC2)cc1C	ZINC000101183059	397779071	/nfs/dbraw/zinc/77/90/71/397779071.db2.gz	QXBNTLSHMNOUCI-UHFFFAOYSA-N	1	0	264.394	1.927	50	0		CDAARO
CC[NH+](CC)CCNC(=O)C(=O)Nc1ccc(C)cc1	ZINC000005183958	170074583	/nfs/dbraw/zinc/07/45/83/170074583.db2.gz	DHFYRDTWXHQQAA-UHFFFAOYSA-N	1	0	277.368	1.392	50	0		CDAARO
[NH3+]Cc1ccc(S(=O)(=O)N2CCCCC2)s1	ZINC000009646681	170383589	/nfs/dbraw/zinc/38/35/89/170383589.db2.gz	WLLPHCYNAIIAFO-UHFFFAOYSA-N	1	0	260.384	1.381	50	0		CDAARO
CCn1c(C)[n+](CC)c2cc(S(=O)(=O)N(C)C)ccc21	ZINC000015961623	170683516	/nfs/dbraw/zinc/68/35/16/170683516.db2.gz	MDDDUQHAVQWEFX-UHFFFAOYSA-N	1	0	296.416	1.527	50	0		CDAARO
CC[C@H](CO)[NH2+]C[C@@H](O)COc1cccc2ccccc21	ZINC000017269041	170731326	/nfs/dbraw/zinc/73/13/26/170731326.db2.gz	OWASUJBWCYEWTB-HUUCEWRRSA-N	1	0	289.375	1.940	50	0		CDAARO
O=C(NCCc1cccc(Cl)c1)[C@@H]1CCC[NH2+]C1	ZINC000020269801	171125240	/nfs/dbraw/zinc/12/52/40/171125240.db2.gz	HJOFCPWSPYXDEC-GFCCVEGCSA-N	1	0	266.772	1.998	50	0		CDAARO
Cc1ccc(-c2noc(CCCN3CC[NH2+]CC3)n2)cc1	ZINC000020283460	171132863	/nfs/dbraw/zinc/13/28/63/171132863.db2.gz	BRCNVYFGSXPLIH-UHFFFAOYSA-N	1	0	286.379	1.883	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC[C@@H]2CCC[NH2+]C2)c(C)c1	ZINC000020432087	171196755	/nfs/dbraw/zinc/19/67/55/171196755.db2.gz	QNHVNWLTZVYQFA-CYBMUJFWSA-N	1	0	282.409	1.581	50	0		CDAARO
COCC[NH+]1CCN(CCc2ccccc2F)CC1	ZINC000020905699	171278972	/nfs/dbraw/zinc/27/89/72/171278972.db2.gz	YMZIBBMFQBKZFZ-UHFFFAOYSA-N	1	0	266.360	1.632	50	0		CDAARO
Cc1ccc(C)c(C[N@H+]2CCN(C)[C@@H](CCO)C2)c1	ZINC000020996493	171284292	/nfs/dbraw/zinc/28/42/92/171284292.db2.gz	KCQXCZWYBYENKU-INIZCTEOSA-N	1	0	262.397	1.802	50	0		CDAARO
CNC(=O)NC(=O)[C@@H](C)[NH+]1CCC(c2ccccc2)CC1	ZINC000024991307	171446416	/nfs/dbraw/zinc/44/64/16/171446416.db2.gz	KZKHYOBNDCYURV-GFCCVEGCSA-N	1	0	289.379	1.710	50	0		CDAARO
CCN(CC)S(=O)(=O)c1ccc(CC[NH3+])s1	ZINC000035206624	172051153	/nfs/dbraw/zinc/05/11/53/172051153.db2.gz	WSZQEGQNZQIXFR-UHFFFAOYSA-N	1	0	262.400	1.280	50	0		CDAARO
CCOC(=O)C1(C[NH3+])CCN(C(=O)OC(C)(C)C)CC1	ZINC000044831780	175261740	/nfs/dbraw/zinc/26/17/40/175261740.db2.gz	UHHUEAGCENEXAJ-UHFFFAOYSA-N	1	0	286.372	1.526	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCC([NH3+])CC1	ZINC000058040854	175606380	/nfs/dbraw/zinc/60/63/80/175606380.db2.gz	UHYJALVBGNHXLW-LBPRGKRZSA-N	1	0	297.399	1.336	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](CNC(=O)c2cnn(CC)c2)C1	ZINC000067695099	175785220	/nfs/dbraw/zinc/78/52/20/175785220.db2.gz	IBFZKJRZKZMQOZ-CYBMUJFWSA-N	1	0	278.400	1.755	50	0		CDAARO
CNC(=O)CC1CC[NH+](CC[C@H](C)SC)CC1	ZINC000067975681	175805315	/nfs/dbraw/zinc/80/53/15/175805315.db2.gz	BHCQIGWRGNAIRB-NSHDSACASA-N	1	0	258.431	1.976	50	0		CDAARO
OC[C@]1(O)CCC[N@H+](CCOc2ccc(Cl)cc2)C1	ZINC000072127411	176321296	/nfs/dbraw/zinc/32/12/96/176321296.db2.gz	PKFJJILLZOBTSD-AWEZNQCLSA-N	1	0	285.771	1.538	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(Cc2nnc(C3CC3)o2)CC1	ZINC000072149598	176326317	/nfs/dbraw/zinc/32/63/17/176326317.db2.gz	OGBVRSCSYCQUGX-LBPRGKRZSA-N	1	0	264.373	1.863	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCCN(C(=O)c2c(F)cccc2F)C1	ZINC000072154321	176328287	/nfs/dbraw/zinc/32/82/87/176328287.db2.gz	MHFRFYFZKYNJTC-OAHLLOKOSA-N	1	0	298.333	1.494	50	0		CDAARO
Cn1cc(Cl)c(C(=O)N2CCC[N@H+](CC3CC3)CC2)n1	ZINC000072252847	176350131	/nfs/dbraw/zinc/35/01/31/176350131.db2.gz	JQUXYSMJBLNODI-UHFFFAOYSA-N	1	0	296.802	1.631	50	0		CDAARO
NC(=O)c1cc(F)ccc1OCC[NH+]1CCCCC1	ZINC000530174656	271131123	/nfs/dbraw/zinc/13/11/23/271131123.db2.gz	JRBBNSHJXQRWPM-UHFFFAOYSA-N	1	0	266.316	1.789	50	0		CDAARO
CO[C@H](C[N@@H+]1C[C@H](O)C[C@@H]1CO)c1ccc(Cl)cc1	ZINC000241383455	274077435	/nfs/dbraw/zinc/07/74/35/274077435.db2.gz	MVLKNDFMRJKBSU-MGPQQGTHSA-N	1	0	285.771	1.455	50	0		CDAARO
COc1ccc(-c2cc(F)cc3c2O[C@@H](C[NH3+])C3)nn1	ZINC000299799139	274103934	/nfs/dbraw/zinc/10/39/34/274103934.db2.gz	VHRHVKPLCIIYGH-SNVBAGLBSA-N	1	0	275.283	1.554	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2CCC[NH2+]2)C[C@H](c2ccsc2)O1	ZINC000261645520	274329372	/nfs/dbraw/zinc/32/93/72/274329372.db2.gz	GSNUYALSQAVKHS-RAIGVLPGSA-N	1	0	280.393	1.789	50	0		CDAARO
CC[NH+](CC)C[C@@H](O)COc1ccc(OC)cc1	ZINC000000189893	276105279	/nfs/dbraw/zinc/10/52/79/276105279.db2.gz	AFHIPGDASBQREJ-GFCCVEGCSA-N	1	0	253.342	1.777	50	0		CDAARO
CN1CCN(C(=O)[C@H]2CCC[NH2+]2)c2ccc(F)cc21	ZINC000072535236	277095451	/nfs/dbraw/zinc/09/54/51/277095451.db2.gz	MCZKFLWDFLIGHA-LLVKDONJSA-N	1	0	263.316	1.361	50	0		CDAARO
CC(C)(C)OC(=O)N1CCO[C@]2(CCC[NH2+]C2)C1	ZINC000091303964	277190073	/nfs/dbraw/zinc/19/00/73/277190073.db2.gz	WPWQOZQQBMPUIV-ZDUSSCGKSA-N	1	0	256.346	1.376	50	0		CDAARO
COC[C@H]([NH3+])C(=O)N1CCc2c(F)cc(F)cc2[C@H]1C	ZINC000262319342	277594545	/nfs/dbraw/zinc/59/45/45/277594545.db2.gz	QDJMGYITGZKQRO-OQPBUACISA-N	1	0	284.306	1.384	50	0		CDAARO
CC(C)(C)OC(=O)N1CCCC[C@H]1C1(O)C[NH2+]C1	ZINC000090411629	278388299	/nfs/dbraw/zinc/38/82/99/278388299.db2.gz	DBXFIYLGJDPVHA-JTQLQIEISA-N	1	0	256.346	1.110	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)[C@H]1CCOc2ccccc21	ZINC000111189002	278452934	/nfs/dbraw/zinc/45/29/34/278452934.db2.gz	DGIVSORBBMSFHR-AAEUAGOBSA-N	1	0	260.337	1.373	50	0		CDAARO
CC(C)C[C@H](CO)NC(=O)[C@@H](C)[N@H+]1[C@H](C)CC[C@@H]1C	ZINC000245338935	279172038	/nfs/dbraw/zinc/17/20/38/279172038.db2.gz	PKKPOEDIGMNOJP-XJFOESAGSA-N	1	0	270.417	1.771	50	0		CDAARO
CCN(CC[NH+]1CCCCCC1)C(=O)Cn1ccnc1	ZINC000218981012	279187505	/nfs/dbraw/zinc/18/75/05/279187505.db2.gz	YJIKSTADMITFEW-UHFFFAOYSA-N	1	0	278.400	1.608	50	0		CDAARO
C[n+]1c2n(c(=O)c3c4c(sc31)CCCC4)CCC2	ZINC000031773465	280180868	/nfs/dbraw/zinc/18/08/68/280180868.db2.gz	GFORIPGYEZBVRI-UHFFFAOYSA-N	1	0	261.370	1.713	50	0		CDAARO
Cc1cnc(N2CCC3(C2)CC[NH+](C)CC3)nc1N	ZINC000065493182	281600180	/nfs/dbraw/zinc/60/01/80/281600180.db2.gz	BHKNZZBXKTWXAS-UHFFFAOYSA-N	1	0	261.373	1.289	50	0		CDAARO
C[NH+](C)C[C@H]1CSCC[C@@]1(O)c1cccc(O)c1	ZINC000000347732	289218856	/nfs/dbraw/zinc/21/88/56/289218856.db2.gz	OXSWTJCCCLUDOE-GXTWGEPZSA-N	1	0	267.394	1.895	50	0		CDAARO
Cc1ccccc1OCCN(C)C(=O)[C@@H]1CCC[C@H]1[NH3+]	ZINC000085367450	302107480	/nfs/dbraw/zinc/10/74/80/302107480.db2.gz	OVZWLLRPFSXDRH-ZIAGYGMSSA-N	1	0	276.380	1.960	50	0		CDAARO
NS(=O)(=O)CC1CC[NH+](CC2CCCCCC2)CC1	ZINC000097140499	303433426	/nfs/dbraw/zinc/43/34/26/303433426.db2.gz	NZYMOERMFOTYJW-UHFFFAOYSA-N	1	0	288.457	1.957	50	0		CDAARO
C[C@@H](C(=O)NCCc1cc[nH]n1)[NH+]1CCCCCC1	ZINC000534578223	328310788	/nfs/dbraw/zinc/31/07/88/328310788.db2.gz	ZGEUKWBFSBKZJR-LBPRGKRZSA-N	1	0	264.373	1.333	50	0		CDAARO
COCC1(CNC(=O)CC[C@H]2CCCC[N@@H+]2C)CC1	ZINC000534586312	328315506	/nfs/dbraw/zinc/31/55/06/328315506.db2.gz	ZNMBJDCYQBFLIG-CYBMUJFWSA-N	1	0	268.401	1.794	50	0		CDAARO
C[NH+]1CCN(CC2(CNc3nccs3)CC2)CC1	ZINC000534643602	328329825	/nfs/dbraw/zinc/32/98/25/328329825.db2.gz	OICIAZQMZVIITA-UHFFFAOYSA-N	1	0	266.414	1.583	50	0		CDAARO
O=C(C[C@H]1CCOC1)NC1(C[NH+]2CCCCC2)CC1	ZINC000534639522	328335409	/nfs/dbraw/zinc/33/54/09/328335409.db2.gz	CWLCLNIWGXJZTJ-CYBMUJFWSA-N	1	0	266.385	1.548	50	0		CDAARO
CCC[C@@H](CNC(=O)c1cc(O)ccc1F)[NH+](C)C	ZINC000534653731	328338557	/nfs/dbraw/zinc/33/85/57/328338557.db2.gz	QGKRDRUWERNFIX-JTQLQIEISA-N	1	0	268.332	1.991	50	0		CDAARO
COc1nc(NCC2(C[NH+]3CCCC3)CC2)ncc1F	ZINC000534660422	328342400	/nfs/dbraw/zinc/34/24/00/328342400.db2.gz	KTJVAOGSXVLVLG-UHFFFAOYSA-N	1	0	280.347	1.912	50	0		CDAARO
O=C(NC[C@@H]1CC[NH2+]C[C@H]1O)c1sccc1Cl	ZINC000534654382	328338780	/nfs/dbraw/zinc/33/87/80/328338780.db2.gz	VCGKCLSSSZMNCH-IONNQARKSA-N	1	0	274.773	1.102	50	0		CDAARO
CN(Cc1cnc2ccccc2n1)C(=O)[C@@H]1CCC[NH2+]CC1	ZINC000534662374	328350237	/nfs/dbraw/zinc/35/02/37/328350237.db2.gz	AJALKFVLRVWYGG-CYBMUJFWSA-N	1	0	298.390	1.978	50	0		CDAARO
COCCC1CCN(C(=O)[C@@H]2CCC[NH2+]CC2)CC1	ZINC000534663383	328351146	/nfs/dbraw/zinc/35/11/46/328351146.db2.gz	SMNJLFFCXBLSTK-CQSZACIVSA-N	1	0	268.401	1.651	50	0		CDAARO
CC[C@@H]([NH2+]CC(=O)NC1CC1)c1c(C)nn(C)c1C	ZINC000097374423	323207837	/nfs/dbraw/zinc/20/78/37/323207837.db2.gz	OTUAMXZXJJDHSK-GFCCVEGCSA-N	1	0	264.373	1.356	50	0		CDAARO
Cc1nc(CN2CC([N@H+]3CCCC[C@@H]3C)C2)no1	ZINC000244899881	1159708105	/nfs/dbraw/zinc/70/81/05/1159708105.db2.gz	ZSFJEQGYCDOLCM-JTQLQIEISA-N	1	0	250.346	1.437	50	0		CDAARO
C[C@@H](C(=O)N1CC[NH2+][C@H](C)C1)n1cnc2ccccc21	ZINC000188411135	482445651	/nfs/dbraw/zinc/44/56/51/482445651.db2.gz	ZAWNMQXZXYRXCW-NEPJUHHUSA-N	1	0	272.352	1.418	50	0		CDAARO
COc1ccnc(CN2CCCC[C@H]([NH3+])C2)c1OC	ZINC000082107134	482762661	/nfs/dbraw/zinc/76/26/61/482762661.db2.gz	MYGGCWUQLLEWPL-NSHDSACASA-N	1	0	265.357	1.412	50	0		CDAARO
CCC[C@@H]1CN(c2ncc(OC)cn2)C[C@H]1[NH+](C)C	ZINC000082146637	482764482	/nfs/dbraw/zinc/76/44/82/482764482.db2.gz	CHOWTKBDAUUJOB-DGCLKSJQSA-N	1	0	264.373	1.652	50	0		CDAARO
C[C@H](CN1CCCCC1)[NH2+]CCc1nc(C2CC2)no1	ZINC000670445430	482992956	/nfs/dbraw/zinc/99/29/56/482992956.db2.gz	ZOYMCLNGDGFNFZ-GFCCVEGCSA-N	1	0	278.400	1.954	50	0		CDAARO
O=C(C1CCC1)N1CC[NH+](C[C@H]2CCCOC2)CC1	ZINC000670445304	482996036	/nfs/dbraw/zinc/99/60/36/482996036.db2.gz	YQBONWFSKRTTSW-CYBMUJFWSA-N	1	0	266.385	1.357	50	0		CDAARO
CNC(=O)C[C@@H]1CC[N@H+](CCc2cccc(C)n2)C1	ZINC000670450017	483011778	/nfs/dbraw/zinc/01/17/78/483011778.db2.gz	HSPCLBYFNTXFMB-ZDUSSCGKSA-N	1	0	261.369	1.391	50	0		CDAARO
Cc1nncn1CC[N@@H+](C)Cc1ccc2c(c1)OCO2	ZINC000670456086	483032143	/nfs/dbraw/zinc/03/21/43/483032143.db2.gz	XLSGQIDZULJOQF-UHFFFAOYSA-N	1	0	274.324	1.447	50	0		CDAARO
C[C@H](Cc1ccsc1)[N@H+](C)CCn1cncn1	ZINC000096448432	534156209	/nfs/dbraw/zinc/15/62/09/534156209.db2.gz	PGXWVLQWMSXZAF-LLVKDONJSA-N	1	0	250.371	1.903	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccc([S@](C)=O)cc2)C[C@H](C)[NH2+]1	ZINC000179163360	534424951	/nfs/dbraw/zinc/42/49/51/534424951.db2.gz	BBWRLDBXECEFOA-QQKBFRNYSA-N	1	0	280.393	1.246	50	0		CDAARO
CC[N@@H+]1CCC[C@@](C)(C(=O)NCCCc2cnn(C)c2)C1	ZINC000095352659	521640420	/nfs/dbraw/zinc/64/04/20/521640420.db2.gz	BDPJHHPFDNTMQX-MRXNPFEDSA-N	1	0	292.427	1.591	50	0		CDAARO
CN1CCC[N@H+](C[C@H](O)COCc2cccs2)CC1	ZINC000022036960	523808280	/nfs/dbraw/zinc/80/82/80/523808280.db2.gz	IKHZLHKOPZJERA-ZDUSSCGKSA-N	1	0	284.425	1.263	50	0		CDAARO
CCC(CC)C[N@@H+]1CCC[C@@H](NS(C)(=O)=O)C1	ZINC000096487700	528753319	/nfs/dbraw/zinc/75/33/19/528753319.db2.gz	KATKJAXINVYPMO-GFCCVEGCSA-N	1	0	262.419	1.436	50	0		CDAARO
CN1CC[C@H]([N@@H+]2CCC[C@H]2C[C@@H](O)c2ccccc2)C1=O	ZINC000245338626	536478015	/nfs/dbraw/zinc/47/80/15/536478015.db2.gz	NISBGRIODMBHNH-HRCADAONSA-N	1	0	288.391	1.805	50	0		CDAARO
CN1CCN(C2CC[NH+](C[C@H]3CCCCO3)CC2)C1=O	ZINC000075604005	538371828	/nfs/dbraw/zinc/37/18/28/538371828.db2.gz	ODLALPZYABJQQO-CQSZACIVSA-N	1	0	281.400	1.387	50	0		CDAARO
[NH3+]C[C@H](c1ccccc1Cl)N1CC[C@@H](C(=O)[O-])C1	ZINC000242728104	545545149	/nfs/dbraw/zinc/54/51/49/545545149.db2.gz	YTGVQIOLIBQSHG-BXKDBHETSA-N	1	0	268.744	1.746	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@](O)([C@@H]([NH3+])C2CCCC2)C1	ZINC000958528826	613980705	/nfs/dbraw/zinc/98/07/05/613980705.db2.gz	WBHHXFZINGEEKD-SWLSCSKDSA-N	1	0	284.400	1.876	50	0		CDAARO
C[N@@H+](Cc1cncnc1)C[C@@H]1CC(=O)N(C(C)(C)C)C1	ZINC000952964171	616095396	/nfs/dbraw/zinc/09/53/96/616095396.db2.gz	OAEXGAQUGZIOOE-LBPRGKRZSA-N	1	0	276.384	1.555	50	0		CDAARO
COCc1nccc(N2CC[C@@H]([NH+](C)C)[C@H]2C)n1	ZINC000928995731	620830008	/nfs/dbraw/zinc/83/00/08/620830008.db2.gz	IYNHGTIAPYEZJA-GHMZBOCLSA-N	1	0	250.346	1.152	50	0		CDAARO
O=C(NCC[C@H]1CCCCO1)[C@@H]1[NH2+]CC12CCCC2	ZINC000888101495	617765288	/nfs/dbraw/zinc/76/52/88/617765288.db2.gz	CSBCTDAKKGAHOK-OLZOCXBDSA-N	1	0	266.385	1.594	50	0		CDAARO
C=CC(=O)N1C[C@@H]2C[N@@H+](C)[C@H](c3ccccc3)[C@@H]2C1	ZINC000888102171	617767414	/nfs/dbraw/zinc/76/74/14/617767414.db2.gz	KZDDFIXKIUXDSX-SQWLQELKSA-N	1	0	256.349	1.934	50	0		CDAARO
COC(=O)c1nccc(N2CC[N@H+](C)[C@H](C(C)(C)C)C2)n1	ZINC000874435002	632390361	/nfs/dbraw/zinc/39/03/61/632390361.db2.gz	ISHVKZQVBBNJPC-NSHDSACASA-N	1	0	292.383	1.430	50	0		CDAARO
CCc1[nH+]c(N)nc(N[C@@H]2CC(=O)N(C(C)C)C2)c1C	ZINC001704309630	1177684110	/nfs/dbraw/zinc/68/41/10/1177684110.db2.gz	ZTLRJSQZVJXFRV-SNVBAGLBSA-N	1	0	277.372	1.351	50	0		CDAARO
Cc1nc(NC(=O)c2ccc([C@@H]3CCC[NH2+]3)s2)n(C)n1	ZINC000023192366	897193685	/nfs/dbraw/zinc/19/36/85/897193685.db2.gz	DEAIUBVVWKYMAW-VIFPVBQESA-N	1	0	291.380	1.862	50	0		CDAARO
CN1CC[N@H+](Cc2cccc3cnccc32)C[C@@H]1CCO	ZINC000023374666	898233577	/nfs/dbraw/zinc/23/35/77/898233577.db2.gz	IMHMYRAISBOAKT-INIZCTEOSA-N	1	0	285.391	1.733	50	0		CDAARO
Cc1nnc(CN2CC([N@H+]3CCCC[C@@H]3C)C2)s1	ZINC000299781886	900264199	/nfs/dbraw/zinc/26/41/99/900264199.db2.gz	MLGIQLBCZYYVQY-JTQLQIEISA-N	1	0	266.414	1.905	50	0		CDAARO
Cc1n[nH]c(C)c1CNC(=O)CC[C@H](C)[NH+]1CCCC1	ZINC000426383842	902497367	/nfs/dbraw/zinc/49/73/67/902497367.db2.gz	MYCAQMVCISCUFN-NSHDSACASA-N	1	0	278.400	1.907	50	0		CDAARO
CC(C)(O)[C@H]1CC[N@H+](CCn2cc(Cl)cn2)C1	ZINC000721880173	908166311	/nfs/dbraw/zinc/16/63/11/908166311.db2.gz	CYYMRWLXUSXGPK-JTQLQIEISA-N	1	0	257.765	1.629	50	0		CDAARO
O=C(NC[C@@H]1C[C@H](F)C[NH2+]1)NC12CC3CC(CC(C3)C1)C2	ZINC000082171966	909856738	/nfs/dbraw/zinc/85/67/38/909856738.db2.gz	RLTKAZJAMAAWML-FUDOWXGNSA-N	1	0	295.402	1.954	50	0		CDAARO
Fc1cnc(C[C@@H]2CC[C@H](C[N@@H+]3CCCOCC3)O2)nc1	ZINC000952854504	910409384	/nfs/dbraw/zinc/40/93/84/910409384.db2.gz	USGDTFOJOAENNA-UONOGXRCSA-N	1	0	295.358	1.428	50	0		CDAARO
Cc1ccc(C[C@@H]2CC[C@H](C[NH+]3CCSCC3)O2)nn1	ZINC000952854456	910409656	/nfs/dbraw/zinc/40/96/56/910409656.db2.gz	IVCPXMTXBLQGAB-LSDHHAIUSA-N	1	0	293.436	1.924	50	0		CDAARO
C[C@@H](NCc1ccc(CC[NH3+])cc1)c1nncn1C	ZINC000952862204	910416280	/nfs/dbraw/zinc/41/62/80/910416280.db2.gz	NHEIHQLDDLUHSQ-LLVKDONJSA-N	1	0	259.357	1.167	50	0		CDAARO
CCn1nnc(C)c1CN1CC[C@]2(CCC[N@@H+]2C)C1	ZINC000952879896	910438743	/nfs/dbraw/zinc/43/87/43/910438743.db2.gz	AFSMXKPGDMFKRI-CQSZACIVSA-N	1	0	263.389	1.277	50	0		CDAARO
COc1ccc(C[NH2+]CCN2CCC[C@@H](CO)C2)cc1O	ZINC000952962945	910474691	/nfs/dbraw/zinc/47/46/91/910474691.db2.gz	GQPBOAIAZUTZHL-CQSZACIVSA-N	1	0	294.395	1.195	50	0		CDAARO
OCCOc1ccccc1C[NH2+]Cc1cccc(CO)c1	ZINC000952969839	910502065	/nfs/dbraw/zinc/50/20/65/910502065.db2.gz	KFZCWBWSZLYFBT-UHFFFAOYSA-N	1	0	287.359	1.840	50	0		CDAARO
CSCC[NH+]1CCC(NC(=O)[C@H]2CC2(C)C)CC1	ZINC000952978255	910526188	/nfs/dbraw/zinc/52/61/88/910526188.db2.gz	YCLYDXSSUXPGAA-GFCCVEGCSA-N	1	0	270.442	1.976	50	0		CDAARO
O=C(NCC1CC[NH+](C[C@H]2CCOC2)CC1)c1ccoc1	ZINC000952984627	910551368	/nfs/dbraw/zinc/55/13/68/910551368.db2.gz	PZDVRKALAPWCBT-CQSZACIVSA-N	1	0	292.379	1.758	50	0		CDAARO
Cc1cc[nH]c(=O)c1C(=O)N1CC[N@@H+]2CCCC[C@@H]2C1	ZINC000183646991	917482288	/nfs/dbraw/zinc/48/22/88/917482288.db2.gz	YUGBFDAJSHJWGM-GFCCVEGCSA-N	1	0	275.352	1.406	50	0		CDAARO
[NH3+]C[C@H]1CCN(Cc2cnc(-c3ccccn3)nc2)C1	ZINC000067982053	936621141	/nfs/dbraw/zinc/62/11/41/936621141.db2.gz	LIIGSTKTQLUFEX-GFCCVEGCSA-N	1	0	269.352	1.319	50	0		CDAARO
CCOc1ccnc(NC[C@@]2(C)CC[N@H+](C)C2)n1	ZINC000823399287	925692032	/nfs/dbraw/zinc/69/20/32/925692032.db2.gz	IAEZOGYTHQMPOG-CYBMUJFWSA-N	1	0	250.346	1.629	50	0		CDAARO
O=C(NC1(CO)CCSCC1)[C@H]1CCC[C@H]2CCC[N@@H+]21	ZINC000585121958	930987957	/nfs/dbraw/zinc/98/79/57/930987957.db2.gz	HOOMOXFGRVBWMI-QWHCGFSZSA-N	1	0	298.452	1.378	50	0		CDAARO
Cn1cccc1C(=O)N[C@@H]1C[C@H]([NH+](C)C)C12CCC2	ZINC000585131559	931023499	/nfs/dbraw/zinc/02/34/99/931023499.db2.gz	ZJAMOXIKXNHAAF-OLZOCXBDSA-N	1	0	261.369	1.628	50	0		CDAARO
O=c1ccncn1CC1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1	ZINC000585636804	932834960	/nfs/dbraw/zinc/83/49/60/932834960.db2.gz	NIDHMZWSMMDAKM-HUUCEWRRSA-N	1	0	291.395	1.259	50	0		CDAARO
C[NH+](C)CC[C@@H]1CN(C(=O)Cc2ccc(F)cc2)CCO1	ZINC000012703258	935367022	/nfs/dbraw/zinc/36/70/22/935367022.db2.gz	WQRYPUJREVPUBT-OAHLLOKOSA-N	1	0	294.370	1.547	50	0		CDAARO
CC[C@@H]1CN(Cc2cc(=O)[nH]c(C)n2)CC[N@@H+]1C(C)C	ZINC001529098497	968982291	/nfs/dbraw/zinc/98/22/91/968982291.db2.gz	GVVPJLVLRIUPHV-CQSZACIVSA-N	1	0	278.400	1.795	50	0		CDAARO
C[NH+](C)CCc1nnc(NC(=O)Cc2ccncc2)s1	ZINC001529178409	969004479	/nfs/dbraw/zinc/00/44/79/969004479.db2.gz	KOIQOBSOGYVXIH-UHFFFAOYSA-N	1	0	291.380	1.218	50	0		CDAARO
CCc1cc(N[C@@H]2CCOC2)nc(N2CCCC2)[nH+]1	ZINC001529174460	969004620	/nfs/dbraw/zinc/00/46/20/969004620.db2.gz	UNDKJQQQTCKETR-GFCCVEGCSA-N	1	0	262.357	1.840	50	0		CDAARO
CCCCCc1nnc(NC(=O)[C@@H]2C=CC[NH2+]2)s1	ZINC001529177672	969004764	/nfs/dbraw/zinc/00/47/64/969004764.db2.gz	COJURKOTYSXGPL-VIFPVBQESA-N	1	0	266.370	1.737	50	0		CDAARO
C[NH2+]CC(=O)N1C[C@@H](c2ccccc2)O[C@@H](C2CC2)C1	ZINC001529180953	969006832	/nfs/dbraw/zinc/00/68/32/969006832.db2.gz	NYPPYLBNWHHXIO-LSDHHAIUSA-N	1	0	274.364	1.585	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]CCCC(=O)N(C)C	ZINC001506396089	975148237	/nfs/dbraw/zinc/14/82/37/975148237.db2.gz	NBVAREZDGBLXAH-LBPRGKRZSA-N	1	0	266.389	1.292	50	0		CDAARO
Cc1cccnc1N1CCC(O)(C[NH+]2CCCC2)CC1	ZINC001506430149	975162196	/nfs/dbraw/zinc/16/21/96/975162196.db2.gz	WYFOKIXMLHYFGM-UHFFFAOYSA-N	1	0	275.396	1.817	50	0		CDAARO
O=C1C[C@H]2CC[C@@H](CN1CCCOc1ccc(F)cc1)[NH2+]2	ZINC000095507933	185000370	/nfs/dbraw/zinc/00/03/70/185000370.db2.gz	UGMSREIVDNJLLT-KGLIPLIRSA-N	1	0	292.354	1.948	50	0		CDAARO
CCc1ncnc(NC2CC[NH+]([C@@H]3CCOC3)CC2)c1F	ZINC000095981612	185053666	/nfs/dbraw/zinc/05/36/66/185053666.db2.gz	CFQDCJHMNYWHKY-GFCCVEGCSA-N	1	0	294.374	1.843	50	0		CDAARO
COCCC(=O)Nc1ccc2c(c1)N(C)CC[N@@H+](C)C2	ZINC000095993464	185059253	/nfs/dbraw/zinc/05/92/53/185059253.db2.gz	DJEPPMVKJUNGQJ-UHFFFAOYSA-N	1	0	277.368	1.543	50	0		CDAARO
C[NH+](C)CC[C@H]1CCCCN1S(=O)(=O)c1cccnc1	ZINC000077489884	282114330	/nfs/dbraw/zinc/11/43/30/282114330.db2.gz	AFAUEHSCJMNFBI-CYBMUJFWSA-N	1	0	297.424	1.577	50	0		CDAARO
CCCOc1ccc(CNC(=O)C(C)(C)[NH3+])cc1	ZINC000083382989	178384714	/nfs/dbraw/zinc/38/47/14/178384714.db2.gz	PUXKSMXYBNAGFI-UHFFFAOYSA-N	1	0	250.342	1.829	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)Cc1ccc(F)cc1Cl	ZINC000195554037	342625772	/nfs/dbraw/zinc/62/57/72/342625772.db2.gz	HXNQPSZVAGNVMR-RYUDHWBXSA-N	1	0	286.734	1.125	50	0		CDAARO
OCCO[C@@H]1CCC[N@@H+]([C@@H]2Cc3ccccc3[C@@H]2O)C1	ZINC000195550351	342626741	/nfs/dbraw/zinc/62/67/41/342626741.db2.gz	HUNUDVAKSCQCDI-BMFZPTHFSA-N	1	0	277.364	1.118	50	0		CDAARO
CN(CCN1CCCC1=O)C(=O)C[C@@H]([NH3+])c1ccccc1	ZINC000119160376	342147008	/nfs/dbraw/zinc/14/70/08/342147008.db2.gz	BVAPQLAEEGAQIQ-CQSZACIVSA-N	1	0	289.379	1.157	50	0		CDAARO
O=C(CC[N@@H+]1CCc2nc[nH]c2C1)NCc1cccs1	ZINC000243932111	361830444	/nfs/dbraw/zinc/83/04/44/361830444.db2.gz	BSYXRZXMZIXHGF-UHFFFAOYSA-N	1	0	290.392	1.536	50	0		CDAARO
Cc1cnc(C)c(N2CC[NH+](C[C@H]3CCCOC3)CC2)n1	ZINC000244708118	361858432	/nfs/dbraw/zinc/85/84/32/361858432.db2.gz	KNRKYNSRMIAORB-OAHLLOKOSA-N	1	0	290.411	1.642	50	0		CDAARO
Nc1nc(NCCOc2ccccc2)cc([C@H]2C[C@@H]([NH3+])C2)n1	ZINC000244858586	361866346	/nfs/dbraw/zinc/86/63/46/361866346.db2.gz	VNYQVJQWZFPXLO-TXEJJXNPSA-N	1	0	299.378	1.754	50	0		CDAARO
CCN(CC)C(=O)N1CCCC[C@@H]([NH+]2CCN(C)CC2)C1	ZINC000095994947	539088229	/nfs/dbraw/zinc/08/82/29/539088229.db2.gz	OADRHYYCVPZGLC-OAHLLOKOSA-N	1	0	296.459	1.550	50	0		CDAARO
CCN(CC)CC[N@@H+]1CCCC[C@@H]1[C@H]1CNC(=O)C1	ZINC000097235662	342205635	/nfs/dbraw/zinc/20/56/35/342205635.db2.gz	QMOSCNVCYPKZRJ-ZIAGYGMSSA-N	1	0	267.417	1.319	50	0		CDAARO
O=C(c1cccc(Cl)n1)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000097019692	185153195	/nfs/dbraw/zinc/15/31/95/185153195.db2.gz	QUYCDPINCMIXDE-ZJUUUORDSA-N	1	0	265.744	1.702	50	0		CDAARO
CCC[C@@H](C)NC(=O)[C@H]1CCC[N@H+](CCOC(C)=O)C1	ZINC000585141416	342219174	/nfs/dbraw/zinc/21/91/74/342219174.db2.gz	VLVVWKCIDAIAKJ-OCCSQVGLSA-N	1	0	284.400	1.566	50	0		CDAARO
CC(C)(CCC(=O)NCc1nccs1)[NH+]1CCOCC1	ZINC000585140954	342218863	/nfs/dbraw/zinc/21/88/63/342218863.db2.gz	NFQYFPHHTKNTTJ-UHFFFAOYSA-N	1	0	297.424	1.650	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N[C@H]2C[N@@H+](C)C[C@H]2C)c1	ZINC000257365934	539096235	/nfs/dbraw/zinc/09/62/35/539096235.db2.gz	COKIHFULKDPGPD-PWSUYJOCSA-N	1	0	286.372	1.363	50	0		CDAARO
O=C1N(CCc2c[nH]c3ccccc23)C[C@@H]2C[NH2+]CCN12	ZINC000072233608	342273184	/nfs/dbraw/zinc/27/31/84/342273184.db2.gz	CSBYAAJNDCNBRV-ZDUSSCGKSA-N	1	0	284.363	1.420	50	0		CDAARO
C[C@@]1(C[N@@H+]2CC[C@H](C(N)=O)C2)C[C@H]1c1ccccc1	ZINC000585117443	362046630	/nfs/dbraw/zinc/04/66/30/362046630.db2.gz	CRZGYVHUPSMUJK-DZKIICNBSA-N	1	0	258.365	1.987	50	0		CDAARO
CCc1ccc(S(=O)(=O)N2CCC[NH2+]CC2)s1	ZINC000019680056	529696185	/nfs/dbraw/zinc/69/61/85/529696185.db2.gz	KPYLNHXEEULRJH-UHFFFAOYSA-N	1	0	274.411	1.295	50	0		CDAARO
C[NH+](C)[C@H]1CCCC[C@@H]1NS(=O)(=O)c1ccccc1	ZINC000000858966	282251642	/nfs/dbraw/zinc/25/16/42/282251642.db2.gz	VLEJSVXWQQVRQO-KBPBESRZSA-N	1	0	282.409	1.838	50	0		CDAARO
CCN(CC)c1cc(C)[nH+]c(N2CCOCC2)n1	ZINC000000378403	136391784	/nfs/dbraw/zinc/39/17/84/136391784.db2.gz	IFGONIXMCSPCGY-UHFFFAOYSA-N	1	0	250.346	1.468	50	0		CDAARO
COc1cc(C)c(C[NH2+][C@@H]2CC(=O)N(C)C2)cc1OC	ZINC000083454660	362248607	/nfs/dbraw/zinc/24/86/07/362248607.db2.gz	LXDOVFVIRWRVSD-GFCCVEGCSA-N	1	0	278.352	1.333	50	0		CDAARO
CN(CC(=O)NCC1CCCCC1)C1CC[NH+](C)CC1	ZINC000002632822	529833383	/nfs/dbraw/zinc/83/33/83/529833383.db2.gz	APNMNZMLUQGLEZ-UHFFFAOYSA-N	1	0	281.444	1.709	50	0		CDAARO
Cc1nc(-c2ccc(C(=O)N3CC[NH2+]C[C@@H]3C)cc2)n[nH]1	ZINC000125730815	282309512	/nfs/dbraw/zinc/30/95/12/282309512.db2.gz	LBHATLVXIHSFRA-JTQLQIEISA-N	1	0	285.351	1.214	50	0		CDAARO
O=C1NCCN(C[C@@H]2CCCCO2)[C@@H]1c1cccs1	ZINC000084437069	362264091	/nfs/dbraw/zinc/26/40/91/362264091.db2.gz	ZWDCLBOWWDHIPQ-WCQYABFASA-N	1	0	280.393	1.790	50	0		CDAARO
O=C(Cc1ccccc1Br)N[C@@H]1CCC[NH2+]C1	ZINC000084719074	362270099	/nfs/dbraw/zinc/27/00/99/362270099.db2.gz	XVCCDFTUNSXLAV-LLVKDONJSA-N	1	0	297.196	1.860	50	0		CDAARO
CC[N@H+](C)C[C@@H]1CCN(C(=O)NCc2cccn2C)C1	ZINC000084760834	362270488	/nfs/dbraw/zinc/27/04/88/362270488.db2.gz	RMVUNWDXZWORGR-ZDUSSCGKSA-N	1	0	278.400	1.508	50	0		CDAARO
CC[N@H+](Cc1cc(=O)n2cc(C)ccc2n1)C1CC1	ZINC000084774822	362271338	/nfs/dbraw/zinc/27/13/38/362271338.db2.gz	GIVUQFVXZYAUIY-UHFFFAOYSA-N	1	0	257.337	1.987	50	0		CDAARO
CCS(=O)(=O)NCC[NH2+]C/C(C)=C/c1ccccc1	ZINC000089274493	362308502	/nfs/dbraw/zinc/30/85/02/362308502.db2.gz	LOUGWHNQUORKDP-ACCUITESSA-N	1	0	282.409	1.619	50	0		CDAARO
COc1cccc(/C=C/C(=O)N2CC[N@H+](C)C[C@@H]2C)c1	ZINC000089937744	362323651	/nfs/dbraw/zinc/32/36/51/362323651.db2.gz	BERXWLLLFVNROO-GWJCSSMESA-N	1	0	274.364	1.871	50	0		CDAARO
O[C@@H](C[N@@H+]1CCSC2(CCOCC2)C1)CC(F)(F)F	ZINC000189989000	362345039	/nfs/dbraw/zinc/34/50/39/362345039.db2.gz	XUPVMLVRJWPQID-SNVBAGLBSA-N	1	0	299.358	1.898	50	0		CDAARO
C[C@H](c1cccs1)[N@H+](C)CCc1c[nH]c(=O)n(C)c1=O	ZINC000253536570	362435387	/nfs/dbraw/zinc/43/53/87/362435387.db2.gz	WEKVGRJPRICMIX-SNVBAGLBSA-N	1	0	293.392	1.783	50	0		CDAARO
COCc1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CNC(=O)C2)o1	ZINC000092104689	345623965	/nfs/dbraw/zinc/62/39/65/345623965.db2.gz	APFGGBOEFWLFIW-IUODEOHRSA-N	1	0	292.379	1.917	50	0		CDAARO
C[C@H]1CN(C(=O)c2csc(CC[NH3+])n2)CC(C)(C)O1	ZINC000090953369	290793313	/nfs/dbraw/zinc/79/33/13/290793313.db2.gz	KWTITTCDJRJXGX-VIFPVBQESA-N	1	0	283.397	1.284	50	0		CDAARO
C[NH+](C)[C@@H]1CCC[C@H]1NC(=O)c1cncc(F)c1	ZINC000613659999	347854873	/nfs/dbraw/zinc/85/48/73/347854873.db2.gz	GMUMFBQSWQTIEX-VXGBXAGGSA-N	1	0	251.305	1.433	50	0		CDAARO
Cc1nc(N)nc(NC[C@@H]2CC[N@@H+](C3CC3)C2)c1Cl	ZINC000584885249	349343198	/nfs/dbraw/zinc/34/31/98/349343198.db2.gz	LHAJYHBVTXYMDP-VIFPVBQESA-N	1	0	281.791	1.169	50	0		CDAARO
Cn1cc(CC[NH2+]C2CSCCSC2)cn1	ZINC000584889288	349348108	/nfs/dbraw/zinc/34/81/08/349348108.db2.gz	ZSJNURXPTXBPIL-UHFFFAOYSA-N	1	0	257.428	1.401	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1Cn1cnc2cccnc2c1=O	ZINC000584891307	349350363	/nfs/dbraw/zinc/35/03/63/349350363.db2.gz	HNEFQQJLRCDMNA-NSHDSACASA-N	1	0	258.325	1.276	50	0		CDAARO
O=C(C[N@H+]1CCC[C@H](O)C1)N1CCC2(CCCC2)C1	ZINC000584892199	349350851	/nfs/dbraw/zinc/35/08/51/349350851.db2.gz	DTXXMQBVLSIETK-ZDUSSCGKSA-N	1	0	266.385	1.236	50	0		CDAARO
O=C(CCC[NH+]1CCCC1)N1CCC[C@@H](O)CC1	ZINC000584894598	349354331	/nfs/dbraw/zinc/35/43/31/349354331.db2.gz	XDOAFROVEDRZAH-CYBMUJFWSA-N	1	0	254.374	1.236	50	0		CDAARO
CN(Cc1cnn2cccnc12)C[C@H]1CCCC[N@@H+]1C	ZINC000584895336	349356002	/nfs/dbraw/zinc/35/60/02/349356002.db2.gz	JJLSHIHUVMNJKL-CQSZACIVSA-N	1	0	273.384	1.645	50	0		CDAARO
c1cc(NC2CC[NH+](C3CCOCC3)CC2)ncn1	ZINC000091326646	180135047	/nfs/dbraw/zinc/13/50/47/180135047.db2.gz	KZBBBLCEHCYHTH-UHFFFAOYSA-N	1	0	262.357	1.532	50	0		CDAARO
Cc1cccc(OCC(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)c1	ZINC000091595968	180202273	/nfs/dbraw/zinc/20/22/73/180202273.db2.gz	BNLIJKQFCSVASW-CABCVRRESA-N	1	0	274.364	1.570	50	0		CDAARO
CCCCC[NH2+][C@H]1CS(=O)(=O)C[C@@H]1N1CCCC1	ZINC000089953457	282675477	/nfs/dbraw/zinc/67/54/77/282675477.db2.gz	BMVSEMLBNHMGAH-STQMWFEESA-N	1	0	274.430	1.028	50	0		CDAARO
Cc1nn(CC(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)c(C)c1Cl	ZINC000091745540	180244157	/nfs/dbraw/zinc/24/41/57/180244157.db2.gz	RKYWQNROMCWCKB-NEPJUHHUSA-N	1	0	296.802	1.349	50	0		CDAARO
Cc1cc(C[NH2+]C[C@@H]2CN(C)CCO2)ccc1F	ZINC000105470758	186059802	/nfs/dbraw/zinc/05/98/02/186059802.db2.gz	RIHJIYLITJLJAG-CYBMUJFWSA-N	1	0	252.333	1.554	50	0		CDAARO
COCCC[C@@]1(CO)CCC[N@@H+](C2CCOCC2)C1	ZINC000091988545	180299321	/nfs/dbraw/zinc/29/93/21/180299321.db2.gz	ANDQQZWGPSYRTE-HNNXBMFYSA-N	1	0	271.401	1.667	50	0		CDAARO
CCC[C@H]1CN(C(=O)Cc2cccc(OC)c2)C[C@@H]1[NH3+]	ZINC000092066333	180316128	/nfs/dbraw/zinc/31/61/28/180316128.db2.gz	ZFMNLVJBBVSPGZ-ZFWWWQNUSA-N	1	0	276.380	1.824	50	0		CDAARO
C[C@H](CNC(=O)c1cnccn1)[N@@H+]1CCC[C@@H](C)C1	ZINC000106078700	186101888	/nfs/dbraw/zinc/10/18/88/186101888.db2.gz	VLAGCBHFAIKALH-VXGBXAGGSA-N	1	0	262.357	1.327	50	0		CDAARO
COc1ccc(CN2CC[N@H+](C[C@H](C)O)[C@H](C)C2)cc1F	ZINC000106840860	186139909	/nfs/dbraw/zinc/13/99/09/186139909.db2.gz	SYABXLYVKOFQNJ-OLZOCXBDSA-N	1	0	296.386	1.721	50	0		CDAARO
Cn1cc([C@H]2OCC[C@H]2C[NH2+]Cc2ccccn2)cn1	ZINC000095402033	351396469	/nfs/dbraw/zinc/39/64/69/351396469.db2.gz	BCNWMBAGSMZTMO-WFASDCNBSA-N	1	0	272.352	1.683	50	0		CDAARO
CCc1nc(C)c(C(=O)N[C@@H]2C[NH+]3CCC2CC3)o1	ZINC000065395009	363036030	/nfs/dbraw/zinc/03/60/30/363036030.db2.gz	IJPXASXUYYRBKI-LLVKDONJSA-N	1	0	263.341	1.369	50	0		CDAARO
COCc1noc(C[NH2+][C@H]2CCCCC[C@H]2CO)n1	ZINC000126145518	351570220	/nfs/dbraw/zinc/57/02/20/351570220.db2.gz	DMWKTTWWVPWLSO-QWRGUYRKSA-N	1	0	269.345	1.247	50	0		CDAARO
[NH3+]C1CCN(S(=O)(=O)c2cc(F)ccc2Cl)CC1	ZINC000123868634	187111882	/nfs/dbraw/zinc/11/18/82/187111882.db2.gz	JHFUALIBZQLDOT-UHFFFAOYSA-N	1	0	292.763	1.591	50	0		CDAARO
C[C@@H](CCn1cccn1)[NH2+]CCc1nccs1	ZINC000158780051	188393811	/nfs/dbraw/zinc/39/38/11/188393811.db2.gz	RGFMUMBMCUYGJQ-NSHDSACASA-N	1	0	250.371	1.951	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)NC[C@@H]1CCC[NH2+]C1	ZINC000036961717	363302288	/nfs/dbraw/zinc/30/22/88/363302288.db2.gz	LIJFCVKQBGEMHC-LLVKDONJSA-N	1	0	286.372	1.412	50	0		CDAARO
Cc1n[nH]cc1C[NH2+][C@@H]1CCCN(c2ncccn2)C1	ZINC000037090238	363367542	/nfs/dbraw/zinc/36/75/42/363367542.db2.gz	WVEWLGTVUFRYCB-CYBMUJFWSA-N	1	0	272.356	1.267	50	0		CDAARO
C[C@H]([NH3+])C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000121580715	366188540	/nfs/dbraw/zinc/18/85/40/366188540.db2.gz	WQYINDSPEMMTEK-YUTCNCBUSA-N	1	0	262.353	1.448	50	0		CDAARO
Cc1cc(N[C@H]2C[NH+]3CCC2CC3)ccc1-n1cnnn1	ZINC000037104099	363379221	/nfs/dbraw/zinc/37/92/21/363379221.db2.gz	FCPMHRMXJNDWTL-AWEZNQCLSA-N	1	0	284.367	1.477	50	0		CDAARO
COCCNC(=O)C1CC[NH+](C[C@@H]2CC=CCC2)CC1	ZINC000002828201	355983180	/nfs/dbraw/zinc/98/31/80/355983180.db2.gz	IAHKAEQTOHIIJO-CQSZACIVSA-N	1	0	280.412	1.817	50	0		CDAARO
COc1ccc(Cl)cc1C(=O)NCC[NH+](C)C	ZINC000002842112	355984253	/nfs/dbraw/zinc/98/42/53/355984253.db2.gz	VOVHUQIKTIZQTH-UHFFFAOYSA-N	1	0	256.733	1.640	50	0		CDAARO
Cc1c(Cl)cccc1NC(=O)C(=O)NCC[NH+](C)C	ZINC000002352411	355967202	/nfs/dbraw/zinc/96/72/02/355967202.db2.gz	PATGIIZLCKRLJT-UHFFFAOYSA-N	1	0	283.759	1.265	50	0		CDAARO
C[C@H]1C[C@H]([NH3+])CCN1C(=O)c1ccc2c(c1)CCO2	ZINC000124675306	356058423	/nfs/dbraw/zinc/05/84/23/356058423.db2.gz	UBXKCAHAEQIVCG-GXFFZTMASA-N	1	0	260.337	1.573	50	0		CDAARO
C[NH+](C)CCNC(=O)c1nc(-c2cccc3[nH]ccc32)no1	ZINC000012409763	356298880	/nfs/dbraw/zinc/29/88/80/356298880.db2.gz	ZUDFJUGVQZFGCJ-UHFFFAOYSA-N	1	0	299.334	1.509	50	0		CDAARO
COc1ccc(C[NH2+]CCCN2CCCC2=O)cc1OC	ZINC000013727392	356354989	/nfs/dbraw/zinc/35/49/89/356354989.db2.gz	LSBXMHCDURFWPU-UHFFFAOYSA-N	1	0	292.379	1.806	50	0		CDAARO
Cc1cccc(C(=O)N2CCN(C[C@@H](C)O)C[C@@H]2C)c1F	ZINC000194030068	358503819	/nfs/dbraw/zinc/50/38/19/358503819.db2.gz	WOQWVHNICMRCRU-QWHCGFSZSA-N	1	0	294.370	1.661	50	0		CDAARO
CCS(=O)(=O)c1ccc(N2CC[NH2+][C@H](C)C2)c(F)c1	ZINC000015443630	356416304	/nfs/dbraw/zinc/41/63/04/356416304.db2.gz	QLOVVGFUELASSZ-SNVBAGLBSA-N	1	0	286.372	1.417	50	0		CDAARO
Fc1ccccc1N1CCN([C@@H]2CCC[NH2+]C2)CC1	ZINC000037746630	356490253	/nfs/dbraw/zinc/49/02/53/356490253.db2.gz	BXUAAQNMWXBKFT-CYBMUJFWSA-N	1	0	263.360	1.700	50	0		CDAARO
O=C(CCc1ccc(Cl)cc1)N1CC[NH2+]CC1	ZINC000019684128	356495241	/nfs/dbraw/zinc/49/52/41/356495241.db2.gz	BHDCEIWXQNUJRB-UHFFFAOYSA-N	1	0	252.745	1.704	50	0		CDAARO
C[C@H](CC[N@@H+]1CCN2C(=O)NC[C@@H]2C1)c1ccccc1	ZINC000194060036	358505684	/nfs/dbraw/zinc/50/56/84/358505684.db2.gz	MEMUXWHMRHTWFB-UKRRQHHQSA-N	1	0	273.380	1.890	50	0		CDAARO
C[C@H]1C[NH+](C2CCN(C(=O)c3ccco3)CC2)C[C@H](C)O1	ZINC000019888799	356514627	/nfs/dbraw/zinc/51/46/27/356514627.db2.gz	ILWYUUFBSAZZBD-STQMWFEESA-N	1	0	292.379	1.993	50	0		CDAARO
O=S1(=O)C[C@H](N2CCCCC2)[C@H](N2CCCCC2)C1	ZINC000022919124	356624434	/nfs/dbraw/zinc/62/44/34/356624434.db2.gz	WAHBBOGSKMBXSI-OKILXGFUSA-N	1	0	286.441	1.124	50	0		CDAARO
O=C(CN(Cc1ccccc1)C1CC1)NC(=O)NC1CC1	ZINC000025127659	356668005	/nfs/dbraw/zinc/66/80/05/356668005.db2.gz	JMPVGUBOMWPUEN-UHFFFAOYSA-N	1	0	287.363	1.639	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@H]([NH2+][C@@H]2CCOC2)C1	ZINC000088724581	366322822	/nfs/dbraw/zinc/32/28/22/366322822.db2.gz	DQCWXLJEMIMTFP-NWDGAFQWSA-N	1	0	270.373	1.764	50	0		CDAARO
O=C(c1ccc2c(c1)NC(=O)CO2)C1CC[NH2+]CC1	ZINC000034956442	356825208	/nfs/dbraw/zinc/82/52/08/356825208.db2.gz	RTUHFYGVAFPFKQ-UHFFFAOYSA-N	1	0	260.293	1.200	50	0		CDAARO
CC(C)CC(=O)N1CCN(C(=O)CCCCC[NH3+])CC1	ZINC000037815137	356935834	/nfs/dbraw/zinc/93/58/34/356935834.db2.gz	VRZYMMVEALDDBH-UHFFFAOYSA-N	1	0	283.416	1.222	50	0	in-vitro	CDAARO
CC[NH2+]Cc1cccc(N2CCCS2(=O)=O)c1	ZINC000041157533	357026314	/nfs/dbraw/zinc/02/63/14/357026314.db2.gz	ZUVZDOQYVFXMPU-UHFFFAOYSA-N	1	0	254.355	1.336	50	0		CDAARO
COc1ccc(Br)cc1C[C@@H](C[NH3+])CO	ZINC000063065245	357502578	/nfs/dbraw/zinc/50/25/78/357502578.db2.gz	TWGSZHOFHRHTRB-QMMMGPOBSA-N	1	0	274.158	1.567	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCC(C)(C)[NH3+])c(F)c1	ZINC000095432134	357516461	/nfs/dbraw/zinc/51/64/61/357516461.db2.gz	WWFCHLHSGFYUSP-UHFFFAOYSA-N	1	0	260.334	1.150	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)c1cnn2ccn(C)c12	ZINC000065374485	357533115	/nfs/dbraw/zinc/53/31/15/357533115.db2.gz	ZPLGXSXFXRDBAO-UHFFFAOYSA-N	1	0	298.350	1.218	50	0		CDAARO
Cc1c[nH+]ccc1-n1nc(C(C)C)nc1CS(C)(=O)=O	ZINC000065461328	357543757	/nfs/dbraw/zinc/54/37/57/357543757.db2.gz	IOFCOFIJWSWZRP-UHFFFAOYSA-N	1	0	294.380	1.639	50	0		CDAARO
CC(C)[C@H](Cn1ccnc1)NC(=O)c1ccc(=O)n(C)c1	ZINC000065491556	357544103	/nfs/dbraw/zinc/54/41/03/357544103.db2.gz	NXKNOLHDWNSZMH-ZDUSSCGKSA-N	1	0	288.351	1.036	50	0		CDAARO
[NH3+]C[C@@H]1CCN(Cc2cnc(NCc3ccccc3)nc2)C1	ZINC000067758090	357625414	/nfs/dbraw/zinc/62/54/14/357625414.db2.gz	KHRXQLCMLVVHNH-HNNXBMFYSA-N	1	0	297.406	1.869	50	0		CDAARO
O=C(CCc1ccccc1O)N1CCC[C@@]2(CC[NH2+]C2)C1	ZINC000067726265	357621061	/nfs/dbraw/zinc/62/10/61/357621061.db2.gz	BQAMHCDPSVFJTP-KRWDZBQOSA-N	1	0	288.391	1.927	50	0		CDAARO
COCCOc1ccccc1C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188473882	357694476	/nfs/dbraw/zinc/69/44/76/357694476.db2.gz	JWLSMUBHZRIWTM-GFCCVEGCSA-N	1	0	278.352	1.146	50	0		CDAARO
c1ncc(C[N@@H+]2CCOCC3(CCOCC3)C2)s1	ZINC000097108691	357984216	/nfs/dbraw/zinc/98/42/16/357984216.db2.gz	KYMGYAPXXWYPMJ-UHFFFAOYSA-N	1	0	268.382	1.772	50	0		CDAARO
[NH3+]C[C@H](NS(=O)(=O)c1cc(F)c(F)c(F)c1)C1CC1	ZINC000097229415	358043762	/nfs/dbraw/zinc/04/37/62/358043762.db2.gz	XDWMYODVYFDGIG-JTQLQIEISA-N	1	0	294.298	1.120	50	0		CDAARO
C[C@H](CN1CCOCC1)[NH2+][C@@H](CO)c1ccccc1	ZINC000097238528	358051460	/nfs/dbraw/zinc/05/14/60/358051460.db2.gz	AIIHAGBTUAGAFG-HIFRSBDPSA-N	1	0	264.369	1.030	50	0		CDAARO
CCCc1cc(C(=O)N2C[C@@H]3CCC[NH2+][C@@H]3C2)n(C)n1	ZINC000082091704	358146232	/nfs/dbraw/zinc/14/62/32/358146232.db2.gz	FZGQPXRQKDSHEO-WCQYABFASA-N	1	0	276.384	1.197	50	0		CDAARO
COC[C@@H]([NH3+])C(=O)N1CCC(Oc2ccc(C)cc2)CC1	ZINC000082172038	358150261	/nfs/dbraw/zinc/15/02/61/358150261.db2.gz	UAKCCQHNCNFKPF-OAHLLOKOSA-N	1	0	292.379	1.339	50	0		CDAARO
[NH3+][C@@H]1CC[C@H]2CN(C(=O)CCc3cccs3)C[C@@H]12	ZINC000195562262	358565682	/nfs/dbraw/zinc/56/56/82/358565682.db2.gz	ZIGZRERIIHCQSD-CYZMBNFOSA-N	1	0	264.394	1.876	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1NCCc1nncn1CC	ZINC000095391424	358691797	/nfs/dbraw/zinc/69/17/97/358691797.db2.gz	XFLGDXZRAVFSCQ-UHFFFAOYSA-N	1	0	275.360	1.196	50	0		CDAARO
O=C(C1CCC1)N1CC[N@H+](Cc2ccccc2)C[C@H](O)C1	ZINC000095501374	358696262	/nfs/dbraw/zinc/69/62/62/358696262.db2.gz	SEOJBKSWSGHRGR-INIZCTEOSA-N	1	0	288.391	1.492	50	0		CDAARO
CNC(=O)C[C@H](C)N(C)C(=O)Nc1cccc(C[NH3+])c1	ZINC000097619607	358788186	/nfs/dbraw/zinc/78/81/86/358788186.db2.gz	ZJTQJVGNFOSTHZ-JTQLQIEISA-N	1	0	278.356	1.134	50	0		CDAARO
Cc1ccc(-c2n[nH]cc2CN2CC[NH2+]C[C@@H](O)C2)cc1	ZINC000097744679	358795506	/nfs/dbraw/zinc/79/55/06/358795506.db2.gz	GQPCRQHBUISWGN-OAHLLOKOSA-N	1	0	286.379	1.151	50	0		CDAARO
CCc1ccc(CN2CCN3CC[N@H+](C)C[C@@H]3C2)o1	ZINC000215365478	358886149	/nfs/dbraw/zinc/88/61/49/358886149.db2.gz	YATWVNYXCRJWIU-CYBMUJFWSA-N	1	0	263.385	1.274	50	0		CDAARO
CN(C(=O)c1cnc2c(c1)CCCC2)[C@@H]1CC[N@H+](C)C1	ZINC000215552663	358894389	/nfs/dbraw/zinc/89/43/89/358894389.db2.gz	DQYKRWGHOZSKMS-CQSZACIVSA-N	1	0	273.380	1.737	50	0		CDAARO
Cc1c(F)cccc1C[N@H+]1CC[C@H](N2CCN(C)CC2)C1	ZINC000216300850	358936432	/nfs/dbraw/zinc/93/64/32/358936432.db2.gz	QQZKCZQPBNIAGY-INIZCTEOSA-N	1	0	291.414	1.956	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)CCc1c(C)n[nH]c1C	ZINC000095479229	358987294	/nfs/dbraw/zinc/98/72/94/358987294.db2.gz	HCCWOMUUTDPTTI-ZDUSSCGKSA-N	1	0	278.400	1.560	50	0		CDAARO
O=C(c1c[nH]cn1)N1CCCC[C@H]1C[NH+]1CCCC1	ZINC000219636181	359109597	/nfs/dbraw/zinc/10/95/97/359109597.db2.gz	AOBWYLAZWVXBBF-LBPRGKRZSA-N	1	0	262.357	1.500	50	0		CDAARO
C[NH2+]CCC1CCN(Cc2cc(=O)c(OC)co2)CC1	ZINC000261965077	359590781	/nfs/dbraw/zinc/59/07/81/359590781.db2.gz	ARPBUXSKTSEMPR-UHFFFAOYSA-N	1	0	280.368	1.470	50	0		CDAARO
COC(=O)c1ccccc1NC(=O)c1cc[n+](C)cc1	ZINC000000364621	359613603	/nfs/dbraw/zinc/61/36/03/359613603.db2.gz	WZUWJEBERBYHPM-UHFFFAOYSA-O	1	0	271.296	1.550	50	0		CDAARO
O=C1C[C@H](C[N@H+]2CCC[C@H](C(F)(F)F)C2)CN1	ZINC000585094224	482828620	/nfs/dbraw/zinc/82/86/20/482828620.db2.gz	RYKWCKUWFKNANI-IUCAKERBSA-N	1	0	250.264	1.397	50	0		CDAARO
CCOC(=O)[C@H](CC)Sc1ncnc2c1C[N@H+](C)CC2	ZINC000267009598	360116907	/nfs/dbraw/zinc/11/69/07/360116907.db2.gz	HLVSKJIWBFOJEH-LBPRGKRZSA-N	1	0	295.408	1.898	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)c2ccc3nccn3c2)C1	ZINC000178336556	189108126	/nfs/dbraw/zinc/10/81/26/189108126.db2.gz	DITUIKLYLUKOJW-LBPRGKRZSA-N	1	0	272.352	1.406	50	0		CDAARO
COc1ccccc1CNC(=O)NCC[C@@H]1CCC[NH2+]1	ZINC000426515455	360679302	/nfs/dbraw/zinc/67/93/02/360679302.db2.gz	BJUBNIHCDVOCFB-ZDUSSCGKSA-N	1	0	277.368	1.637	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)COc2ccccc2Cl)C1	ZINC000178994526	189160673	/nfs/dbraw/zinc/16/06/73/189160673.db2.gz	BBPFUAIJFCBKMW-LLVKDONJSA-N	1	0	282.771	1.787	50	0		CDAARO
C[C@H](OC[C@@H]1CCCO1)C(=O)N1CCC[C@H](C)[C@@H]1C[NH3+]	ZINC000299739090	200849529	/nfs/dbraw/zinc/84/95/29/200849529.db2.gz	KKNJONFFNZGZQI-XUXIUFHCSA-N	1	0	284.400	1.156	50	0		CDAARO
O=C(NC1CC[NH+](C2CCOCC2)CC1)c1ccoc1	ZINC000299784311	200873162	/nfs/dbraw/zinc/87/31/62/200873162.db2.gz	NPKLRWPMPHGVMV-UHFFFAOYSA-N	1	0	278.352	1.653	50	0		CDAARO
CC1(C)[C@H]([NH2+]Cc2nnc3n2CCCC3)[C@H]2CCCO[C@H]21	ZINC000248872446	361509590	/nfs/dbraw/zinc/50/95/90/361509590.db2.gz	KTESGAHJDCXLOJ-KCPJHIHWSA-N	1	0	290.411	1.908	50	0		CDAARO
COc1cccc(CN2CC[N@H+](C)[C@H](CCO)C2)c1	ZINC000104396730	361587016	/nfs/dbraw/zinc/58/70/16/361587016.db2.gz	PRELKPJCCVHDGS-CQSZACIVSA-N	1	0	264.369	1.194	50	0		CDAARO
CC[N@H+](C)C[C@]1(O)CCCN(Cc2ccccc2F)C1=O	ZINC000012589775	370720314	/nfs/dbraw/zinc/72/03/14/370720314.db2.gz	KDMJZPDYCJXFMZ-MRXNPFEDSA-N	1	0	294.370	1.631	50	0		CDAARO
COC(=O)[C@H]1CCN(Cc2cncs2)C[C@@H]1C	ZINC000188101323	365029910	/nfs/dbraw/zinc/02/99/10/365029910.db2.gz	NZWBTYWCFYGOMC-ONGXEEELSA-N	1	0	254.355	1.774	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](Nc2nc(C(C)C)no2)C1	ZINC000089893676	366957154	/nfs/dbraw/zinc/95/71/54/366957154.db2.gz	DVLRCGOBLGQAJM-NSHDSACASA-N	1	0	268.361	1.716	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1CC(=O)NCc1cccs1	ZINC000089939110	366972496	/nfs/dbraw/zinc/97/24/96/366972496.db2.gz	IIGAKQSBFCYMNX-NSHDSACASA-N	1	0	267.398	1.000	50	0		CDAARO
CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1[NH2+]Cc1nccn1C	ZINC000089949194	366978817	/nfs/dbraw/zinc/97/88/17/366978817.db2.gz	SUGJNMPXUHWHHN-GXTWGEPZSA-N	1	0	290.411	1.547	50	0		CDAARO
CC[C@@H](CO)[NH2+]C[C@@H](O)COCc1ccc(Cl)cc1	ZINC000003893464	371103148	/nfs/dbraw/zinc/10/31/48/371103148.db2.gz	RKQDUSVCVGWAKJ-UONOGXRCSA-N	1	0	287.787	1.578	50	0		CDAARO
Cc1cc(=O)c(OCc2ccccc2)c(C[NH3+])n1C	ZINC000036259246	372341008	/nfs/dbraw/zinc/34/10/08/372341008.db2.gz	YWDKTOKVJMCHGW-UHFFFAOYSA-N	1	0	258.321	1.731	50	0		CDAARO
C[C@H](C1CCN(C(=O)Cn2nccn2)CC1)[NH+]1CCCC1	ZINC000299765858	372749544	/nfs/dbraw/zinc/74/95/44/372749544.db2.gz	CKOLKHRXKVPSSW-CYBMUJFWSA-N	1	0	291.399	1.001	50	0		CDAARO
O=C(NC[C@]1(O)CC[NH2+]C1)Nc1ccc2ccccc2c1	ZINC000299779874	372756713	/nfs/dbraw/zinc/75/67/13/372756713.db2.gz	OGQRXNLELKUJQK-INIZCTEOSA-N	1	0	285.347	1.686	50	0		CDAARO
[NH3+]CCSc1ccc(NC(=O)c2ccno2)cn1	ZINC000299803925	372772646	/nfs/dbraw/zinc/77/26/46/372772646.db2.gz	LJYQEPUZVIBCFZ-UHFFFAOYSA-N	1	0	264.310	1.373	50	0		CDAARO
COc1cccnc1C[N@@H+]1CC[C@]2(OC)CC[C@H](O)C[C@H]12	ZINC000299802741	372772972	/nfs/dbraw/zinc/77/29/72/372772972.db2.gz	OJSLMVSIRZYMNT-VBNZEHGJSA-N	1	0	292.379	1.595	50	0		CDAARO
CN(CCc1cccc2ccccc21)C(=O)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000239722534	189902199	/nfs/dbraw/zinc/90/21/99/189902199.db2.gz	CDDYEFDSBDEFEM-RDJZCZTQSA-N	1	0	298.386	1.564	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCN(S(C)(=O)=O)C2)C[C@H]1C	ZINC000253370409	373676574	/nfs/dbraw/zinc/67/65/74/373676574.db2.gz	QKFKGEZVYFDTDN-SYQHCUMBSA-N	1	0	288.457	1.682	50	0		CDAARO
COc1ccc([C@@H](C[NH+](C)C)NCc2cnnn2C)cc1	ZINC000253416419	373725772	/nfs/dbraw/zinc/72/57/72/373725772.db2.gz	APVWDOHFFPDSSY-OAHLLOKOSA-N	1	0	289.383	1.216	50	0		CDAARO
CN(C)C(=O)[C@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1	ZINC000012997966	374005515	/nfs/dbraw/zinc/00/55/15/374005515.db2.gz	HHUHKGUFUAPVKE-CQSZACIVSA-N	1	0	289.379	1.568	50	0		CDAARO
Cn1nccc1C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000002781579	169829836	/nfs/dbraw/zinc/82/98/36/169829836.db2.gz	MTYKIVATDSWTPE-UHFFFAOYSA-N	1	0	264.373	1.459	50	0		CDAARO
c1c([C@H]2CCC[NH2+]C2)nnn1Cc1cn2c(n1)SCC2	ZINC000095355028	374888764	/nfs/dbraw/zinc/88/87/64/374888764.db2.gz	XHHKSAGFZUYZGC-JTQLQIEISA-N	1	0	290.396	1.096	50	0		CDAARO
Cc1ccc(CN2C[C@@H](O)[C@H](O)C2)c(Br)c1	ZINC000278416818	374843220	/nfs/dbraw/zinc/84/32/20/374843220.db2.gz	QYVSOVRIDKGOJD-VXGBXAGGSA-N	1	0	286.169	1.295	50	0		CDAARO
O[C@H](CNc1cc[nH+]c2ccccc12)CN1CCOCC1	ZINC000095428399	374926823	/nfs/dbraw/zinc/92/68/23/374926823.db2.gz	ARXMAQJVDZEODT-CYBMUJFWSA-N	1	0	287.363	1.340	50	0		CDAARO
C[C@@H](C(=O)NCC(F)(F)F)[N@H+](C)CC1CCC1	ZINC000095430673	374932768	/nfs/dbraw/zinc/93/27/68/374932768.db2.gz	XRESUCWFBPPJEL-QMMMGPOBSA-N	1	0	252.280	1.785	50	0		CDAARO
NC(=O)C1(C[NH2+]Cc2ccsc2)CCOCC1	ZINC000095409898	374912376	/nfs/dbraw/zinc/91/23/76/374912376.db2.gz	BFOXNCTVAFXSPL-UHFFFAOYSA-N	1	0	254.355	1.120	50	0		CDAARO
CCO[C@H]1CCCN(C(=O)[C@@H](C2CC2)[NH+]2CCCC2)C1	ZINC000095939780	375037236	/nfs/dbraw/zinc/03/72/36/375037236.db2.gz	ANZCHLXPDCBAHP-LSDHHAIUSA-N	1	0	280.412	1.888	50	0		CDAARO
C[C@H]1OCC[C@H]1[NH2+]C(C)(C)C(=O)NCC1CCCC1	ZINC000097038411	375139353	/nfs/dbraw/zinc/13/93/53/375139353.db2.gz	FQAWYFXJPXQMLB-DGCLKSJQSA-N	1	0	268.401	1.838	50	0		CDAARO
CCn1cc(C[N@@H+]2C[C@H]3CCC[C@]3(C(=O)OC)C2)cn1	ZINC000097084939	375146753	/nfs/dbraw/zinc/14/67/53/375146753.db2.gz	LTJKLFIWQCAKNF-HIFRSBDPSA-N	1	0	277.368	1.678	50	0		CDAARO
COc1ccc(C(=O)NCC[NH2+][C@H]2CCCSC2)cc1	ZINC000097084593	375146916	/nfs/dbraw/zinc/14/69/16/375146916.db2.gz	SDHRYAUGGTXLFL-ZDUSSCGKSA-N	1	0	294.420	1.910	50	0		CDAARO
O=C(NC[C@H](O)c1ccccc1Cl)[C@H]1CCC[NH2+]1	ZINC000299741569	375202190	/nfs/dbraw/zinc/20/21/90/375202190.db2.gz	GLUXHDHYSWHQBV-NEPJUHHUSA-N	1	0	268.744	1.242	50	0		CDAARO
[NH3+]C[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1cccc(F)c1	ZINC000299745964	375204728	/nfs/dbraw/zinc/20/47/28/375204728.db2.gz	UIGOMBJARAUVKC-MELADBBJSA-N	1	0	262.328	1.879	50	0		CDAARO
O=C(NCc1cc2cc(F)ccc2s1)[C@@H]1C[C@@H](O)C[NH2+]1	ZINC000299749646	375207496	/nfs/dbraw/zinc/20/74/96/375207496.db2.gz	LDGGVKKZUDIVNB-PWSUYJOCSA-N	1	0	294.351	1.379	50	0		CDAARO
Cc1cc(NC(=O)CN2C[C@H](C)C[C@H](C)C2)no1	ZINC000012686179	375273285	/nfs/dbraw/zinc/27/32/85/375273285.db2.gz	MLGBHNMSVWORNJ-AOOOYVTPSA-N	1	0	251.330	1.899	50	0		CDAARO
Cc1cc(NC(=O)CNCC(C)(C)C[NH+](C)C)no1	ZINC000003310072	375637918	/nfs/dbraw/zinc/63/79/18/375637918.db2.gz	VVZQWBKXGQJSMR-UHFFFAOYSA-N	1	0	268.361	1.099	50	0		CDAARO
CCNC(=O)NC(=O)[C@H](C)[N@@H+]1CC[C@H]2CCCC[C@H]2C1	ZINC000239425986	376015478	/nfs/dbraw/zinc/01/54/78/376015478.db2.gz	VOMLNBIKGLAHPU-XQQFMLRXSA-N	1	0	281.400	1.733	50	0		CDAARO
CCc1nn(C)cc1CN1CC[N@H+](C)C[C@H]1C(C)C	ZINC000241124387	376017447	/nfs/dbraw/zinc/01/74/47/376017447.db2.gz	JHWVSVVHGWZGHL-HNNXBMFYSA-N	1	0	264.417	1.755	50	0		CDAARO
CCNc1ncc(C(=O)NCC[C@@H]2CCC[N@H+](C)C2)cn1	ZINC000067563332	377158405	/nfs/dbraw/zinc/15/84/05/377158405.db2.gz	HNRWKWYQVXALPE-LBPRGKRZSA-N	1	0	291.399	1.370	50	0		CDAARO
Cc1ccccc1C[NH2+]C[C@@H](O)CN1CCCC1=O	ZINC000001391346	377592502	/nfs/dbraw/zinc/59/25/02/377592502.db2.gz	AMTALYNWDRKLON-CQSZACIVSA-N	1	0	262.353	1.068	50	0		CDAARO
FC(F)(F)CN1CCN(C[C@@H]2CCC[NH2+]C2)CC1	ZINC000061941405	378186933	/nfs/dbraw/zinc/18/69/33/378186933.db2.gz	QWEKGBRGCQTIPA-LLVKDONJSA-N	1	0	265.323	1.166	50	0		CDAARO
O=C(c1coc2c1C(=O)CCC2)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065469912	296295993	/nfs/dbraw/zinc/29/59/93/296295993.db2.gz	CSDMTTPADBTGDG-MNOVXSKESA-N	1	0	288.347	1.765	50	0		CDAARO
Cc1cc(C)n(CCC[NH2+]C2CCN(C)CC2)n1	ZINC000120727030	412997874	/nfs/dbraw/zinc/99/78/74/412997874.db2.gz	HYXLVGCYAMYHMB-UHFFFAOYSA-N	1	0	250.390	1.574	50	0		CDAARO
COc1ccc(C(=O)N[C@H]2CC[NH2+]C[C@@H]2C)c(OC)c1	ZINC000094344996	184786010	/nfs/dbraw/zinc/78/60/10/184786010.db2.gz	VUOLDKORNKBSSV-GWCFXTLKSA-N	1	0	278.352	1.432	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)c2ccc(C)cc2F)C1	ZINC000094919019	184893227	/nfs/dbraw/zinc/89/32/27/184893227.db2.gz	VVNSJLCVTXCWOL-NSHDSACASA-N	1	0	250.317	1.958	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@H](C[NH2+][C@@H]2CCOC2)C1	ZINC000097372194	390176603	/nfs/dbraw/zinc/17/66/03/390176603.db2.gz	XAUVDQSSGQNPCX-NWDGAFQWSA-N	1	0	270.373	1.622	50	0		CDAARO
Cc1cc(-c2cccc3c2O[C@H](C[NH3+])C3)nc(N(C)C)n1	ZINC000067741941	390576225	/nfs/dbraw/zinc/57/62/25/390576225.db2.gz	CZCZUXJZRRLANL-LBPRGKRZSA-N	1	0	284.363	1.780	50	0		CDAARO
Cc1c(CNc2cc(C[NH+](C)C)ccn2)cnn1C	ZINC000097045286	390658873	/nfs/dbraw/zinc/65/88/73/390658873.db2.gz	JFXOJCANVAIAMV-UHFFFAOYSA-N	1	0	259.357	1.797	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1C(=O)/C=C\c1ccc2c(c1)CCO2	ZINC000098055869	390869980	/nfs/dbraw/zinc/86/99/80/390869980.db2.gz	DOFORYIRJBVTPP-RYWCDNDXSA-N	1	0	286.375	1.797	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](Nc2nc3ccccc3c(=O)[nH]2)C1	ZINC000097995092	390815260	/nfs/dbraw/zinc/81/52/60/390815260.db2.gz	VFUSZHQFIJZNCK-LLVKDONJSA-N	1	0	272.352	1.819	50	0		CDAARO
Cn1cncc1C[N@H+](C)C[C@@H]1CC(=O)N(C(C)(C)C)C1	ZINC000215527188	390994618	/nfs/dbraw/zinc/99/46/18/390994618.db2.gz	ZORNBSFAJPKDHT-LBPRGKRZSA-N	1	0	278.400	1.499	50	0		CDAARO
C[C@@H](NC(=O)[C@H]1CCCOC1)C(C)(C)C[NH+](C)C	ZINC000096449598	533266318	/nfs/dbraw/zinc/26/63/18/533266318.db2.gz	LXCAXPVEVGKZDE-NEPJUHHUSA-N	1	0	256.390	1.506	50	0		CDAARO
COc1c(C)cc(C[NH2+]C(C)(CO)CO)cc1C	ZINC000096499894	533398396	/nfs/dbraw/zinc/39/83/96/533398396.db2.gz	BTRROXZFJYXJHZ-UHFFFAOYSA-N	1	0	253.342	1.145	50	0		CDAARO
CCOC[C@H](O)C[N@@H+]1C[C@@H](O)C[C@@H]1c1cccc(F)c1	ZINC000281939402	391430909	/nfs/dbraw/zinc/43/09/09/391430909.db2.gz	TWBVNBWULSYDPO-RRFJBIMHSA-N	1	0	283.343	1.331	50	0		CDAARO
C[NH2+]C[C@@H](C)C(=O)NC[C@@H](O)c1ccccc1C	ZINC000262674922	131249754	/nfs/dbraw/zinc/24/97/54/131249754.db2.gz	TWGKNRHVDBBDJD-DGCLKSJQSA-N	1	0	250.342	1.000	50	0		CDAARO
Cc1ccccc1-n1cc(C(=O)N(C)[C@H]2CC[NH2+]C2)cn1	ZINC000269145988	132120811	/nfs/dbraw/zinc/12/08/11/132120811.db2.gz	DGHUNQVWJFLJRW-AWEZNQCLSA-N	1	0	284.363	1.615	50	0		CDAARO
C[C@H](CNC(=O)c1c(F)cccc1F)N1CC[NH+](C)CC1	ZINC000096403436	393178970	/nfs/dbraw/zinc/17/89/70/393178970.db2.gz	USKTWAWSEMOQCA-LLVKDONJSA-N	1	0	297.349	1.331	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)COc1ccc(F)cc1F	ZINC000178285574	140002842	/nfs/dbraw/zinc/00/28/42/140002842.db2.gz	BBWDJAPRVODTDJ-NSHDSACASA-N	1	0	284.306	1.554	50	0		CDAARO
C[C@H]1C[C@@H](C[NH3+])CN1C(=O)c1cccc2[nH]ncc21	ZINC000261623407	140364298	/nfs/dbraw/zinc/36/42/98/140364298.db2.gz	CELBKIFQXGOIQI-UWVGGRQHSA-N	1	0	258.325	1.372	50	0		CDAARO
Cc1ccc(C[NH2+][C@@H](CN2CCOCC2)C(C)C)nc1	ZINC000095416710	292106105	/nfs/dbraw/zinc/10/61/05/292106105.db2.gz	XAOBWAYTTXRYSO-INIZCTEOSA-N	1	0	277.412	1.836	50	0		CDAARO
CCc1cccc(-n2cc(C(=O)N3CCC([NH3+])CC3)nn2)c1	ZINC000071775237	397909587	/nfs/dbraw/zinc/90/95/87/397909587.db2.gz	GZNUAHHTBGBTKA-UHFFFAOYSA-N	1	0	299.378	1.393	50	0		CDAARO
CCOC(=O)[C@H]1C[NH2+]C[C@@]12CCN(C(=O)OC(C)(C)C)C2	ZINC000091303163	285944538	/nfs/dbraw/zinc/94/45/38/285944538.db2.gz	LKKYIMUKDUHHII-IAQYHMDHSA-N	1	0	298.383	1.396	50	0		CDAARO
CC1(C)C(NC(=O)COC2CC[NH2+]CC2)C1(C)C	ZINC000092818299	147026076	/nfs/dbraw/zinc/02/60/76/147026076.db2.gz	VAGZNQBPKSUESA-UHFFFAOYSA-N	1	0	254.374	1.306	50	0		CDAARO
CCN(CC)S(=O)(=O)c1ccc([C@@H](C)[NH3+])cc1	ZINC000004200446	169943492	/nfs/dbraw/zinc/94/34/92/169943492.db2.gz	FIYBJCPCCOIVNL-SNVBAGLBSA-N	1	0	256.371	1.737	50	0		CDAARO
CCS(=O)(=O)N1CCC([N@@H+]2CCC[C@H](C)C2)CC1	ZINC000004744106	170009630	/nfs/dbraw/zinc/00/96/30/170009630.db2.gz	KJHRSAIJHNPEJG-LBPRGKRZSA-N	1	0	274.430	1.532	50	0		CDAARO
COc1ccccc1C[C@H](C)[NH2+][C@@H]1CCCCNC1=O	ZINC000005729902	170134538	/nfs/dbraw/zinc/13/45/38/170134538.db2.gz	PRMOMIGBCGVQBO-GXTWGEPZSA-N	1	0	276.380	1.885	50	0		CDAARO
Cn1c2ccc(C[NH2+]C3CCCC3)cc2n(C)c1=O	ZINC000006670045	170224624	/nfs/dbraw/zinc/22/46/24/170224624.db2.gz	YOUYNSDGJHLMQQ-UHFFFAOYSA-N	1	0	259.353	1.909	50	0		CDAARO
C[NH+](C)CCNC(=O)c1ccc(N2CCCC2=O)cc1	ZINC000006769310	170242690	/nfs/dbraw/zinc/24/26/90/170242690.db2.gz	XKLTXPHXILETQB-UHFFFAOYSA-N	1	0	275.352	1.105	50	0		CDAARO
CCOCCCN1C(=O)C(C=C2C=C[NH2+]C=C2)=NC1=S	ZINC000009337884	170372646	/nfs/dbraw/zinc/37/26/46/170372646.db2.gz	FJDIGOSUHBHDBA-UHFFFAOYSA-N	1	0	291.376	1.538	50	0		CDAARO
COc1ccccc1NC(=[NH2+])Nc1nc2c(c(=O)[nH]1)CCC2	ZINC000009938428	170391670	/nfs/dbraw/zinc/39/16/70/170391670.db2.gz	OKOQVWGKCCAOJM-UHFFFAOYSA-N	1	0	299.334	1.726	50	0		CDAARO
CNc1ccc(C(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)cn1	ZINC000011946822	170460254	/nfs/dbraw/zinc/46/02/54/170460254.db2.gz	HNWQDCMSVCQCSF-CYBMUJFWSA-N	1	0	290.411	1.831	50	0		CDAARO
CC[NH+]1CCC(NC(=O)COc2ccccc2F)CC1	ZINC000016580606	170703180	/nfs/dbraw/zinc/70/31/80/170703180.db2.gz	GYNUGMMPSHQPPL-UHFFFAOYSA-N	1	0	280.343	1.805	50	0		CDAARO
CC[NH+]1CCN(CCOc2ccccc2CO)CC1	ZINC000020390520	171179685	/nfs/dbraw/zinc/17/96/85/171179685.db2.gz	UCMHTEBPVPLGNN-UHFFFAOYSA-N	1	0	264.369	1.195	50	0		CDAARO
COC1CC[NH+](Cc2ccccc2-c2nn[nH]n2)CC1	ZINC000020450375	171207706	/nfs/dbraw/zinc/20/77/06/171207706.db2.gz	AHZDMWYLNSBDPV-UHFFFAOYSA-N	1	0	273.340	1.478	50	0		CDAARO
C[C@H]1CN(CCOc2ccc(C=O)cc2)C[C@H](C)O1	ZINC000020639430	171268970	/nfs/dbraw/zinc/26/89/70/171268970.db2.gz	FWGFRHFIGCOVLE-STQMWFEESA-N	1	0	263.337	1.987	50	0		CDAARO
c1[nH]nc(-c2cccnc2)c1C[NH2+]C[C@@H]1CCCO1	ZINC000037215295	173035346	/nfs/dbraw/zinc/03/53/46/173035346.db2.gz	PSZOUUQLOYEMHW-ZDUSSCGKSA-N	1	0	258.325	1.740	50	0		CDAARO
c1cc2c(c(CNC[C@@H]3CC[N@@H+](C4CC4)C3)c1)OCO2	ZINC000037409509	173186023	/nfs/dbraw/zinc/18/60/23/173186023.db2.gz	XAACTYPCVBJSLF-LBPRGKRZSA-N	1	0	274.364	1.989	50	0		CDAARO
O=S(=O)(CC[NH2+]Cc1ccc(O)cc1)N1CCCCC1	ZINC000040451272	174266030	/nfs/dbraw/zinc/26/60/30/174266030.db2.gz	AODFPHLMMVNTTC-UHFFFAOYSA-N	1	0	298.408	1.298	50	0		CDAARO
CNC(=O)[C@H](Nc1cc(C)[nH+]c(N)n1)c1ccccc1	ZINC000053576201	175549636	/nfs/dbraw/zinc/54/96/36/175549636.db2.gz	PMPREMJULXGMRZ-GFCCVEGCSA-N	1	0	271.324	1.266	50	0		CDAARO
Cc1nn(CCO)cc1CN1CC([N@H+]2CCCC[C@H]2C)C1	ZINC000071278999	176108324	/nfs/dbraw/zinc/10/83/24/176108324.db2.gz	FKBLPZUOADOHFY-CYBMUJFWSA-N	1	0	292.427	1.242	50	0		CDAARO
CCCn1nccc1C(=O)N1CC([N@@H+]2CCCC[C@H]2C)C1	ZINC000071479620	176187483	/nfs/dbraw/zinc/18/74/83/176187483.db2.gz	TVPZTGZPRMEDDR-CYBMUJFWSA-N	1	0	290.411	1.992	50	0		CDAARO
CCCn1nccc1C(=O)N1CC([N@@H+]2CCCC[C@@H]2C)C1	ZINC000071479619	176187672	/nfs/dbraw/zinc/18/76/72/176187672.db2.gz	TVPZTGZPRMEDDR-ZDUSSCGKSA-N	1	0	290.411	1.992	50	0		CDAARO
O=C(NCC1(COc2ccccc2)CC1)[C@@H]1CCC[NH2+]1	ZINC000071748007	176258743	/nfs/dbraw/zinc/25/87/43/176258743.db2.gz	DFCYKALVHIMXIQ-AWEZNQCLSA-N	1	0	274.364	1.714	50	0		CDAARO
O=C(OCc1ccccc1)N1CC[C@H]([NH2+]C2COC2)C1	ZINC000071792069	176263293	/nfs/dbraw/zinc/26/32/93/176263293.db2.gz	ZLFLPXLSIFBWSV-ZDUSSCGKSA-N	1	0	276.336	1.386	50	0		CDAARO
COc1cccc(CN2CCC[C@@]3(CC[NH2+]C3)C2=O)c1	ZINC000072129072	176321115	/nfs/dbraw/zinc/32/11/15/176321115.db2.gz	VTPTWGWEHMYESO-INIZCTEOSA-N	1	0	274.364	1.797	50	0		CDAARO
C[N@@H+]1CCOC[C@@H](CNc2cnc3ccccc3n2)C1	ZINC000072137293	176322575	/nfs/dbraw/zinc/32/25/75/176322575.db2.gz	ZNHMHLNVXCCECT-LBPRGKRZSA-N	1	0	272.352	1.620	50	0		CDAARO
COc1ccc2[nH]c(C(=O)N[C@H]3CC[C@H]3[NH3+])cc2c1	ZINC000072143772	176324331	/nfs/dbraw/zinc/32/43/31/176324331.db2.gz	WUCXSIUEHJRTFO-PWSUYJOCSA-N	1	0	259.309	1.396	50	0		CDAARO
COc1ccc(NC(=O)NC[C@H]2C[NH2+]CCOC2)c(C)c1	ZINC000072163441	176330470	/nfs/dbraw/zinc/33/04/70/176330470.db2.gz	UIRZQUCARGTLFI-GFCCVEGCSA-N	1	0	293.367	1.361	50	0		CDAARO
O[C@@]1(CNCc2c(F)ccc(Cl)c2F)CCC[NH2+]C1	ZINC000072411710	176398829	/nfs/dbraw/zinc/39/88/29/176398829.db2.gz	GOGXHTPYAMVKAC-ZDUSSCGKSA-N	1	0	290.741	1.822	50	0		CDAARO
C[C@@H]1CCCN(C(=O)[C@H]2CSCCS2)[C@@H]1C[NH3+]	ZINC000247447898	287338087	/nfs/dbraw/zinc/33/80/87/287338087.db2.gz	YPTNKOUPVBBDQH-GMTAPVOTSA-N	1	0	274.455	1.421	50	0		CDAARO
COc1ccc(OC)c(COC[C@@H](O)C[NH+](C)C)c1	ZINC000012420251	424377339	/nfs/dbraw/zinc/37/73/39/424377339.db2.gz	JDLJMJQQOOHSLS-LBPRGKRZSA-N	1	0	269.341	1.143	50	0		CDAARO
COc1ccc(-c2cc(C)cc3c2O[C@@H](C[NH3+])C3)nn1	ZINC000299790923	274103576	/nfs/dbraw/zinc/10/35/76/274103576.db2.gz	CAIKCALSCCBGSZ-LLVKDONJSA-N	1	0	271.320	1.723	50	0		CDAARO
O=C1Nc2cc(Cl)c(Cl)cc2N2CC[NH2+]C[C@H]12	ZINC000003966376	275024731	/nfs/dbraw/zinc/02/47/31/275024731.db2.gz	PHGWDAICBXUJDU-SNVBAGLBSA-N	1	0	272.135	1.724	50	0	in-vitro	CDAARO
CC(C)(C)n1nc(C(=O)N2CC[C@@H]([NH3+])C2)cc1C1CC1	ZINC000097019548	275543949	/nfs/dbraw/zinc/54/39/49/275543949.db2.gz	BQTZWCZLEGOQOH-LLVKDONJSA-N	1	0	276.384	1.689	50	0		CDAARO
CCO[C@@H]1C[C@@H](NC(=O)NCC[N@H+](C)C2CC2)C12CCC2	ZINC000096444034	276343842	/nfs/dbraw/zinc/34/38/42/276343842.db2.gz	KPYHKZOZTORFLX-ZIAGYGMSSA-N	1	0	295.427	1.728	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)[C@@H]2Cc3ccccc3O2)CC1	ZINC000096956477	277048841	/nfs/dbraw/zinc/04/88/41/277048841.db2.gz	GMYLNPIHDQHGGY-AWEZNQCLSA-N	1	0	260.337	1.154	50	0		CDAARO
COC(=O)N1CCC[C@@H]([NH2+][C@H]2CCN(C3CC3)C2)C1	ZINC000089401071	277334279	/nfs/dbraw/zinc/33/42/79/277334279.db2.gz	DWHZMQTVBGTBTC-NEPJUHHUSA-N	1	0	267.373	1.044	50	0		CDAARO
C[C@@H]([NH3+])C(=O)N1CCc2c(cnn2-c2ccccc2)C1	ZINC000261884994	278304114	/nfs/dbraw/zinc/30/41/14/278304114.db2.gz	SFQKXPCVCRXKOP-LLVKDONJSA-N	1	0	270.336	1.104	50	0		CDAARO
C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)CCC(F)(F)F	ZINC000095440459	288080603	/nfs/dbraw/zinc/08/06/03/288080603.db2.gz	PDHJRNLSIOXPIL-RKDXNWHRSA-N	1	0	252.280	1.880	50	0		CDAARO
C[NH2+]CCCNS(=O)(=O)Cc1ccccc1Cl	ZINC000122971210	279427949	/nfs/dbraw/zinc/42/79/49/279427949.db2.gz	PPSLSEGXXVMUOH-UHFFFAOYSA-N	1	0	276.789	1.369	50	0		CDAARO
CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)N(C)CC(F)(F)F	ZINC000096486454	279902287	/nfs/dbraw/zinc/90/22/87/279902287.db2.gz	MDVZPBXLSPJHFG-LLVKDONJSA-N	1	0	296.333	1.800	50	0		CDAARO
O=C(Nc1ccc2c(c1)C[NH2+]CCO2)N1CCCC1	ZINC000261594354	280026275	/nfs/dbraw/zinc/02/62/75/280026275.db2.gz	NMSUMIPYTVOHBC-UHFFFAOYSA-N	1	0	261.325	1.796	50	0		CDAARO
O=C1NCCCC[C@H]1[NH+]1CCC(C(F)(F)F)CC1	ZINC000120826846	280285196	/nfs/dbraw/zinc/28/51/96/280285196.db2.gz	RTRVRRHXNFLZNS-SNVBAGLBSA-N	1	0	264.291	1.929	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)/C=C\c2c(C)nn(C)c2Cl)C1	ZINC000254991629	289348879	/nfs/dbraw/zinc/34/88/79/289348879.db2.gz	OIDHXNNPLYTURJ-WYGGZMRJSA-N	1	0	296.802	1.463	50	0		CDAARO
C[C@H]1CCC(=O)N1CC(=O)NCC[N@H+]1[C@H](C)CCC[C@@H]1C	ZINC000027733696	290366605	/nfs/dbraw/zinc/36/66/05/290366605.db2.gz	SRENKLLCHKVTEE-MJBXVCDLSA-N	1	0	295.427	1.376	50	0		CDAARO
O=C(CCc1cnn(-c2ccccc2)c1)NC[C@@H]1CCC[NH2+]1	ZINC000178725468	315958919	/nfs/dbraw/zinc/95/89/19/315958919.db2.gz	LQCSQFOBWPDXGM-HNNXBMFYSA-N	1	0	298.390	1.673	50	0		CDAARO
NC(=O)c1ccc(C[NH2+]C2CSCCSC2)cc1	ZINC000534576217	328310127	/nfs/dbraw/zinc/31/01/27/328310127.db2.gz	SDHWTOMLWDXSGK-UHFFFAOYSA-N	1	0	282.434	1.724	50	0		CDAARO
CC1(C(=O)NC[C@@H]2CC[N@@H+](C3CCCC3)C2)COC1	ZINC000534645397	328330550	/nfs/dbraw/zinc/33/05/50/328330550.db2.gz	IHTWONXPVNACEP-LBPRGKRZSA-N	1	0	266.385	1.404	50	0		CDAARO
Nc1ncc(C(=O)NC[C@H]2CC[N@@H+](C3CCCC3)C2)s1	ZINC000534636987	328333938	/nfs/dbraw/zinc/33/39/38/328333938.db2.gz	IRMJCYAOOUAFPA-SNVBAGLBSA-N	1	0	294.424	1.550	50	0		CDAARO
CC[N@H+](C)C[C@H](C)CNC(=O)N(C)Cc1ccon1	ZINC000534637080	328334214	/nfs/dbraw/zinc/33/42/14/328334214.db2.gz	IKGASXVJFPYTHO-LLVKDONJSA-N	1	0	268.361	1.404	50	0		CDAARO
Fc1ccc(N2CC[C@H]([NH2+]CCn3cncn3)C2)cc1	ZINC000534668544	328346513	/nfs/dbraw/zinc/34/65/13/328346513.db2.gz	LLVYYZVZIJRVNP-ZDUSSCGKSA-N	1	0	275.331	1.286	50	0		CDAARO
CCC[C@@H]1CN(C(=O)[C@@H]([NH3+])c2ccccc2)CCO1	ZINC000182850710	323304674	/nfs/dbraw/zinc/30/46/74/323304674.db2.gz	VQVKFKIGNXCKNL-KGLIPLIRSA-N	1	0	262.353	1.714	50	0		CDAARO
[NH3+][C@@H]1CCC[C@H]1C(=O)N1CCOc2ccccc2C1	ZINC000085370634	482578935	/nfs/dbraw/zinc/57/89/35/482578935.db2.gz	KRQDRGKPVDOLFI-CHWSQXEVSA-N	1	0	260.337	1.535	50	0		CDAARO
CCn1nc(C)c(CN2CCCC[C@@H]([NH3+])C2)c1C	ZINC000082127167	482763429	/nfs/dbraw/zinc/76/34/29/482763429.db2.gz	GGCCUFYMBOCTQE-CYBMUJFWSA-N	1	0	250.390	1.833	50	0		CDAARO
CCc1nsc(N2C[C@@H]3CC[N@H+](C)C[C@@H]3C2)n1	ZINC000585092355	482827632	/nfs/dbraw/zinc/82/76/32/482827632.db2.gz	RGFYVGYKKFAJOH-VHSXEESVSA-N	1	0	252.387	1.488	50	0		CDAARO
Cc1nccn1CC[C@@H](C)[NH2+]Cc1cnc2cnccn12	ZINC000670443475	482988172	/nfs/dbraw/zinc/98/81/72/482988172.db2.gz	ZNRNJXRADNYCOZ-GFCCVEGCSA-N	1	0	284.367	1.803	50	0		CDAARO
Cc1c[nH]c(C[N@@H+]2CCC[C@H](c3nnc[nH]3)C2)c(C)c1=O	ZINC000670446624	482997921	/nfs/dbraw/zinc/99/79/21/482997921.db2.gz	PNLJABHISXOMKK-LBPRGKRZSA-N	1	0	287.367	1.489	50	0		CDAARO
Cc1n[nH]c(C2CC[NH+]([C@H]3CCSC3)CC2)n1	ZINC000670470551	483070046	/nfs/dbraw/zinc/07/00/46/483070046.db2.gz	ZMWNDMVVHRJUBQ-NSHDSACASA-N	1	0	252.387	1.798	50	0		CDAARO
COc1ccccc1N1CC[C@@H]([NH2+]C2CCOCC2)C1=O	ZINC000090392526	483233120	/nfs/dbraw/zinc/23/31/20/483233120.db2.gz	SQLXMBMHCWNOHC-CYBMUJFWSA-N	1	0	290.363	1.569	50	0		CDAARO
CC[N@@H+]1CCC[C@](C)(C(=O)NCCCc2cnn(C)c2)C1	ZINC000095352660	521659857	/nfs/dbraw/zinc/65/98/57/521659857.db2.gz	BDPJHHPFDNTMQX-INIZCTEOSA-N	1	0	292.427	1.591	50	0		CDAARO
CC[C@@H](C(=O)N1CC[C@H](Oc2ccccn2)C1)[NH+](C)C	ZINC000096477439	529279032	/nfs/dbraw/zinc/27/90/32/529279032.db2.gz	PIGIQYZJKMFLRA-STQMWFEESA-N	1	0	277.368	1.402	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@H]([NH3+])C(C)(C)C)C1	ZINC000958527867	613973473	/nfs/dbraw/zinc/97/34/73/613973473.db2.gz	HKDKSINENXVMRU-SECBINFHSA-N	1	0	258.362	1.342	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@](O)([C@H]([NH3+])C2CCC2)C1	ZINC000958528752	613978736	/nfs/dbraw/zinc/97/87/36/613978736.db2.gz	UGABYRSCXBBBBQ-RISCZKNCSA-N	1	0	270.373	1.486	50	0		CDAARO
CC(C)C[N@@H+]1CCN(C(=O)c2cc[nH]c2)C[C@@H]1CCO	ZINC000952967175	614096188	/nfs/dbraw/zinc/09/61/88/614096188.db2.gz	KVJOYBSLCBHBBR-AWEZNQCLSA-N	1	0	279.384	1.180	50	0		CDAARO
CCN(C[C@H]1CC[N@H+](CC)C1)C(=O)CCn1ccnc1C	ZINC000952981554	615271092	/nfs/dbraw/zinc/27/10/92/615271092.db2.gz	ISCWNFGIRWFMAZ-HNNXBMFYSA-N	1	0	292.427	1.772	50	0		CDAARO
C[NH+]1CCN(C(C)(C)CNC(=O)[C@H]2CC2(C)C)CC1	ZINC000952981403	616232931	/nfs/dbraw/zinc/23/29/31/616232931.db2.gz	IBJJLUWQJPJVJI-GFCCVEGCSA-N	1	0	267.417	1.175	50	0		CDAARO
COc1ccc(-c2cc3c(=O)n(CC[NH3+])ccn3n2)cc1	ZINC000888088169	618077458	/nfs/dbraw/zinc/07/74/58/618077458.db2.gz	KIFKZXPKSJHBFK-UHFFFAOYSA-N	1	0	284.319	1.130	50	0		CDAARO
CCOc1ccccc1OCC[N@H+]1C[C@@H]2[C@H](O)C[C@@H]2C1	ZINC001772707329	1159441907	/nfs/dbraw/zinc/44/19/07/1159441907.db2.gz	VTNXMOKQYDCGMM-HZSPNIEDSA-N	1	0	277.364	1.777	50	0		CDAARO
CCC[NH+](CCC)C1CCN(c2nnc(CN)o2)CC1	ZINC001772710078	1159444511	/nfs/dbraw/zinc/44/45/11/1159444511.db2.gz	LWYGTOBQTDQWND-UHFFFAOYSA-N	1	0	281.404	1.619	50	0		CDAARO
COc1cccc(C[N@H+]2CCc3nncn3CC2)c1	ZINC000020996189	1166944301	/nfs/dbraw/zinc/94/43/01/1166944301.db2.gz	XMUNHZORRQUHFB-UHFFFAOYSA-N	1	0	258.325	1.345	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](CC3CCC3)C[C@H]2O)on1	ZINC001704344069	1177694918	/nfs/dbraw/zinc/69/49/18/1177694918.db2.gz	NMTBOPCYIDAZGH-TZMCWYRMSA-N	1	0	250.342	1.618	50	0		CDAARO
COc1cccc(F)c1C[NH2+][C@@H]1CC=CC[C@H]1C(N)=O	ZINC000952860044	910411598	/nfs/dbraw/zinc/41/15/98/910411598.db2.gz	AVIYOSYEQMQGPQ-ZWNOBZJWSA-N	1	0	278.327	1.744	50	0		CDAARO
C[C@H]([NH2+][C@H]1C(=O)NCC1(C)C)C1(Br)CC1	ZINC000952876871	910435005	/nfs/dbraw/zinc/43/50/05/910435005.db2.gz	GXRXZSWZCUYMLJ-YUMQZZPRSA-N	1	0	275.190	1.417	50	0		CDAARO
COC1(c2noc(C[C@@]3(O)CCC[N@H+](C)C3)n2)CCCC1	ZINC000952885667	910440932	/nfs/dbraw/zinc/44/09/32/910440932.db2.gz	SRHLOASMLADNKJ-AWEZNQCLSA-N	1	0	295.383	1.485	50	0		CDAARO
CC(=O)N1CCC[NH2+]CCNC(=O)C[C@@H]1c1ccccc1	ZINC000952865456	910460700	/nfs/dbraw/zinc/46/07/00/910460700.db2.gz	YHERYRYPXDKXBV-OAHLLOKOSA-N	1	0	289.379	1.076	50	0		CDAARO
CN1CCCC[C@H]1C[NH2+]C1CSCCSC1	ZINC000823778031	925729428	/nfs/dbraw/zinc/72/94/28/925729428.db2.gz	ZUHKLOVPWFNHNS-LBPRGKRZSA-N	1	0	260.472	1.909	50	0		CDAARO
COc1cccc(C)c1C(=O)NCC1(O)CC[NH+](C)CC1	ZINC000824795710	925835569	/nfs/dbraw/zinc/83/55/69/925835569.db2.gz	RUACDWKUZBSDRA-UHFFFAOYSA-N	1	0	292.379	1.190	50	0		CDAARO
CN(CC[NH+]1CCCC1)C(=O)[C@H]1CC[C@@H](O)CC1	ZINC000828863555	926201672	/nfs/dbraw/zinc/20/16/72/926201672.db2.gz	XLFJABRSBKJYGV-BETUJISGSA-N	1	0	254.374	1.092	50	0		CDAARO
COCc1nc(C)cc(N2[C@@H]3CC[C@H]2CC[N@@H+](C)C3)n1	ZINC000585092035	930922522	/nfs/dbraw/zinc/92/25/22/930922522.db2.gz	BONHGOINUWBFFT-QWHCGFSZSA-N	1	0	276.384	1.604	50	0		CDAARO
CCOc1cccc(CNC(=O)[C@@]2(C)C[C@H](O)C[N@@H+]2C)c1	ZINC000585121924	930988390	/nfs/dbraw/zinc/98/83/90/930988390.db2.gz	GHQFWKTVQWXFEP-XJKSGUPXSA-N	1	0	292.379	1.157	50	0		CDAARO
Cn1ccc(C(=O)N2C[C@@H]([NH+](C)C)CCc3ccccc32)n1	ZINC000585122514	930988948	/nfs/dbraw/zinc/98/89/48/930988948.db2.gz	SWXORXVBZXZDIX-AWEZNQCLSA-N	1	0	298.390	1.943	50	0		CDAARO
CC(C)C[N@@H+]1CCN(CCCn2cccc2)C[C@H]1CCO	ZINC001529180619	969006476	/nfs/dbraw/zinc/00/64/76/969006476.db2.gz	FQEPCWKHPPUSPQ-QGZVFWFLSA-N	1	0	293.455	1.903	50	0		CDAARO
Cc1nc[nH]c1C[N@@H+](C[C@H]1CCC(=O)N1)C(C)C	ZINC001506405997	975151493	/nfs/dbraw/zinc/15/14/93/975151493.db2.gz	PEUKVEPCKJCFSD-LLVKDONJSA-N	1	0	250.346	1.207	50	0		CDAARO
COCC[NH+]1CCC(CN(C)Cc2nc(C)c[nH]2)CC1	ZINC001506414692	975155651	/nfs/dbraw/zinc/15/56/51/975155651.db2.gz	SOXGUURVWSPBMB-UHFFFAOYSA-N	1	0	280.416	1.508	50	0		CDAARO
Cc1nncn1CCN1CC[NH+](CC2CCC2)CC1	ZINC001506418224	975156656	/nfs/dbraw/zinc/15/66/56/975156656.db2.gz	VWRRHEHSGBTKIH-UHFFFAOYSA-N	1	0	263.389	1.004	50	0		CDAARO
COc1cccc(CN(CC[NH+](C)C)S(C)(=O)=O)c1	ZINC000190497853	342453120	/nfs/dbraw/zinc/45/31/20/342453120.db2.gz	BYGFMYUUSZIFTD-UHFFFAOYSA-N	1	0	286.397	1.018	50	0		CDAARO
Cn1ccc(CNC(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)c1	ZINC000096499810	230384370	/nfs/dbraw/zinc/38/43/70/230384370.db2.gz	KCNMLPRRRITDLH-CABCVRRESA-N	1	0	290.411	1.651	50	0		CDAARO
CCC[C@@H]1CN(C(=O)C(=O)c2cccn2C)C[C@H]1[NH+](C)C	ZINC000095506451	185000535	/nfs/dbraw/zinc/00/05/35/185000535.db2.gz	YZMBGEUDTKBEBD-TZMCWYRMSA-N	1	0	291.395	1.397	50	0		CDAARO
CC(C)C[C@@H]([NH3+])C(=O)N1CCC(c2ncc[nH]2)CC1	ZINC000095506265	185000872	/nfs/dbraw/zinc/00/08/72/185000872.db2.gz	NRZUBFWVCDFYMD-GFCCVEGCSA-N	1	0	264.373	1.489	50	0		CDAARO
Cc1ccc2c(C)cc(NCCc3nc(N)n[nH]3)nc2c1C	ZINC000584902257	341986798	/nfs/dbraw/zinc/98/67/98/341986798.db2.gz	AINQRPSJVNMZOI-UHFFFAOYSA-N	1	0	296.378	1.767	50	0		CDAARO
Cc1ccccc1CC(=O)N1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1	ZINC000185122758	230395904	/nfs/dbraw/zinc/39/59/04/230395904.db2.gz	WVMZCRDWAHFHFL-ZNMIVQPWSA-N	1	0	258.365	1.733	50	0		CDAARO
Cc1ccc(C)c(CNC(=O)NC[C@@H]2CCC[NH2+]2)c1	ZINC000426478106	230419702	/nfs/dbraw/zinc/41/97/02/230419702.db2.gz	WREWTVMUMFJSTO-AWEZNQCLSA-N	1	0	261.369	1.855	50	0		CDAARO
CC[N@H+](C[C@H]1CCOC1)[C@H]1CCN(C(C)C)C1=O	ZINC000110695260	342561596	/nfs/dbraw/zinc/56/15/96/342561596.db2.gz	SBWYTIXEQAKAIP-OLZOCXBDSA-N	1	0	254.374	1.354	50	0		CDAARO
CC1(c2ccccc2)CCC([NH2+]C(CO)CO)CC1	ZINC000095982177	185053756	/nfs/dbraw/zinc/05/37/56/185053756.db2.gz	VTMUMFZPJWZDID-UHFFFAOYSA-N	1	0	263.381	1.830	50	0		CDAARO
COc1cc(C[N@@H+]2CC[C@@H](C(N)=O)C2)cc(OC)c1	ZINC000095982236	185054140	/nfs/dbraw/zinc/05/41/40/185054140.db2.gz	BRKUTIKRJXNVEC-LLVKDONJSA-N	1	0	264.325	1.011	50	0		CDAARO
CC[C@H](C)[C@H]([NH3+])C(=O)N(C)OCc1ccccc1	ZINC000095996359	185060562	/nfs/dbraw/zinc/06/05/62/185060562.db2.gz	NQVLDCIUUBFCLT-AAEUAGOBSA-N	1	0	250.342	1.950	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCNc2cnccc2C(N)=O)C[C@H](C)O1	ZINC000096006361	185062982	/nfs/dbraw/zinc/06/29/82/185062982.db2.gz	ONZODLAPJLLZAU-TXEJJXNPSA-N	1	0	292.383	1.092	50	0		CDAARO
O=S(=O)(/C=C\c1ccccc1)N1CC[N@@H+]2CCC[C@@H]2C1	ZINC000096034953	185068092	/nfs/dbraw/zinc/06/80/92/185068092.db2.gz	PDHTVMCUUHTGJD-LDCOFTPGSA-N	1	0	292.404	1.767	50	0		CDAARO
C[C@](O)(C[N@@H+]1CCC[C@H](Cn2ccnn2)C1)C(F)(F)F	ZINC000241587907	361753714	/nfs/dbraw/zinc/75/37/14/361753714.db2.gz	OYBLWSZGJUEHQP-QWRGUYRKSA-N	1	0	292.305	1.303	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)CCc1cc(F)ccc1F	ZINC000124777305	187153637	/nfs/dbraw/zinc/15/36/37/187153637.db2.gz	JZFOSLJLNVMZPU-SNVBAGLBSA-N	1	0	268.307	1.718	50	0		CDAARO
CCCC[NH+]1CCN(C(=O)c2cn3ccccc3n2)CC1	ZINC000097938986	342101379	/nfs/dbraw/zinc/10/13/79/342101379.db2.gz	KXJQWHXZEHDZKM-UHFFFAOYSA-N	1	0	286.379	1.892	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)CCC(C)(C)c1ccccc1	ZINC000195554011	342625787	/nfs/dbraw/zinc/62/57/87/342625787.db2.gz	VKXFKJLRRCAKBV-GJZGRUSLSA-N	1	0	290.407	1.847	50	0		CDAARO
CNC(=O)C[C@H](C)[N@H+](C)Cc1cc(OC)ccn1	ZINC000244852884	361866413	/nfs/dbraw/zinc/86/64/13/361866413.db2.gz	VBCOOGOAIBOXRL-JTQLQIEISA-N	1	0	251.330	1.047	50	0		CDAARO
O=C(c1ccco1)N1CCC[N@H+](C[C@@H]2CCOC2)CC1	ZINC000244882709	361867889	/nfs/dbraw/zinc/86/78/89/361867889.db2.gz	XWYWBTXYWVLJQE-ZDUSSCGKSA-N	1	0	278.352	1.464	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@@H](O)C[NH2+]Cc1ccccc1	ZINC000096675811	342173104	/nfs/dbraw/zinc/17/31/04/342173104.db2.gz	YCTJTEUCQCEJNN-ZDUSSCGKSA-N	1	0	280.368	1.662	50	0		CDAARO
CN1CCO[C@H](CNc2ncnc3ccccc32)C1	ZINC000065593902	361918461	/nfs/dbraw/zinc/91/84/61/361918461.db2.gz	ZXRRHMDNTNBYDD-LLVKDONJSA-N	1	0	258.325	1.372	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@H](COC(=O)c2cncc(F)c2)C1	ZINC000097014679	185151792	/nfs/dbraw/zinc/15/17/92/185151792.db2.gz	YOKYYHFMFICBED-AWEZNQCLSA-N	1	0	296.342	1.734	50	0		CDAARO
C[C@H](O)C1CCN(C(=O)C2([NH3+])Cc3ccccc3C2)CC1	ZINC000097019813	185153278	/nfs/dbraw/zinc/15/32/78/185153278.db2.gz	BRZKYZVFFLCGLY-LBPRGKRZSA-N	1	0	288.391	1.102	50	0		CDAARO
CCn1cc(C[N@H+](C)[C@H]2Cc3ccccc3[C@@H]2O)cn1	ZINC000097034112	185157501	/nfs/dbraw/zinc/15/75/01/185157501.db2.gz	RNHQKNQMJUQKCG-HOTGVXAUSA-N	1	0	271.364	1.993	50	0		CDAARO
Cc1cccc2nc(C(=O)N3CCC([NH+](C)C)CC3)cn21	ZINC000685945167	539046119	/nfs/dbraw/zinc/04/61/19/539046119.db2.gz	FQXNGWZXHCBSRG-UHFFFAOYSA-N	1	0	286.379	1.809	50	0		CDAARO
NC(=[NH2+])NCCCO[C@H]1CCC[C@H](C(F)(F)F)C1	ZINC000102192475	342262380	/nfs/dbraw/zinc/26/23/80/342262380.db2.gz	OETBCKZVZFNTCU-IUCAKERBSA-N	1	0	267.295	1.997	50	0		CDAARO
C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)C[NH+]1CCCC1	ZINC000012934804	539100987	/nfs/dbraw/zinc/10/09/87/539100987.db2.gz	FSGSPLVFZNCXSD-GFCCVEGCSA-N	1	0	287.363	1.846	50	0		CDAARO
C[C@@H](Cc1cnccn1)[NH2+]Cc1nncn1-c1ccccc1	ZINC000585116954	362045206	/nfs/dbraw/zinc/04/52/06/362045206.db2.gz	NIAQUGOTZBVQJJ-ZDUSSCGKSA-N	1	0	294.362	1.778	50	0		CDAARO
COc1ccccc1CNC(=O)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000171807180	362071078	/nfs/dbraw/zinc/07/10/78/362071078.db2.gz	NFGKUCUXGQOFLT-AWEZNQCLSA-N	1	0	289.379	1.685	50	0		CDAARO
Cn1ccc(C(=O)N2CC[N@H+](C)[C@H](C(C)(C)C)C2)n1	ZINC000585126904	362059871	/nfs/dbraw/zinc/05/98/71/362059871.db2.gz	KWPWCDAWYUFFCY-LBPRGKRZSA-N	1	0	264.373	1.222	50	0		CDAARO
Cn1cc(CN2CC=C(c3ccc(O)cc3)CC2)nn1	ZINC000093057752	342423502	/nfs/dbraw/zinc/42/35/02/342423502.db2.gz	SOYAMDDRZLNSNK-UHFFFAOYSA-N	1	0	270.336	1.810	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CN(C(=O)c2coc3ccccc23)CCO1	ZINC000127892473	187339543	/nfs/dbraw/zinc/33/95/43/187339543.db2.gz	VKYPVMHZMBIJJK-IINYFYTJSA-N	1	0	274.320	1.621	50	0		CDAARO
C[NH+](C)[C@H]1CN(c2cc(C(F)(F)F)ccn2)C[C@@H]1O	ZINC000365818994	282272414	/nfs/dbraw/zinc/27/24/14/282272414.db2.gz	VYVIDLMKKGPOHS-UWVGGRQHSA-N	1	0	275.274	1.212	50	0		CDAARO
CSC1(C[N@@H+]2CC[C@@H](N(C)C(=O)N(C)C)C2)CCC1	ZINC000597224245	343486324	/nfs/dbraw/zinc/48/63/24/343486324.db2.gz	BHKZXFGJGZNMFK-GFCCVEGCSA-N	1	0	285.457	1.960	50	0		CDAARO
C[C@H]1CN(C(=O)COc2ccc(F)cc2F)C[C@H](C)[NH2+]1	ZINC000179151450	362252359	/nfs/dbraw/zinc/25/23/59/362252359.db2.gz	FWGNGZADWNGSEE-UWVGGRQHSA-N	1	0	284.306	1.552	50	0		CDAARO
O=c1cc(C[NH+](CCO)CCO)[nH]c2c(Cl)cccc12	ZINC000253536662	362435133	/nfs/dbraw/zinc/43/51/33/362435133.db2.gz	JRVHWZMCWXXGQV-UHFFFAOYSA-N	1	0	296.754	1.380	50	0		CDAARO
NC(=O)C1([NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)CC1	ZINC000191488206	362443773	/nfs/dbraw/zinc/44/37/73/362443773.db2.gz	OUWFZWYPIFMUAG-SFYZADRCSA-N	1	0	250.264	1.715	50	0		CDAARO
C[C@@H](CS(C)(=O)=O)[NH2+]Cc1ccc2[nH]cnc2c1	ZINC000603517070	344815741	/nfs/dbraw/zinc/81/57/41/344815741.db2.gz	QVIDJGASSNCMPC-VIFPVBQESA-N	1	0	267.354	1.086	50	0		CDAARO
CCS(=O)(=O)CC[NH2+][C@@H]1CCc2ccc(F)cc21	ZINC000095421748	362531546	/nfs/dbraw/zinc/53/15/46/362531546.db2.gz	LGJUSTWTCDLPPP-CYBMUJFWSA-N	1	0	271.357	1.837	50	0		CDAARO
C[C@H](Cc1ccc(F)cc1)[NH2+]CC(C)(C)C(N)=O	ZINC000097084671	185526588	/nfs/dbraw/zinc/52/65/88/185526588.db2.gz	KPYSITKLVBCHCV-SNVBAGLBSA-N	1	0	252.333	1.858	50	0		CDAARO
Cc1ccccc1CN1CCN([C@H]2CC[NH2+]C2)C1=O	ZINC000085347890	179028747	/nfs/dbraw/zinc/02/87/47/179028747.db2.gz	DCDZNBZQZCZEGM-AWEZNQCLSA-N	1	0	259.353	1.595	50	0		CDAARO
O[C@@H](C[NH+]1CCN(Cc2ccc(F)c(F)c2)CC1)C1CC1	ZINC000085436873	179063008	/nfs/dbraw/zinc/06/30/08/179063008.db2.gz	MONCTYAFIZRLLO-INIZCTEOSA-N	1	0	296.361	1.853	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)Nc1cccnn1)c1cccs1	ZINC000089313843	179768204	/nfs/dbraw/zinc/76/82/04/179768204.db2.gz	DTEIBJMUXIKSFU-SNVBAGLBSA-N	1	0	291.380	1.963	50	0		CDAARO
CC(C)O[C@H]1CN(C(=O)C[NH+]2CCCCCCC2)C[C@@H]1O	ZINC000584884991	349343445	/nfs/dbraw/zinc/34/34/45/349343445.db2.gz	STFHMHXPNIYJBD-GJZGRUSLSA-N	1	0	298.427	1.249	50	0		CDAARO
O=c1ccc(-c2ccccc2)nn1CC[NH2+][C@H]1CCOC1	ZINC000584890973	349349577	/nfs/dbraw/zinc/34/95/77/349349577.db2.gz	YYBGYVPRBVTNTF-AWEZNQCLSA-N	1	0	285.347	1.289	50	0		CDAARO
Nc1nc(C[NH2+][C@@H]2CCC(=O)N(CC3CC3)CC2)cs1	ZINC000584892484	349352008	/nfs/dbraw/zinc/35/20/08/349352008.db2.gz	SOMJOWHQYGJKON-LLVKDONJSA-N	1	0	294.424	1.436	50	0		CDAARO
Cc1c[nH+]ccc1N1CCN(C(=O)c2cncc(O)c2)CC1	ZINC000584894640	349354951	/nfs/dbraw/zinc/35/49/51/349354951.db2.gz	YGGXPRIQSIOQNW-UHFFFAOYSA-N	1	0	298.346	1.453	50	0		CDAARO
COc1ccc2c(c1)CCC[C@@H]2[NH2+]C[C@]1(O)CCOC1	ZINC000090848581	180045736	/nfs/dbraw/zinc/04/57/36/180045736.db2.gz	RKGWXDASLRSJAW-JKSUJKDBSA-N	1	0	277.364	1.814	50	0		CDAARO
OCCO[C@H]1C[C@@H](O)C12CC[NH+](Cc1ccsc1)CC2	ZINC000091493059	180170776	/nfs/dbraw/zinc/17/07/76/180170776.db2.gz	RWPXMGCDOFEZEH-KGLIPLIRSA-N	1	0	297.420	1.472	50	0		CDAARO
CCCn1ncc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)c1C	ZINC000091390649	180143600	/nfs/dbraw/zinc/14/36/00/180143600.db2.gz	KTQGSKQEKPQIKL-KGLIPLIRSA-N	1	0	276.384	1.411	50	0		CDAARO
COC[C@H](Nc1nc(N)[nH+]c(C)c1C)c1ccnn1C	ZINC000091390975	180144813	/nfs/dbraw/zinc/14/48/13/180144813.db2.gz	SRRMJLJIOLXCLJ-JTQLQIEISA-N	1	0	276.344	1.209	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@H]1CC[C@H]([NH3+])C1	ZINC000091545649	180186650	/nfs/dbraw/zinc/18/66/50/180186650.db2.gz	CIFTZGGGJYRGNY-UWVGGRQHSA-N	1	0	253.371	1.537	50	0		CDAARO
CN1CCO[C@@H](C[NH2+]Cc2cc(F)ccc2F)C1	ZINC000105471290	186059304	/nfs/dbraw/zinc/05/93/04/186059304.db2.gz	FBEOYDQTPRORCU-LBPRGKRZSA-N	1	0	256.296	1.385	50	0		CDAARO
CCC[C@H]1CN(C(=O)CCc2scnc2C)C[C@@H]1[NH3+]	ZINC000092106743	180326817	/nfs/dbraw/zinc/32/68/17/180326817.db2.gz	ZVPDQUACEYCMGA-RYUDHWBXSA-N	1	0	281.425	1.970	50	0		CDAARO
CC(=O)NCCC[N@H+]1CCN(C)C[C@H]1c1ccccc1	ZINC000105761393	186070609	/nfs/dbraw/zinc/07/06/09/186070609.db2.gz	FHKRMXXSQZLIFR-INIZCTEOSA-N	1	0	275.396	1.501	50	0		CDAARO
CCC[C@H]1CN(C(=O)CCc2c(C)n[nH]c2C)C[C@@H]1[NH3+]	ZINC000092076917	180317512	/nfs/dbraw/zinc/31/75/12/180317512.db2.gz	HZWYUSAKRFSFEL-JSGCOSHPSA-N	1	0	278.400	1.545	50	0		CDAARO
COC(=O)[C@@]1(C[NH3+])C[C@]12CCN(C(=O)OC(C)(C)C)C2	ZINC000260106087	351202020	/nfs/dbraw/zinc/20/20/20/351202020.db2.gz	GXIZSJFUUBKNJU-KBPBESRZSA-N	1	0	284.356	1.135	50	0		CDAARO
CC(C)(O)c1cn(C2CN(Cc3cccc(F)c3)C2)nn1	ZINC000096000067	351469167	/nfs/dbraw/zinc/46/91/67/351469167.db2.gz	SNEUENDZNDOZAR-UHFFFAOYSA-N	1	0	290.342	1.702	50	0		CDAARO
C[C@H]1CN(C(=O)c2ccc(F)c(F)c2F)C[C@H](C)[NH2+]1	ZINC000094185059	363243114	/nfs/dbraw/zinc/24/31/14/363243114.db2.gz	CUSQYVZFUGHEKB-YUMQZZPRSA-N	1	0	272.270	1.926	50	0		CDAARO
COC(=O)C[C@@]1(C)OC[C@H](C[NH+]2CCCCC2)O1	ZINC000000191974	355895536	/nfs/dbraw/zinc/89/55/36/355895536.db2.gz	GMGIMSPSNKVNFU-AAEUAGOBSA-N	1	0	257.330	1.167	50	0		CDAARO
C[NH+](C)CCOC(=O)C1(c2ccccc2)CCOCC1	ZINC000000217321	355897496	/nfs/dbraw/zinc/89/74/96/355897496.db2.gz	VHNHOBKTWVIXIL-UHFFFAOYSA-N	1	0	277.364	1.840	50	0		CDAARO
COc1ccc(OC)c(C[NH+]2CCC(O)CC2)c1	ZINC000000241738	355898477	/nfs/dbraw/zinc/89/84/77/355898477.db2.gz	MVDDKXZTOZFYIF-UHFFFAOYSA-N	1	0	251.326	1.661	50	0		CDAARO
CC[NH+](CC)C[C@@H](C)NC(=O)c1ccnn1C(F)F	ZINC000002782316	356105509	/nfs/dbraw/zinc/10/55/09/356105509.db2.gz	SBEAHXFAJASRDE-SECBINFHSA-N	1	0	274.315	1.738	50	0		CDAARO
C[NH+]1CCN(c2nc(-c3ccc(F)cc3)cc(=O)[nH]2)CC1	ZINC000009196223	356206207	/nfs/dbraw/zinc/20/62/07/356206207.db2.gz	XGOWDSXOGASSCE-UHFFFAOYSA-N	1	0	288.326	1.328	50	0		CDAARO
CC[N@@H+]1CCC[C@H](Cn2cnc3ccncc3c2=O)C1	ZINC000032573443	356281093	/nfs/dbraw/zinc/28/10/93/356281093.db2.gz	QPEDLPIPHBWWRE-LBPRGKRZSA-N	1	0	272.352	1.523	50	0		CDAARO
C[NH+]1CCC(Cn2cnc3ccncc3c2=O)CC1	ZINC000032582141	356304247	/nfs/dbraw/zinc/30/42/47/356304247.db2.gz	OETJLMHGBFIEKU-UHFFFAOYSA-N	1	0	258.325	1.133	50	0		CDAARO
CC[NH+]1CCC(NC(=O)c2ccc(OC)c(OC)c2)CC1	ZINC000016602762	356442997	/nfs/dbraw/zinc/44/29/97/356442997.db2.gz	SXGZDLYQDGQFCX-UHFFFAOYSA-N	1	0	292.379	1.918	50	0		CDAARO
COc1ccc(N2C(=O)C[C@@H](SCC[NH3+])C2=O)cc1	ZINC000018275881	356471950	/nfs/dbraw/zinc/47/19/50/356471950.db2.gz	UPPLCWKFQXAGKI-LLVKDONJSA-N	1	0	280.349	1.019	50	0		CDAARO
CC[N@@H+]1CCC[C@H](C[NH+]2CCC(OCCOC)CC2)C1	ZINC000019114390	356475262	/nfs/dbraw/zinc/47/52/62/356475262.db2.gz	WTKPPPMODPIDBS-HNNXBMFYSA-N	1	0	284.444	1.846	50	0		CDAARO
CC(C)([NH3+])C(=O)N1CCN(Cc2ccccc2)CC1	ZINC000019672431	356495136	/nfs/dbraw/zinc/49/51/36/356495136.db2.gz	POCCCHSFEVQZBQ-UHFFFAOYSA-N	1	0	261.369	1.068	50	0		CDAARO
C[NH+]1CCN(C[C@@H]2Cn3c4ccoc4cc3C(=O)O2)CC1	ZINC000025757936	356682510	/nfs/dbraw/zinc/68/25/10/356682510.db2.gz	DZFYXJYAKFHASE-LLVKDONJSA-N	1	0	289.335	1.021	50	0		CDAARO
COc1cc(/C=C\C(=O)N2CC[C@@H](C[NH3+])C2)cc(OC)c1	ZINC000255516485	356755244	/nfs/dbraw/zinc/75/52/44/356755244.db2.gz	DYCQKMJYVXRNEM-SCOBNMCVSA-N	1	0	290.363	1.524	50	0		CDAARO
COC[C@@H]([NH2+][C@H]1CCN(c2ccccn2)C1)C(C)C	ZINC000090802805	356834049	/nfs/dbraw/zinc/83/40/49/356834049.db2.gz	GSRSYQGRUUSQGE-UONOGXRCSA-N	1	0	263.385	1.921	50	0		CDAARO
Cc1cc(N2CCC[C@H](OCc3cccnc3)C2)nc(N)[nH+]1	ZINC000032576340	356782385	/nfs/dbraw/zinc/78/23/85/356782385.db2.gz	HQCHKUUGTLJLSZ-AWEZNQCLSA-N	1	0	299.378	1.948	50	0		CDAARO
NC(=O)c1ccc(NC(=O)CCC[NH3+])cc1Cl	ZINC000037046989	356898487	/nfs/dbraw/zinc/89/84/87/356898487.db2.gz	HZNFKPSYNCUKBE-UHFFFAOYSA-N	1	0	255.705	1.116	50	0		CDAARO
CCCS(=O)(=O)N1CC[NH+](C[C@@H]2CC=CCC2)CC1	ZINC000049967590	357226741	/nfs/dbraw/zinc/22/67/41/357226741.db2.gz	QSUYKINLPPFIRE-CQSZACIVSA-N	1	0	286.441	1.700	50	0		CDAARO
CC(C)CN1CCO[C@H](C[NH2+][C@H](C)C2CCOCC2)C1	ZINC000107524698	357333422	/nfs/dbraw/zinc/33/34/22/357333422.db2.gz	WVFMHTWNODRJPM-GDBMZVCRSA-N	1	0	284.444	1.748	50	0		CDAARO
C[C@H]([NH3+])c1nnnn1-c1ccc(Br)cc1	ZINC000062494062	357475112	/nfs/dbraw/zinc/47/51/12/357475112.db2.gz	BFVKRBXIEDSSSR-LURJTMIESA-N	1	0	268.118	1.445	50	0		CDAARO
Cc1nc2ccccc2n1Cc1cn(C2CC[NH2+]CC2)nn1	ZINC000063857709	357517798	/nfs/dbraw/zinc/51/77/98/357517798.db2.gz	PTMYXQJLZMSYKU-UHFFFAOYSA-N	1	0	296.378	1.909	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N(C)Cc2cnccn2)c1C	ZINC000065383537	357534234	/nfs/dbraw/zinc/53/42/34/357534234.db2.gz	PJOHENFDBSBFDM-UHFFFAOYSA-N	1	0	272.356	1.586	50	0		CDAARO
C[N@@H+]1CCC=C(CNC(=O)COCc2ccccc2)C1	ZINC000065383377	357534824	/nfs/dbraw/zinc/53/48/24/357534824.db2.gz	CBANUIFLYBAAIS-UHFFFAOYSA-N	1	0	274.364	1.581	50	0		CDAARO
c1cc(CCCNc2cc(N3CCOCC3)ncn2)ccn1	ZINC000065421934	357540524	/nfs/dbraw/zinc/54/05/24/357540524.db2.gz	RHMJQBCJUITEFY-UHFFFAOYSA-N	1	0	299.378	1.753	50	0		CDAARO
CCO[C@H]1COC[C@@H]1Nc1cc(NC(C)C)ncn1	ZINC000065459132	357542641	/nfs/dbraw/zinc/54/26/41/357542641.db2.gz	UNTVAOMDAFORNY-QWRGUYRKSA-N	1	0	266.345	1.513	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](NC(=O)c2cc(C(F)(F)F)n[nH]2)C1	ZINC000067740015	357622464	/nfs/dbraw/zinc/62/24/64/357622464.db2.gz	HOUHNWYVGIGPQS-PHDIDXHHSA-N	1	0	262.235	1.038	50	0		CDAARO
CNc1nc(N2CCC3(C2)CC[NH2+]CC3)ncc1F	ZINC000067472752	357610585	/nfs/dbraw/zinc/61/05/85/357610585.db2.gz	UVINDHAJEBJDQQ-UHFFFAOYSA-N	1	0	265.336	1.237	50	0		CDAARO
[NH3+]CC[C@@H]1CCCN(C(=O)c2ccc(-c3nc[nH]n3)cc2)C1	ZINC000067955151	357640154	/nfs/dbraw/zinc/64/01/54/357640154.db2.gz	ROHLRXCMSYQBOK-LBPRGKRZSA-N	1	0	299.378	1.673	50	0		CDAARO
CC(C)[C@@H](Nc1ncnc2c1CC[NH2+]C2)c1nccn1C	ZINC000067841661	357631158	/nfs/dbraw/zinc/63/11/58/357631158.db2.gz	UDIDDDNTFLXOSG-CYBMUJFWSA-N	1	0	286.383	1.665	50	0		CDAARO
CCc1nc(C)sc1C[NH2+][C@@H](C)Cn1cncn1	ZINC000067851851	357632771	/nfs/dbraw/zinc/63/27/71/357632771.db2.gz	VJJJZWMEFJYSSH-VIFPVBQESA-N	1	0	265.386	1.784	50	0		CDAARO
CCc1cccc(S(=O)(=O)N2CC[C@@H]([NH3+])C[C@H]2C)c1	ZINC000299740292	357700192	/nfs/dbraw/zinc/70/01/92/357700192.db2.gz	YCKPFYZYYDNKMD-DGCLKSJQSA-N	1	0	282.409	1.749	50	0		CDAARO
Cc1cc(C(=O)N2CCCC[C@H]2CC[NH+](C)C)on1	ZINC000072421088	357834015	/nfs/dbraw/zinc/83/40/15/357834015.db2.gz	YSVYFQKRLQQSBF-LBPRGKRZSA-N	1	0	265.357	1.929	50	0		CDAARO
Cc1cc(N2CCN(Cc3cccnc3N)CC2)cc(C)[nH+]1	ZINC000072476594	357838107	/nfs/dbraw/zinc/83/81/07/357838107.db2.gz	MEYFSNBUOWHSPR-UHFFFAOYSA-N	1	0	297.406	1.998	50	0		CDAARO
Cc1cccc(N2CC[C@H](S(=O)(=O)NC(C)C)C2)n1	ZINC000097096488	357953246	/nfs/dbraw/zinc/95/32/46/357953246.db2.gz	LNBKOCYBOBJIRV-LBPRGKRZSA-N	1	0	283.397	1.297	50	0		CDAARO
C[C@H]([NH2+]CC(=O)NCc1cccs1)[C@H]1CCCO1	ZINC000097111726	357986957	/nfs/dbraw/zinc/98/69/57/357986957.db2.gz	JQKZQHSNNKZJIV-CMPLNLGQSA-N	1	0	268.382	1.521	50	0		CDAARO
CC(C)C[C@@H](C[NH+](C)C)NS(=O)(=O)CCOC(C)C	ZINC000097166157	358005748	/nfs/dbraw/zinc/00/57/48/358005748.db2.gz	QSDQEYKDYUMLMW-ZDUSSCGKSA-N	1	0	294.461	1.307	50	0		CDAARO
CC(C)c1cc(C(=O)N2CC([NH+]3CCCCC3)C2)n(C)n1	ZINC000082083146	358145871	/nfs/dbraw/zinc/14/58/71/358145871.db2.gz	FBQSUAVGWOJXLE-UHFFFAOYSA-N	1	0	290.411	1.854	50	0		CDAARO
NC(=O)[C@H]1CCCC[C@H]1[NH2+]Cc1ccccc1F	ZINC000097113848	283347804	/nfs/dbraw/zinc/34/78/04/283347804.db2.gz	QPQSDZYZTPNSQW-WCQYABFASA-N	1	0	250.317	1.959	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1C(=O)/C=C\c1cscn1	ZINC000098055831	358342445	/nfs/dbraw/zinc/34/24/45/358342445.db2.gz	LJTHYDJLQYLIET-UMBAGQNISA-N	1	0	251.355	1.319	50	0		CDAARO
O=S(=O)(c1ccc(Br)cc1)C1C[NH2+]C1	ZINC000095908507	358703282	/nfs/dbraw/zinc/70/32/82/358703282.db2.gz	NLLZHTJWBQXCAJ-UHFFFAOYSA-N	1	0	276.155	1.195	50	0		CDAARO
CCc1cnc(N)nc1N1CC[C@@H]([NH+]2CCCC2)C1	ZINC000095372351	358688649	/nfs/dbraw/zinc/68/86/49/358688649.db2.gz	KCAGJVJPHMDVLV-GFCCVEGCSA-N	1	0	261.373	1.296	50	0		CDAARO
O=C(NCCc1c[nH]cn1)c1cccc([C@H]2CCC[NH2+]C2)c1	ZINC000095391563	358691780	/nfs/dbraw/zinc/69/17/80/358691780.db2.gz	NCJXBJXWCFRDNR-HNNXBMFYSA-N	1	0	298.390	1.849	50	0		CDAARO
CS[C@H](CO)[C@@H](C)NC(=O)C1CC[NH+](C(C)C)CC1	ZINC000095445642	358693939	/nfs/dbraw/zinc/69/39/39/358693939.db2.gz	FMWWRLULHVWRFJ-DGCLKSJQSA-N	1	0	288.457	1.335	50	0		CDAARO
CC[NH+]1CCC(CC(=O)NCCc2nnc(C)s2)CC1	ZINC000095498442	358694903	/nfs/dbraw/zinc/69/49/03/358694903.db2.gz	KBUUGIITZNOPAE-UHFFFAOYSA-N	1	0	296.440	1.627	50	0		CDAARO
c1cnc(N2CCC([NH2+]CCc3cccnc3)CC2)nc1	ZINC000095522894	358696165	/nfs/dbraw/zinc/69/61/65/358696165.db2.gz	YXCKPFOXWSLZAG-UHFFFAOYSA-N	1	0	283.379	1.673	50	0		CDAARO
Cc1cc2cc(C(=O)NC[C@@H]3C[NH2+]CCO3)ccc2o1	ZINC000097475045	358779014	/nfs/dbraw/zinc/77/90/14/358779014.db2.gz	MSFKLVWMSLKALD-ZDUSSCGKSA-N	1	0	274.320	1.459	50	0		CDAARO
[NH3+][C@H](c1nc(C2CCOCC2)nn1-c1ccncc1)C1CC1	ZINC000097499451	358780436	/nfs/dbraw/zinc/78/04/36/358780436.db2.gz	MSCRWVQEZYRCKP-AWEZNQCLSA-N	1	0	299.378	1.966	50	0		CDAARO
Cc1nc(C2CC[NH+](C[C@@H]3CCOC3)CC2)no1	ZINC000097797420	358800020	/nfs/dbraw/zinc/80/00/20/358800020.db2.gz	BEKBOYCKIMGMEJ-NSHDSACASA-N	1	0	251.330	1.594	50	0		CDAARO
CCc1nn(C)c(Cl)c1CN(CC)[C@H]1COC[C@@H]1O	ZINC000216032649	358919047	/nfs/dbraw/zinc/91/90/47/358919047.db2.gz	RUSTYMOIVMMHHU-RYUDHWBXSA-N	1	0	287.791	1.218	50	0		CDAARO
C[N@@H+]1CCN(Cc2[nH]c3ccccc3c2Cl)C[C@@H]1CO	ZINC000215840686	358905443	/nfs/dbraw/zinc/90/54/43/358905443.db2.gz	VXQOBJBWAXXVEQ-LLVKDONJSA-N	1	0	293.798	1.930	50	0		CDAARO
Cn1cncc1CN1CCCC[C@@H]1C[NH+]1CCCC1	ZINC000215922397	358909393	/nfs/dbraw/zinc/90/93/93/358909393.db2.gz	CWWJRBCEGICUHS-CQSZACIVSA-N	1	0	262.401	1.870	50	0		CDAARO
O=C(c1cccnc1)N1CCC(O)(C[NH+]2CCCC2)CC1	ZINC000219345322	359090781	/nfs/dbraw/zinc/09/07/81/359090781.db2.gz	KDQARCXMHHMFLP-UHFFFAOYSA-N	1	0	289.379	1.145	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(O)(C[NH2+]C2CC2)CC1	ZINC000032118235	359186895	/nfs/dbraw/zinc/18/68/95/359186895.db2.gz	JQPAAVMXIVKROP-UHFFFAOYSA-N	1	0	270.373	1.500	50	0		CDAARO
Nc1nc(NCc2ccc(O)cc2)cc(C2CC(O)C2)[nH+]1	ZINC000220495285	359176324	/nfs/dbraw/zinc/17/63/24/359176324.db2.gz	AQWSNPNZLCDFJN-UHFFFAOYSA-N	1	0	286.335	1.615	50	0		CDAARO
COCCCNC(=O)C[N@@H+]1CC[C@@H](Nc2ccccc2)C1	ZINC000089410280	359266614	/nfs/dbraw/zinc/26/66/14/359266614.db2.gz	KSGNLXYCCZALFU-OAHLLOKOSA-N	1	0	291.395	1.326	50	0		CDAARO
CN1C(=O)[C@H]2C[N@H+](Cc3ccccc3Cl)C[C@H]2C1=O	ZINC000257183224	359488232	/nfs/dbraw/zinc/48/82/32/359488232.db2.gz	QZPJQOAFLVUDEP-PHIMTYICSA-N	1	0	278.739	1.387	50	0		CDAARO
Cn1cc(C[NH+]2CCC3(CC2)C[C@@](C)(O)CCO3)cn1	ZINC000257192518	359591735	/nfs/dbraw/zinc/59/17/35/359591735.db2.gz	USKYMKYXHQPOKP-AWEZNQCLSA-N	1	0	279.384	1.316	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)c2cccc(Cl)c2)C[C@H]1CO	ZINC000257195524	359613803	/nfs/dbraw/zinc/61/38/03/359613803.db2.gz	WGYYKZANHUVTCP-WCQYABFASA-N	1	0	282.771	1.335	50	0		CDAARO
COc1ccccc1C[NH2+]C1CCN(S(C)(=O)=O)CC1	ZINC000030656290	359618024	/nfs/dbraw/zinc/61/80/24/359618024.db2.gz	NOMYXIBGFHMVCM-UHFFFAOYSA-N	1	0	298.408	1.209	50	0		CDAARO
COc1ccc(CC(=O)OCC[NH+](C)C)cc1OC	ZINC000000379343	359645137	/nfs/dbraw/zinc/64/51/37/359645137.db2.gz	INRSQRNEGGASFM-UHFFFAOYSA-N	1	0	267.325	1.351	50	0		CDAARO
O=C(N1CC[C@@]2(CC[NH2+]C2)C1)C1(c2ccccc2)CC1	ZINC000033426415	359668561	/nfs/dbraw/zinc/66/85/61/359668561.db2.gz	PWHDBQDTOSBXFH-MRXNPFEDSA-N	1	0	270.376	1.930	50	0		CDAARO
CCn1cnc2c1ncnc2NC[C@@H]1CC[C@H](C)[N@@H+]1C	ZINC000408518459	359909125	/nfs/dbraw/zinc/90/91/25/359909125.db2.gz	JJKWDPPNGQTXHQ-QWRGUYRKSA-N	1	0	274.372	1.741	50	0		CDAARO
C[C@H]1CN(C(=O)Cc2cn3ccsc3n2)C[C@@H]1[NH+](C)C	ZINC000089937164	360196843	/nfs/dbraw/zinc/19/68/43/360196843.db2.gz	VWPJXNHSOYSCFF-JQWIXIFHSA-N	1	0	292.408	1.347	50	0		CDAARO
COCCOc1cccc(CNC(=O)[C@@H](C)[NH+](C)C)c1	ZINC000426512311	360678526	/nfs/dbraw/zinc/67/85/26/360678526.db2.gz	RPJYARJZDWLXLH-GFCCVEGCSA-N	1	0	280.368	1.278	50	0		CDAARO
C[NH2+]Cc1nnc(SC[C@H]2CCCCO2)n1C	ZINC000426397315	360664212	/nfs/dbraw/zinc/66/42/12/360664212.db2.gz	ASCYYNNWQGHDGL-SECBINFHSA-N	1	0	256.375	1.196	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)CCc2cc(F)ccc2F)C1	ZINC000178570701	189127413	/nfs/dbraw/zinc/12/74/13/189127413.db2.gz	JDGAPIDRWZAWNX-SNVBAGLBSA-N	1	0	268.307	1.705	50	0		CDAARO
CCc1ccccc1OCC(=O)N1CC[C@H](C[NH3+])C1	ZINC000178523998	189123841	/nfs/dbraw/zinc/12/38/41/189123841.db2.gz	UACIZDJYLONTGG-GFCCVEGCSA-N	1	0	262.353	1.435	50	0		CDAARO
CC[C@@H]1C[N@H+](C[C@@H]2CCC=CO2)C[C@@]2(CCOC2)O1	ZINC000370210040	360975558	/nfs/dbraw/zinc/97/55/58/360975558.db2.gz	MZDBLLRGRBFFPK-QLFBSQMISA-N	1	0	267.369	1.949	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)NCc2cnc3ccccc3c2)C1	ZINC000426651471	361393329	/nfs/dbraw/zinc/39/33/29/361393329.db2.gz	ZSHQLPMIVOKDQN-LBPRGKRZSA-N	1	0	284.363	1.725	50	0		CDAARO
OCC[C@@]1([NH2+]Cc2cccc3c2OCCO3)CCOC1	ZINC000278112352	366761102	/nfs/dbraw/zinc/76/11/02/366761102.db2.gz	BLTIEALXKFUTNL-OAHLLOKOSA-N	1	0	279.336	1.089	50	0		CDAARO
Cc1ccc2cccc(C(=O)N3CC[NH2+][C@H](C)C3)c2n1	ZINC000188409982	189501612	/nfs/dbraw/zinc/50/16/12/189501612.db2.gz	KFOIMTAHSPTUTH-GFCCVEGCSA-N	1	0	269.348	1.977	50	0		CDAARO
Cc1c(CNC(=O)C[C@H]2C[NH2+]CCO2)oc2ccccc12	ZINC000269237359	364165469	/nfs/dbraw/zinc/16/54/69/364165469.db2.gz	XDMHZTVZWYQGPN-LBPRGKRZSA-N	1	0	288.347	1.736	50	0		CDAARO
FC(F)(F)CN1CCC(C[NH2+]Cc2cncnc2)CC1	ZINC000189458699	189535172	/nfs/dbraw/zinc/53/51/72/189535172.db2.gz	SEAQZODAJSUHGM-UHFFFAOYSA-N	1	0	288.317	1.841	50	0		CDAARO
Cc1nnc(NC(=O)[C@@H]2CCc3nc[nH]c3C2)s1	ZINC000034503880	364872364	/nfs/dbraw/zinc/87/23/64/364872364.db2.gz	LSCLYVBBOFSTDM-SSDOTTSWSA-N	1	0	263.326	1.313	50	0		CDAARO
C=Cn1cc(C[NH2+]CCc2nnc3n2CCCCC3)cn1	ZINC000194196447	189656420	/nfs/dbraw/zinc/65/64/20/189656420.db2.gz	MXQUNXKIPPVEGQ-UHFFFAOYSA-N	1	0	286.383	1.634	50	0		CDAARO
O=C(NC[C@H]1CCc2ccccc2O1)[C@H]1CCC[NH2+]1	ZINC000215618851	189696130	/nfs/dbraw/zinc/69/61/30/189696130.db2.gz	NUSKGPHXDAWWGL-CHWSQXEVSA-N	1	0	260.337	1.248	50	0		CDAARO
COc1ccccc1OCCCN(C)C(=O)[C@@H]1CC[NH2+]C1	ZINC000215897749	189698350	/nfs/dbraw/zinc/69/83/50/189698350.db2.gz	YYMUYYOXNUEIFF-CYBMUJFWSA-N	1	0	292.379	1.532	50	0		CDAARO
CC[N@@H+]1CCCN(CC(=O)N2[C@H](C)CCC[C@H]2C)CC1	ZINC000249687784	365160559	/nfs/dbraw/zinc/16/05/59/365160559.db2.gz	HVFCXRQYCQSTKI-HUUCEWRRSA-N	1	0	281.444	1.804	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)c1cnccn1	ZINC000249698764	365200407	/nfs/dbraw/zinc/20/04/07/365200407.db2.gz	WJHGNWPKROQRQW-UONOGXRCSA-N	1	0	274.368	1.566	50	0		CDAARO
CCN1CCN(C(=O)N[C@H](C)C(C)(C)C[NH+](C)C)CC1	ZINC000089977281	366993823	/nfs/dbraw/zinc/99/38/23/366993823.db2.gz	LGALXWZQMBIJPU-CYBMUJFWSA-N	1	0	284.448	1.310	50	0		CDAARO
COC(=O)[C@H]1C[NH+](Cc2ccccc2)C[C@@H]1C(=O)OC	ZINC000039399994	367279656	/nfs/dbraw/zinc/27/96/56/367279656.db2.gz	JSRVVUSBZJFOJO-STQMWFEESA-N	1	0	277.320	1.081	50	0		CDAARO
COc1ccc(-c2cc(N3CC[C@@H]([NH3+])C3)n[nH]2)cc1	ZINC000070460193	367347386	/nfs/dbraw/zinc/34/73/86/367347386.db2.gz	WLRGIABPSCXRCE-LLVKDONJSA-N	1	0	258.325	1.623	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1F	ZINC000094345685	367464086	/nfs/dbraw/zinc/46/40/86/367464086.db2.gz	IYXWKDHMGWXYCZ-KCJUWKMLSA-N	1	0	290.335	1.241	50	0		CDAARO
COCC1(C[NH2+]CC(C)(C)N2CCOCC2)CCC1	ZINC000638296567	369242075	/nfs/dbraw/zinc/24/20/75/369242075.db2.gz	TYVRHDXENMMWOK-UHFFFAOYSA-N	1	0	270.417	1.504	50	0		CDAARO
COc1ccc(CNc2ncnc3c2cnn3C)cc1	ZINC000001577358	369513226	/nfs/dbraw/zinc/51/32/26/369513226.db2.gz	MLUABCZOCRMQSC-UHFFFAOYSA-N	1	0	269.308	1.984	50	0		CDAARO
CCNC(=O)NC(=O)[C@H](C)[NH+]1CCCCCCC1	ZINC000012601234	371382025	/nfs/dbraw/zinc/38/20/25/371382025.db2.gz	NFTWVDWHYBFRTK-NSHDSACASA-N	1	0	255.362	1.487	50	0		CDAARO
CO[C@]12CC[N@H+](CCn3nc(C)cc3C)[C@H]1C[C@H](O)CC2	ZINC000299756613	372744977	/nfs/dbraw/zinc/74/49/77/372744977.db2.gz	FRDPMBYBFHBZHX-OWCLPIDISA-N	1	0	293.411	1.504	50	0		CDAARO
O=C(NCCC[N@H+]1CCC[C@@H](O)C1)c1ccc(F)c(O)c1	ZINC000299785175	372760001	/nfs/dbraw/zinc/76/00/01/372760001.db2.gz	KEOFEBXBNFXABP-GFCCVEGCSA-N	1	0	296.342	1.108	50	0		CDAARO
COc1cccc(C(=O)N2CC[C@H]3[NH2+]CCC[C@@H]3C2)c1	ZINC000299796624	372768714	/nfs/dbraw/zinc/76/87/14/372768714.db2.gz	PASSCLKLOOOUSI-UKRRQHHQSA-N	1	0	274.364	1.909	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1CCNC(=O)c1cn(C)nc1C	ZINC000253408442	373711532	/nfs/dbraw/zinc/71/15/32/373711532.db2.gz	KSOQRRBCROSPLQ-UHFFFAOYSA-N	1	0	287.367	1.541	50	0		CDAARO
COC(=O)[C@@H]1CCN(Cc2cc(F)ncc2F)C[C@H]1C	ZINC000253430654	373736244	/nfs/dbraw/zinc/73/62/44/373736244.db2.gz	NDIVOQVCHZJAGM-MWLCHTKSSA-N	1	0	284.306	1.991	50	0		CDAARO
CC[NH+](CC)CCNS(=O)(=O)c1ccc(Cl)cc1	ZINC000001760515	374465633	/nfs/dbraw/zinc/46/56/33/374465633.db2.gz	KVQQWVRVJDYYMC-UHFFFAOYSA-N	1	0	290.816	1.960	50	0	in-vitro	CDAARO
[NH3+]C[C@H]1CCN(C(=O)Cc2cccc(F)c2F)C1	ZINC000094713527	374643832	/nfs/dbraw/zinc/64/38/32/374643832.db2.gz	YDLLOOSBCYDEFD-SECBINFHSA-N	1	0	254.280	1.315	50	0		CDAARO
C[C@H](C[NH2+][C@H]1CCc2ncnn2C1)c1ccccc1	ZINC000095398048	374901653	/nfs/dbraw/zinc/90/16/53/374901653.db2.gz	HORPZXGPBLYPGO-OCCSQVGLSA-N	1	0	256.353	1.986	50	0		CDAARO
CC[C@@H]([NH2+]CCN1CCN(C(C)=O)CC1)c1ccccc1	ZINC000095420285	374921564	/nfs/dbraw/zinc/92/15/64/374921564.db2.gz	MTUJTLPPFRRJAO-QGZVFWFLSA-N	1	0	289.423	1.891	50	0		CDAARO
C[N@H+](CCCO)C1CCN(C(=O)CC(C)(C)C)CC1	ZINC000095443688	374944879	/nfs/dbraw/zinc/94/48/79/374944879.db2.gz	ZPSGSHBSFFNPNQ-UHFFFAOYSA-N	1	0	270.417	1.728	50	0		CDAARO
COc1cncc(N2CC[NH+](CCc3ccncc3)CC2)n1	ZINC000096406661	375096564	/nfs/dbraw/zinc/09/65/64/375096564.db2.gz	HDCDZHGHINRQOM-UHFFFAOYSA-N	1	0	299.378	1.245	50	0		CDAARO
Cc1cc(C)n(-c2ccnc(N3CC[NH+](C)CC3)n2)n1	ZINC000096101965	375058422	/nfs/dbraw/zinc/05/84/22/375058422.db2.gz	LMQFATDBWBYHST-UHFFFAOYSA-N	1	0	272.356	1.031	50	0		CDAARO
CC[N@H+](CC(=O)Nc1cccc(-c2ncn(C)n2)c1)C1CC1	ZINC000097084751	375146929	/nfs/dbraw/zinc/14/69/29/375146929.db2.gz	BJCCINFMSKCKRU-UHFFFAOYSA-N	1	0	299.378	1.905	50	0		CDAARO
Cc1ccc([C@@H](CNC(=O)c2cncn2C)[NH+](C)C)cc1	ZINC000277807602	375827289	/nfs/dbraw/zinc/82/72/89/375827289.db2.gz	WBVRTQIEGYONPJ-CQSZACIVSA-N	1	0	286.379	1.761	50	0		CDAARO
C[NH+]1CCC2(CC1)CN(c1ncccc1F)CCO2	ZINC000645384862	377231291	/nfs/dbraw/zinc/23/12/91/377231291.db2.gz	KTHPDTALDYPNHA-UHFFFAOYSA-N	1	0	265.332	1.522	50	0		CDAARO
Nc1n[nH]c(C(=O)N[C@@H]2CC[C@@H]([NH3+])C2)c1-c1ccccc1	ZINC000067673326	377201489	/nfs/dbraw/zinc/20/14/89/377201489.db2.gz	YFLDWGDFENRKEF-GHMZBOCLSA-N	1	0	285.351	1.269	50	0		CDAARO
C[N@H+](CCO)C1CCN(C(=O)Nc2cccnc2)CC1	ZINC000089346272	377836240	/nfs/dbraw/zinc/83/62/40/377836240.db2.gz	CPVPBXBNCDCCIS-UHFFFAOYSA-N	1	0	278.356	1.002	50	0		CDAARO
Cn1cncc1C(=O)NCC1([NH+](C)C)CCCCCC1	ZINC000278586323	194056476	/nfs/dbraw/zinc/05/64/76/194056476.db2.gz	KCLWODSKKGRYKH-UHFFFAOYSA-N	1	0	278.400	1.805	50	0		CDAARO
O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)[C@H]1CC[NH2+]C1	ZINC000246498675	379590219	/nfs/dbraw/zinc/59/02/19/379590219.db2.gz	PSAYWRPQHXMARL-SOUVJXGZSA-N	1	0	274.364	1.632	50	0		CDAARO
O=C(Nc1cccc(CO)c1)C12CCC[NH+]1CCC2	ZINC000279202047	194330477	/nfs/dbraw/zinc/33/04/77/194330477.db2.gz	LEJNEFZIXNIMLB-UHFFFAOYSA-N	1	0	260.337	1.746	50	0		CDAARO
CNC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C[NH3+])cc1	ZINC000493282043	253418502	/nfs/dbraw/zinc/41/85/02/253418502.db2.gz	AZYRNMMFIWPNID-DEBLGDTFSA-N	1	0	287.363	1.009	50	0		CDAARO
COC[C@@H](O)C[N@H+](C)[C@H](C)Cc1ccc(C)cc1	ZINC000096415702	256788575	/nfs/dbraw/zinc/78/85/75/256788575.db2.gz	XMNJLMSLUYLLLZ-HIFRSBDPSA-N	1	0	251.370	1.865	50	0		CDAARO
Cc1nc(N)ncc1C(=O)N(C)CC[N@H+](C)C1CCCC1	ZINC000071762119	256878686	/nfs/dbraw/zinc/87/86/86/256878686.db2.gz	WQNSDTQSTCKQOT-UHFFFAOYSA-N	1	0	291.399	1.314	50	0		CDAARO
CC[NH+]1CCC(CC(=O)NCc2nc(C)cc(C)n2)CC1	ZINC000095379435	184959520	/nfs/dbraw/zinc/95/95/20/184959520.db2.gz	GVAYPCFIICFWIP-UHFFFAOYSA-N	1	0	290.411	1.832	50	0		CDAARO
C[C@H]1CN(c2cc(-n3cccn3)nc(N)[nH+]2)C[C@H](C)S1	ZINC000092917612	390468298	/nfs/dbraw/zinc/46/82/98/390468298.db2.gz	HADOLUXIXBORNO-UWVGGRQHSA-N	1	0	290.396	1.575	50	0		CDAARO
COc1ccc(CCC[N@@H+]2CC[C@H](C(N)=O)C2)cc1F	ZINC000097103872	390791824	/nfs/dbraw/zinc/79/18/24/390791824.db2.gz	WQTLKYHACONQGC-LBPRGKRZSA-N	1	0	280.343	1.574	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@@H](C(=O)N2CC[C@]3(CCOC3)C2)C1	ZINC000097228021	390816721	/nfs/dbraw/zinc/81/67/21/390816721.db2.gz	JPOVIFSQRCDPCZ-ZBFHGGJFSA-N	1	0	280.412	1.603	50	0		CDAARO
Cc1cc(N2C[C@@H](C)[C@@](C)(O)C2)nc(N2CCCCC2)[nH+]1	ZINC000091625354	390890471	/nfs/dbraw/zinc/89/04/71/390890471.db2.gz	YGMJZIRZQAQMOS-WBMJQRKESA-N	1	0	290.411	1.982	50	0		CDAARO
Cc1ccc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)cc1O	ZINC000091526392	390890597	/nfs/dbraw/zinc/89/05/97/390890597.db2.gz	TZGNJAREXWZGNM-OLZOCXBDSA-N	1	0	260.337	1.510	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cc(C)n(-c3ccccc3)n2)C1	ZINC000178989548	390927448	/nfs/dbraw/zinc/92/74/48/390927448.db2.gz	NYDDPJCQQWHFAG-AWEZNQCLSA-N	1	0	298.390	1.862	50	0		CDAARO
COc1ccc2c(c1)C[C@@H]([NH2+][C@@H]1CCC(=O)N(C)C1)CC2	ZINC000095973401	391182129	/nfs/dbraw/zinc/18/21/29/391182129.db2.gz	LNDSQGSRLYSFMA-LSDHHAIUSA-N	1	0	288.391	1.763	50	0		CDAARO
COc1ccccc1OCCN1CC[NH+](C)CC1	ZINC000019590051	391324529	/nfs/dbraw/zinc/32/45/29/391324529.db2.gz	HFJIWMSDHYDZMB-UHFFFAOYSA-N	1	0	250.342	1.321	50	0		CDAARO
CC(C)[NH+]1CCC(N2C(=O)N3CCC[C@@]3(C)C2=O)CC1	ZINC000240333289	391328675	/nfs/dbraw/zinc/32/86/75/391328675.db2.gz	FCTSQKPWPFFRRT-HNNXBMFYSA-N	1	0	279.384	1.676	50	0		CDAARO
CN1CC[NH+](CC2CCN(C(=O)[C@@H]3CC3(C)C)CC2)CC1	ZINC000129801159	391619815	/nfs/dbraw/zinc/61/98/15/391619815.db2.gz	RQFSGBKDGRAMRC-HNNXBMFYSA-N	1	0	293.455	1.519	50	0		CDAARO
C[C@H]1CCC[C@H]1OC[C@@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000012414200	391630256	/nfs/dbraw/zinc/63/02/56/391630256.db2.gz	NOPQVBCPBSUPGR-SBJFKYEJSA-N	1	0	271.401	1.662	50	0		CDAARO
Cc1ccccc1CCC[NH+]1CCN([C@@H](C)C(N)=O)CC1	ZINC000089689325	392459934	/nfs/dbraw/zinc/45/99/34/392459934.db2.gz	TZZYBBSJBAUVLG-HNNXBMFYSA-N	1	0	289.423	1.419	50	0		CDAARO
CCC(=O)N1CC[C@H]([NH2+]Cc2ncc[nH]2)[C@@H](CC)C1	ZINC000089948780	392523267	/nfs/dbraw/zinc/52/32/67/392523267.db2.gz	UOVWEDSHSYVXLW-RYUDHWBXSA-N	1	0	264.373	1.536	50	0		CDAARO
CC[C@H]1CN(C(C)=O)CC[C@@H]1[NH2+]Cc1c[nH]nc1C	ZINC000089948802	392523411	/nfs/dbraw/zinc/52/34/11/392523411.db2.gz	CFWLSPBMPBTRQR-JSGCOSHPSA-N	1	0	264.373	1.455	50	0		CDAARO
CC(C)OCCC[N@H+](C)[C@@H]1CCN(CC(F)(F)F)C1=O	ZINC000095395831	393144733	/nfs/dbraw/zinc/14/47/33/393144733.db2.gz	KEPIXUKFQBKKKK-LLVKDONJSA-N	1	0	296.333	1.897	50	0		CDAARO
COc1cc(C[NH+]2CCC(O)CC2)cc(OC)c1OC	ZINC000004990222	170050592	/nfs/dbraw/zinc/05/05/92/170050592.db2.gz	WMXWEYSDXQMQNL-UHFFFAOYSA-N	1	0	281.352	1.669	50	0		CDAARO
CCOC(=O)C[C@@H]([NH3+])c1ccc(OC)c(OC)c1	ZINC000004990710	170050767	/nfs/dbraw/zinc/05/07/67/170050767.db2.gz	QJFIEJGVDLYEPY-SNVBAGLBSA-N	1	0	253.298	1.657	50	0		CDAARO
CCCC(=O)c1c[nH]c(C(=O)NCCC[NH+](C)C)c1	ZINC000005524562	170108018	/nfs/dbraw/zinc/10/80/18/170108018.db2.gz	OGUNHXVJUHKOPA-UHFFFAOYSA-N	1	0	265.357	1.679	50	0		CDAARO
Cc1ccc(C)c(S(=O)(=O)NCC[NH+](C)C)c1	ZINC000007653409	170295602	/nfs/dbraw/zinc/29/56/02/170295602.db2.gz	BDDCQYVSGXTIMS-UHFFFAOYSA-N	1	0	256.371	1.143	50	0		CDAARO
COc1ccc(CNC(=O)[C@@H](C)[NH2+]C(C)C)cc1	ZINC000007985946	170311978	/nfs/dbraw/zinc/31/19/78/170311978.db2.gz	RMNMJQVNSHEDSH-LLVKDONJSA-N	1	0	250.342	1.698	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1ccc2ccccc2n1	ZINC000009846126	170386959	/nfs/dbraw/zinc/38/69/59/170386959.db2.gz	QTQJQSDYAZCIHW-UHFFFAOYSA-N	1	0	257.337	1.916	50	0		CDAARO
COc1ccc(NC(=O)[C@H]2CCC[NH2+]2)cc1OC	ZINC000019411402	170789552	/nfs/dbraw/zinc/78/95/52/170789552.db2.gz	XOABJPWPOIDRSO-SNVBAGLBSA-N	1	0	250.298	1.394	50	0		CDAARO
CCC[NH+]1CCN(C[C@H]2COc3ccccc3O2)CC1	ZINC000020790519	171272651	/nfs/dbraw/zinc/27/26/51/171272651.db2.gz	CWAUDKLVCUJVTK-AWEZNQCLSA-N	1	0	276.380	1.854	50	0		CDAARO
COc1ccc([C@@H](CNC(=O)CSC)[NH+](C)C)cc1	ZINC000022621379	171394872	/nfs/dbraw/zinc/39/48/72/171394872.db2.gz	FZKWWZTWGIPAGA-CYBMUJFWSA-N	1	0	282.409	1.777	50	0		CDAARO
Cc1cc(CNC(=O)N[C@@H](C)C2=CC[N@H+](C)CC2)n(C)n1	ZINC000285411481	196276293	/nfs/dbraw/zinc/27/62/93/196276293.db2.gz	MSDCBRPAOQSTPM-LBPRGKRZSA-N	1	0	291.399	1.178	50	0		CDAARO
CCC[C@H](Nc1cc(CC[NH3+])ncn1)c1nccn1C	ZINC000039500805	174169182	/nfs/dbraw/zinc/16/91/82/174169182.db2.gz	HICVKMYLKFTCTO-LBPRGKRZSA-N	1	0	274.372	1.665	50	0		CDAARO
[NH3+]C[C@H]1Cc2cc(F)cc(-c3cnn4cccnc34)c2O1	ZINC000067855876	175797784	/nfs/dbraw/zinc/79/77/84/175797784.db2.gz	SDVGYNZVWJVUGH-LLVKDONJSA-N	1	0	284.294	1.798	50	0		CDAARO
CCC(CC)c1nccn1CC[N@@H+]1CCC[C@H](C(N)=O)C1	ZINC000071419284	176160548	/nfs/dbraw/zinc/16/05/48/176160548.db2.gz	BYFVOVQKTAOTLX-AWEZNQCLSA-N	1	0	292.427	1.984	50	0		CDAARO
Cc1ccc(O[C@H](C)C(=O)NCC[NH+](C)C)c(C)c1	ZINC000072117305	176318646	/nfs/dbraw/zinc/31/86/46/176318646.db2.gz	JWDMOMURXGNCQU-CYBMUJFWSA-N	1	0	264.369	1.749	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1CCCn1ccnc1-c1ncc[nH]1	ZINC000072134638	176322064	/nfs/dbraw/zinc/32/20/64/176322064.db2.gz	QEEGGSDWIVQSGO-ZDUSSCGKSA-N	1	0	289.383	1.510	50	0		CDAARO
Cc1nc2c(cnn2C)c(N(C)CC[NH+]2CCCC2)n1	ZINC000072148692	176325971	/nfs/dbraw/zinc/32/59/71/176325971.db2.gz	JDANLJGFKQWPKT-UHFFFAOYSA-N	1	0	274.372	1.204	50	0		CDAARO
C[C@H](CCC(=O)N1CCn2cncc2C1)[NH+]1CCCC1	ZINC000072161683	176330086	/nfs/dbraw/zinc/33/00/86/176330086.db2.gz	GGSAGRUTVDYOOR-CYBMUJFWSA-N	1	0	276.384	1.490	50	0		CDAARO
Cc1nc([C@H]2CCC[N@H+](Cc3cccnc3N)C2)cc(=O)[nH]1	ZINC000072409940	176398424	/nfs/dbraw/zinc/39/84/24/176398424.db2.gz	YZAQZWJFIDOEMO-LBPRGKRZSA-N	1	0	299.378	1.435	50	0		CDAARO
c1cncc(NCCCNc2ncnc3c2CC[NH2+]CC3)c1	ZINC000072436442	176403015	/nfs/dbraw/zinc/40/30/15/176403015.db2.gz	ZLYREQZGNUFXQB-UHFFFAOYSA-N	1	0	298.394	1.474	50	0		CDAARO
Cn1ccnc1CCNC(=O)[C@@H](O)c1cccc(Cl)c1	ZINC000218969744	262347935	/nfs/dbraw/zinc/34/79/35/262347935.db2.gz	WIEKSCLCBXSJKA-ZDUSSCGKSA-N	1	0	293.754	1.466	50	0		CDAARO
O=C(c1cccc(=O)[nH]1)N1CCC[N@@H+](C2CCCC2)CC1	ZINC000278747505	275013845	/nfs/dbraw/zinc/01/38/45/275013845.db2.gz	FDJGSVBAZANOJE-UHFFFAOYSA-N	1	0	289.379	1.878	50	0		CDAARO
CC1(C)NC(=[NH2+])NC(=N)N1c1ccc(F)cc1F	ZINC000000203659	275875820	/nfs/dbraw/zinc/87/58/20/275875820.db2.gz	UDRBBDNKWHCUFR-UHFFFAOYSA-N	1	0	253.256	1.150	50	0		CDAARO
C[N@@H+]1CCC[C@H](c2nc3c([nH]2)C(=O)NCC(C)(C)C3)C1	ZINC000095381081	277074680	/nfs/dbraw/zinc/07/46/80/277074680.db2.gz	BSXOWMCZJHHKHH-JTQLQIEISA-N	1	0	276.384	1.531	50	0		CDAARO
COCC(=O)N1CC[NH+](CC2CCC(C)CC2)CC1	ZINC000128736978	277195643	/nfs/dbraw/zinc/19/56/43/277195643.db2.gz	OAMBEQXZSSIVSG-UHFFFAOYSA-N	1	0	268.401	1.603	50	0		CDAARO
C[NH2+]CC(=O)N1CCC[C@H](c2nc3c(cccc3C)[nH]2)C1	ZINC000071755168	277263744	/nfs/dbraw/zinc/26/37/44/277263744.db2.gz	DKOVWVXTZPIIKX-LBPRGKRZSA-N	1	0	286.379	1.797	50	0		CDAARO
C[C@@H](C(=O)NC1CCC(O)CC1)[NH+]1CCCCCC1	ZINC000072794216	278205653	/nfs/dbraw/zinc/20/56/53/278205653.db2.gz	ZSKNGPANAGBTPZ-HSBZDZAISA-N	1	0	268.401	1.671	50	0		CDAARO
Cc1cnc(C)c(N2CC[NH+](C[C@H]3CCOC3)CC2)n1	ZINC000184131815	279010861	/nfs/dbraw/zinc/01/08/61/279010861.db2.gz	NRXSYXHUYPRMRE-CQSZACIVSA-N	1	0	276.384	1.252	50	0		CDAARO
Cc1ccccc1OCCN(C)C(=O)[C@]1(F)CC[NH2+]C1	ZINC000299740201	281352655	/nfs/dbraw/zinc/35/26/55/281352655.db2.gz	WWUJLJYYJHPAPV-HNNXBMFYSA-N	1	0	280.343	1.534	50	0		CDAARO
CCn1ccnc1CN1C[C@H](CO)[C@H](C[NH+]2CCCC2)C1	ZINC000091663199	281644942	/nfs/dbraw/zinc/64/49/42/281644942.db2.gz	WUSTVAOLENGDNH-HUUCEWRRSA-N	1	0	292.427	1.039	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1CCN1CCOc2ccc(CO)cc2C1	ZINC000243893810	328041872	/nfs/dbraw/zinc/04/18/72/328041872.db2.gz	AUMPIWDQDXZYHY-MRXNPFEDSA-N	1	0	290.407	1.858	50	0		CDAARO
CC(C)OCC(=O)NCC1([NH+]2CCN(C)CC2)CCCC1	ZINC000534583372	328312826	/nfs/dbraw/zinc/31/28/26/328312826.db2.gz	IRCTWFQTTDKNRM-UHFFFAOYSA-N	1	0	297.443	1.088	50	0		CDAARO
O=C(C[C@H]1CC1(F)F)N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000534584180	328311320	/nfs/dbraw/zinc/31/13/20/328311320.db2.gz	OJUVKOIUXSXSFK-QUARPLMYSA-N	1	0	256.296	1.241	50	0		CDAARO
C[NH+](C)C1(CNC(=O)C[C@@H]2CCCOC2)CCCC1	ZINC000534580790	328311654	/nfs/dbraw/zinc/31/16/54/328311654.db2.gz	RIZFKXSZMQSICL-ZDUSSCGKSA-N	1	0	268.401	1.794	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCC(=O)NCC2(CO)CCCC2)C1	ZINC000534585459	328314957	/nfs/dbraw/zinc/31/49/57/328314957.db2.gz	ZDJBGOGFNSHKJQ-CQSZACIVSA-N	1	0	282.428	1.777	50	0		CDAARO
COc1cc(Cl)ccc1C(=O)N1C[C@@H]2[NH2+]CCO[C@H]2C1	ZINC000534588650	328316877	/nfs/dbraw/zinc/31/68/77/328316877.db2.gz	FNHYDDFZZUUQNV-AAEUAGOBSA-N	1	0	296.754	1.161	50	0		CDAARO
CCOCC(=O)NC[C@H]1CC[N@@H+](C2CCCCC2)C1	ZINC000534655004	328338981	/nfs/dbraw/zinc/33/89/81/328338981.db2.gz	XRCZRYVLLVSMIJ-CYBMUJFWSA-N	1	0	268.401	1.794	50	0		CDAARO
CC(C)c1noc(C2CCN(C(=O)[C@@H]3C=CC[NH2+]3)CC2)n1	ZINC000534660495	328339303	/nfs/dbraw/zinc/33/93/03/328339303.db2.gz	RINHIQOCJHATTG-LBPRGKRZSA-N	1	0	290.367	1.427	50	0		CDAARO
O=C(CCCC1CCCCC1)N[C@@H]1C[NH2+]C[C@H]1O	ZINC000534673610	328348870	/nfs/dbraw/zinc/34/88/70/328348870.db2.gz	GFNVCAQMABYJOL-CHWSQXEVSA-N	1	0	254.374	1.186	50	0		CDAARO
CN(CC1(CO)CCCC1)C(=O)[C@H]1CC12CC[NH2+]CC2	ZINC000534661156	328349100	/nfs/dbraw/zinc/34/91/00/328349100.db2.gz	XGLXDPMMKPNIJD-CYBMUJFWSA-N	1	0	280.412	1.387	50	0		CDAARO
Cc1nnc(CSc2nnc([C@H]3CCC[NH2+]C3)n2C)[nH]1	ZINC000534661204	328349272	/nfs/dbraw/zinc/34/92/72/328349272.db2.gz	COPATHNZWIBLHT-VIFPVBQESA-N	1	0	293.400	1.001	50	0		CDAARO
COc1ccc(C(=O)NC(C)(C)C[NH+](C)C)c(OC)n1	ZINC000534664027	328351434	/nfs/dbraw/zinc/35/14/34/328351434.db2.gz	ZPBRPUCLXAGNJL-UHFFFAOYSA-N	1	0	281.356	1.169	50	0		CDAARO
CC(C)[C@H](CNc1ccc(CS(C)(=O)=O)cn1)[NH+](C)C	ZINC000534664248	328351572	/nfs/dbraw/zinc/35/15/72/328351572.db2.gz	KUJBRJSLRHBINF-ZDUSSCGKSA-N	1	0	299.440	1.624	50	0		CDAARO
COC(=O)c1cn(C2CC[NH+](Cc3ccco3)CC2)nn1	ZINC000097376961	323208192	/nfs/dbraw/zinc/20/81/92/323208192.db2.gz	YLVHMOQVOXYSCF-UHFFFAOYSA-N	1	0	290.323	1.495	50	0		CDAARO
CC(C)Oc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H](O)C[NH2+]2)cc1	ZINC000037007598	326833805	/nfs/dbraw/zinc/83/38/05/326833805.db2.gz	TYQPVPKVUWPXNV-WHOFXGATSA-N	1	0	292.379	1.374	50	0		CDAARO
CC(=O)c1cnc(NC[C@@H](O)C[NH+]2CCCCC2)nc1C	ZINC001772710472	1159444102	/nfs/dbraw/zinc/44/41/02/1159444102.db2.gz	ROMPQQWXXUQEKX-CYBMUJFWSA-N	1	0	292.383	1.246	50	0		CDAARO
CC(C)=CC[C@]1(CO)CCC[N@H+](CCC(N)=O)C1	ZINC000091468898	482444189	/nfs/dbraw/zinc/44/41/89/482444189.db2.gz	FDZHWNLGUNISDN-CQSZACIVSA-N	1	0	254.374	1.293	50	0		CDAARO
C[C@@H]1OCC[C@H]1[NH2+]Cc1cccc(OCC(F)F)n1	ZINC000090971907	482522817	/nfs/dbraw/zinc/52/28/17/482522817.db2.gz	ZDXAWNDSQMAVNP-GXSJLCMTSA-N	1	0	272.295	1.993	50	0		CDAARO
Cc1ccc(N2CC[N@H+](CCOCCO)[C@@H](C)C2)cc1	ZINC000670435523	482971412	/nfs/dbraw/zinc/97/14/12/482971412.db2.gz	OUFJATZWKPKZQJ-HNNXBMFYSA-N	1	0	278.396	1.514	50	0		CDAARO
c1cn2nc(N3CC[NH+]([C@H]4CCSC4)CC3)ccc2n1	ZINC000670436113	482975073	/nfs/dbraw/zinc/97/50/73/482975073.db2.gz	UUAYZPANNVKRDC-LBPRGKRZSA-N	1	0	289.408	1.357	50	0		CDAARO
O=C(CCc1cn[nH]c1)N1CC[NH+](CC2CCCC2)CC1	ZINC000670437466	482978512	/nfs/dbraw/zinc/97/85/12/482978512.db2.gz	BZXMCFBFWZQWHO-UHFFFAOYSA-N	1	0	290.411	1.677	50	0		CDAARO
CCOC(=O)N1CC[C@@H]([NH2+]CCc2noc(C(C)C)n2)C1	ZINC000670443393	482988737	/nfs/dbraw/zinc/98/87/37/482988737.db2.gz	NGGRMAZNYFCQTM-LLVKDONJSA-N	1	0	296.371	1.556	50	0		CDAARO
Cn1nccc1C[N@H+](C)C[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000670447413	483000000	/nfs/dbraw/zinc/00/00/00/483000000.db2.gz	CMTSXURPLMDUKP-ZDUSSCGKSA-N	1	0	290.411	1.643	50	0		CDAARO
C[C@@H](C[NH+]1CCN(C)CC1)N1CC(Oc2ccccc2)C1	ZINC000670448375	483004459	/nfs/dbraw/zinc/00/44/59/483004459.db2.gz	RAPFKKYXEZUKLD-HNNXBMFYSA-N	1	0	289.423	1.386	50	0		CDAARO
CCCC[C@@H]1C[C@@H]1C(=O)NCC1(O)CC[NH+](C)CC1	ZINC000670450474	483009241	/nfs/dbraw/zinc/00/92/41/483009241.db2.gz	ZMRHNGRCIZFOMZ-OLZOCXBDSA-N	1	0	268.401	1.386	50	0		CDAARO
CC(C)c1noc(C2CC[NH+](CCn3cnnc3)CC2)n1	ZINC000670452356	483019319	/nfs/dbraw/zinc/01/93/19/483019319.db2.gz	UQXKVDYJNZLZGE-UHFFFAOYSA-N	1	0	290.371	1.664	50	0		CDAARO
COc1nc(N(C)C[C@H]2CCC[N@@H+]2C)ncc1F	ZINC000670461002	483046214	/nfs/dbraw/zinc/04/62/14/483046214.db2.gz	UMTGAPPCJPYSQE-SECBINFHSA-N	1	0	254.309	1.155	50	0		CDAARO
CC1CCC(O)(C[N@@H+]2CCCC3(C2)OCCO3)CC1	ZINC000090561398	483256417	/nfs/dbraw/zinc/25/64/17/483256417.db2.gz	LKQGEVQUBKWCPI-UHFFFAOYSA-N	1	0	269.385	1.767	50	0		CDAARO
Cc1ccc(C(=O)NC[C@@H]2C[C@H](F)C[NH2+]2)n1C(F)F	ZINC000426388257	534267002	/nfs/dbraw/zinc/26/70/02/534267002.db2.gz	ZKFOSXXAVMUIIN-IUCAKERBSA-N	1	0	275.274	1.621	50	0		CDAARO
CC(C)Oc1ccccc1CC(=O)N1CC[C@H](C[NH3+])C1	ZINC000178531090	519783915	/nfs/dbraw/zinc/78/39/15/519783915.db2.gz	LEWGQLZEWTUHDY-CYBMUJFWSA-N	1	0	276.380	1.824	50	0		CDAARO
CCC[NH+]1CCC(Nc2nnnn2-c2ccccc2)CC1	ZINC000007468521	528206208	/nfs/dbraw/zinc/20/62/08/528206208.db2.gz	IKBFZUDMNBNXRS-UHFFFAOYSA-N	1	0	286.383	1.949	50	0		CDAARO
CC(=O)NC[C@@H](c1ccc2c(c1)OCO2)[NH+]1CCCC1	ZINC000012197094	574466970	/nfs/dbraw/zinc/46/69/70/574466970.db2.gz	VTHYCOWIXUPBJT-ZDUSSCGKSA-N	1	0	276.336	1.688	50	0		CDAARO
C[N@@H+]1CCC[C@H]1C(=O)NCCSC(F)(F)F	ZINC000748551912	576916940	/nfs/dbraw/zinc/91/69/40/576916940.db2.gz	VDIPHUQIWJQCBH-ZETCQYMHSA-N	1	0	256.293	1.450	50	0		CDAARO
C[C@@H]1C[NH2+][C@H]([C@@H]2CC[C@H](C(F)(F)F)NC2)[C@H](N)C1	ZINC000757209126	577035855	/nfs/dbraw/zinc/03/58/55/577035855.db2.gz	FYDKCBZQGYYGEM-VPJKUYQRSA-N	1	0	265.323	1.242	50	0		CDAARO
CC(C)(C)OC(=O)NCC[NH2+][C@H]1C[C@@H]2COC[C@@H]21	ZINC000952993334	613989258	/nfs/dbraw/zinc/98/92/58/613989258.db2.gz	GHCUJBYPENZDMX-VWYCJHECSA-N	1	0	256.346	1.136	50	0		CDAARO
CC1(C)[NH2+]CC[C@H]1NC(=O)c1c(F)cncc1F	ZINC000952992974	614808191	/nfs/dbraw/zinc/80/81/91/614808191.db2.gz	LREUULLNIHXKLD-SECBINFHSA-N	1	0	255.268	1.230	50	0		CDAARO
CC[C@@H](C(=O)NCc1cccc(C(=O)NC)c1)[N@H+](C)CC	ZINC000952976161	615382515	/nfs/dbraw/zinc/38/25/15/615382515.db2.gz	DYULECAQZCNCOU-AWEZNQCLSA-N	1	0	291.395	1.393	50	0		CDAARO
C[NH+](C)CC(C)(C)CNC(=O)CCCn1cccc1	ZINC000888104634	617783733	/nfs/dbraw/zinc/78/37/33/617783733.db2.gz	ICQNOERANOGGET-UHFFFAOYSA-N	1	0	265.401	1.972	50	0		CDAARO
O=C(Cc1cc[nH]n1)NC[C@H](c1ccccc1)[NH+]1CCCC1	ZINC000120670232	620286514	/nfs/dbraw/zinc/28/65/14/620286514.db2.gz	SPVABUKEIRNZCV-MRXNPFEDSA-N	1	0	298.390	1.906	50	0		CDAARO
CC1(C)CC([NH2+][C@H]2CNCC[C@H]2O)CC(C)(C)C1	ZINC000426668522	677763670	/nfs/dbraw/zinc/76/36/70/677763670.db2.gz	ZOPDDRBJSJCTRC-QWHCGFSZSA-N	1	0	254.418	1.904	50	0		CDAARO
c1nc2ccnc(N3CC[N@H+]4CCCC[C@H]4C3)c2[nH]1	ZINC000863982503	678061062	/nfs/dbraw/zinc/06/10/62/678061062.db2.gz	PSSNTYWPGZYJOB-NSHDSACASA-N	1	0	257.341	1.632	50	0		CDAARO
Cc1nn(C)c(C)c1/C=C/C(=O)N1CC[N@@H+](C)C[C@H]1C	ZINC000089505601	678719800	/nfs/dbraw/zinc/71/98/00/678719800.db2.gz	OULHUDVALSPHSW-XUIVZRPNSA-N	1	0	276.384	1.213	50	0		CDAARO
Cc1nc[nH]c1C[NH2+][C@H]1CC(=O)N(CC2CCCCC2)C1	ZINC000012302036	678886189	/nfs/dbraw/zinc/88/61/89/678886189.db2.gz	CQBDBFALRFZOHT-AWEZNQCLSA-N	1	0	290.411	1.989	50	0		CDAARO
Cc1cccnc1N1CC[NH+](C[C@@H]2CCCO2)CC1	ZINC000020543312	678912390	/nfs/dbraw/zinc/91/23/90/678912390.db2.gz	IEZAKGCAUVZMOK-AWEZNQCLSA-N	1	0	261.369	1.691	50	0		CDAARO
C[C@H](C[C@H](Nc1ccccn1)n1cncn1)n1cncn1	ZINC000022014256	679142497	/nfs/dbraw/zinc/14/24/97/679142497.db2.gz	GNPFBFVJSOTSNB-DGCLKSJQSA-N	1	0	284.327	1.527	50	0		CDAARO
[NH3+][C@H](c1ccsc1C(F)(F)F)C1(O)CNC1	ZINC000958527765	679142892	/nfs/dbraw/zinc/14/28/92/679142892.db2.gz	HNJKGIAOXABLAN-ZCFIWIBFSA-N	1	0	252.261	1.101	50	0		CDAARO
CC(C)=CC[NH+]1CCC(CNC(=O)[C@H]2CCC(=O)N2)CC1	ZINC001001255539	679162938	/nfs/dbraw/zinc/16/29/38/679162938.db2.gz	YLQIUYGNFKRZIG-CQSZACIVSA-N	1	0	293.411	1.059	50	0		CDAARO
O=S1(=O)C=C[C@@H]([NH2+]C2CCC3(CC[NH2+]CC3)CC2)C1	ZINC000067689074	679379762	/nfs/dbraw/zinc/37/97/62/679379762.db2.gz	JKQVUTWETYHFCZ-CYBMUJFWSA-N	1	0	284.425	1.199	50	0		CDAARO
O[C@]1(c2ccccc2)CC[N@H+](CCCCn2cncn2)C1	ZINC000019608011	679476148	/nfs/dbraw/zinc/47/61/48/679476148.db2.gz	ZXTCKJLQYBOQIJ-MRXNPFEDSA-N	1	0	286.379	1.652	50	0		CDAARO
CCOc1ccc(CN2CC[N@H+](C)[C@@H](CCO)C2)cc1	ZINC000023145413	679517036	/nfs/dbraw/zinc/51/70/36/679517036.db2.gz	RHZYHJKNTJJCJH-HNNXBMFYSA-N	1	0	278.396	1.584	50	0		CDAARO
CCc1n[nH]cc1C(=O)NCc1c(C)ncc2c1CC[NH2+]C2	ZINC000072481069	679525006	/nfs/dbraw/zinc/52/50/06/679525006.db2.gz	GPHBDFVFTUIZOZ-UHFFFAOYSA-N	1	0	299.378	1.251	50	0		CDAARO
CCC[N@@H+]1CC[C@H](Nc2ncc(F)c(N(C)C)n2)C1	ZINC001772712043	1159444955	/nfs/dbraw/zinc/44/49/55/1159444955.db2.gz	GMTRTHXKQUHROU-JTQLQIEISA-N	1	0	267.352	1.578	50	0		CDAARO
CCCCCOCC(=O)N[C@]1(C)C[NH+]2CCC1CC2	ZINC000585126612	1164214313	/nfs/dbraw/zinc/21/43/13/1164214313.db2.gz	DBWICJSWXNXYNA-OAHLLOKOSA-N	1	0	268.401	1.794	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OCC[C@@H]1CCOC1=O	ZINC000585123443	1164209393	/nfs/dbraw/zinc/20/93/93/1164209393.db2.gz	JODPUJQMQWIWNQ-NWDGAFQWSA-N	1	0	271.357	1.494	50	0		CDAARO
C1CC1c1nc2c(c(O[C@@H]3CCC[NH2+]C3)n1)CCOCC2	ZINC000675013538	899869106	/nfs/dbraw/zinc/86/91/06/899869106.db2.gz	HRPFIPGIMRFDPR-GFCCVEGCSA-N	1	0	289.379	1.600	50	0		CDAARO
c1cnc(C[C@@H]2CC[C@H](C[NH+]3CCSCC3)O2)cn1	ZINC000952854436	910408013	/nfs/dbraw/zinc/40/80/13/910408013.db2.gz	IHULEFXGCDBAIB-UONOGXRCSA-N	1	0	279.409	1.616	50	0		CDAARO
CCOc1ccnc(NC[C@]2(C)CC[N@H+](C)C2)n1	ZINC000823399289	925691732	/nfs/dbraw/zinc/69/17/32/925691732.db2.gz	IAEZOGYTHQMPOG-ZDUSSCGKSA-N	1	0	250.346	1.629	50	0		CDAARO
Cc1cccc(C2(NC(=O)N[C@@H]3CC[NH2+]C[C@H]3O)CC2)c1	ZINC000828001256	926016369	/nfs/dbraw/zinc/01/63/69/926016369.db2.gz	LPMYKWNYDWRXBG-ZIAGYGMSSA-N	1	0	289.379	1.006	50	0		CDAARO
Cc1[nH]ccc1C(=O)NCCC[N@@H+]1CCCC[C@@H]1CO	ZINC000828710997	926168377	/nfs/dbraw/zinc/16/83/77/926168377.db2.gz	VOBPBLKUEPPRMD-CYBMUJFWSA-N	1	0	279.384	1.290	50	0		CDAARO
COCCC1([NH+](C)C)CCN(C(=O)CC(C)C)CC1	ZINC000581805370	927203572	/nfs/dbraw/zinc/20/35/72/927203572.db2.gz	ZGAWGNULBGFFLF-UHFFFAOYSA-N	1	0	270.417	1.992	50	0		CDAARO
O=CN1CCC[N@H+](C[C@H]2CCc3ccccc3C2)CC1	ZINC000585087123	930898801	/nfs/dbraw/zinc/89/88/01/930898801.db2.gz	PDXDESOLHSMQNK-HNNXBMFYSA-N	1	0	272.392	1.956	50	0		CDAARO
C[C@H]1CCC[C@H](CC[NH+](C)C)N1C(=O)c1ccn(C)n1	ZINC000585128242	931013370	/nfs/dbraw/zinc/01/33/70/931013370.db2.gz	WVCHUCQJWSTTIS-QWHCGFSZSA-N	1	0	278.400	1.755	50	0		CDAARO
COc1ccc(C[N@H+]2C[C@@H](Cc3cnccn3)[C@H](O)C2)cc1	ZINC001529146918	968995787	/nfs/dbraw/zinc/99/57/87/968995787.db2.gz	RBPYWMLGSKPBSR-RHSMWYFYSA-N	1	0	299.374	1.521	50	0		CDAARO
CN(C)c1nccnc1N(C)CC[NH+]1CCCCCC1	ZINC001529159085	968997334	/nfs/dbraw/zinc/99/73/34/968997334.db2.gz	NVPWCYYAJCOXFF-UHFFFAOYSA-N	1	0	277.416	1.855	50	0		CDAARO
Cn1ccnc1CC[N@@H+]1CCOc2ccc(CO)cc2C1	ZINC001506413678	975154409	/nfs/dbraw/zinc/15/44/09/975154409.db2.gz	LCOCTNNSDPXZOY-UHFFFAOYSA-N	1	0	287.363	1.350	50	0		CDAARO
Cc1ccc2ncccc2c1C[NH2+][C@H](C)CN(C)CCO	ZINC001506417044	975156120	/nfs/dbraw/zinc/15/61/20/975156120.db2.gz	KGCQPYYZVAGJST-CQSZACIVSA-N	1	0	287.407	1.945	50	0		CDAARO
CCc1ncc(C[NH2+]CCn2cnc(C)c2C)cn1	ZINC001506419630	975157406	/nfs/dbraw/zinc/15/74/06/975157406.db2.gz	GWXNQTSUOLEYEM-UHFFFAOYSA-N	1	0	259.357	1.642	50	0		CDAARO
CCc1c(C)nn(C)c1NC(=O)[C@H]1CC12CC[NH2+]CC2	ZINC001506422989	975159463	/nfs/dbraw/zinc/15/94/63/975159463.db2.gz	BRSDNMVZVBKSOW-GFCCVEGCSA-N	1	0	276.384	1.619	50	0		CDAARO
Cc1nc(CN(C)CC[C@H]2CCCC[N@@H+]2C)no1	ZINC000096441539	230373037	/nfs/dbraw/zinc/37/30/37/230373037.db2.gz	ZOOHQYZKQKQUPO-GFCCVEGCSA-N	1	0	252.362	1.684	50	0		CDAARO
Cc1noc(C)c1C[NH2+]C[C@H]1COC2(CCOCC2)O1	ZINC000096494773	230383853	/nfs/dbraw/zinc/38/38/53/230383853.db2.gz	WVYUBVCPQGULBB-LBPRGKRZSA-N	1	0	282.340	1.303	50	0		CDAARO
Cc1nc(CN2CC3(CC[NH2+]CC3)OC2=O)co1	ZINC000095513172	185001508	/nfs/dbraw/zinc/00/15/08/185001508.db2.gz	ZATANBDYUNDLCD-UHFFFAOYSA-N	1	0	251.286	1.057	50	0		CDAARO
C[C@H](O)CSc1nnc(CC[NH3+])n1-c1ccc(F)cc1	ZINC000426368307	230415979	/nfs/dbraw/zinc/41/59/79/230415979.db2.gz	MJMCKLMHFIXHPI-VIFPVBQESA-N	1	0	296.371	1.381	50	0		CDAARO
O=C(C[NH+]1CCC(c2ccccc2)CC1)N1C[C@H](O)CO1	ZINC000095510633	185002031	/nfs/dbraw/zinc/00/20/31/185002031.db2.gz	SISPQSUALABUCB-HNNXBMFYSA-N	1	0	290.363	1.001	50	0		CDAARO
Cc1ncsc1CCNC(=O)[C@@H]([NH3+])C(C)(C)C	ZINC000220548417	230397477	/nfs/dbraw/zinc/39/74/77/230397477.db2.gz	DYDMYBBSGVZPAT-SNVBAGLBSA-N	1	0	255.387	1.484	50	0		CDAARO
CCc1nnc(CNC(=O)[C@@H]([NH3+])[C@@H](C)CC)s1	ZINC000220591604	230397569	/nfs/dbraw/zinc/39/75/69/230397569.db2.gz	LEHFZOUZLNVIMQ-XVKPBYJWSA-N	1	0	256.375	1.090	50	0		CDAARO
CC(C)NC(=O)C[NH2+]Cc1c[nH]nc1-c1cccs1	ZINC000035052734	341993569	/nfs/dbraw/zinc/99/35/69/341993569.db2.gz	MFGMYLLUUUDQTN-UHFFFAOYSA-N	1	0	278.381	1.752	50	0		CDAARO
Cc1nc(C[NH2+][C@@H]2CCCC[C@@H]2C(N)=O)cs1	ZINC000097375137	342002718	/nfs/dbraw/zinc/00/27/18/342002718.db2.gz	PKEUZMLNHMVIFL-WDEREUQCSA-N	1	0	253.371	1.585	50	0		CDAARO
COc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2C(N)=O)cc1F	ZINC000097375119	342002814	/nfs/dbraw/zinc/00/28/14/342002814.db2.gz	WQBBRKGGPPIIHS-WCQYABFASA-N	1	0	280.343	1.968	50	0		CDAARO
Cc1noc(C)c1CNC(=O)N1CC[NH+](CC2CC2)CC1	ZINC000095955268	185042163	/nfs/dbraw/zinc/04/21/63/185042163.db2.gz	OCLUNLGIRQMMNS-UHFFFAOYSA-N	1	0	292.383	1.529	50	0		CDAARO
CSC[C@H](C)NC(=O)[C@@H]1C[C@H]2CCCC[C@H]2[NH2+]1	ZINC000239359503	361745509	/nfs/dbraw/zinc/74/55/09/361745509.db2.gz	AEHVWHCDSNMYCY-QCNOEVLYSA-N	1	0	256.415	1.775	50	0		CDAARO
O=C(NCCn1cccc1)[C@H]1COCCN1CC1CCC1	ZINC000239667855	361746768	/nfs/dbraw/zinc/74/67/68/361746768.db2.gz	BRSFEENOEIYHPS-OAHLLOKOSA-N	1	0	291.395	1.105	50	0		CDAARO
NC(=O)C1(C[NH2+]C2CC(c3ccccc3)C2)CCOCC1	ZINC000127126069	342080277	/nfs/dbraw/zinc/08/02/77/342080277.db2.gz	VHCLPGMWLBWMTH-UHFFFAOYSA-N	1	0	288.391	1.804	50	0		CDAARO
CCOC(=O)[C@]1(C(C)C)CCN(Cc2nnc(C)n2C)C1	ZINC000194881705	342609313	/nfs/dbraw/zinc/60/93/13/342609313.db2.gz	ZDCNCTSWSRZIRT-OAHLLOKOSA-N	1	0	294.399	1.535	50	0		CDAARO
CN1CCO[C@H](C(=O)N2CC[C@H]3CCCC[C@@H]32)C1	ZINC000089385595	539087463	/nfs/dbraw/zinc/08/74/63/539087463.db2.gz	RCCCYVLEPOTXOO-AGIUHOORSA-N	1	0	252.358	1.108	50	0		CDAARO
COc1ccc(C[C@H](C)[NH+]2CCN(C)CC2)cc1OC	ZINC000022586752	342089059	/nfs/dbraw/zinc/08/90/59/342089059.db2.gz	JZEYQYISFZVSPS-ZDUSSCGKSA-N	1	0	278.396	1.882	50	0		CDAARO
CC(C)OC1CCC(NC(=O)[C@H]2CCC[NH2+]2)CC1	ZINC000195554715	342626169	/nfs/dbraw/zinc/62/61/69/342626169.db2.gz	FFHHQZLAAOZDEZ-WXRRBKDZSA-N	1	0	254.374	1.591	50	0		CDAARO
CC(C)(C)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[NH2+]CCO1	ZINC000195543497	342626654	/nfs/dbraw/zinc/62/66/54/342626654.db2.gz	BZEKFIQWLNOSJM-HUUCEWRRSA-N	1	0	290.407	1.748	50	0		CDAARO
O=C(Cc1cc(F)ccc1F)NC[C@@H]1CCCC[NH2+]1	ZINC000195542818	342626702	/nfs/dbraw/zinc/62/67/02/342626702.db2.gz	ZBXUZLHRXKKDSP-LBPRGKRZSA-N	1	0	268.307	1.766	50	0		CDAARO
Cn1cc([C@](C)(O)C[NH2+][C@H]2CCCSC2)cn1	ZINC000195558533	342628575	/nfs/dbraw/zinc/62/85/75/342628575.db2.gz	DQKWDRUYAFXQLI-NWDGAFQWSA-N	1	0	255.387	1.113	50	0		CDAARO
O=C(CCn1cnc2ccccc21)NC[C@@H]1C[C@H](F)C[NH2+]1	ZINC000244894017	361869004	/nfs/dbraw/zinc/86/90/04/361869004.db2.gz	YYNRVJOTMFQJGU-RYUDHWBXSA-N	1	0	290.342	1.243	50	0		CDAARO
CSC[C@H](C)C(=O)N[C@@H]1C[C@@H]([NH+](C)C)C1(C)C	ZINC000600841146	342252470	/nfs/dbraw/zinc/25/24/70/342252470.db2.gz	AHQZSXZSJBIOTG-HBNTYKKESA-N	1	0	258.431	1.830	50	0		CDAARO
CCN1C[C@@H](C[N@H+](C)Cc2[nH]cc(C)c(=O)c2C)CC1=O	ZINC000670446892	539114313	/nfs/dbraw/zinc/11/43/13/539114313.db2.gz	IQJSEUVOFNWXEK-CYBMUJFWSA-N	1	0	291.395	1.292	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)/C=C/c1ccc2c(c1)CCO2	ZINC000125795810	187200280	/nfs/dbraw/zinc/20/02/80/187200280.db2.gz	ORMDJUHGLYAKOR-PYEVWLCESA-N	1	0	272.348	1.455	50	0		CDAARO
Cc1noc(-c2cncnc2NCCC[NH+]2CCCC2)n1	ZINC000263618637	346911490	/nfs/dbraw/zinc/91/14/90/346911490.db2.gz	UTODYIITKYIOOR-UHFFFAOYSA-N	1	0	288.355	1.733	50	0		CDAARO
Nc1nc([C@@H]2CC[N@H+](Cc3cccc(F)c3)C2)cc(=O)[nH]1	ZINC000585116316	362043952	/nfs/dbraw/zinc/04/39/52/362043952.db2.gz	QKAURUNSOJWTKT-LLVKDONJSA-N	1	0	288.326	1.723	50	0		CDAARO
Cc1cnccc1CC[NH2+][C@H](C)Cc1cnccn1	ZINC000585116543	362045461	/nfs/dbraw/zinc/04/54/61/362045461.db2.gz	AHEROMDJEJGYDX-CYBMUJFWSA-N	1	0	256.353	1.943	50	0		CDAARO
Cc1cc(C(=O)N[C@@H]2C[C@@H]([NH+](C)C)C2(C)C)ns1	ZINC000585130414	362055904	/nfs/dbraw/zinc/05/59/04/362055904.db2.gz	PKTBUHZHECDVIO-GHMZBOCLSA-N	1	0	267.398	1.910	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)Cc2ccc(C)nc2)C1	ZINC000269100388	362104863	/nfs/dbraw/zinc/10/48/63/362104863.db2.gz	AYMAHNRAPDUINY-CQSZACIVSA-N	1	0	261.369	1.391	50	0		CDAARO
C[N@H+](C[C@@H](O)CC1CCCC1)[C@H]1CCCCNC1=O	ZINC000253396957	342419856	/nfs/dbraw/zinc/41/98/56/342419856.db2.gz	WMZNYJLIVXECMH-KBPBESRZSA-N	1	0	268.401	1.528	50	0		CDAARO
CCOc1ccccc1CCC(=O)N1CC[C@H](C[NH3+])C1	ZINC000178550827	362246752	/nfs/dbraw/zinc/24/67/52/362246752.db2.gz	HGGPIHUXMRZLEQ-CYBMUJFWSA-N	1	0	276.380	1.825	50	0		CDAARO
Cn1cc([C@@H]2CC[N@@H+]([C@@H]3Cc4ccccc4[C@@H]3O)C2)cn1	ZINC000182786311	362291899	/nfs/dbraw/zinc/29/18/99/362291899.db2.gz	XTSVZHDLTIFBIO-XYPHTWIQSA-N	1	0	283.375	1.868	50	0		CDAARO
COc1ccc(CNc2cc([C@H]3C[C@@H]([NH3+])C3)nc(N)n2)cc1	ZINC000252536047	362391460	/nfs/dbraw/zinc/39/14/60/362391460.db2.gz	HMQOLSCTCUULLC-TXEJJXNPSA-N	1	0	299.378	1.884	50	0		CDAARO
CCN(C)C(=O)NCC1(C[NH+]2CCOCC2)CCCCC1	ZINC000083752519	178741088	/nfs/dbraw/zinc/74/10/88/178741088.db2.gz	HDYDDNOEPFNFJY-UHFFFAOYSA-N	1	0	297.443	1.930	50	0		CDAARO
Cn1nc(C(=O)N2C[C@H]3C[NH2+]C[C@H]3C2)cc1-c1ccccc1	ZINC000097099577	185530884	/nfs/dbraw/zinc/53/08/84/185530884.db2.gz	GURHTKBGDMAUIY-OKILXGFUSA-N	1	0	296.374	1.379	50	0		CDAARO
C[C@@H](CC[NH+](C)C)NC(=O)Nc1ccc(N(C)C)nc1	ZINC000084637211	178907146	/nfs/dbraw/zinc/90/71/46/178907146.db2.gz	ODVZZWJABCAMPS-NSHDSACASA-N	1	0	279.388	1.609	50	0		CDAARO
O=C(CCC1CCCC1)N1CC[NH+](C[C@@H](O)C2CC2)CC1	ZINC000085436592	179062871	/nfs/dbraw/zinc/06/28/71/179062871.db2.gz	MLRMZLTUTFTRFD-MRXNPFEDSA-N	1	0	294.439	1.872	50	0		CDAARO
O=C(CC1CCCCC1)N1CC[NH+](C[C@H](O)C2CC2)CC1	ZINC000085436589	179063130	/nfs/dbraw/zinc/06/31/30/179063130.db2.gz	BVKJTECRSYUJHZ-INIZCTEOSA-N	1	0	294.439	1.872	50	0		CDAARO
CCn1cc([C@H]2OCC[C@@H]2C[NH2+]Cc2ncc[nH]2)cn1	ZINC000089305971	346755664	/nfs/dbraw/zinc/75/56/64/346755664.db2.gz	QOHIVJOZJNBKFQ-RISCZKNCSA-N	1	0	275.356	1.494	50	0		CDAARO
C[C@@H]1CC[NH2+]C[C@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC000086996428	179376718	/nfs/dbraw/zinc/37/67/18/179376718.db2.gz	JGJCAMQSEJPZRW-RDDDGLTNSA-N	1	0	272.270	1.832	50	0		CDAARO
CC(C)n1cnnc1CC[NH2+][C@H](C)Cn1ccnc1	ZINC000584896296	349357332	/nfs/dbraw/zinc/35/73/32/349357332.db2.gz	NOTYGBYORXJJII-GFCCVEGCSA-N	1	0	262.361	1.276	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CN(C)C(=O)Cc2ccncc2)C1	ZINC000584886684	349345044	/nfs/dbraw/zinc/34/50/44/349345044.db2.gz	QCUIJVOUOQVVPC-OAHLLOKOSA-N	1	0	291.395	1.051	50	0		CDAARO
CC[N@@H+]1CCCN(C(=O)[C@@]2(C)CC(C)=NO2)CC1	ZINC000584887081	349345442	/nfs/dbraw/zinc/34/54/42/349345442.db2.gz	JRDYQTGYMPYUFU-CYBMUJFWSA-N	1	0	253.346	1.096	50	0		CDAARO
CC[C@@H](C(=O)N(C)CC1(CO)CCCC1)[NH+]1CCCC1	ZINC000584897502	349359190	/nfs/dbraw/zinc/35/91/90/349359190.db2.gz	AQIRMBUVDKXLNG-AWEZNQCLSA-N	1	0	282.428	1.872	50	0		CDAARO
CN(CC[NH+]1CCCC1)C(=O)c1cccc2c1CCC2=O	ZINC000584899725	349361214	/nfs/dbraw/zinc/36/12/14/349361214.db2.gz	RZPZOJGKEHRZBE-UHFFFAOYSA-N	1	0	286.375	1.983	50	0		CDAARO
Cc1c[nH]c(C[N@@H+]2CC(C)(C)[C@@](C)(O)C2)c(C)c1=O	ZINC000091587238	180200183	/nfs/dbraw/zinc/20/01/83/180200183.db2.gz	LMYKKOCSWBZINY-HNNXBMFYSA-N	1	0	264.369	1.585	50	0		CDAARO
CCn1nc(CC(C)C)cc1C(=O)N1CC[C@H]([NH3+])C1	ZINC000091603075	180203501	/nfs/dbraw/zinc/20/35/01/180203501.db2.gz	AAEMAQBPCTZYPA-NSHDSACASA-N	1	0	264.373	1.275	50	0		CDAARO
COCCN(Cc1ccccc1)C(=O)[C@H]1CC[C@H]([NH3+])C1	ZINC000091548211	180188187	/nfs/dbraw/zinc/18/81/87/180188187.db2.gz	PJGJGMMSMAHYCM-GJZGRUSLSA-N	1	0	276.380	1.789	50	0		CDAARO
COCCN(Cc1ccccc1)C(=O)[C@@H]1CC[C@H]([NH3+])C1	ZINC000091548210	180188458	/nfs/dbraw/zinc/18/84/58/180188458.db2.gz	PJGJGMMSMAHYCM-CABCVRRESA-N	1	0	276.380	1.789	50	0		CDAARO
CCc1nnc(CN2C[C@H]3CC[C@H](C[N@H+]3CCOC)C2)o1	ZINC000091818458	180263255	/nfs/dbraw/zinc/26/32/55/180263255.db2.gz	YJMLAZLSBKKCDA-QWHCGFSZSA-N	1	0	294.399	1.175	50	0		CDAARO
CCC[C@H]1CN(C(=O)Cc2ccc(CO)cc2)C[C@@H]1[NH3+]	ZINC000092028750	180309552	/nfs/dbraw/zinc/30/95/52/180309552.db2.gz	UQFPGYGURMSSRD-GJZGRUSLSA-N	1	0	276.380	1.307	50	0		CDAARO
Cc1ccccc1C[N@@H+]1CCCN([C@H]2CCOC2=O)CC1	ZINC000106652279	186130310	/nfs/dbraw/zinc/13/03/10/186130310.db2.gz	PLZJUSVNYZCKQF-INIZCTEOSA-N	1	0	288.391	1.818	50	0		CDAARO
O=C(c1cncc(O)c1)N1CC[NH+](C2CCCC2)CC1	ZINC000109041311	186241049	/nfs/dbraw/zinc/24/10/49/186241049.db2.gz	JVYULKSYOIPKNA-UHFFFAOYSA-N	1	0	275.352	1.488	50	0		CDAARO
CC[C@@H]1CCCC[C@H]1C[NH+]1CCC2(CC1)NC(=O)NC2=O	ZINC000583650795	366007875	/nfs/dbraw/zinc/00/78/75/366007875.db2.gz	BIAFTEHYGYSCCT-OLZOCXBDSA-N	1	0	293.411	1.877	50	0		CDAARO
Cc1noc([C@@H]2C[N@@H+](C[C@]3(C)CCCS3)CCN2C)n1	ZINC000583651488	366012156	/nfs/dbraw/zinc/01/21/56/366012156.db2.gz	NQTHMCMBEXTWSL-JSGCOSHPSA-N	1	0	296.440	1.952	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1C(=O)N[C@H]1CCc2nccn2C1	ZINC000257365241	350964008	/nfs/dbraw/zinc/96/40/08/350964008.db2.gz	AVJZYWUJKFRRSX-QWHCGFSZSA-N	1	0	276.384	1.189	50	0		CDAARO
CC(C)N1C(=O)N[C@]2(CC[N@H+](CCC(F)(F)F)C2)C1=O	ZINC000095402404	351396695	/nfs/dbraw/zinc/39/66/95/351396695.db2.gz	ODTVCAFKKZBXAT-NSHDSACASA-N	1	0	293.289	1.344	50	0		CDAARO
CCCC[NH+]1CCN([C@@H]2CCCN(C(C)C)C2=O)CC1	ZINC000095999471	351468477	/nfs/dbraw/zinc/46/84/77/351468477.db2.gz	UEYJJOZMGIIWIN-OAHLLOKOSA-N	1	0	281.444	1.804	50	0		CDAARO
Cc1noc(-c2ccnc(N3CC[C@H]4CC[C@@H](C3)[NH2+]4)c2)n1	ZINC000065536201	363311045	/nfs/dbraw/zinc/31/10/45/363311045.db2.gz	JKOOOKBSIGILMD-OLZOCXBDSA-N	1	0	285.351	1.771	50	0		CDAARO
O=C(CC[N@H+]1CCC[C@H](O)C1)N1CCc2ccccc21	ZINC000012984307	358486044	/nfs/dbraw/zinc/48/60/44/358486044.db2.gz	RRFURBBVXAHVLT-AWEZNQCLSA-N	1	0	274.364	1.423	50	0		CDAARO
Ic1cccnc1N1CC[NH2+]CC1	ZINC000002526501	283041537	/nfs/dbraw/zinc/04/15/37/283041537.db2.gz	YEMFQTAXPFSLAE-UHFFFAOYSA-N	1	0	289.120	1.096	50	0		CDAARO
CCOC[C@@H](O)C[N@@H+]1CC[C@@H](Oc2ccccc2)C1	ZINC000195530314	363455420	/nfs/dbraw/zinc/45/54/20/363455420.db2.gz	WBIUPXVTPZEVTL-DZGCQCFKSA-N	1	0	265.353	1.537	50	0		CDAARO
COc1cc2c(cc1OC)[C@@H](C)[N@H+](CCC(N)=O)CC2	ZINC000000525572	355915194	/nfs/dbraw/zinc/91/51/94/355915194.db2.gz	MIAYHTHDFIRHNM-SNVBAGLBSA-N	1	0	278.352	1.498	50	0		CDAARO
COC(=O)C[C@]1(C)OC[C@H](C[NH+]2CCCCC2)O1	ZINC000000191969	355895584	/nfs/dbraw/zinc/89/55/84/355895584.db2.gz	GMGIMSPSNKVNFU-WCQYABFASA-N	1	0	257.330	1.167	50	0		CDAARO
C[C@H](O)C[NH2+]C[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000002639613	355978185	/nfs/dbraw/zinc/97/81/85/355978185.db2.gz	ZYCUQNVZGLYZEI-WCBMZHEXSA-N	1	0	294.178	1.704	50	0		CDAARO
[NH3+]CCCCNS(=O)(=O)c1ccc2ccccc2c1	ZINC000002169536	355962330	/nfs/dbraw/zinc/96/23/30/355962330.db2.gz	BUGAJERDTXSWQA-UHFFFAOYSA-N	1	0	278.377	1.857	50	0	in-vitro	CDAARO
CCCC[NH2+]CC(=O)NCC(=O)Nc1ccc(C)cc1	ZINC000004506442	356033463	/nfs/dbraw/zinc/03/34/63/356033463.db2.gz	LHCNBCJDGFRGDH-UHFFFAOYSA-N	1	0	277.368	1.439	50	0		CDAARO
CCOC(=O)CC[NH2+][C@@H](C)[C@@H]1COc2ccccc2O1	ZINC000004104218	356019338	/nfs/dbraw/zinc/01/93/38/356019338.db2.gz	VPEJVSUDRBRPKB-FZMZJTMJSA-N	1	0	279.336	1.758	50	0		CDAARO
Cn1ccnc1CN1CCC[C@H]([NH+]2CCC(CO)CC2)C1	ZINC000022851148	356226950	/nfs/dbraw/zinc/22/69/50/356226950.db2.gz	CIEDEPJPUAWNRQ-HNNXBMFYSA-N	1	0	292.427	1.089	50	0		CDAARO
COc1cccc(OC)c1C(=O)NCCC[NH+]1CCCC1	ZINC000010450022	356258551	/nfs/dbraw/zinc/25/85/51/356258551.db2.gz	MTQZDAKWUUXVNS-UHFFFAOYSA-N	1	0	292.379	1.920	50	0		CDAARO
COc1ccc(CCN2C[C@@H]([NH2+]CC3CC3)CC2=O)cc1	ZINC000011879736	356281796	/nfs/dbraw/zinc/28/17/96/356281796.db2.gz	DXGXZYYBKMIEMC-HNNXBMFYSA-N	1	0	288.391	1.838	50	0		CDAARO
CC(C)CN1C(=O)N(C)C2(CC[NH+](C)CC2)C1=O	ZINC000014748057	356397025	/nfs/dbraw/zinc/39/70/25/356397025.db2.gz	FYLVLGJXYPJROG-UHFFFAOYSA-N	1	0	253.346	1.001	50	0		CDAARO
CC(C)=CC[N@@H+]1CCN(Cc2c[nH]c(C)n2)C[C@@H]1CCO	ZINC000019227836	356477867	/nfs/dbraw/zinc/47/78/67/356477867.db2.gz	FKHXLCLVMVTHCZ-INIZCTEOSA-N	1	0	292.427	1.553	50	0		CDAARO
OCC[NH+]1CCN(Cc2ccc(Br)cc2)CC1	ZINC000019607248	356493297	/nfs/dbraw/zinc/49/32/97/356493297.db2.gz	ZEYMJAPCVCOFKR-UHFFFAOYSA-N	1	0	299.212	1.559	50	0		CDAARO
C1=C[C@H](N2CC[NH+](C[C@@H]3CCOC3)CC2)CCC1	ZINC000084137110	356525663	/nfs/dbraw/zinc/52/56/63/356525663.db2.gz	HKJWBGPMOFRXDG-GJZGRUSLSA-N	1	0	250.386	1.749	50	0		CDAARO
OCC[NH+]1CCN(c2ncnc3c4ccccc4[nH]c32)CC1	ZINC000020479600	356544478	/nfs/dbraw/zinc/54/44/78/356544478.db2.gz	CUNOLZBLKDUIOQ-UHFFFAOYSA-N	1	0	297.362	1.225	50	0		CDAARO
ClC1=CC[C@@H]2C[N@H+](CCN3CCOCC3)C[C@@H]2C1	ZINC000020813091	356554034	/nfs/dbraw/zinc/55/40/34/356554034.db2.gz	NTRSYCHJIBTEDS-OLZOCXBDSA-N	1	0	270.804	1.783	50	0		CDAARO
CC[N@H+](CCNC(=O)N[C@@H]1[C@H]2CCO[C@H]2C1(C)C)C1CC1	ZINC000246967907	356562765	/nfs/dbraw/zinc/56/27/65/356562765.db2.gz	OORQDLFNZISJDB-MGPQQGTHSA-N	1	0	295.427	1.583	50	0		CDAARO
CCCC(=O)NCC1(C(F)(F)F)CC[NH2+]CC1	ZINC000725264678	538455608	/nfs/dbraw/zinc/45/56/08/538455608.db2.gz	GTJORXDOJFYEFE-UHFFFAOYSA-N	1	0	252.280	1.835	50	0		CDAARO
[NH3+]CC1(C(F)(F)F)CCN(C(=O)C2CC2)CC1	ZINC000725264729	538455641	/nfs/dbraw/zinc/45/56/41/538455641.db2.gz	OSTNPSVAOMOKEX-UHFFFAOYSA-N	1	0	250.264	1.526	50	0		CDAARO
CCOc1ccc(CN2CC[NH+](CCC(N)=O)CC2)cc1	ZINC000022969424	356625134	/nfs/dbraw/zinc/62/51/34/356625134.db2.gz	NFXHYVZQEIFBQG-UHFFFAOYSA-N	1	0	291.395	1.078	50	0		CDAARO
CCC[N@@H+]1CCN(Cc2cccc(OC)c2)[C@@H](CCO)C1	ZINC000023375498	356641610	/nfs/dbraw/zinc/64/16/10/356641610.db2.gz	FIYXUWWHSRIBDO-INIZCTEOSA-N	1	0	292.423	1.974	50	0		CDAARO
COc1ccc(S(=O)(=O)N[C@H]2C[N@H+](C)C[C@H]2C)cc1C	ZINC000257366245	538486687	/nfs/dbraw/zinc/48/66/87/538486687.db2.gz	OZIDBLWYALJSCC-YPMHNXCESA-N	1	0	298.408	1.232	50	0		CDAARO
NC(=O)[C@@H]([NH2+]C[C@H]1Cc2ccccc2O1)c1ccccc1	ZINC000027032834	356703166	/nfs/dbraw/zinc/70/31/66/356703166.db2.gz	OGHGNCJYECCLBI-ZBFHGGJFSA-N	1	0	282.343	1.806	50	0		CDAARO
CC[C@@H]([NH2+]C[C@@H]1CCCO1)C(=O)Nc1cc(C)on1	ZINC000028624078	356723166	/nfs/dbraw/zinc/72/31/66/356723166.db2.gz	RPVQLHHCGROIMC-WDEREUQCSA-N	1	0	267.329	1.469	50	0		CDAARO
C[N@@H+](CC(=O)NCc1cccnc1)C[C@H]1CCCOC1	ZINC000095395069	357113803	/nfs/dbraw/zinc/11/38/03/357113803.db2.gz	DHJBCPZTXVXVDM-CQSZACIVSA-N	1	0	277.368	1.056	50	0		CDAARO
CC[N@@H+]1CC[C@H](CNC(=O)Nc2ccc(F)cn2)C1	ZINC000360397411	357115572	/nfs/dbraw/zinc/11/55/72/357115572.db2.gz	OLEHEIGXBOLTFY-SNVBAGLBSA-N	1	0	266.320	1.684	50	0		CDAARO
COC(=O)[C@H](O)C1CC[NH+](CCc2ccc(C)cc2)CC1	ZINC000095432430	357522171	/nfs/dbraw/zinc/52/21/71/357522171.db2.gz	QJJSCDHVTWKVOR-MRXNPFEDSA-N	1	0	291.391	1.783	50	0		CDAARO
COCc1nc(CNC2CC[NH+](C(C)C)CC2)no1	ZINC000065370457	357531937	/nfs/dbraw/zinc/53/19/37/357531937.db2.gz	LTXCAGBCWGRZPW-UHFFFAOYSA-N	1	0	268.361	1.178	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]CCNc2cccnc2)CC1	ZINC000065403385	357538123	/nfs/dbraw/zinc/53/81/23/357538123.db2.gz	SFTRAAVGSRQBBY-UHFFFAOYSA-N	1	0	292.383	1.704	50	0		CDAARO
Cc1ccccc1[C@H](C(=O)N1CCCOCC1)N(C)C	ZINC000065489750	357544721	/nfs/dbraw/zinc/54/47/21/357544721.db2.gz	SUFPMANWCWWWFN-OAHLLOKOSA-N	1	0	276.380	1.847	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CCN(C)c1cc(N(C)C)ncn1	ZINC000065530276	357547905	/nfs/dbraw/zinc/54/79/05/357547905.db2.gz	DDIFJBQSJQNAAA-ZDUSSCGKSA-N	1	0	277.416	1.853	50	0		CDAARO
COCc1ncc(C[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)cn1	ZINC000067934281	357638880	/nfs/dbraw/zinc/63/88/80/357638880.db2.gz	SIPHQRQUYKDTEA-ZDUSSCGKSA-N	1	0	287.367	1.726	50	0		CDAARO
COC(=O)c1ccc(C(=O)NC[C@H](C(C)C)[NH+](C)C)cc1	ZINC000033244206	357806323	/nfs/dbraw/zinc/80/63/23/357806323.db2.gz	MUMRSGDJWGFOIQ-CQSZACIVSA-N	1	0	292.379	1.789	50	0		CDAARO
Cc1nn[nH]c1C(=O)NC[C@H](c1ccc(C)cc1)[NH+](C)C	ZINC000188785393	357937361	/nfs/dbraw/zinc/93/73/61/357937361.db2.gz	ZNDLJHHDRRZHPB-CYBMUJFWSA-N	1	0	287.367	1.454	50	0		CDAARO
CNC(=O)CC[N@H+](C)C[C@@H]1CCCN2CCCC[C@H]12	ZINC000072133386	283302571	/nfs/dbraw/zinc/30/25/71/283302571.db2.gz	YOXIRZIBPPWTGI-UONOGXRCSA-N	1	0	267.417	1.319	50	0		CDAARO
CCC(=O)c1cccc(S(=O)(=O)N[C@@H](C[NH3+])C2CC2)c1	ZINC000097229429	358043617	/nfs/dbraw/zinc/04/36/17/358043617.db2.gz	DLGDHAKQNSNZON-ZDUSSCGKSA-N	1	0	296.392	1.295	50	0		CDAARO
Cc1cnc(C(=O)NC[C@@H](c2ccsc2)[NH+](C)C)cn1	ZINC000023133070	358079193	/nfs/dbraw/zinc/07/91/93/358079193.db2.gz	LSCSTWZNOKTTIQ-ZDUSSCGKSA-N	1	0	290.392	1.879	50	0		CDAARO
O=C(NCc1cc2n(n1)CCC[NH2+]C2)NC1CCCC1	ZINC000082156488	358149783	/nfs/dbraw/zinc/14/97/83/358149783.db2.gz	DYHIPJBEHBMURG-UHFFFAOYSA-N	1	0	277.372	1.118	50	0		CDAARO
Cc1nnc(N2CC[NH+](C3CCSCC3)CC2)o1	ZINC000095354805	358683567	/nfs/dbraw/zinc/68/35/67/358683567.db2.gz	YAHGUFAOJRNMLE-UHFFFAOYSA-N	1	0	268.386	1.396	50	0		CDAARO
Cc1nnc(N2CCCO[C@H](C[NH+]3CCCC3)C2)o1	ZINC000095360549	358685292	/nfs/dbraw/zinc/68/52/92/358685292.db2.gz	GPXUDUBYTRKJBH-GFCCVEGCSA-N	1	0	266.345	1.069	50	0		CDAARO
CC(C)[N@@H+]1CC[C@@H](CN2C(=O)COc3cccnc32)C1	ZINC000095362825	358685926	/nfs/dbraw/zinc/68/59/26/358685926.db2.gz	CBYBBJVSHWDHMM-GFCCVEGCSA-N	1	0	275.352	1.537	50	0		CDAARO
Cc1nnc(CCNC(=O)CC[C@H]2CCCC[N@H+]2C)s1	ZINC000095371020	358687826	/nfs/dbraw/zinc/68/78/26/358687826.db2.gz	ZQSDZVGSBMOTSY-GFCCVEGCSA-N	1	0	296.440	1.770	50	0		CDAARO
CCc1cc(N2CCOC[C@@H](C[NH+](C)C)C2)ncn1	ZINC000095385334	358691277	/nfs/dbraw/zinc/69/12/77/358691277.db2.gz	YQKZENUWLGAVMX-LBPRGKRZSA-N	1	0	264.373	1.053	50	0		CDAARO
O=C(NCC[C@@H]1CCC[NH2+]1)c1cnc2c(c1)CCCC2	ZINC000097635084	358788314	/nfs/dbraw/zinc/78/83/14/358788314.db2.gz	ZRWDWECIEJUPTE-AWEZNQCLSA-N	1	0	273.380	1.832	50	0		CDAARO
O=C(C[C@H]1COCCN1CCCO)c1cccs1	ZINC000119625004	358912684	/nfs/dbraw/zinc/91/26/84/358912684.db2.gz	PLTDIMHHCHJCGY-NSHDSACASA-N	1	0	269.366	1.404	50	0		CDAARO
CCc1nccc(C[NH+]2CCC(CCC(N)=O)CC2)n1	ZINC000215198975	358878229	/nfs/dbraw/zinc/87/82/29/358878229.db2.gz	VMBPJWDZTNJVHT-UHFFFAOYSA-N	1	0	276.384	1.517	50	0		CDAARO
COc1ccc(C[N@H+](C)CCc2cnn(C)c2)cn1	ZINC000215369267	358886445	/nfs/dbraw/zinc/88/64/45/358886445.db2.gz	OZHPBOZCPUMKGT-UHFFFAOYSA-N	1	0	260.341	1.498	50	0		CDAARO
CN1C(=O)[C@H]2C[N@H+](Cc3cccc4[nH]ccc43)C[C@H]2C1=O	ZINC000257177925	359137733	/nfs/dbraw/zinc/13/77/33/359137733.db2.gz	FPGRSRQSLVONMC-BETUJISGSA-N	1	0	283.331	1.215	50	0		CDAARO
O[C@](C1=[NH+]CCN1)(c1ccc(Cl)cc1)c1ccccn1	ZINC000011616987	359609814	/nfs/dbraw/zinc/60/98/14/359609814.db2.gz	DITYEPYMBCHKLF-OAHLLOKOSA-N	1	0	287.750	1.973	50	0	in-man	CDAARO
COCCCC[NH+]1CCN(c2cnccn2)CC1	ZINC000117872674	359730415	/nfs/dbraw/zinc/73/04/15/359730415.db2.gz	QOHDKYGUWRUAKW-UHFFFAOYSA-N	1	0	250.346	1.025	50	0		CDAARO
COC[C@]1(O)CCOC2(CC[NH+](Cc3ccoc3)CC2)C1	ZINC000409420411	360224542	/nfs/dbraw/zinc/22/45/42/360224542.db2.gz	QYJNWPYLDIKWSA-HNNXBMFYSA-N	1	0	295.379	1.802	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@@H]1CCN(C(=O)c2cnc(C)cn2)C1	ZINC000409421079	360230805	/nfs/dbraw/zinc/23/08/05/360230805.db2.gz	FIWWEODJIDBGHP-CYBMUJFWSA-N	1	0	285.351	1.686	50	0		CDAARO
CC(C)N1C[C@@H](C(=O)NCC[N@@H+]2CCC[C@H](C)C2)CC1=O	ZINC000248160900	360414408	/nfs/dbraw/zinc/41/44/08/360414408.db2.gz	LKPYURRKYZSSST-KBPBESRZSA-N	1	0	295.427	1.091	50	0		CDAARO
CC[NH+](CC)C[C@@H](O)COc1ccccc1C(C)=O	ZINC000004320469	360546785	/nfs/dbraw/zinc/54/67/85/360546785.db2.gz	CSNITBQQXAQVFX-CYBMUJFWSA-N	1	0	265.353	1.971	50	0		CDAARO
COCCCSc1nnc(C[NH3+])n1-c1ccc(F)cc1	ZINC000426581007	360684008	/nfs/dbraw/zinc/68/40/08/360684008.db2.gz	RDSPMLLJOODDGK-UHFFFAOYSA-N	1	0	296.371	1.994	50	0		CDAARO
C1C[C@H]2CN(C3CSCCSC3)C[C@@H]1C[NH2+]2	ZINC000426582724	360685332	/nfs/dbraw/zinc/68/53/32/360685332.db2.gz	BVWXXPNLMJHXSB-QWRGUYRKSA-N	1	0	258.456	1.519	50	0		CDAARO
C[C@@H](CCC(=O)N(C)Cc1cnccn1)[NH+]1CCCC1	ZINC000426438740	360670926	/nfs/dbraw/zinc/67/09/26/360670926.db2.gz	OJURCCFXGXGZHC-ZDUSSCGKSA-N	1	0	276.384	1.700	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)c2c(Cl)nc3ccccn32)C1	ZINC000178550639	189125834	/nfs/dbraw/zinc/12/58/34/189125834.db2.gz	GIWNDXNAZFIEFC-VIFPVBQESA-N	1	0	278.743	1.409	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)Cc2cc(F)ccc2F)C1	ZINC000178547183	189126302	/nfs/dbraw/zinc/12/63/02/189126302.db2.gz	DPMQVYAKRPTMHZ-SECBINFHSA-N	1	0	254.280	1.315	50	0		CDAARO
Cc1c(C(=O)N(C)[C@H]2CC[NH2+]C2)cnn1-c1ccccc1C	ZINC000179058602	189165923	/nfs/dbraw/zinc/16/59/23/189165923.db2.gz	WDYFQOJBJZVCCI-AWEZNQCLSA-N	1	0	298.390	1.923	50	0		CDAARO
[NH3+][C@@H]1CCOc2c(Br)cccc2[C@H]1O	ZINC000062626552	283593798	/nfs/dbraw/zinc/59/37/98/283593798.db2.gz	VDUBMHPWJFWWTE-RKDXNWHRSA-N	1	0	258.115	1.592	50	0		CDAARO
COCC[N@@H+](Cc1cccn1C)C[C@@H](O)COCC(C)C	ZINC000036098069	360908879	/nfs/dbraw/zinc/90/88/79/360908879.db2.gz	HBZHLUQLKHCZIQ-MRXNPFEDSA-N	1	0	298.427	1.507	50	0		CDAARO
C[N@@H+]1CCN(c2nccc(C3CCCC3)n2)C[C@H]1CCO	ZINC000106944218	361595010	/nfs/dbraw/zinc/59/50/10/361595010.db2.gz	GNDOIOJMZRZDBZ-CQSZACIVSA-N	1	0	290.411	1.637	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2C[C@@H]([NH+]3CCCC3)C2)ns1	ZINC000630030743	364444769	/nfs/dbraw/zinc/44/47/69/364444769.db2.gz	WRUAQHXGUPPTGR-PHIMTYICSA-N	1	0	265.382	1.808	50	0		CDAARO
O=C1CCCN1C1CCN(CCC[NH+]2CCCC2)CC1	ZINC000089819103	366941550	/nfs/dbraw/zinc/94/15/50/366941550.db2.gz	AQPZLNLMKHRRQH-UHFFFAOYSA-N	1	0	279.428	1.559	50	0		CDAARO
COCc1ccc(C[NH2+]CC(C)(C)S(C)(=O)=O)cc1	ZINC000089761797	366929079	/nfs/dbraw/zinc/92/90/79/366929079.db2.gz	LLKXQFUUGDZWTC-UHFFFAOYSA-N	1	0	285.409	1.746	50	0		CDAARO
CCC1(CC)[C@H](OC)C[C@H]1[N@H+](C)CCn1cncn1	ZINC000089948130	366976151	/nfs/dbraw/zinc/97/61/51/366976151.db2.gz	DBHLLYUGMWDOSZ-CHWSQXEVSA-N	1	0	266.389	1.804	50	0		CDAARO
CCOC(=O)C1CCN(CC[C@H]2CCC[N@@H+]2C)CC1	ZINC000089983614	367001699	/nfs/dbraw/zinc/00/16/99/367001699.db2.gz	GTEGMCWFKAZKCU-CQSZACIVSA-N	1	0	268.401	1.746	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@@H]1NC(=O)c1cccc(F)c1F	ZINC000094345236	367428220	/nfs/dbraw/zinc/42/82/20/367428220.db2.gz	RVIOFXNDFATHHU-KWQFWETISA-N	1	0	254.280	1.693	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[N@H+](CCO)CCSC(C)(C)C	ZINC000252493990	367641013	/nfs/dbraw/zinc/64/10/13/367641013.db2.gz	NIAQGSIKTZYRIL-RYUDHWBXSA-N	1	0	261.431	1.990	50	0		CDAARO
CCn1ncnc1CNCC1([NH+](C)C)CCCCC1	ZINC000638281287	369123445	/nfs/dbraw/zinc/12/34/45/369123445.db2.gz	PRVOYXINKITIBO-UHFFFAOYSA-N	1	0	265.405	1.652	50	0		CDAARO
CC[N@@H+]1CC[C@@H](CNCc2cccc3c2OCCO3)C1	ZINC000037644344	369505901	/nfs/dbraw/zinc/50/59/01/369505901.db2.gz	BMXJMUROMUIYQF-ZDUSSCGKSA-N	1	0	276.380	1.889	50	0		CDAARO
CC(C)CC(C)(C)C(=O)N1CCN([C@H]2CC[NH2+]C2)CC1	ZINC000377535799	371569339	/nfs/dbraw/zinc/56/93/39/371569339.db2.gz	MJNLTXLIINWPOB-AWEZNQCLSA-N	1	0	281.444	1.565	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@@H]([NH3+])CN1Cc1ccc(Cl)cc1	ZINC000299801662	372773638	/nfs/dbraw/zinc/77/36/38/372773638.db2.gz	ZXQMGFPUTUZWDI-OLZOCXBDSA-N	1	0	281.787	1.378	50	0		CDAARO
Nc1ccccc1C(=O)N1CC[N@@H+]2CCCC[C@H]2C1	ZINC000037839727	373597121	/nfs/dbraw/zinc/59/71/21/373597121.db2.gz	RBUHCSLJIHVBCR-LBPRGKRZSA-N	1	0	259.353	1.579	50	0		CDAARO
O[C@@H](C[NH2+]Cc1cccnc1)COc1ccc(F)cc1	ZINC000037850951	374091207	/nfs/dbraw/zinc/09/12/07/374091207.db2.gz	ZJIDUPYDYNOSHQ-AWEZNQCLSA-N	1	0	276.311	1.750	50	0		CDAARO
COC(=O)CCC[N@H+](C)[C@@H]1CCN(c2ccccc2)C1=O	ZINC000117340986	374535290	/nfs/dbraw/zinc/53/52/90/374535290.db2.gz	WHGLRWZZAAOTEQ-CQSZACIVSA-N	1	0	290.363	1.677	50	0		CDAARO
CN(Cc1csc2ccccc12)C(=O)[C@H]1C[C@H](O)C[NH2+]1	ZINC000277450098	374787272	/nfs/dbraw/zinc/78/72/72/374787272.db2.gz	HGSJVZJSUOUEAJ-WCQYABFASA-N	1	0	290.388	1.583	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1CCCNc1ccncn1	ZINC000095355255	374888054	/nfs/dbraw/zinc/88/80/54/374888054.db2.gz	FTJFVXYHODESRK-GFCCVEGCSA-N	1	0	250.346	1.125	50	0		CDAARO
C[C@H](CS(C)(=O)=O)[NH2+]Cc1cc(F)cc2cccnc21	ZINC000095415483	374917749	/nfs/dbraw/zinc/91/77/49/374917749.db2.gz	QHKWQVMUBHLZCB-SNVBAGLBSA-N	1	0	296.367	1.897	50	0		CDAARO
C[C@](CO)(NC(=O)NC1CC[NH+](C2CC2)CC1)C1CC1	ZINC000095417079	374918496	/nfs/dbraw/zinc/91/84/96/374918496.db2.gz	MGIBLWZQRCRNOE-OAHLLOKOSA-N	1	0	281.400	1.073	50	0		CDAARO
C[C@@H]1C[N@H+](C[C@@H]2CCCO2)CC[C@@H]1NC(=O)NC(C)(C)C	ZINC000095411319	374914280	/nfs/dbraw/zinc/91/42/80/374914280.db2.gz	KVWQMJHJSBYUBJ-RDBSUJKOSA-N	1	0	297.443	1.974	50	0		CDAARO
Cc1cc(S(=O)(=O)N(C)CCCC[NH+](C)C)c(C)o1	ZINC000095988812	375047964	/nfs/dbraw/zinc/04/79/64/375047964.db2.gz	RNSJPAKQFLORLW-UHFFFAOYSA-N	1	0	288.413	1.859	50	0		CDAARO
C[C@@H]1OCC[C@H]1[NH2+]Cc1ccc(N2CCOC2=O)cc1	ZINC000097084776	375147060	/nfs/dbraw/zinc/14/70/60/375147060.db2.gz	MCZFZJMFPJPXLL-SMDDNHRTSA-N	1	0	276.336	1.910	50	0		CDAARO
O=c1[nH]c(CSC2=[NH+]CCN2)nc2cc(Cl)ccc21	ZINC000012679928	375176042	/nfs/dbraw/zinc/17/60/42/375176042.db2.gz	PSJPSQREYMMRFI-UHFFFAOYSA-N	1	0	294.767	1.769	50	0		CDAARO
CCNc1ncc(C[N@H+](C)C[C@@H]2CCOC2)cn1	ZINC000670469186	483063330	/nfs/dbraw/zinc/06/33/30/483063330.db2.gz	SMYLGBPJERVIJO-NSHDSACASA-N	1	0	250.346	1.377	50	0		CDAARO
c1cc2c(ncnc2N2CCC[C@@]3(CC[NH2+]C3)C2)[nH]1	ZINC000333546639	375822790	/nfs/dbraw/zinc/82/27/90/375822790.db2.gz	OPUWGMHWVMNYEV-AWEZNQCLSA-N	1	0	257.341	1.538	50	0		CDAARO
COc1ccc(/C=C\C(=O)N(C)[C@@H]2CC[NH2+]C2)cc1F	ZINC000606441324	375823641	/nfs/dbraw/zinc/82/36/41/375823641.db2.gz	HVRCAGYCUWIHJA-TXNVCOODSA-N	1	0	278.327	1.668	50	0		CDAARO
C/C=C\c1ccc(OCC(=O)N2CC[C@H]([NH3+])C2)c(OC)c1	ZINC000429065742	247410803	/nfs/dbraw/zinc/41/08/03/247410803.db2.gz	QCZLSQHUICZEON-SCOBNMCVSA-N	1	0	290.363	1.667	50	0		CDAARO
O[C@@H](Cn1cccn1)C[N@@H+]1CC[C@@H]2CCCC[C@H]2C1	ZINC000239351863	376015453	/nfs/dbraw/zinc/01/54/53/376015453.db2.gz	AAEAUHRZMQCGTD-SOUVJXGZSA-N	1	0	263.385	1.756	50	0		CDAARO
Cc1n[nH]c(CN2CC[N@@H+]3CCC[C@H]3C2)c1Cl	ZINC000244787656	376022733	/nfs/dbraw/zinc/02/27/33/376022733.db2.gz	QBAPXQKEEPXKQB-JTQLQIEISA-N	1	0	254.765	1.652	50	0		CDAARO
CCc1ncnc(N2CCOC3(CC[NH+](C)CC3)C2)c1F	ZINC000645384671	377212467	/nfs/dbraw/zinc/21/24/67/377212467.db2.gz	JOVNJDWZQWKKMS-UHFFFAOYSA-N	1	0	294.374	1.479	50	0		CDAARO
CCc1ccccc1C[NH+]1CCC([C@H](O)C(=O)OC)CC1	ZINC000189257476	377232789	/nfs/dbraw/zinc/23/27/89/377232789.db2.gz	ADQRYZWNEGKRLD-INIZCTEOSA-N	1	0	291.391	1.995	50	0		CDAARO
CCC(=O)O[C@@H](CN1CCCC1=O)C[NH+]1CCCCC1	ZINC000001407144	377875499	/nfs/dbraw/zinc/87/54/99/377875499.db2.gz	TYPSXUFZGDLBRA-CYBMUJFWSA-N	1	0	282.384	1.417	50	0		CDAARO
COCCC1(CNC(=O)N[C@@H]2CCC[N@H+](C)C2)CC1	ZINC000089375314	377848277	/nfs/dbraw/zinc/84/82/77/377848277.db2.gz	JBRHFEQRHWWSBW-GFCCVEGCSA-N	1	0	269.389	1.197	50	0		CDAARO
COC(=O)[C@@H](NC(=O)OC(C)(C)C)C1CC[NH2+]CC1	ZINC000039363581	184546167	/nfs/dbraw/zinc/54/61/67/184546167.db2.gz	YMRAMAYADDQJIS-JTQLQIEISA-N	1	0	272.345	1.052	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)/C=C\C2CCOCC2)C1	ZINC000493201879	253399118	/nfs/dbraw/zinc/39/91/18/253399118.db2.gz	GKYAAFSXNOIXPA-ZRUQZJFASA-N	1	0	266.385	1.427	50	0		CDAARO
C[C@H]1CN(C(=O)/C=C\c2ccc3c(c2)CCO3)CC[NH2+]1	ZINC000493309505	253426278	/nfs/dbraw/zinc/42/62/78/253426278.db2.gz	XUXDYUDGHNNSPS-FHMRSRPSSA-N	1	0	272.348	1.455	50	0		CDAARO
C[C@@H](C[NH2+][C@H]1CC(C)(C)OC1(C)C)CS(C)(=O)=O	ZINC000119688755	390492152	/nfs/dbraw/zinc/49/21/52/390492152.db2.gz	LAXFCYYZKNBCRH-QWRGUYRKSA-N	1	0	277.430	1.603	50	0		CDAARO
C[NH+](C)CCn1ccc(NC(=O)NCc2ccsc2)n1	ZINC000096435349	390519053	/nfs/dbraw/zinc/51/90/53/390519053.db2.gz	PGADUGNTXVCRIP-UHFFFAOYSA-N	1	0	293.396	1.828	50	0		CDAARO
COC(=O)[C@H]1[C@H]2CCC[N@@H+]2C[C@]12c1ccccc1NC2=O	ZINC000012296508	391003345	/nfs/dbraw/zinc/00/33/45/391003345.db2.gz	SACUHBGXWYEFEY-IOASZLSFSA-N	1	0	286.331	1.144	50	0	biogenic	CDAARO
OC[C@]1([NH2+]C2CCN(Cc3ccccc3)CC2)CCOC1	ZINC000186650244	391345641	/nfs/dbraw/zinc/34/56/41/391345641.db2.gz	RXRCMIWNOFYDQK-QGZVFWFLSA-N	1	0	290.407	1.392	50	0		CDAARO
Cc1cc(NC(=O)N2CCC([NH+]3CC=CC3)CC2)no1	ZINC000101397381	391784313	/nfs/dbraw/zinc/78/43/13/391784313.db2.gz	NNQJGXKHPAUZCI-UHFFFAOYSA-N	1	0	276.340	1.851	50	0		CDAARO
CC[N@H+]1C[C@H](NS(=O)(=O)/C=C\c2ccccc2)[C@@H](C)C1	ZINC000588086366	392117162	/nfs/dbraw/zinc/11/71/62/392117162.db2.gz	LMYWPOXQFKEENR-YDKYRJPGSA-N	1	0	294.420	1.917	50	0		CDAARO
CN(C)C[C@H](O)C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1	ZINC000252586183	392530179	/nfs/dbraw/zinc/53/01/79/392530179.db2.gz	OAGBLHRSQXVBCI-GVDBMIGSSA-N	1	0	276.424	1.910	50	0		CDAARO
Cc1cc2c(cc1C)O[C@@H](C(=O)N1CC[NH2+][C@H](C)C1)C2	ZINC000188383972	292003197	/nfs/dbraw/zinc/00/31/97/292003197.db2.gz	OLKCDDOWNZCUJD-IUODEOHRSA-N	1	0	274.364	1.427	50	0		CDAARO
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CCC([NH3+])CC1	ZINC000020521588	299631863	/nfs/dbraw/zinc/63/18/63/299631863.db2.gz	HHVXPNQOTFFNGK-LLVKDONJSA-N	1	0	282.409	1.574	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)COc2cccc(F)c2)C1	ZINC000195107573	393061818	/nfs/dbraw/zinc/06/18/18/393061818.db2.gz	KAPSEGSMYGXLGN-NSHDSACASA-N	1	0	252.289	1.154	50	0		CDAARO
CC[C@H](O)C[NH+]1CCC(OC2CCOCC2)CC1	ZINC000096417886	393183627	/nfs/dbraw/zinc/18/36/27/393183627.db2.gz	JJFHUFUVWAXZSH-LBPRGKRZSA-N	1	0	257.374	1.417	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CCC[C@H](C(=O)c2ccc(F)cc2)C1	ZINC000096415729	393183692	/nfs/dbraw/zinc/18/36/92/393183692.db2.gz	IHYGCNDBKHHEPY-DZGCQCFKSA-N	1	0	295.354	1.728	50	0		CDAARO
COC(=O)N1CCC[C@H]([NH2+][C@@H]2CCCSC2)C1	ZINC000097084520	393193019	/nfs/dbraw/zinc/19/30/19/393193019.db2.gz	IFAHXWCEDTWEFE-WDEREUQCSA-N	1	0	258.387	1.702	50	0		CDAARO
C[C@@H]1C[NH+](C[C@H]2CCCN2c2ncccn2)C[C@@H](C)O1	ZINC000195570823	393301657	/nfs/dbraw/zinc/30/16/57/393301657.db2.gz	DOGPHANFVICORJ-MGPQQGTHSA-N	1	0	276.384	1.555	50	0		CDAARO
CC(C)SCC[N@@H+]1CCC[C@H](NC(=O)N(C)C)C1	ZINC000452021264	393427460	/nfs/dbraw/zinc/42/74/60/393427460.db2.gz	SRZHGJPHLATIDF-LBPRGKRZSA-N	1	0	273.446	1.864	50	0		CDAARO
Cc1ccccc1N1CCN([C@H]2CCC[NH2+]C2)CC1	ZINC000071738640	134975869	/nfs/dbraw/zinc/97/58/69/134975869.db2.gz	VZXANXLMMZVSCE-HNNXBMFYSA-N	1	0	259.397	1.869	50	0		CDAARO
C[NH2+]C1CCN(C(=O)Cc2cc(F)ccc2F)CC1	ZINC000095971595	147113482	/nfs/dbraw/zinc/11/34/82/147113482.db2.gz	PQZBJIPZIBIEIO-UHFFFAOYSA-N	1	0	268.307	1.718	50	0		CDAARO
CCO[C@H](C)C(=O)NC[C@@H]1[NH2+]CCc2ccccc21	ZINC000262399656	149058213	/nfs/dbraw/zinc/05/82/13/149058213.db2.gz	PJTPLECVZJOYQS-RISCZKNCSA-N	1	0	262.353	1.415	50	0		CDAARO
COc1cc2c(cc1C[N@H+](C)C[C@@H]1CCOC1)OCO2	ZINC000355386768	157019930	/nfs/dbraw/zinc/01/99/30/157019930.db2.gz	RCIUAXICEYHDBP-NSHDSACASA-N	1	0	279.336	1.892	50	0		CDAARO
[NH3+]Cc1ccc(C(=O)N[C@@H]2CCc3c[nH]nc3C2)cc1	ZINC000364033178	159366298	/nfs/dbraw/zinc/36/62/98/159366298.db2.gz	UDXJEEZFMQMVBB-CYBMUJFWSA-N	1	0	270.336	1.156	50	0		CDAARO
COc1ccccc1OCC[NH2+]C[C@@H]1CCCO1	ZINC000003315097	169877902	/nfs/dbraw/zinc/87/79/02/169877902.db2.gz	UVJQBHRCKMVDEU-LBPRGKRZSA-N	1	0	251.326	1.843	50	0		CDAARO
CCOc1ccc(C[NH2+][C@@H](CC)CO)cc1OC	ZINC000004840593	170027912	/nfs/dbraw/zinc/02/79/12/170027912.db2.gz	GAWWZMNWLLDFME-LBPRGKRZSA-N	1	0	253.342	1.954	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)cc1OC	ZINC000004988955	170050277	/nfs/dbraw/zinc/05/02/77/170050277.db2.gz	AVVRUCRJLFLQQK-LBPRGKRZSA-N	1	0	278.352	1.401	50	0		CDAARO
CCOc1ccc(N2C(=O)C[C@@H]([NH2+]C3CC3)C2=O)cc1	ZINC000005565173	170114281	/nfs/dbraw/zinc/11/42/81/170114281.db2.gz	QPMKMEGMRHAONT-CYBMUJFWSA-N	1	0	274.320	1.469	50	0		CDAARO
NC(=O)C[NH+]1CCC(c2c[nH]c3ccccc32)CC1	ZINC000008752618	170354324	/nfs/dbraw/zinc/35/43/24/170354324.db2.gz	RDRFQGOZNDQHHC-UHFFFAOYSA-N	1	0	257.337	1.833	50	0		CDAARO
CCOc1ccccc1C(=O)NCC1CC[NH2+]CC1	ZINC000019269577	170766571	/nfs/dbraw/zinc/76/65/71/170766571.db2.gz	SHLVYHRVBFGHIQ-UHFFFAOYSA-N	1	0	262.353	1.815	50	0		CDAARO
CCOC(=O)[C@H](c1ccc(Cl)cc1)N1CC[NH2+]CC1	ZINC000020268585	171125118	/nfs/dbraw/zinc/12/51/18/171125118.db2.gz	BYMTYIQWJHLTDK-ZDUSSCGKSA-N	1	0	282.771	1.849	50	0		CDAARO
COc1ccc2c(c1)[nH]c1c2ncn(CC[NH+](C)C)c1=O	ZINC000020503966	171227873	/nfs/dbraw/zinc/22/78/73/171227873.db2.gz	AVOKARPKIPEIOY-UHFFFAOYSA-N	1	0	286.335	1.448	50	0		CDAARO
Cc1nc[nH]c1CN1CC[N@H+](C2CCCC2)[C@@H](CCO)C1	ZINC000020534167	171240578	/nfs/dbraw/zinc/24/05/78/171240578.db2.gz	OOMQZIHZOAAPLD-HNNXBMFYSA-N	1	0	292.427	1.529	50	0		CDAARO
CC(=O)N1CCC([NH2+][C@H](C)CCCC(C)(C)O)CC1	ZINC000032507890	171730337	/nfs/dbraw/zinc/73/03/37/171730337.db2.gz	QTAQABKQKLQNPF-GFCCVEGCSA-N	1	0	270.417	1.917	50	0		CDAARO
Cc1cc(N[C@@H]2C[NH+]3CCC2CC3)ccc1-n1cnnn1	ZINC000037104098	172957580	/nfs/dbraw/zinc/95/75/80/172957580.db2.gz	FCPMHRMXJNDWTL-CQSZACIVSA-N	1	0	284.367	1.477	50	0		CDAARO
COc1ccc(-c2noc(CN3CCC[NH2+]CC3)n2)cc1	ZINC000037400113	173177760	/nfs/dbraw/zinc/17/77/60/173177760.db2.gz	HQJBAFHJHXPGCE-UHFFFAOYSA-N	1	0	288.351	1.541	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)NC[C@H]1Cc2ccccc21	ZINC000038075567	174085658	/nfs/dbraw/zinc/08/56/58/174085658.db2.gz	IJRMHTMZKKSDKE-CQSZACIVSA-N	1	0	258.365	1.832	50	0		CDAARO
Cn1nccc1CNC(=O)CC[NH+]1CCCCCCC1	ZINC000055099669	175570204	/nfs/dbraw/zinc/57/02/04/175570204.db2.gz	HBYBGUXTFHNLEY-UHFFFAOYSA-N	1	0	278.400	1.693	50	0		CDAARO
[NH3+]CC(=O)N1CCC[C@H](CCc2ccccc2F)C1	ZINC000071662921	176242643	/nfs/dbraw/zinc/24/26/43/176242643.db2.gz	DGKQCAMFWOMLOW-GFCCVEGCSA-N	1	0	264.344	1.956	50	0		CDAARO
CO[C@H]1CN(C(=O)c2cc3ccccc3[nH]2)CC[C@H]1[NH3+]	ZINC000071751946	176260126	/nfs/dbraw/zinc/26/01/26/176260126.db2.gz	QMJJJVCKTPPMPV-RISCZKNCSA-N	1	0	273.336	1.356	50	0		CDAARO
O=S(=O)(c1ccc(Cl)s1)N1CCC[NH2+]CC1	ZINC000019680058	260114698	/nfs/dbraw/zinc/11/46/98/260114698.db2.gz	XUVLOCJEHKEAQH-UHFFFAOYSA-N	1	0	280.802	1.386	50	0		CDAARO
Cc1cc(N2CC[C@H]([NH3+])C2=O)ccc1Br	ZINC000049648445	274710965	/nfs/dbraw/zinc/71/09/65/274710965.db2.gz	DSTFDWMELKKNBB-JTQLQIEISA-N	1	0	269.142	1.822	50	0		CDAARO
CC[NH+]1CCN(c2ncc(Br)cn2)CC1	ZINC000021166455	276204074	/nfs/dbraw/zinc/20/40/74/276204074.db2.gz	JMVPUQAKHMQWAF-UHFFFAOYSA-N	1	0	271.162	1.381	50	0		CDAARO
CC[NH+](CC)CCOC(=O)[C@@H]1COc2ccccc2O1	ZINC000001823079	276327466	/nfs/dbraw/zinc/32/74/66/276327466.db2.gz	PJHMVOHUUHWFIW-AWEZNQCLSA-N	1	0	279.336	1.711	50	0		CDAARO
C[NH+]1CCN(c2nc3ccccc3c(N3CCCC3)n2)CC1	ZINC000041148310	277114016	/nfs/dbraw/zinc/11/40/16/277114016.db2.gz	JGMPKEUMORMWNO-UHFFFAOYSA-N	1	0	297.406	1.982	50	0		CDAARO
COC(=O)N1CCC[C@@H]([NH2+][C@@H]2CCN(C3CC3)C2)C1	ZINC000089401067	277334419	/nfs/dbraw/zinc/33/44/19/277334419.db2.gz	DWHZMQTVBGTBTC-VXGBXAGGSA-N	1	0	267.373	1.044	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(C[C@H]([NH3+])CO2)CC1	ZINC000066339730	278384712	/nfs/dbraw/zinc/38/47/12/278384712.db2.gz	GBLUNQGZHFQTPW-JTQLQIEISA-N	1	0	256.346	1.504	50	0		CDAARO
C[C@@H]1C[C@H]([NH3+])CCN1C(=O)[C@@H]1CCOc2ccccc21	ZINC000129230870	278967483	/nfs/dbraw/zinc/96/74/83/278967483.db2.gz	XSEXYPWORYSNMO-YRGRVCCFSA-N	1	0	274.364	1.891	50	0		CDAARO
Cc1nc(C)c(C)c(N2CCC([NH+]3CCOCC3)CC2)n1	ZINC000095390185	279075686	/nfs/dbraw/zinc/07/56/86/279075686.db2.gz	PORYELAQQOEQSH-UHFFFAOYSA-N	1	0	290.411	1.703	50	0		CDAARO
C[C@@H]1[C@H](NC(=O)c2cc(-c3ccco3)n[nH]2)CCC[N@@H+]1C	ZINC000096010242	279124354	/nfs/dbraw/zinc/12/43/54/279124354.db2.gz	CMQDWAOFWFXWCP-GHMZBOCLSA-N	1	0	288.351	1.882	50	0		CDAARO
CN(C)CC(=O)N[C@H]1CCC[N@@H+](C2CCCCCC2)C1	ZINC000011840358	282058889	/nfs/dbraw/zinc/05/88/89/282058889.db2.gz	OFQULTBYJYDJSZ-AWEZNQCLSA-N	1	0	281.444	1.851	50	0		CDAARO
COc1ccccc1/C=C\C(=O)N1CCC[C@@H]([NH3+])C1	ZINC000255176347	289360630	/nfs/dbraw/zinc/36/06/30/289360630.db2.gz	SFSGOQSQXXIKQZ-LJTDUEICSA-N	1	0	260.337	1.658	50	0		CDAARO
COC[C@H](O)C[N@H+](C)[C@@H](C)C(=O)NC1CCC(C)CC1	ZINC000195530851	293172915	/nfs/dbraw/zinc/17/29/15/293172915.db2.gz	QWCXMQZOFXRKJP-GNRIBBGQSA-N	1	0	286.416	1.009	50	0		CDAARO
C[C@H]1COC2(CC[NH+](CC3(O)CCCCC3)CC2)O1	ZINC000089941319	300335947	/nfs/dbraw/zinc/33/59/47/300335947.db2.gz	CFUBNCYXSYOSCN-ZDUSSCGKSA-N	1	0	269.385	1.909	50	0		CDAARO
Cc1ccccc1[C@@H](CN1CCOCC1)[NH2+][C@H](C)CO	ZINC000183396992	302128374	/nfs/dbraw/zinc/12/83/74/302128374.db2.gz	XIRSHNFBPJCKQA-GDBMZVCRSA-N	1	0	278.396	1.339	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)c2c(F)cc(F)cc2F)C1	ZINC000086997897	303483496	/nfs/dbraw/zinc/48/34/96/303483496.db2.gz	VGQJZNFXUPAQCX-QMMMGPOBSA-N	1	0	258.243	1.667	50	0		CDAARO
C[C@@H](C(=O)NCCCOC1CCCC1)[NH+]1CCCC1	ZINC000534591723	328318292	/nfs/dbraw/zinc/31/82/92/328318292.db2.gz	CVQGQIWWNYATNU-ZDUSSCGKSA-N	1	0	268.401	1.936	50	0		CDAARO
C[C@@H](CCc1c[nH]c2ccccc12)[NH2+]CCc1nc(N)n[nH]1	ZINC000534644809	328330237	/nfs/dbraw/zinc/33/02/37/328330237.db2.gz	SFOUAMUZMCGEPO-NSHDSACASA-N	1	0	298.394	1.852	50	0		CDAARO
O=C(NC[C@@H]1CC[N@@H+](C2CCCCC2)C1)c1cncnc1	ZINC000534645473	328330526	/nfs/dbraw/zinc/33/05/26/328330526.db2.gz	ZTOGTOAONGJPLI-ZDUSSCGKSA-N	1	0	288.395	1.861	50	0		CDAARO
CC[N@H+](C)C1(CNc2cccc(C(N)=O)n2)CCCC1	ZINC000534645430	328330683	/nfs/dbraw/zinc/33/06/83/328330683.db2.gz	ONJYDHCPGMXZNE-UHFFFAOYSA-N	1	0	276.384	1.857	50	0		CDAARO
O=C(NC[C@H]1CC[N@@H+](C2CCCCC2)C1)C1(CO)CC1	ZINC000534634740	328333231	/nfs/dbraw/zinc/33/32/31/328333231.db2.gz	SKUKEGVSEMPVNP-CYBMUJFWSA-N	1	0	280.412	1.530	50	0		CDAARO
O=C(NCC[C@H]1CCCC[NH2+]1)[C@H]1CC[C@@H](O)CC1	ZINC000534637792	328334590	/nfs/dbraw/zinc/33/45/90/328334590.db2.gz	IVBWGYAYPYGKPP-UPJWGTAASA-N	1	0	254.374	1.186	50	0		CDAARO
[NH3+][C@H]1[C@@H]2CC[C@H]1CN(C(=O)Cc1ccccc1O)C2	ZINC000534651054	328337042	/nfs/dbraw/zinc/33/70/42/328337042.db2.gz	HXRDDRQMDNGEEL-JYAVWHMHSA-N	1	0	260.337	1.130	50	0		CDAARO
[NH3+][C@H]1[C@@H]2CC[C@H]1CN(CCS(=O)(=O)c1ccccc1)C2	ZINC000534651780	328337649	/nfs/dbraw/zinc/33/76/49/328337649.db2.gz	DLYQZMDFZXHZMT-NHAGDIPZSA-N	1	0	294.420	1.129	50	0		CDAARO
CCCOC[C@H]1CCN(C(=O)C2CC[NH2+]CC2)C1	ZINC000534659687	328342428	/nfs/dbraw/zinc/34/24/28/328342428.db2.gz	QBEHDZDUHKWKPC-LBPRGKRZSA-N	1	0	254.374	1.261	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)CCc2cn[nH]c2)CC1	ZINC000534673590	328348899	/nfs/dbraw/zinc/34/88/99/328348899.db2.gz	HFQBZVNUEDLVAN-UHFFFAOYSA-N	1	0	264.373	1.333	50	0		CDAARO
Cc1ncc(Cl)c(C(=O)N2C[C@@H](C)[C@H]([NH+](C)C)C2)n1	ZINC000084290499	323207305	/nfs/dbraw/zinc/20/73/05/323207305.db2.gz	VSTPFKOBNNCBHT-LDYMZIIASA-N	1	0	282.775	1.461	50	0		CDAARO
[NH3+]CCCNS(=O)(=O)Cc1cccc(C(F)(F)F)c1	ZINC000097229279	323207722	/nfs/dbraw/zinc/20/77/22/323207722.db2.gz	XXGZFZWWZUGOFP-UHFFFAOYSA-N	1	0	296.314	1.474	50	0		CDAARO
c1csc(N2CC[NH+](CC[C@@H]3CCCO3)CC2)n1	ZINC000188653851	323453912	/nfs/dbraw/zinc/45/39/12/323453912.db2.gz	BWMVDTLSHWKEBH-LBPRGKRZSA-N	1	0	267.398	1.834	50	0		CDAARO
C[NH+]1CCC(OCCCn2ccnc2[C@H]2CCOC2)CC1	ZINC000077420794	327132125	/nfs/dbraw/zinc/13/21/25/327132125.db2.gz	OKEJRSQJMCUDOT-AWEZNQCLSA-N	1	0	293.411	1.888	50	0		CDAARO
O=C1CC[C@H]([NH2+][C@@H]2CCCOc3ccccc32)CN1	ZINC000096477786	329526822	/nfs/dbraw/zinc/52/68/22/329526822.db2.gz	RJLMKNUWBGBLOZ-WCQYABFASA-N	1	0	260.337	1.769	50	0		CDAARO
CCO[C@@H]1C[C@H]([N@H+](C)CCN2CCOC2=O)C1(C)C	ZINC000084800726	482507282	/nfs/dbraw/zinc/50/72/82/482507282.db2.gz	IVJLVIQVWXINQG-NWDGAFQWSA-N	1	0	270.373	1.574	50	0		CDAARO
OC[C@@H]([NH2+]C1CCN([C@@H]2CCOC2)CC1)c1ccsc1	ZINC000585091226	482825571	/nfs/dbraw/zinc/82/55/71/482825571.db2.gz	NUZLOAZZZJXJEW-HUUCEWRRSA-N	1	0	296.436	1.624	50	0		CDAARO
CCCOc1cccc(CNC(=O)N[C@@H]2CC[NH2+]C2)c1	ZINC000670446694	482997874	/nfs/dbraw/zinc/99/78/74/482997874.db2.gz	XRZFKKNRPZIBOT-CYBMUJFWSA-N	1	0	277.368	1.637	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CCCn2ccccc2=O)n1	ZINC000670450635	483008516	/nfs/dbraw/zinc/00/85/16/483008516.db2.gz	SVPOOLGUHUSOKT-CQSZACIVSA-N	1	0	288.395	1.730	50	0		CDAARO
CCCCn1ncnc1[C@H](C)N1CC[NH+](C)CC1	ZINC000670452595	483023451	/nfs/dbraw/zinc/02/34/51/483023451.db2.gz	DJHYUMIGHKDYGH-LBPRGKRZSA-N	1	0	251.378	1.387	50	0		CDAARO
CC[N@@H+]1CCN(CCc2nccn2C)CC1(C)C	ZINC000670459779	483044008	/nfs/dbraw/zinc/04/40/08/483044008.db2.gz	JDLZZTKATPWMAG-UHFFFAOYSA-N	1	0	250.390	1.379	50	0		CDAARO
[NH3+][C@H]1CC[C@@H](n2cnc3ccc(F)cc3c2=O)CC1	ZINC000670465111	483055349	/nfs/dbraw/zinc/05/53/49/483055349.db2.gz	NRXHCCZTVHYEKU-PHIMTYICSA-N	1	0	261.300	1.978	50	0		CDAARO
CC[C@H]1CN(c2nc(C)c(C)cc2C(N)=O)CC[N@@H+]1C	ZINC000670473358	483083514	/nfs/dbraw/zinc/08/35/14/483083514.db2.gz	RRVIFEZTQLMDIS-LBPRGKRZSA-N	1	0	276.384	1.328	50	0		CDAARO
O=C(c1ccon1)N1CCCO[C@@H](C[NH+]2CCCCC2)C1	ZINC000670473311	483083566	/nfs/dbraw/zinc/08/35/66/483083566.db2.gz	UHHDOQIZFLRCJT-ZDUSSCGKSA-N	1	0	293.367	1.392	50	0		CDAARO
O=C1[C@@H]([NH2+]C2CCOCC2)CCCN1CC(F)(F)F	ZINC000090592353	483266676	/nfs/dbraw/zinc/26/66/76/483266676.db2.gz	LCXVVASMEKDMNN-JTQLQIEISA-N	1	0	280.290	1.308	50	0		CDAARO
C[C@H](CCc1cccc(F)c1)[NH2+]C[C@@H]1CN(C)CCN1C	ZINC000095422304	518181977	/nfs/dbraw/zinc/18/19/77/518181977.db2.gz	WOMKCFSAAIHWEW-RHSMWYFYSA-N	1	0	293.430	1.982	50	0		CDAARO
CN(C(=O)c1ccc(N2CCCC2)c(F)c1)[C@H]1CC[NH2+]C1	ZINC000179103728	523935052	/nfs/dbraw/zinc/93/50/52/523935052.db2.gz	BYFSIFZUFVPXIE-ZDUSSCGKSA-N	1	0	291.370	1.860	50	0		CDAARO
COc1ccc(C[NH2+]CCCSc2nnnn2C)cc1	ZINC000004993823	524070665	/nfs/dbraw/zinc/07/06/65/524070665.db2.gz	ZOYQUKWKOQXHGJ-UHFFFAOYSA-N	1	0	293.396	1.491	50	0		CDAARO
COc1ccccc1/C=C/C[N@@H+]1CCC[C@@H](C(N)=O)C1	ZINC000023281609	524317104	/nfs/dbraw/zinc/31/71/04/524317104.db2.gz	OHVFDYSITWQQEJ-BTKRWWFXSA-N	1	0	274.364	1.906	50	0		CDAARO
OC1CCN([C@@H]2CC[N@@H+](C3CCCCC3)C[C@H]2O)CC1	ZINC000012303215	527516306	/nfs/dbraw/zinc/51/63/06/527516306.db2.gz	CXRDPCJLUYMINX-HZPDHXFCSA-N	1	0	282.428	1.211	50	0		CDAARO
CCOCC1CCN(c2cc(C3CC([NH3+])C3)ncn2)CC1	ZINC000220134094	535444546	/nfs/dbraw/zinc/44/45/46/535444546.db2.gz	OLTRDZMFSGRXTO-UHFFFAOYSA-N	1	0	290.411	1.934	50	0		CDAARO
C[NH+]1CCN(c2cc(-c3ccccc3)ncn2)CC1	ZINC000005698897	536417822	/nfs/dbraw/zinc/41/78/22/536417822.db2.gz	NRJJRVIMKKANAW-UHFFFAOYSA-N	1	0	254.337	1.895	50	0		CDAARO
Cc1cc(C)c(C)c(OCCOCC[N@H+](C)CCO)c1	ZINC000002974976	538148785	/nfs/dbraw/zinc/14/87/85/538148785.db2.gz	XTONNJKGMZFEFY-UHFFFAOYSA-N	1	0	281.396	1.931	50	0		CDAARO
Cc1nnc([C@H]2CCC[N@H+](Cc3cnc(C)cn3)C2)[nH]1	ZINC000328651266	538244450	/nfs/dbraw/zinc/24/44/50/538244450.db2.gz	JMHQVUOCIYXYQW-LBPRGKRZSA-N	1	0	272.356	1.591	50	0		CDAARO
Cc1cc(NC(=O)C[NH+]2C[C@@H]3CC=CC[C@H]3C2)on1	ZINC000076040416	538435968	/nfs/dbraw/zinc/43/59/68/538435968.db2.gz	LJSACSNAHDRRCG-RYUDHWBXSA-N	1	0	261.325	1.820	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](CNc2ncc(Cl)cn2)C1	ZINC000952963753	616349341	/nfs/dbraw/zinc/34/93/41/616349341.db2.gz	KBFYIQDNVAESIP-LLVKDONJSA-N	1	0	284.791	1.900	50	0		CDAARO
COCCCCN(C)C(=O)[C@@H]1CC[C@@H]2C[C@H](C)C[N@@H+]2C1	ZINC000952995801	616862099	/nfs/dbraw/zinc/86/20/99/616862099.db2.gz	ZFNHYCKCPNNLIC-RRFJBIMHSA-N	1	0	282.428	1.992	50	0		CDAARO
Cc1nc[nH]c1C[NH2+][C@@H]1CC(=O)N(CC2CCCCC2)C1	ZINC000012302040	679820189	/nfs/dbraw/zinc/82/01/89/679820189.db2.gz	CQBDBFALRFZOHT-CQSZACIVSA-N	1	0	290.411	1.989	50	0		CDAARO
CC(C)OCC[NH+]1CCN(c2cccc([C@@H](C)O)n2)CC1	ZINC000863949108	679841256	/nfs/dbraw/zinc/84/12/56/679841256.db2.gz	IHJWNNDJQMQKKY-CQSZACIVSA-N	1	0	293.411	1.682	50	0		CDAARO
O=C1CC[C@H](C[N@@H+]2CCCN(c3ccccc3)CC2)O1	ZINC000821363144	679846152	/nfs/dbraw/zinc/84/61/52/679846152.db2.gz	UHURKNWFGNTXBR-OAHLLOKOSA-N	1	0	274.364	1.904	50	0		CDAARO
[NH3+][C@@H](CC(=O)N1CC(OCC(F)F)C1)c1ccccc1	ZINC000707215651	681225155	/nfs/dbraw/zinc/22/51/55/681225155.db2.gz	MRZZBGWGRAUXDQ-LBPRGKRZSA-N	1	0	284.306	1.569	50	0		CDAARO
Cc1cc(NC2CCOCC2)nc(N2CCCC2)[nH+]1	ZINC000032513750	681594291	/nfs/dbraw/zinc/59/42/91/681594291.db2.gz	SYPYELWGMGRRDK-UHFFFAOYSA-N	1	0	262.357	1.976	50	0		CDAARO
COC[C@@H](NC(=O)C(C)(C)[NH+]1CCCC1)c1ccnn1C	ZINC000426465366	681762596	/nfs/dbraw/zinc/76/25/96/681762596.db2.gz	ZKFZEUHYZMHRBO-GFCCVEGCSA-N	1	0	294.399	1.098	50	0		CDAARO
O[C@@H]1CCC[N@H+](CCNc2ncc(Cl)cc2F)C1	ZINC000032576279	682372181	/nfs/dbraw/zinc/37/21/81/682372181.db2.gz	GMLAAEDKCXECOL-SNVBAGLBSA-N	1	0	273.739	1.743	50	0		CDAARO
COc1ccc(C[NH2+][C@H]2CN3CCC2CC3)cc1OC	ZINC000019946016	683091920	/nfs/dbraw/zinc/09/19/20/683091920.db2.gz	LQULSYSPTUXELV-AWEZNQCLSA-N	1	0	276.380	1.888	50	0		CDAARO
O[C@H]1CN(c2ncccn2)CC[N@H+](Cc2ccccc2)C1	ZINC000096159748	683491437	/nfs/dbraw/zinc/49/14/37/683491437.db2.gz	JQDGJOYSSUPDEI-OAHLLOKOSA-N	1	0	284.363	1.160	50	0		CDAARO
O=c1c2c(Cl)cccc2ncn1C[C@@H]1C[NH2+]CCO1	ZINC000032529798	683531205	/nfs/dbraw/zinc/53/12/05/683531205.db2.gz	SDCLIQHOTNHFSD-VIFPVBQESA-N	1	0	279.727	1.038	50	0		CDAARO
Cc1ncc(CN2CC[N@@H+](C(C)C)[C@H](CCO)C2)s1	ZINC000038149270	683594009	/nfs/dbraw/zinc/59/40/09/683594009.db2.gz	GKNMZCGSFJKCIY-CYBMUJFWSA-N	1	0	283.441	1.729	50	0		CDAARO
O=C(NCc1ccccc1-n1cccn1)[C@H]1C[C@H](F)C[NH2+]1	ZINC000188406826	684157693	/nfs/dbraw/zinc/15/76/93/684157693.db2.gz	VCSHSDJWSIPJON-QWHCGFSZSA-N	1	0	288.326	1.189	50	0		CDAARO
Cc1ncc(Cl)c(NC2CC[NH+](CCO)CC2)n1	ZINC001772704458	1159440004	/nfs/dbraw/zinc/44/00/04/1159440004.db2.gz	RJSQDIBRUYIYFM-UHFFFAOYSA-N	1	0	270.764	1.307	50	0		CDAARO
COc1ccnc(N2CC[NH+](CCc3ccccn3)CC2)c1	ZINC000104719912	722008627	/nfs/dbraw/zinc/00/86/27/722008627.db2.gz	UGKFYRFRQDBKNE-UHFFFAOYSA-N	1	0	298.390	1.850	50	0		CDAARO
CC[N@H+](C1CN(C(=O)CC(C)C)C1)C1CCOCC1	ZINC000581794361	899631904	/nfs/dbraw/zinc/63/19/04/899631904.db2.gz	BNADCDPFTVZPHS-UHFFFAOYSA-N	1	0	268.401	1.744	50	0		CDAARO
CCCCCOCC(=O)N[C@@H](C[NH+](C)C)C(C)C	ZINC000585146011	902304370	/nfs/dbraw/zinc/30/43/70/902304370.db2.gz	HLQSBWGMTZKZCL-ZDUSSCGKSA-N	1	0	258.406	1.896	50	0		CDAARO
Cc1[nH]nc(C(=O)N(C)C[C@H]2CCCC[N@@H+]2C)c1Cl	ZINC001506420223	909170657	/nfs/dbraw/zinc/17/06/57/909170657.db2.gz	YWCBJMOZHJGINX-SNVBAGLBSA-N	1	0	284.791	1.928	50	0		CDAARO
CCc1cc(OC)ccc1C[N@@H+]1CC[C@@H](CC(N)=O)C1	ZINC000952846236	910405296	/nfs/dbraw/zinc/40/52/96/910405296.db2.gz	RFAOVWPIKQXSQX-LBPRGKRZSA-N	1	0	276.380	1.955	50	0		CDAARO
CC(C)[C@@H](CNC(=O)c1ccnnc1)[NH+]1CCCC1	ZINC000820696460	925544964	/nfs/dbraw/zinc/54/49/64/925544964.db2.gz	XLSWRAKMDXRFSR-CYBMUJFWSA-N	1	0	262.357	1.327	50	0		CDAARO
CN(Cc1cccc(C[NH+](C)C)c1)C(=O)c1ccnn1C	ZINC000823709393	925722969	/nfs/dbraw/zinc/72/29/69/925722969.db2.gz	XUTULKOOSHLMTO-UHFFFAOYSA-N	1	0	286.379	1.754	50	0		CDAARO
COc1ncc(CN2CCC[C@@H]([NH+](C)C)C2)cn1	ZINC000824851772	925840527	/nfs/dbraw/zinc/84/05/27/925840527.db2.gz	FGCOFQYBLBWENO-GFCCVEGCSA-N	1	0	250.346	1.011	50	0		CDAARO
O=C(NCC1CC[NH+](Cc2ccoc2)CC1)[C@@H]1CCOC1	ZINC000827778565	925964814	/nfs/dbraw/zinc/96/48/14/925964814.db2.gz	KHGRLIBEZYVKGO-OAHLLOKOSA-N	1	0	292.379	1.644	50	0		CDAARO
Cn1ccnc1CC[NH+]1CCC2(CCC(=O)N2C)CC1	ZINC000828256284	926086259	/nfs/dbraw/zinc/08/62/59/926086259.db2.gz	NRILOIRABOYIEA-UHFFFAOYSA-N	1	0	276.384	1.049	50	0		CDAARO
c1nnc2n1CC[N@@H+](Cc1ccc3c(c1)CCO3)CC2	ZINC000200518114	929253766	/nfs/dbraw/zinc/25/37/66/929253766.db2.gz	XJZRQLDVDJSNTF-UHFFFAOYSA-N	1	0	270.336	1.271	50	0		CDAARO
Cc1nn(C)cc1-c1ccnc(NC2CC[NH+](C)CC2)n1	ZINC000048319812	937333265	/nfs/dbraw/zinc/33/32/65/937333265.db2.gz	JNZGZJNLVAEDDT-UHFFFAOYSA-N	1	0	286.383	1.692	50	0		CDAARO
O=C(NCc1nccs1)[C@H]1CCC[C@H]2CCC[N@@H+]21	ZINC000585121984	930988509	/nfs/dbraw/zinc/98/85/09/930988509.db2.gz	ITLGEJIXZWZLIZ-WDEREUQCSA-N	1	0	265.382	1.776	50	0		CDAARO
CC1(C)C[C@@H]1C(=O)N1CCOC2(CC[NH2+]CC2)C1	ZINC001506402083	975150763	/nfs/dbraw/zinc/15/07/63/975150763.db2.gz	IJQLPDWXWRZGJL-LLVKDONJSA-N	1	0	252.358	1.014	50	0		CDAARO
NC(=O)[C@H](Cc1ccccc1)[NH2+]C1CSCCSC1	ZINC001506404352	975151569	/nfs/dbraw/zinc/15/15/69/975151569.db2.gz	HAYSKYUXYNKNPP-ZDUSSCGKSA-N	1	0	296.461	1.521	50	0		CDAARO
CCNC(=O)c1cc(NC(=O)CC2C[NH2+]C2)ccc1Cl	ZINC001506423248	975159086	/nfs/dbraw/zinc/15/90/86/975159086.db2.gz	XDPLCPGESZAGEN-UHFFFAOYSA-N	1	0	295.770	1.638	50	0		CDAARO
COc1nccnc1NC[C@H]1CCC[N@@H+]1C(C)C	ZINC001506423099	975159113	/nfs/dbraw/zinc/15/91/13/975159113.db2.gz	UDAPIBCXZMTXIL-LLVKDONJSA-N	1	0	250.346	1.770	50	0		CDAARO
C[C@H](CNC(=O)[C@@H](C)[NH+]1CCCCCC1)Cn1ccnc1	ZINC000096446803	230374678	/nfs/dbraw/zinc/37/46/78/230374678.db2.gz	HBFKEXVBNRJNAD-HUUCEWRRSA-N	1	0	292.427	1.900	50	0		CDAARO
[NH3+][C@H]1CCCCN(C(=O)CCN2CCc3ccccc32)C1	ZINC000082086678	177918999	/nfs/dbraw/zinc/91/89/99/177918999.db2.gz	YLDRSZFRPRSFKF-HNNXBMFYSA-N	1	0	287.407	1.779	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2cnc(-c3ccccc3)s2)C[C@H]1O	ZINC000426477788	230419280	/nfs/dbraw/zinc/41/92/80/230419280.db2.gz	VSSPWXURLAYCEL-ZIAGYGMSSA-N	1	0	289.404	1.704	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1c1nc(-c2ccc(C)nn2)no1	ZINC000095519323	185002395	/nfs/dbraw/zinc/00/23/95/185002395.db2.gz	KUTHMSJYUHBUHV-LLVKDONJSA-N	1	0	259.313	1.992	50	0		CDAARO
C[C@@H](C[N@@H+]1CCC[C@H](C)C1)NC(=S)NC1CC1	ZINC000107341383	398140416	/nfs/dbraw/zinc/14/04/16/398140416.db2.gz	XMNLAYJWJNEKLD-QWRGUYRKSA-N	1	0	255.431	1.733	50	0		CDAARO
O=C(N[C@@H]1C[NH2+]CCC1(F)F)OCc1ccccc1	ZINC000110916119	342561518	/nfs/dbraw/zinc/56/15/18/342561518.db2.gz	CYAZBXNRJGQQSC-LLVKDONJSA-N	1	0	270.279	1.910	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@@H]2CCCC[C@H]2O)n1C	ZINC000590596452	342579475	/nfs/dbraw/zinc/57/94/75/342579475.db2.gz	ZKUZYFGWCYMBRQ-DGCLKSJQSA-N	1	0	266.341	1.205	50	0		CDAARO
CC(C)c1nn(C)cc1CN(C)C(=O)C1CC[NH2+]CC1	ZINC000195554357	342625883	/nfs/dbraw/zinc/62/58/83/342625883.db2.gz	VMILDFDLENKFMK-UHFFFAOYSA-N	1	0	278.400	1.502	50	0		CDAARO
C[C@@H](CC(=O)N1CCCCCC1)[NH2+][C@@H]1C=C[C@H](CO)C1	ZINC000195558599	342628531	/nfs/dbraw/zinc/62/85/31/342628531.db2.gz	UPFWPKIWYBPIMU-SOUVJXGZSA-N	1	0	280.412	1.694	50	0		CDAARO
Fc1ccc(-c2noc(CC3CC[NH2+]CC3)n2)nc1	ZINC000094044087	539087967	/nfs/dbraw/zinc/08/79/67/539087967.db2.gz	ANNDLGVQKBTQPS-UHFFFAOYSA-N	1	0	262.288	1.813	50	0		CDAARO
[NH3+]Cc1cc(C(=O)N[C@@H]2CCC[C@H]3OCC[C@H]32)co1	ZINC000249067887	361836285	/nfs/dbraw/zinc/83/62/85/361836285.db2.gz	JKCHHYXZWKSVSL-YNEHKIRRSA-N	1	0	264.325	1.426	50	0		CDAARO
CO[C@@H]1CC[N@H+](CCN2CCN(c3ccccc3)CC2)C1	ZINC000244595071	361853065	/nfs/dbraw/zinc/85/30/65/361853065.db2.gz	DOCUDDMQMLNTBY-QGZVFWFLSA-N	1	0	289.423	1.529	50	0		CDAARO
[NH3+]C[C@@H]1CCCCN1CCC(=O)NCc1cccs1	ZINC000244601898	361854100	/nfs/dbraw/zinc/85/41/00/361854100.db2.gz	DTWBGGGKCSOPLB-LBPRGKRZSA-N	1	0	281.425	1.568	50	0		CDAARO
Cc1nnc(CN2CC[NH+](C3CCSCC3)CC2)o1	ZINC000244852716	361866572	/nfs/dbraw/zinc/86/65/72/361866572.db2.gz	UXHNGFJBINGHQY-UHFFFAOYSA-N	1	0	282.413	1.391	50	0		CDAARO
CCC(=O)N1CCC([NH2+][C@@H]2CCN3CCCC[C@@H]23)CC1	ZINC000685939659	539045769	/nfs/dbraw/zinc/04/57/69/539045769.db2.gz	XJBXDRNIQXEHLD-CABCVRRESA-N	1	0	279.428	1.604	50	0		CDAARO
C[C@@H]1CCC[C@@H](OCC(=O)N2CC[NH2+]C[C@@H]2C)C1	ZINC000126277699	187229516	/nfs/dbraw/zinc/22/95/16/187229516.db2.gz	KKEMQGNZIQXDSG-FRRDWIJNSA-N	1	0	254.374	1.402	50	0		CDAARO
O[C@@H](C[NH+]1CCC(Cn2ccnn2)CC1)CC(F)(F)F	ZINC000189393104	362057114	/nfs/dbraw/zinc/05/71/14/362057114.db2.gz	KQBJRXRLDJIHOA-LLVKDONJSA-N	1	0	292.305	1.303	50	0		CDAARO
[NH3+]C1(C(=O)N2CCO[C@@H](c3ccccc3F)C2)CCCC1	ZINC000178105336	362238942	/nfs/dbraw/zinc/23/89/42/362238942.db2.gz	FOTZHSPGSHVPJW-CQSZACIVSA-N	1	0	292.354	1.997	50	0		CDAARO
COc1cccc(CN(C)C(=O)COC2CC[NH2+]CC2)c1	ZINC000111796116	365753807	/nfs/dbraw/zinc/75/38/07/365753807.db2.gz	PVLQGPLONOICSX-UHFFFAOYSA-N	1	0	292.379	1.422	50	0		CDAARO
C[C@H](Oc1ccccc1Cl)C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178546951	362246633	/nfs/dbraw/zinc/24/66/33/362246633.db2.gz	AHHAHBNKYVELPQ-WDEREUQCSA-N	1	0	282.771	1.915	50	0		CDAARO
CCc1oc(C(=O)N2CC[C@H](C[NH2+]C)C2)cc1C	ZINC000178985822	362251373	/nfs/dbraw/zinc/25/13/73/362251373.db2.gz	GLXOMBIUTAZHST-LLVKDONJSA-N	1	0	250.342	1.832	50	0		CDAARO
Cc1nn2c(nc(C)cc2N2C[C@H]3C[NH2+]C[C@H]3C2)c1C	ZINC000072462586	282308074	/nfs/dbraw/zinc/30/80/74/282308074.db2.gz	KARLDIGTOJRQDJ-BETUJISGSA-N	1	0	271.368	1.310	50	0		CDAARO
C[NH2+]C1CCN(C(=O)[C@H](C)n2nc(C)cc2C)CC1	ZINC000179144954	362252792	/nfs/dbraw/zinc/25/27/92/362252792.db2.gz	MMCRAYUQQYPYLN-LBPRGKRZSA-N	1	0	264.373	1.271	50	0		CDAARO
COc1ccnc(N2CC[NH+](C[C@H]3CCCOC3)CC2)n1	ZINC000252485158	362385893	/nfs/dbraw/zinc/38/58/93/362385893.db2.gz	GOGYKHVFNRFQCX-CYBMUJFWSA-N	1	0	292.383	1.034	50	0		CDAARO
CC(=O)N(C)[C@@H]1CC[N@H+](CCCc2cccnc2)C1	ZINC000252487808	362386743	/nfs/dbraw/zinc/38/67/43/362386743.db2.gz	IBTQIBYBCXUGPA-OAHLLOKOSA-N	1	0	261.369	1.567	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN1C(=O)CC1CCCC1	ZINC000085469776	179075056	/nfs/dbraw/zinc/07/50/56/179075056.db2.gz	ODPYGNQUAYVIAM-ZDUSSCGKSA-N	1	0	254.374	1.356	50	0		CDAARO
CCOC(=O)c1c(C)[nH+]c(C)cc1N1CCOCC1	ZINC000019117296	365813169	/nfs/dbraw/zinc/81/31/69/365813169.db2.gz	BWVRBDOYLOCREV-UHFFFAOYSA-N	1	0	264.325	1.712	50	0		CDAARO
CCn1nccc1C[NH2+][C@@H]1CCCN(c2ncccn2)C1	ZINC000125214585	136706684	/nfs/dbraw/zinc/70/66/84/136706684.db2.gz	RXGJSFVHGZYJPB-CYBMUJFWSA-N	1	0	286.383	1.452	50	0		CDAARO
CC[C@@H]1CN(C(=O)c2csc(COC)n2)C[C@H]1[NH+](C)C	ZINC000089948583	347628051	/nfs/dbraw/zinc/62/80/51/347628051.db2.gz	WSNWDXHCKACLLQ-ZYHUDNBSSA-N	1	0	297.424	1.702	50	0		CDAARO
CCCSCC(=O)NC[C@@H]1CC[N@H+](CCC)C1	ZINC000053405375	348747952	/nfs/dbraw/zinc/74/79/52/348747952.db2.gz	LLCHIAQLQBERCA-LBPRGKRZSA-N	1	0	258.431	1.978	50	0		CDAARO
COc1ccsc1C(=O)NCC1(C)CC[NH2+]CC1	ZINC000129068312	187408482	/nfs/dbraw/zinc/40/84/82/187408482.db2.gz	CAOCOBCDTMCZCA-UHFFFAOYSA-N	1	0	268.382	1.876	50	0		CDAARO
CO[C@H](C)C(=O)N1CCC([NH+]2CCCCCC2)CC1	ZINC000584896057	349357643	/nfs/dbraw/zinc/35/76/43/349357643.db2.gz	SPCIYEPMEATWIR-CYBMUJFWSA-N	1	0	268.401	1.888	50	0		CDAARO
CC[N@@H+]1CCCN(C(=O)[C@]2(C)CC(C)=NO2)CC1	ZINC000584887082	349345400	/nfs/dbraw/zinc/34/54/00/349345400.db2.gz	JRDYQTGYMPYUFU-ZDUSSCGKSA-N	1	0	253.346	1.096	50	0		CDAARO
COCC1(C(=O)N2CC[NH+](CC3CCCC3)CC2)CC1	ZINC000584887815	349346317	/nfs/dbraw/zinc/34/63/17/349346317.db2.gz	SEKKILXMUCIRCH-UHFFFAOYSA-N	1	0	280.412	1.747	50	0		CDAARO
CC(=O)Nc1cccc([C@@H](C)[NH2+]C[C@]2(O)CCOC2)c1	ZINC000090848885	180045386	/nfs/dbraw/zinc/04/53/86/180045386.db2.gz	QIYOLRHGNGTHNC-IAQYHMDHSA-N	1	0	278.352	1.447	50	0		CDAARO
CCCCn1ccnc1C1CCN(C(=O)C2([NH3+])CC2)CC1	ZINC000091493900	180171549	/nfs/dbraw/zinc/17/15/49/180171549.db2.gz	BWDBZHDLNIUTPU-UHFFFAOYSA-N	1	0	290.411	1.881	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@H]1NC(=O)c1cccc(F)c1F	ZINC000091496329	180171876	/nfs/dbraw/zinc/17/18/76/180171876.db2.gz	HLXHBEOZAOBXQR-GZMMTYOYSA-N	1	0	254.280	1.835	50	0		CDAARO
Cc1ccccc1Cn1ncnc1C1(O)CC[NH+](C)CC1	ZINC000091550667	180188993	/nfs/dbraw/zinc/18/89/93/180188993.db2.gz	ANPWGLBMKJRTNG-UHFFFAOYSA-N	1	0	286.379	1.548	50	0		CDAARO
Cc1ccc(C)c2c(=O)cc(C[NH2+]CCOCCO)[nH]c12	ZINC000091644428	180214921	/nfs/dbraw/zinc/21/49/21/180214921.db2.gz	YLLZDYPQAPLNLO-UHFFFAOYSA-N	1	0	290.363	1.243	50	0		CDAARO
CCc1cc(N2CC(C)(C)[C@@](C)(O)C2)nc(N(C)C)[nH+]1	ZINC000091707130	180230313	/nfs/dbraw/zinc/23/03/13/180230313.db2.gz	DVPZSRQYVQLDPD-HNNXBMFYSA-N	1	0	278.400	1.702	50	0		CDAARO
CN1CCO[C@H](C[NH2+]Cc2ccccc2Cl)C1	ZINC000105472053	186058552	/nfs/dbraw/zinc/05/85/52/186058552.db2.gz	NUTWCCHIDYTXCT-GFCCVEGCSA-N	1	0	254.761	1.760	50	0		CDAARO
CC(C)N1C[C@H]([NH2+][C@H](C)CCS(C)(=O)=O)[C@@H](C)C1	ZINC000110689026	350262822	/nfs/dbraw/zinc/26/28/22/350262822.db2.gz	NOZLPZMXLCFMPC-XQQFMLRXSA-N	1	0	276.446	1.128	50	0		CDAARO
CCCCn1ccnc1C1CCN(C(=O)C[NH+](C)C)CC1	ZINC000091808999	180260755	/nfs/dbraw/zinc/26/07/55/180260755.db2.gz	YWIVSHAVZGVYGB-UHFFFAOYSA-N	1	0	292.427	1.951	50	0		CDAARO
COc1ccc(C(=O)NC[C@@H]2C[N@@H+]3CCC[C@H]3CO2)cc1	ZINC000106517118	186123812	/nfs/dbraw/zinc/12/38/12/186123812.db2.gz	VBQKJNPXQHPJPE-DZGCQCFKSA-N	1	0	290.363	1.288	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000110615530	186305299	/nfs/dbraw/zinc/30/52/99/186305299.db2.gz	LSBLPFMUWMSGAU-DOTOQJQBSA-N	1	0	292.423	1.590	50	0		CDAARO
C[C@H](CNS(=O)(=O)CCCF)[N@@H+]1CCCC[C@@H]1C	ZINC000110667551	186312005	/nfs/dbraw/zinc/31/20/05/186312005.db2.gz	XWISNMFQUKEOSU-NWDGAFQWSA-N	1	0	280.409	1.528	50	0		CDAARO
COC(=O)[C@]1(C[NH3+])CC12CCN(C(=O)OC(C)(C)C)CC2	ZINC000260029974	351197707	/nfs/dbraw/zinc/19/77/07/351197707.db2.gz	CKVCWEBYSLEJNT-OAHLLOKOSA-N	1	0	298.383	1.526	50	0		CDAARO
COCCN1CCO[C@H](c2noc(-c3ccccc3)n2)C1	ZINC000096000264	351469193	/nfs/dbraw/zinc/46/91/93/351469193.db2.gz	DTNQJSYZUBVBFB-ZDUSSCGKSA-N	1	0	289.335	1.756	50	0		CDAARO
O=C(c1ccc(F)c(F)c1)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000122466969	187033770	/nfs/dbraw/zinc/03/37/70/187033770.db2.gz	CKYCNHNXMVSPGI-MNOVXSKESA-N	1	0	266.291	1.931	50	0		CDAARO
C[C@H](CN1CCOCC1)[NH2+]Cc1cc(F)ccc1F	ZINC000036932631	363295465	/nfs/dbraw/zinc/29/54/65/363295465.db2.gz	ZUGIXARNPBNOTL-LLVKDONJSA-N	1	0	270.323	1.775	50	0		CDAARO
Nc1cc(N)nc(Sc2ncnc3ccccc32)n1	ZINC000000033720	355880449	/nfs/dbraw/zinc/88/04/49/355880449.db2.gz	VKQJKIUNNLXCIQ-UHFFFAOYSA-N	1	0	270.321	1.735	50	0		CDAARO
CCOc1ccc2[nH]c(=O)c(C[NH2+]CCO)cc2c1	ZINC000002597379	355976948	/nfs/dbraw/zinc/97/69/48/355976948.db2.gz	HXWNUNVQIXBCTN-UHFFFAOYSA-N	1	0	262.309	1.009	50	0		CDAARO
COc1ccc(Br)cc1C[NH2+]CCO	ZINC000002846546	355984380	/nfs/dbraw/zinc/98/43/80/355984380.db2.gz	WVJJXAYLVXGPHO-UHFFFAOYSA-N	1	0	260.131	1.540	50	0		CDAARO
S=C(NCC[NH+]1CCCCC1)NCc1ccco1	ZINC000002872812	355985817	/nfs/dbraw/zinc/98/58/17/355985817.db2.gz	DWSUOIXHZJUKJP-UHFFFAOYSA-N	1	0	267.398	1.730	50	0		CDAARO
C[n+]1cccc(C(=O)NCCOC(=O)c2ccccc2)c1	ZINC000002880567	355986297	/nfs/dbraw/zinc/98/62/97/355986297.db2.gz	XFWWFMQJWDFYBW-UHFFFAOYSA-O	1	0	285.323	1.098	50	0		CDAARO
COCCC[NH2+]CCOCCOc1ccccc1OC	ZINC000002981103	355990229	/nfs/dbraw/zinc/99/02/29/355990229.db2.gz	NQRMIJZVNGBOKC-UHFFFAOYSA-N	1	0	283.368	1.717	50	0		CDAARO
Cc1cc(=O)cc(C(=O)NCC(C)(C)[NH+]2CCCC2)o1	ZINC000584901705	355956167	/nfs/dbraw/zinc/95/61/67/355956167.db2.gz	RUEXCIWRPBTULF-UHFFFAOYSA-N	1	0	278.352	1.552	50	0		CDAARO
COc1ccc(NC2=NC3(CCCC3)NC(=[NH2+])N2)cc1	ZINC000002482860	355970809	/nfs/dbraw/zinc/97/08/09/355970809.db2.gz	XBTTVNCRLWYBTQ-UHFFFAOYSA-N	1	0	273.340	1.651	50	0		CDAARO
COc1ccc(C(=O)O[C@@H]2C[NH+]3CCC2CC3)cc1OC	ZINC000004664803	356039872	/nfs/dbraw/zinc/03/98/72/356039872.db2.gz	JFAJOGLBGXCMLX-OAHLLOKOSA-N	1	0	291.347	1.955	50	0		CDAARO
C[C@@H](Oc1ccc(F)cc1)C(=O)NC1CC[NH+](C)CC1	ZINC000012380606	356296078	/nfs/dbraw/zinc/29/60/78/356296078.db2.gz	KYAMZQAFIBNJJN-LLVKDONJSA-N	1	0	280.343	1.803	50	0		CDAARO
C[NH+](C)CC[C@@H]1CN(C(=O)C2CCCCC2)CCO1	ZINC000012468778	356301072	/nfs/dbraw/zinc/30/10/72/356301072.db2.gz	CJPVCSHJAPLOIW-CQSZACIVSA-N	1	0	268.401	1.746	50	0		CDAARO
O=C(c1cccc(OC(F)F)c1)N1CC[NH2+]CC1	ZINC000012926608	356331313	/nfs/dbraw/zinc/33/13/13/356331313.db2.gz	MPPUIWBILXEFCS-UHFFFAOYSA-N	1	0	256.252	1.333	50	0		CDAARO
CCOC(=O)[C@@H]1[C@@H](C(=O)OCC)C(C)(C)[C@H]1[NH+]1CCCC1	ZINC000013398217	356346046	/nfs/dbraw/zinc/34/60/46/356346046.db2.gz	RJAIFMNTFDYYIO-AGIUHOORSA-N	1	0	297.395	1.849	50	0		CDAARO
Cc1cc(=O)oc2cc(OC(=O)CSC(N)=[NH2+])ccc12	ZINC000004491704	356368996	/nfs/dbraw/zinc/36/89/96/356368996.db2.gz	VHBFHDKAMSKYMC-UHFFFAOYSA-N	1	0	292.316	1.633	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)Cc1noc2ccccc12	ZINC000015674983	356421662	/nfs/dbraw/zinc/42/16/62/356421662.db2.gz	DTSSLERZULPJSJ-GFCCVEGCSA-N	1	0	287.363	1.971	50	0		CDAARO
COc1ccc(NC(=O)NC(=O)C[NH+]2CCCCC2)cc1	ZINC000016442206	356439185	/nfs/dbraw/zinc/43/91/85/356439185.db2.gz	KCKMIWIHXBVQFT-UHFFFAOYSA-N	1	0	291.351	1.829	50	0		CDAARO
CC[NH+]1CCN(Cc2cccc(OC)c2OC)CC1	ZINC000019536483	356491531	/nfs/dbraw/zinc/49/15/31/356491531.db2.gz	GHQYTNVZVPJDJO-UHFFFAOYSA-N	1	0	264.369	1.841	50	0		CDAARO
Cc1cc(C)n(CC(=O)NCC[N@H+]2C[C@H](C)C[C@H](C)C2)n1	ZINC000019573472	356492056	/nfs/dbraw/zinc/49/20/56/356492056.db2.gz	JYOLWFUPXOQWIG-BETUJISGSA-N	1	0	292.427	1.594	50	0		CDAARO
O=C(NC1CC[NH2+]CC1)c1cc(-c2ccccc2)on1	ZINC000019595627	356493366	/nfs/dbraw/zinc/49/33/66/356493366.db2.gz	ZJTUECCBRYWFPX-UHFFFAOYSA-N	1	0	271.320	1.823	50	0		CDAARO
C[C@H]1CCC[C@H]([NH+]2CCN(S(C)(=O)=O)CC2)C1	ZINC000019841826	356509967	/nfs/dbraw/zinc/50/99/67/356509967.db2.gz	FINFRFMKIIFPAO-RYUDHWBXSA-N	1	0	260.403	1.142	50	0		CDAARO
CCOc1cccc(OCCOCCNCC[NH3+])c1	ZINC000020118324	356526047	/nfs/dbraw/zinc/52/60/47/356526047.db2.gz	YDYHGERMNZUZIF-UHFFFAOYSA-N	1	0	268.357	1.029	50	0		CDAARO
CCn1nc(C)c(CN2CCCC[C@H]([NH3+])C2)c1C	ZINC000082127163	482763549	/nfs/dbraw/zinc/76/35/49/482763549.db2.gz	GGCCUFYMBOCTQE-ZDUSSCGKSA-N	1	0	250.390	1.833	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)c1ccc(=O)[nH]c1)c1ccsc1	ZINC000023133119	356629553	/nfs/dbraw/zinc/62/95/53/356629553.db2.gz	LPBVHAMFJLKBCE-GFCCVEGCSA-N	1	0	291.376	1.469	50	0		CDAARO
OCC[C@@H]1CN(CC2CC2)CC[N@@H+]1C1CCCC1	ZINC000023358119	356641748	/nfs/dbraw/zinc/64/17/48/356641748.db2.gz	AXORDGDWHNTXAZ-OAHLLOKOSA-N	1	0	252.402	1.708	50	0		CDAARO
CC[C@@H](CO)[NH2+]C[C@@H](O)Cn1c(C)c(C)c2ccccc21	ZINC000000106240	356734924	/nfs/dbraw/zinc/73/49/24/356734924.db2.gz	CSEDJBHBLGSNMW-LSDHHAIUSA-N	1	0	290.407	1.980	50	0		CDAARO
CN(C(=O)Cc1cccc(F)c1)C1CC[NH+](C)CC1	ZINC000033019536	356793494	/nfs/dbraw/zinc/79/34/94/356793494.db2.gz	RJTYWXWPIPERNT-UHFFFAOYSA-N	1	0	264.344	1.921	50	0		CDAARO
O=C(N[C@H]1C[NH+]2CCC1CC2)c1cc2ccoc2cn1	ZINC000034034921	356809634	/nfs/dbraw/zinc/80/96/34/356809634.db2.gz	IPKZCLGGYKRDES-ZDUSSCGKSA-N	1	0	271.320	1.652	50	0	in-man	CDAARO
CCS(=O)(=O)N1CC[NH+](C[C@@H]2CC=CCC2)CC1	ZINC000049573755	357219628	/nfs/dbraw/zinc/21/96/28/357219628.db2.gz	POBOSHPECWVQDW-CYBMUJFWSA-N	1	0	272.414	1.310	50	0		CDAARO
COc1ccc(CNCCC[NH+](C)C)cc1OC	ZINC000054979087	357327686	/nfs/dbraw/zinc/32/76/86/357327686.db2.gz	YKVZACPPYQZKKR-UHFFFAOYSA-N	1	0	252.358	1.745	50	0		CDAARO
COC[C@H]([NH2+]C1CCSCC1)c1ccnn1C	ZINC000065410997	357538799	/nfs/dbraw/zinc/53/87/99/357538799.db2.gz	GCIQWNLSTGFVOA-NSHDSACASA-N	1	0	255.387	1.593	50	0		CDAARO
COCC[N@@H+]1CC[C@H](C(=O)NCc2sccc2C)C1	ZINC000065503547	357545971	/nfs/dbraw/zinc/54/59/71/357545971.db2.gz	NGQZMEVXUNHGMK-LBPRGKRZSA-N	1	0	282.409	1.641	50	0		CDAARO
CCN(C[C@@H]1CCCO1)c1cc(CC[NH3+])nc(C)n1	ZINC000067741566	357623956	/nfs/dbraw/zinc/62/39/56/357623956.db2.gz	IVFZHSWPFCKFQA-ZDUSSCGKSA-N	1	0	264.373	1.292	50	0		CDAARO
COCC(=O)N[C@@H](CC(C)C)C1=CCC[N@H+](C)C1	ZINC000067771444	357626780	/nfs/dbraw/zinc/62/67/80/357626780.db2.gz	VYSRBBKKVAYDRA-ZDUSSCGKSA-N	1	0	254.374	1.426	50	0		CDAARO
CCCn1nccc1C(=O)NCC[C@H]1CCC[N@H+](C)C1	ZINC000067805590	357629248	/nfs/dbraw/zinc/62/92/48/357629248.db2.gz	HYKWLDBNVLZXBE-CYBMUJFWSA-N	1	0	278.400	1.755	50	0		CDAARO
C[C@H](Cn1cccn1)[NH2+]CCC(=O)N1CCC(C)CC1	ZINC000067604959	357614412	/nfs/dbraw/zinc/61/44/12/357614412.db2.gz	CCMSCFJYNOGTGK-CQSZACIVSA-N	1	0	278.400	1.510	50	0		CDAARO
COCC(=O)NC[C@H]1CCC[N@H+](Cc2ccccc2F)C1	ZINC000067833994	357630216	/nfs/dbraw/zinc/63/02/16/357630216.db2.gz	WJBPSIURKSOSSZ-CYBMUJFWSA-N	1	0	294.370	1.800	50	0		CDAARO
CS(=O)(=O)NC[C@H]1CC[N@H+](CCCc2ccccc2)C1	ZINC000067654193	357617064	/nfs/dbraw/zinc/61/70/64/357617064.db2.gz	VGKKFXSJPRXWQG-OAHLLOKOSA-N	1	0	296.436	1.490	50	0		CDAARO
CCO[C@H]1COC[C@@H]1NC1CC[NH+](CC(C)C)CC1	ZINC000067847219	357631568	/nfs/dbraw/zinc/63/15/68/357631568.db2.gz	JGEMQMXCONSMAW-GJZGRUSLSA-N	1	0	270.417	1.500	50	0		CDAARO
CC(C)C[NH+]1CCC(NCCSc2nc[nH]n2)CC1	ZINC000067867747	357634116	/nfs/dbraw/zinc/63/41/16/357634116.db2.gz	UWTJCIFXWXJKCM-UHFFFAOYSA-N	1	0	283.445	1.607	50	0		CDAARO
C[C@@H]1CN(C(=O)C[C@H]2OCCc3ccccc32)CC[NH2+]1	ZINC000188430642	357681474	/nfs/dbraw/zinc/68/14/74/357681474.db2.gz	HTGWTNZWVXZGMW-IUODEOHRSA-N	1	0	274.364	1.511	50	0		CDAARO
CN(C)Cc1nnc(C(=O)N(C)Cc2ccc(F)cc2)o1	ZINC000071763273	357779432	/nfs/dbraw/zinc/77/94/32/357779432.db2.gz	BQCWXZHETFWXKN-UHFFFAOYSA-N	1	0	292.314	1.543	50	0		CDAARO
Cc1ccsc1CN1CCC[C@@](O)(C[NH+](C)C)C1	ZINC000072421928	357833888	/nfs/dbraw/zinc/83/38/88/357833888.db2.gz	UKHLSCMOJFKVIP-CQSZACIVSA-N	1	0	268.426	1.945	50	0		CDAARO
Cc1ccsc1CN(CCO)C(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000072457074	358052402	/nfs/dbraw/zinc/05/24/02/358052402.db2.gz	VSPNMENZPRCOHE-NWDGAFQWSA-N	1	0	282.409	1.505	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]C(C)(C)C(=O)NCC1CCCC1	ZINC000097038417	358104066	/nfs/dbraw/zinc/10/40/66/358104066.db2.gz	FQAWYFXJPXQMLB-AAEUAGOBSA-N	1	0	268.401	1.838	50	0		CDAARO
CCNc1nc(N2CCN(C(=O)CC)CC2)cc(C)[nH+]1	ZINC000082230296	358151356	/nfs/dbraw/zinc/15/13/56/358151356.db2.gz	KCEOEBKCBNFKDD-UHFFFAOYSA-N	1	0	277.372	1.275	50	0		CDAARO
CCOc1ccc(N2C[C@@H](C)[NH+](CCOC)[C@H](C)C2)nn1	ZINC000097082677	358183564	/nfs/dbraw/zinc/18/35/64/358183564.db2.gz	FBPVBCOZQWZWRL-CHWSQXEVSA-N	1	0	294.399	1.421	50	0		CDAARO
CCOc1ncnc2c1CN(c1cc(C)[nH+]c(N)n1)CC2	ZINC000097201822	358188380	/nfs/dbraw/zinc/18/83/80/358188380.db2.gz	DAAYYHOTYSZVAD-UHFFFAOYSA-N	1	0	286.339	1.119	50	0		CDAARO
CC(C)(F)C(=O)NCc1ccccc1C[N@@H+]1CC[C@H](O)C1	ZINC000195557803	358564471	/nfs/dbraw/zinc/56/44/71/358564471.db2.gz	PZGLHQWOQDBHFU-AWEZNQCLSA-N	1	0	294.370	1.618	50	0		CDAARO
c1nnc2ccc(N3CC[NH+](Cc4ccccc4)CC3)nn12	ZINC000054302560	358570657	/nfs/dbraw/zinc/57/06/57/358570657.db2.gz	MRLNIEQQXJESRV-UHFFFAOYSA-N	1	0	294.362	1.447	50	0		CDAARO
COCC[C@@]1(CO)CCC[N@H+](Cc2ccncc2)C1	ZINC000091845617	358529674	/nfs/dbraw/zinc/52/96/74/358529674.db2.gz	AXABINBRAPAUBU-HNNXBMFYSA-N	1	0	264.369	1.693	50	0		CDAARO
CC(C)CCS(=O)(=O)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000247494068	358539264	/nfs/dbraw/zinc/53/92/64/358539264.db2.gz	MICHYVBNVKSVMS-LBPRGKRZSA-N	1	0	260.403	1.142	50	0		CDAARO
CCn1ncnc1[C@H](C)NC(=O)CCC[NH+]1CCCCC1	ZINC000095372901	358688533	/nfs/dbraw/zinc/68/85/33/358688533.db2.gz	GQTALRGCFBPWCH-ZDUSSCGKSA-N	1	0	293.415	1.741	50	0		CDAARO
CCc1cc(NCCCOC2CC[NH+](C)CC2)ncn1	ZINC000095387108	358691470	/nfs/dbraw/zinc/69/14/70/358691470.db2.gz	RUGDUZWVLSYMES-UHFFFAOYSA-N	1	0	278.400	1.952	50	0		CDAARO
O=C(C1CCC1)N1CC[N@H+](Cc2ccccc2)C[C@@H](O)C1	ZINC000095501373	358695769	/nfs/dbraw/zinc/69/57/69/358695769.db2.gz	SEOJBKSWSGHRGR-MRXNPFEDSA-N	1	0	288.391	1.492	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)Cc3ccc(F)cc3)C[C@@H]12	ZINC000185185636	358776815	/nfs/dbraw/zinc/77/68/15/358776815.db2.gz	VDEYYPIKJPANTB-MRVWCRGKSA-N	1	0	262.328	1.564	50	0		CDAARO
C[C@@H](Oc1cccc(Cl)c1)C(=O)N1CCC[NH2+]CC1	ZINC000041439879	358887671	/nfs/dbraw/zinc/88/76/71/358887671.db2.gz	OILKOVQXFMXDBK-LLVKDONJSA-N	1	0	282.771	1.929	50	0		CDAARO
O=C(C[NH2+]C1CC1)N[C@@H](c1ccccn1)C(F)(F)F	ZINC000215753756	358902166	/nfs/dbraw/zinc/90/21/66/358902166.db2.gz	YMWZWTLEGWJSIA-NSHDSACASA-N	1	0	273.258	1.553	50	0		CDAARO
COC[C@@H]1CC[N@H+](Cc2cc(C(C)=O)cn2C)C1	ZINC000216224696	358932900	/nfs/dbraw/zinc/93/29/00/358932900.db2.gz	OASLGJQPRWMERK-GFCCVEGCSA-N	1	0	250.342	1.696	50	0		CDAARO
Cn1cc(-c2ccnc(NCC[C@H]3CCC[N@@H+]3C)n2)cn1	ZINC000023478177	359144235	/nfs/dbraw/zinc/14/42/35/359144235.db2.gz	DDVWZGJVAXGBKP-CYBMUJFWSA-N	1	0	286.383	1.773	50	0		CDAARO
C[C@@H](CCC(=O)NCCn1cccn1)[NH+]1CCCC1	ZINC000221214509	359218607	/nfs/dbraw/zinc/21/86/07/359218607.db2.gz	YUPJLZPHSHHVQT-ZDUSSCGKSA-N	1	0	264.373	1.264	50	0		CDAARO
NC(=O)[C@@H]1CCC[N@H+](Cc2ccc(F)cc2F)C1	ZINC000000183231	359271727	/nfs/dbraw/zinc/27/17/27/359271727.db2.gz	CAQGZBMVALQNCM-SNVBAGLBSA-N	1	0	254.280	1.662	50	0		CDAARO
CNC(=O)NC(=O)CC[N@@H+]1CCC[C@H]1c1ccc(C)cc1	ZINC000012782275	359676765	/nfs/dbraw/zinc/67/67/65/359676765.db2.gz	OYXCXCMXLQARPB-AWEZNQCLSA-N	1	0	289.379	1.978	50	0		CDAARO
Cc1noc(CC[NH2+][C@@H](C)c2ccc(-n3cnnn3)cc2)n1	ZINC000089517878	360102886	/nfs/dbraw/zinc/10/28/86/360102886.db2.gz	IIVOLQOPANTZMZ-JTQLQIEISA-N	1	0	299.338	1.247	50	0		CDAARO
CC1(C)CC(CC(=O)NCCc2cn[nH]n2)CC(C)(C)[NH2+]1	ZINC000426397336	360663869	/nfs/dbraw/zinc/66/38/69/360663869.db2.gz	DBZSJTUTMRERGK-UHFFFAOYSA-N	1	0	293.415	1.410	50	0		CDAARO
CSc1ccc(S(=O)(=O)NCC[C@@H](C)[NH3+])cc1	ZINC000178915097	189154636	/nfs/dbraw/zinc/15/46/36/189154636.db2.gz	NYJMBRVUECEWLB-SECBINFHSA-N	1	0	274.411	1.424	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)COc2ccc(F)cc2)C1	ZINC000178961142	189157909	/nfs/dbraw/zinc/15/79/09/189157909.db2.gz	IYXDKRUZFREMKA-NSHDSACASA-N	1	0	266.316	1.272	50	0		CDAARO
O=C(Cn1ccc([C@H]2CCC[NH2+]C2)n1)NCc1ccoc1	ZINC000426550094	361004994	/nfs/dbraw/zinc/00/49/94/361004994.db2.gz	VWALBQBECVAOFT-ZDUSSCGKSA-N	1	0	288.351	1.260	50	0		CDAARO
O=C(C[C@H]1CC[NH2+]C1)NCc1ccnc2ccccc12	ZINC000130829936	361008239	/nfs/dbraw/zinc/00/82/39/361008239.db2.gz	CYJMQEDYUHTDLL-GFCCVEGCSA-N	1	0	269.348	1.851	50	0		CDAARO
CN(C)C(=O)[C@H]1CCCN1C(=O)C[C@@H]([NH3+])c1ccccc1	ZINC000036136331	361076501	/nfs/dbraw/zinc/07/65/01/361076501.db2.gz	GBUTWXZOOVFZJS-ZIAGYGMSSA-N	1	0	289.379	1.156	50	0		CDAARO
COC(=O)CC[NH+](CCC(=O)OC)Cc1ccco1	ZINC000041389584	361418864	/nfs/dbraw/zinc/41/88/64/361418864.db2.gz	RCMVHNPKRRPIQZ-UHFFFAOYSA-N	1	0	269.297	1.208	50	0		CDAARO
COc1ccc(OCCSc2nnc(C[NH3+])n2C)cc1	ZINC000071373925	361584650	/nfs/dbraw/zinc/58/46/50/361584650.db2.gz	QCIDELXUBWCQOF-UHFFFAOYSA-N	1	0	294.380	1.454	50	0		CDAARO
CC(C)CC[N@@H+]1CCN(Cc2cccnc2)C[C@H]1CCO	ZINC000104358190	361586419	/nfs/dbraw/zinc/58/64/19/361586419.db2.gz	OZSOKTFZAHRIJX-QGZVFWFLSA-N	1	0	291.439	1.996	50	0		CDAARO
CC(C)(CO)CCCNC(=O)N1CC[C@@H]([NH+]2CC=CC2)C1	ZINC000101559240	363934121	/nfs/dbraw/zinc/93/41/21/363934121.db2.gz	QKXVKYXVUVICGB-CQSZACIVSA-N	1	0	295.427	1.441	50	0		CDAARO
Cc1cc(=O)[nH]c([C@@H](C)[N@H+](C)CC2CCOCC2)n1	ZINC000192716361	363972886	/nfs/dbraw/zinc/97/28/86/363972886.db2.gz	WMNMKNLCZPSODI-LLVKDONJSA-N	1	0	265.357	1.910	50	0		CDAARO
O=C(Cc1cccc(O)c1)NCCCC[NH+]1CCOCC1	ZINC000101644089	363980394	/nfs/dbraw/zinc/98/03/94/363980394.db2.gz	DRCXNEDTNRMXSA-UHFFFAOYSA-N	1	0	292.379	1.163	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1cc2c([nH]c1=O)CCC2	ZINC000049551361	364071834	/nfs/dbraw/zinc/07/18/34/364071834.db2.gz	KNNQNKNIRGWHPK-LBPRGKRZSA-N	1	0	289.379	1.078	50	0		CDAARO
Cc1cnccc1CC[NH2+][C@@H]1CCC[C@@H](S(C)(=O)=O)C1	ZINC000293603054	370709555	/nfs/dbraw/zinc/70/95/55/370709555.db2.gz	LGSJUNCURCYXLE-HUUCEWRRSA-N	1	0	296.436	1.878	50	0		CDAARO
C[C@H](C(N)=O)N1CCC(c2nc3ccccc3o2)CC1	ZINC000012921758	364491526	/nfs/dbraw/zinc/49/15/26/364491526.db2.gz	KBWBXBACYSUVCD-SNVBAGLBSA-N	1	0	273.336	1.881	50	0		CDAARO
O=C(NC[C@H](O)c1ccccc1)[C@H]1Cc2ccccc2C[NH2+]1	ZINC000016020725	364816215	/nfs/dbraw/zinc/81/62/15/364816215.db2.gz	ABYODZCNDMDCOU-SJORKVTESA-N	1	0	296.370	1.551	50	0		CDAARO
CCOC(=O)N(C)CC(=O)NC[C@H]1CCC[N@@H+]1CC(C)C	ZINC000089984718	367003600	/nfs/dbraw/zinc/00/36/00/367003600.db2.gz	RHHVQBFDLNOWCI-CYBMUJFWSA-N	1	0	299.415	1.311	50	0		CDAARO
COc1cc(C(=O)N[C@@H]2CC[NH2+]C[C@@H]2C)ccc1C	ZINC000094345027	367407776	/nfs/dbraw/zinc/40/77/76/367407776.db2.gz	ABCBDASMFUUMIT-WCQYABFASA-N	1	0	262.353	1.731	50	0		CDAARO
Nc1ncnc2c1ncn2CC[NH2+]Cc1ccccc1	ZINC000002146309	367589543	/nfs/dbraw/zinc/58/95/43/367589543.db2.gz	SCSURRDSNJCDQA-UHFFFAOYSA-N	1	0	268.324	1.198	50	0	biogenic	CDAARO
C[C@H]1C[N@H+](CCSC(C)(C)C)CCN1CCO	ZINC000252507666	367651633	/nfs/dbraw/zinc/65/16/33/367651633.db2.gz	WRBIHINILLPTTF-LBPRGKRZSA-N	1	0	260.447	1.517	50	0		CDAARO
O=C(CC[N@H+]1CCC[C@@H](O)C1)N1CCc2ccccc21	ZINC000012984305	367671292	/nfs/dbraw/zinc/67/12/92/367671292.db2.gz	RRFURBBVXAHVLT-CQSZACIVSA-N	1	0	274.364	1.423	50	0		CDAARO
O=C([C@@H]1C[C@H](O)C[NH2+]1)N1CC2(CCCC2)c2ccccc21	ZINC000252519016	367746089	/nfs/dbraw/zinc/74/60/89/367746089.db2.gz	AQXGWCXECJTIAE-JSGCOSHPSA-N	1	0	286.375	1.568	50	0		CDAARO
C[NH+]1CCN(c2ccc(NC(=O)C3(C)CC3)nc2)CC1	ZINC000125253457	368226548	/nfs/dbraw/zinc/22/65/48/368226548.db2.gz	JRRGSPWVZLTYEG-UHFFFAOYSA-N	1	0	274.368	1.572	50	0		CDAARO
CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)[C@H]1CCCO1	ZINC000252668953	371205588	/nfs/dbraw/zinc/20/55/88/371205588.db2.gz	FZYFPWXUJAGXBU-QWHCGFSZSA-N	1	0	254.374	1.498	50	0		CDAARO
[NH3+][C@H]1CCN(Cc2cccc(Br)c2)C1	ZINC000022942162	372356354	/nfs/dbraw/zinc/35/63/54/372356354.db2.gz	XJGDXLQPQHWGBT-NSHDSACASA-N	1	0	255.159	1.982	50	0		CDAARO
O=C(c1c[nH]cn1)N1CCC[N@@H+](C2CCCC2)CC1	ZINC000299790660	372765040	/nfs/dbraw/zinc/76/50/40/372765040.db2.gz	CEQLLCCUKGLDKM-UHFFFAOYSA-N	1	0	262.357	1.500	50	0		CDAARO
CC(C)NC(=O)[C@@H]1C[C@H]([NH3+])CN1Cc1ccc(Cl)cc1	ZINC000299763702	372748362	/nfs/dbraw/zinc/74/83/62/372748362.db2.gz	PNARCPFGTPZJKP-KBPBESRZSA-N	1	0	295.814	1.766	50	0		CDAARO
Cc1ccc(C[N@@H+]2CC[C@@H]3OCc4cnnn4[C@H]3C2)o1	ZINC000299764033	372748688	/nfs/dbraw/zinc/74/86/88/372748688.db2.gz	QVGKVKQVRONBIB-KBPBESRZSA-N	1	0	274.324	1.525	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)Nc2ccnn2Cc2ccccc2)C1	ZINC000299771288	372750831	/nfs/dbraw/zinc/75/08/31/372750831.db2.gz	VPOOWPXPXQGAEJ-ZDUSSCGKSA-N	1	0	285.351	1.496	50	0		CDAARO
NC(=O)c1cncc(-c2ccc(F)c3c2O[C@H](C[NH3+])C3)c1	ZINC000299779368	372757224	/nfs/dbraw/zinc/75/72/24/372757224.db2.gz	TZFJDROARQCDLQ-JTQLQIEISA-N	1	0	287.294	1.249	50	0		CDAARO
Cc1ccnc(N2CCC[C@@H]2C[NH+]2C[C@H](C)O[C@@H](C)C2)n1	ZINC000253370827	373679466	/nfs/dbraw/zinc/67/94/66/373679466.db2.gz	WTYYIPVLLQOVJH-SOUVJXGZSA-N	1	0	290.411	1.863	50	0		CDAARO
CC[N@@H+]1CC[C@@H]2[C@@H](C1)OCCN2C(=O)c1cccnc1	ZINC000253416338	373725439	/nfs/dbraw/zinc/72/54/39/373725439.db2.gz	CZBUNVDHKQZPBT-ZIAGYGMSSA-N	1	0	275.352	1.017	50	0		CDAARO
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1[NH2+]CC(N)=O	ZINC000253417335	373725550	/nfs/dbraw/zinc/72/55/50/373725550.db2.gz	KJPNHIQEZNROHE-FOGDFJRCSA-N	1	0	285.388	1.095	50	0		CDAARO
C[C@H](NC(=O)C(C)(C)C)C(=O)N(C)[C@H]1CC[N@H+](C)C[C@H]1C	ZINC000107053476	373796913	/nfs/dbraw/zinc/79/69/13/373796913.db2.gz	KQWNOZKESDAMFR-AGIUHOORSA-N	1	0	297.443	1.336	50	0		CDAARO
c1[nH]nc(-c2cccnc2)c1C[NH2+][C@H]1CCCOC1	ZINC000103961238	374152368	/nfs/dbraw/zinc/15/23/68/374152368.db2.gz	USNPTJFZTUCZAL-ZDUSSCGKSA-N	1	0	258.325	1.740	50	0		CDAARO
CS(=O)(=O)CCC[NH+]1CCC(C2CCOCC2)CC1	ZINC000104314238	374268174	/nfs/dbraw/zinc/26/81/74/374268174.db2.gz	PMNTWZDQYYCKGO-UHFFFAOYSA-N	1	0	289.441	1.560	50	0		CDAARO
CN(Cc1cccnc1)[C@@H]1CCN(c2cnn(C)c2)C1=O	ZINC000104335983	374284858	/nfs/dbraw/zinc/28/48/58/374284858.db2.gz	KCFHCCSXQRBEFS-CQSZACIVSA-N	1	0	285.351	1.052	50	0		CDAARO
C[N@@H+]1CCN(Cc2cccc3cccnc32)C[C@@H]1CCO	ZINC000019812368	374797408	/nfs/dbraw/zinc/79/74/08/374797408.db2.gz	YIIJCUAWVOISBX-INIZCTEOSA-N	1	0	285.391	1.733	50	0		CDAARO
C[NH+](C)CCN(Cc1cccnc1)c1ncccn1	ZINC000095429738	374930568	/nfs/dbraw/zinc/93/05/68/374930568.db2.gz	RALXUECXCARGHF-UHFFFAOYSA-N	1	0	257.341	1.440	50	0		CDAARO
CCOC(=O)C1(NC(=O)[C@H]2CC=CCC2)CC[NH+](C)CC1	ZINC000095446984	374946170	/nfs/dbraw/zinc/94/61/70/374946170.db2.gz	JANQIRLVKXMAJY-ZDUSSCGKSA-N	1	0	294.395	1.486	50	0		CDAARO
Cc1cc(C)n(CC[N@H+](C)CC[C@@H]2CCS(=O)(=O)C2)n1	ZINC000670462190	483047184	/nfs/dbraw/zinc/04/71/84/483047184.db2.gz	CSPVQQOZUWRIGH-CQSZACIVSA-N	1	0	299.440	1.257	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNC(=O)NCC1(OC)CCC1	ZINC000097055054	375142882	/nfs/dbraw/zinc/14/28/82/375142882.db2.gz	IACYPBMFLZBBLR-ZDUSSCGKSA-N	1	0	283.416	1.729	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CC(=O)NCc1ccc2c(c1)OCO2	ZINC000002633433	375277564	/nfs/dbraw/zinc/27/75/64/375277564.db2.gz	JJYZSKBGDRSDGJ-LBPRGKRZSA-N	1	0	290.363	1.906	50	0		CDAARO
C[C@@H]1CCCN(C(=O)/C=C\c2cncc(F)c2)[C@@H]1C[NH3+]	ZINC000606441556	375823622	/nfs/dbraw/zinc/82/36/22/375823622.db2.gz	ZFISHVYAGOMTPU-UTWMECEDSA-N	1	0	277.343	1.820	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CCCCC[C@H]1C[C@@H](O)c1ccco1	ZINC000245544888	376084412	/nfs/dbraw/zinc/08/44/12/376084412.db2.gz	SULMRBFTBGXNGF-RRFJBIMHSA-N	1	0	297.395	1.955	50	0		CDAARO
NC(=O)c1cncc(-c2cc(F)cc3c2O[C@@H](C[NH3+])C3)c1	ZINC000067587380	377169581	/nfs/dbraw/zinc/16/95/81/377169581.db2.gz	JTMAOLJKCAEEBI-GFCCVEGCSA-N	1	0	287.294	1.249	50	0		CDAARO
CC[NH+](CC)[C@@H](CNc1ccc2nnnn2n1)CC(C)C	ZINC000012734667	377538553	/nfs/dbraw/zinc/53/85/53/377538553.db2.gz	VPSTZXCQWKJHEP-GFCCVEGCSA-N	1	0	291.403	1.688	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCN(c2ccc(F)cc2OC)CC1	ZINC000130528400	377588190	/nfs/dbraw/zinc/58/81/90/377588190.db2.gz	JBSILVKZRMODQJ-GFCCVEGCSA-N	1	0	295.358	1.220	50	0		CDAARO
CC[C@H]1CN(CC(=O)NC[C@H]2CCCO2)CCS1	ZINC000245289593	378045669	/nfs/dbraw/zinc/04/56/69/378045669.db2.gz	CXQBRDKFVRYGKN-NEPJUHHUSA-N	1	0	272.414	1.109	50	0		CDAARO
COCCN1CC[N@H+](C[C@@H]2CC=CCC2)CC1=O	ZINC000096499958	532964421	/nfs/dbraw/zinc/96/44/21/532964421.db2.gz	WMDNHPATLGOVLK-CYBMUJFWSA-N	1	0	252.358	1.133	50	0		CDAARO
O=S1(=O)N=C([C@H]2CCC[NH2+]C2)Nc2ccccc21	ZINC000019375690	285074045	/nfs/dbraw/zinc/07/40/45/285074045.db2.gz	KKMPELAPYDJMTC-VIFPVBQESA-N	1	0	265.338	1.199	50	0		CDAARO
COCCn1cncc1C[N@@H+]1CC[C@](C)(O)[C@H](C)C1	ZINC000091616501	285194596	/nfs/dbraw/zinc/19/45/96/285194596.db2.gz	ZFHJNCLYTNWVLG-OCCSQVGLSA-N	1	0	267.373	1.122	50	0		CDAARO
OCC1(C[NH2+][C@@H]2CCc3cc4c(cc32)OCCO4)CC1	ZINC000089764975	285248073	/nfs/dbraw/zinc/24/80/73/285248073.db2.gz	KASZPASBNPNFIW-CYBMUJFWSA-N	1	0	275.348	1.807	50	0		CDAARO
CN1C[C@H]([NH2+][C@@H]2CC(C)(C)OC2(C)C)CCC1=O	ZINC000094424540	184795387	/nfs/dbraw/zinc/79/53/87/184795387.db2.gz	HEMMYKQKTAOQIR-GHMZBOCLSA-N	1	0	254.374	1.543	50	0		CDAARO
CC(C)N(C)C(=O)[C@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000015075562	390214198	/nfs/dbraw/zinc/21/41/98/390214198.db2.gz	QZVWUVOWIRTPSF-AWEZNQCLSA-N	1	0	281.444	1.659	50	0		CDAARO
O=S(=O)(NCC[NH2+]C[C@H]1CC=CCC1)c1ccccc1	ZINC000095433925	184983206	/nfs/dbraw/zinc/98/32/06/184983206.db2.gz	WZJYMTFYICMBCE-AWEZNQCLSA-N	1	0	294.420	1.911	50	0		CDAARO
Cc1ncc(C(=O)N2CCCC[C@H]2CC[NH+](C)C)cn1	ZINC000072419913	390615698	/nfs/dbraw/zinc/61/56/98/390615698.db2.gz	QXNNPLJYOSKWTQ-AWEZNQCLSA-N	1	0	276.384	1.731	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2ccnc(-n3ccnc3)c2)[C@@H]1C[NH3+]	ZINC000179226494	390945822	/nfs/dbraw/zinc/94/58/22/390945822.db2.gz	HARKAPMUXJLUDN-TZMCWYRMSA-N	1	0	299.378	1.467	50	0		CDAARO
CCc1cnc(N2CC[N@H+](CC(C)C)[C@H](CCO)C2)nc1	ZINC000095386858	390910912	/nfs/dbraw/zinc/91/09/12/390910912.db2.gz	HRPLETLPEVRJKE-OAHLLOKOSA-N	1	0	292.427	1.568	50	0		CDAARO
C[C@H](C[NH+]1CCCC1)c1nc(C2CC2)nn1CCO	ZINC000096151057	390913094	/nfs/dbraw/zinc/91/30/94/390913094.db2.gz	IYSXGNNZEBZPGG-LLVKDONJSA-N	1	0	264.373	1.347	50	0		CDAARO
Cc1ncc(CN2CCN(c3ccccc3)C(=O)C2)n1C	ZINC000215804527	391000363	/nfs/dbraw/zinc/00/03/63/391000363.db2.gz	CWKHIZAHBKARAN-UHFFFAOYSA-N	1	0	284.363	1.577	50	0		CDAARO
CO[C@@H]1C[NH2+][C@@H](C(=O)NC2CCC(OC(C)C)CC2)C1	ZINC000189305527	391748919	/nfs/dbraw/zinc/74/89/19/391748919.db2.gz	PMMPRWUAPDRWGE-CLRIEMFWSA-N	1	0	284.400	1.216	50	0		CDAARO
COc1ccc(C2(C[NH2+]CC(N)=O)CCCC2)cc1OC	ZINC000000174641	392724560	/nfs/dbraw/zinc/72/45/60/392724560.db2.gz	GPRYDLWCWIFYLS-UHFFFAOYSA-N	1	0	292.379	1.591	50	0	biogenic	CDAARO
CC(C)Cn1cc(CN2CCCC[C@H]2C[NH3+])cn1	ZINC000097162633	397981402	/nfs/dbraw/zinc/98/14/02/397981402.db2.gz	VBIICHHCRQXVKY-AWEZNQCLSA-N	1	0	250.390	1.852	50	0		CDAARO
Cn1cc(CCC[NH2+][C@@H]2CCCC[C@H]2S(C)(=O)=O)cn1	ZINC000182767993	148266896	/nfs/dbraw/zinc/26/68/96/148266896.db2.gz	WLNSXVGBLRFKGU-ZIAGYGMSSA-N	1	0	299.440	1.298	50	0		CDAARO
CCO[C@@H](C)C(=O)NC[C@H]1[NH2+]CCc2ccccc21	ZINC000262399659	149058409	/nfs/dbraw/zinc/05/84/09/149058409.db2.gz	PJTPLECVZJOYQS-SMDDNHRTSA-N	1	0	262.353	1.415	50	0		CDAARO
CCC[C@@](C)([NH3+])C(=O)Nc1ccc(NC(=O)C2CC2)nc1	ZINC000262674875	149094304	/nfs/dbraw/zinc/09/43/04/149094304.db2.gz	RKNSDQITNOTQNT-OAHLLOKOSA-N	1	0	290.367	1.886	50	0		CDAARO
COCCC[C@]1(CO)CCC[N@H+](CCN2CCCC2=O)C1	ZINC000091365274	292384366	/nfs/dbraw/zinc/38/43/66/292384366.db2.gz	QSDSCOCWHQKPLS-MRXNPFEDSA-N	1	0	298.427	1.110	50	0		CDAARO
CC(C)CC(C)(C)C(=O)N1CCN([C@@H]2CC[NH2+]C2)CC1	ZINC000377535800	160560807	/nfs/dbraw/zinc/56/08/07/160560807.db2.gz	MJNLTXLIINWPOB-CQSZACIVSA-N	1	0	281.444	1.565	50	0		CDAARO
O=C1C[C@@H]([NH2+]CCc2ccncc2)C(=O)N1c1ccccc1	ZINC000004698052	170000747	/nfs/dbraw/zinc/00/07/47/170000747.db2.gz	MWJPRBOYMFPZNG-OAHLLOKOSA-N	1	0	295.342	1.546	50	0		CDAARO
COc1ccc(C(=O)OC2CC[NH+](C)CC2)cc1OC	ZINC000005013128	170055075	/nfs/dbraw/zinc/05/50/75/170055075.db2.gz	UWQSSCODGAHWKH-UHFFFAOYSA-N	1	0	279.336	1.955	50	0		CDAARO
COC(=O)c1ccc(OC[C@@H](O)C[NH+]2CCCCC2)cc1	ZINC000005021961	170056681	/nfs/dbraw/zinc/05/66/81/170056681.db2.gz	OQNDAPBQOQRXFY-AWEZNQCLSA-N	1	0	293.363	1.699	50	0		CDAARO
CCN(Cc1ccncc1)C(=S)NCC[NH+](C)C	ZINC000006318703	170190973	/nfs/dbraw/zinc/19/09/73/170190973.db2.gz	SNFMLOUUDAOLKR-UHFFFAOYSA-N	1	0	266.414	1.340	50	0		CDAARO
CN1CC[NH+](C2(CNc3cnccn3)CCCC2)CC1	ZINC000534653757	411829644	/nfs/dbraw/zinc/82/96/44/411829644.db2.gz	AXUMCXPVYDZGNF-UHFFFAOYSA-N	1	0	275.400	1.449	50	0		CDAARO
COc1cccc(C(=O)N(C)C[C@@H]2C[C@H](OC)C[N@H+]2C)c1	ZINC000284490679	196068416	/nfs/dbraw/zinc/06/84/16/196068416.db2.gz	BYMFTJCHNPIHPO-ZFWWWQNUSA-N	1	0	292.379	1.486	50	0		CDAARO
COc1ccc(OC)c(CNCC[NH+]2CCCC2)c1	ZINC000020126967	171011632	/nfs/dbraw/zinc/01/16/32/171011632.db2.gz	GZZKECBHQWNMGX-UHFFFAOYSA-N	1	0	264.369	1.889	50	0		CDAARO
c1csc(-c2noc(CCCN3CC[NH2+]CC3)n2)c1	ZINC000020268452	171124789	/nfs/dbraw/zinc/12/47/89/171124789.db2.gz	QBRBMERSESJGMF-UHFFFAOYSA-N	1	0	278.381	1.636	50	0		CDAARO
C[C@@H](c1nc(-c2ccccc2)no1)N1CC[NH2+]CC1	ZINC000020283456	171133067	/nfs/dbraw/zinc/13/30/67/171133067.db2.gz	QTEWSPNIERTTFZ-NSHDSACASA-N	1	0	258.325	1.703	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC[C@@H]2CCC[NH2+]C2)cc1C	ZINC000020432267	171196652	/nfs/dbraw/zinc/19/66/52/171196652.db2.gz	IQJFYTIYNJMKIP-CYBMUJFWSA-N	1	0	282.409	1.581	50	0		CDAARO
CN1CC[N@H+](C)[C@@H](Cc2nc(-c3ccccc3)no2)C1	ZINC000020455002	171208467	/nfs/dbraw/zinc/20/84/67/171208467.db2.gz	AEVNSFRXEFATKO-ZDUSSCGKSA-N	1	0	272.352	1.525	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000020608832	171267479	/nfs/dbraw/zinc/26/74/79/171267479.db2.gz	CIYGYTPOHXNXQS-UHFFFAOYSA-N	1	0	281.787	1.916	50	0		CDAARO
C[NH+](C)CCn1c(=O)[nH]c(=S)c2c1CCCC2	ZINC000021010931	171286677	/nfs/dbraw/zinc/28/66/77/171286677.db2.gz	MNKPMIOAYNAMSC-UHFFFAOYSA-N	1	0	253.371	1.759	50	0		CDAARO
CCCC(=O)NC[C@H](c1ccsc1)N1CC[NH+](C)CC1	ZINC000022794482	171399382	/nfs/dbraw/zinc/39/93/82/171399382.db2.gz	MNEHBGXKHTZDLQ-CQSZACIVSA-N	1	0	295.452	1.953	50	0		CDAARO
NC(=[NH2+])c1ccc(-n2cncn2)cc1C(F)(F)F	ZINC000037306720	173110243	/nfs/dbraw/zinc/11/02/43/173110243.db2.gz	HUPJXIIVWKRDPV-UHFFFAOYSA-N	1	0	255.203	1.570	50	0		CDAARO
NC(=O)N1CCC([NH2+][C@@H]2CCC[C@@H]2n2ccnc2)CC1	ZINC000037314058	173115535	/nfs/dbraw/zinc/11/55/35/173115535.db2.gz	XCYRZWGSEXYOKU-OLZOCXBDSA-N	1	0	277.372	1.109	50	0		CDAARO
Cc1nnc(CN(C)CCn2cc(Cl)cn2)o1	ZINC000661529374	414149208	/nfs/dbraw/zinc/14/92/08/414149208.db2.gz	WMZORNSXXCOJFV-UHFFFAOYSA-N	1	0	255.709	1.360	50	0		CDAARO
COc1ccccc1[C@H]1C[C@@H]1C(=O)N1CC[NH2+]CC1	ZINC000038478362	174141773	/nfs/dbraw/zinc/14/17/73/174141773.db2.gz	GHTGTRWTBIXSFW-OLZOCXBDSA-N	1	0	260.337	1.231	50	0		CDAARO
C[C@H](NC(=O)[C@H]1Cc2ccccc2C[NH2+]1)[C@H]1CCCO1	ZINC000040460073	174269993	/nfs/dbraw/zinc/26/99/93/174269993.db2.gz	AMTYGMXBAPDJML-NILFDRSVSA-N	1	0	274.364	1.385	50	0		CDAARO
C=Cn1cc(C(=O)N(C)CC[N@H+]2CCCC[C@H]2C)cn1	ZINC000071419471	176160487	/nfs/dbraw/zinc/16/04/87/176160487.db2.gz	DBEMXDYGWKPWRV-CYBMUJFWSA-N	1	0	276.384	1.930	50	0		CDAARO
Cc1ccccc1SCC(=O)NC[C@@H]1CC[NH2+]C[C@H]1O	ZINC000072120800	176319546	/nfs/dbraw/zinc/31/95/46/176319546.db2.gz	UCOCPHOFPJXVFD-QWHCGFSZSA-N	1	0	294.420	1.174	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCCN(CCOc2ccc(F)cc2)C1	ZINC000072138781	176322992	/nfs/dbraw/zinc/32/29/92/176322992.db2.gz	XNIXDOJALFIERW-MRXNPFEDSA-N	1	0	296.386	1.593	50	0		CDAARO
CCOC(=O)[C@]12CCC[NH2+][C@@H]1CCN(Cc1ccoc1)C2	ZINC000072144644	176324208	/nfs/dbraw/zinc/32/42/08/176324208.db2.gz	WYOANFISMXYTRT-ZBFHGGJFSA-N	1	0	292.379	1.787	50	0		CDAARO
Cn1cc(NC(=O)C[N@@H+]2C[C@H]3[C@@H](C2)C2CCC3CC2)cn1	ZINC000072172510	176333679	/nfs/dbraw/zinc/33/36/79/176333679.db2.gz	MVWPPECESFSLKY-VWSDQGQDSA-N	1	0	288.395	1.727	50	0		CDAARO
CC[NH+](CC)CCNc1nc(C)nc2c1c(C)nn2C	ZINC000072407397	176398113	/nfs/dbraw/zinc/39/81/13/176398113.db2.gz	PDOSMYTZIGOKOA-UHFFFAOYSA-N	1	0	276.388	1.734	50	0		CDAARO
O[C@@H]1C[NH2+]CC[C@H]1Nc1ccc(-c2ccc(F)cc2)nn1	ZINC000077389441	177262254	/nfs/dbraw/zinc/26/22/54/177262254.db2.gz	RNJXIGLWHMEPGB-ZIAGYGMSSA-N	1	0	288.326	1.417	50	0		CDAARO
CCN1CC2(CC[NH+](C[C@@H]3CCCO3)CC2)OC1=O	ZINC000077457269	177270866	/nfs/dbraw/zinc/27/08/66/177270866.db2.gz	UPFSYWZNODUCLI-LBPRGKRZSA-N	1	0	268.357	1.472	50	0		CDAARO
COc1ccc(-c2cccc3c2O[C@H](C[NH3+])C3)nn1	ZINC000299770039	274103808	/nfs/dbraw/zinc/10/38/08/274103808.db2.gz	YZUABQLCYGXBAW-JTQLQIEISA-N	1	0	257.293	1.414	50	0		CDAARO
CC[C@H](C)[C@H]([NH2+]CC(=O)N(CC(C)C)C(C)C)C(N)=O	ZINC000095452691	287749958	/nfs/dbraw/zinc/74/99/58/287749958.db2.gz	VEEIXXWAZJAUDA-JSGCOSHPSA-N	1	0	285.432	1.369	50	0		CDAARO
Brc1cnc(N2CCC[NH2+]CC2)nc1	ZINC000000154075	275376035	/nfs/dbraw/zinc/37/60/35/275376035.db2.gz	XKAYYTATJMNDJA-UHFFFAOYSA-N	1	0	257.135	1.039	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(C(=O)[C@@H]2Cc3ccccc3N2)C1	ZINC000091392903	276868762	/nfs/dbraw/zinc/86/87/62/276868762.db2.gz	HQTNOAYCBIOICA-ZFWWWQNUSA-N	1	0	273.380	1.576	50	0		CDAARO
CC(C)c1nnc2n1CCN(C[C@H]1CCC[NH2+]C1)[C@H]2C	ZINC000261765028	278108463	/nfs/dbraw/zinc/10/84/63/278108463.db2.gz	MQGFMBIJCJJLIO-STQMWFEESA-N	1	0	277.416	1.778	50	0		CDAARO
CC[N@H+](C)C[C@]1(O)CCCN(CC(C)(C)C)C1=O	ZINC000012090053	279040478	/nfs/dbraw/zinc/04/04/78/279040478.db2.gz	BDTQLUMKRLVOKC-CQSZACIVSA-N	1	0	256.390	1.338	50	0		CDAARO
CN1CC[N@H+](C)C[C@@H]1CNc1nccc2ccccc21	ZINC000227903424	280107472	/nfs/dbraw/zinc/10/74/72/280107472.db2.gz	PBBKXKGOLUOMEI-AWEZNQCLSA-N	1	0	270.380	1.893	50	0		CDAARO
CC[C@@H](CNC(=O)Nc1cn[nH]c1)[NH+]1CCCC1	ZINC000089943417	280143571	/nfs/dbraw/zinc/14/35/71/280143571.db2.gz	BDGODYMGVCVVCH-NSHDSACASA-N	1	0	251.334	1.406	50	0		CDAARO
Cc1cc(Br)cnc1N1CC[NH+](C)CC1	ZINC000008700542	280311086	/nfs/dbraw/zinc/31/10/86/280311086.db2.gz	NHSUNJSCCDVYLK-UHFFFAOYSA-N	1	0	270.174	1.904	50	0		CDAARO
CC1(C)CCC[C@H]1[NH2+]CCN1CCCS1(=O)=O	ZINC000089520151	281067679	/nfs/dbraw/zinc/06/76/79/281067679.db2.gz	NXAOCMDDUYKSEF-LLVKDONJSA-N	1	0	260.403	1.190	50	0		CDAARO
CCC(C)(C)C1CCC2(CC1)[NH2+]C(CO)(CO)CO2	ZINC000049593287	281981340	/nfs/dbraw/zinc/98/13/40/281981340.db2.gz	HXZMPAFKEZIVON-UHFFFAOYSA-N	1	0	271.401	1.652	50	0		CDAARO
C[C@H](C(=O)NC(C)(C)C)[NH+]1CCC2(CC1)OCCO2	ZINC000032765350	289336028	/nfs/dbraw/zinc/33/60/28/289336028.db2.gz	ZXVSDHACUORJPH-LLVKDONJSA-N	1	0	270.373	1.129	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C\C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000255106992	289356469	/nfs/dbraw/zinc/35/64/69/289356469.db2.gz	BOKLMCMFAPPSGU-LWTINBJPSA-N	1	0	282.775	1.215	50	0		CDAARO
CN1CC2(CCC1=O)CCN([C@H]1CCC[NH2+]C1)CC2	ZINC000091625665	289864709	/nfs/dbraw/zinc/86/47/09/289864709.db2.gz	ASHTVYCJWDJGHG-ZDUSSCGKSA-N	1	0	265.401	1.073	50	0		CDAARO
Cn1nccc1[C@H]1CCCCN1C[C@@H]1CCC[NH2+]C1	ZINC000261629225	303088541	/nfs/dbraw/zinc/08/85/41/303088541.db2.gz	CLLJPKHCJXBMMA-UKRRQHHQSA-N	1	0	262.401	1.947	50	0		CDAARO
O[C@H](C[NH+]1CCOCC1)C12CC3CC(CC(C3)C1)C2	ZINC000019707609	304840183	/nfs/dbraw/zinc/84/01/83/304840183.db2.gz	BABHMWLFTDIKCA-IBHBGHMQSA-N	1	0	265.397	1.896	50	0		CDAARO
CN(Cc1nc2cc(F)ccc2[nH]1)C(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000534588968	328316976	/nfs/dbraw/zinc/31/69/76/328316976.db2.gz	HMEJXSOHTRDOHG-GXSJLCMTSA-N	1	0	290.342	1.788	50	0		CDAARO
O=C(C[NH+]1CCCC1)NCCCOC1CCCC1	ZINC000534591708	328318246	/nfs/dbraw/zinc/31/82/46/328318246.db2.gz	WQAQPPPFTMOEGN-UHFFFAOYSA-N	1	0	254.374	1.548	50	0		CDAARO
Cc1ccccc1[C@@H](CNc1cncc(C(N)=O)n1)[NH+](C)C	ZINC000534592699	328318752	/nfs/dbraw/zinc/31/87/52/328318752.db2.gz	DIEJXMWCZAMXID-CQSZACIVSA-N	1	0	299.378	1.599	50	0		CDAARO
Fc1cnc(NCC2(C[NH+]3CCCC3)CC2)nc1	ZINC000534631033	328331400	/nfs/dbraw/zinc/33/14/00/328331400.db2.gz	BAVIKHYRMJVEJC-UHFFFAOYSA-N	1	0	250.321	1.904	50	0		CDAARO
Cc1ncn(C)c1C(=O)NC[C@@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534665429	328345025	/nfs/dbraw/zinc/34/50/25/328345025.db2.gz	NOKFYRXZVRFBMN-ZDUSSCGKSA-N	1	0	290.411	1.723	50	0		CDAARO
CC[C@@H](C(=O)N1C[C@H]2CC[C@@H](C1)[C@H]2[NH3+])n1cccn1	ZINC000534672395	328348150	/nfs/dbraw/zinc/34/81/50/328348150.db2.gz	JZPQIMFJEGUUQG-QNWHQSFQSA-N	1	0	262.357	1.030	50	0		CDAARO
[NH3+][C@H](C(=O)N1CCC(Cn2ccnn2)CC1)c1ccccc1	ZINC000097234152	323207748	/nfs/dbraw/zinc/20/77/48/323207748.db2.gz	OZUAYZIOIQZSQU-HNNXBMFYSA-N	1	0	299.378	1.217	50	0		CDAARO
CN(C(=O)[C@H]([NH3+])c1ccccc1)[C@H]1CCSC1	ZINC000037175057	326918280	/nfs/dbraw/zinc/91/82/80/326918280.db2.gz	CXSIIEMTTWJLEK-NWDGAFQWSA-N	1	0	250.367	1.650	50	0		CDAARO
O=C1CC[C@@H]([N@@H+]2CCCN(c3ccccc3)CC2)CCN1	ZINC000670434958	482971526	/nfs/dbraw/zinc/97/15/26/482971526.db2.gz	NQXKIVCHJDTBNW-MRXNPFEDSA-N	1	0	287.407	1.867	50	0		CDAARO
Cc1ccc(OC2C[NH+]([C@@H]3CCNC(=O)CC3)C2)cc1	ZINC000670437763	482978857	/nfs/dbraw/zinc/97/88/57/482978857.db2.gz	YZAWCVKRIAPBQI-ZDUSSCGKSA-N	1	0	274.364	1.727	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN(C(=O)CCc2ccncc2)C1	ZINC000670439292	482979659	/nfs/dbraw/zinc/97/96/59/482979659.db2.gz	QFYWJTPYFWMBDK-HNNXBMFYSA-N	1	0	291.395	1.051	50	0		CDAARO
CN1CCCNC(=O)C12CC[NH+](C[C@@H]1CC=CCC1)CC2	ZINC000670439030	482982878	/nfs/dbraw/zinc/98/28/78/482982878.db2.gz	GGDUQUGUJFMEJN-OAHLLOKOSA-N	1	0	291.439	1.629	50	0		CDAARO
CN1CCC(CNC(=O)[C@@H]2CC23CCC3)([NH+](C)C)CC1	ZINC000670442322	482989614	/nfs/dbraw/zinc/98/96/14/482989614.db2.gz	LLCCVCIZYPKOHC-ZDUSSCGKSA-N	1	0	279.428	1.319	50	0		CDAARO
CC1(C)C[C@@H](O)CC[N@H+](CCN2CCCC2=O)C1	ZINC000670450493	483008671	/nfs/dbraw/zinc/00/86/71/483008671.db2.gz	SGPQNDRGTWBKLA-LBPRGKRZSA-N	1	0	254.374	1.092	50	0		CDAARO
CCC[C@@H](CNC(=O)[C@H]1CC[C@H](O)CC1)[NH+](C)C	ZINC000670455810	483034626	/nfs/dbraw/zinc/03/46/26/483034626.db2.gz	NIIRTVONXVWFAP-AVGNSLFASA-N	1	0	256.390	1.384	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1CCCNc1ncnc2[nH]ccc21	ZINC000670465162	483055319	/nfs/dbraw/zinc/05/53/19/483055319.db2.gz	GPSFSPMCMRTTJO-GFCCVEGCSA-N	1	0	289.383	1.558	50	0		CDAARO
O[C@H]1CN(CC2=CCCCC2)C[C@@H]1[NH+]1CCCC1	ZINC000670465063	483055307	/nfs/dbraw/zinc/05/53/07/483055307.db2.gz	KCFVKDZYLFJKDE-GJZGRUSLSA-N	1	0	250.386	1.628	50	0		CDAARO
COCCOC1CC[NH+](C2CSCCSC2)CC1	ZINC000670470023	483066886	/nfs/dbraw/zinc/06/68/86/483066886.db2.gz	XOLOTGWGHDSMKX-UHFFFAOYSA-N	1	0	291.482	1.962	50	0		CDAARO
CCC[C@@]1(CO)CCC[N@H+](CCn2cnnc2C)C1	ZINC000670473656	483083588	/nfs/dbraw/zinc/08/35/88/483083588.db2.gz	OYSHJHKYJSVJJZ-CQSZACIVSA-N	1	0	266.389	1.461	50	0		CDAARO
Cn1cc([C@@H]2OCC[C@H]2C[NH2+]Cc2cscn2)cn1	ZINC000084317612	483272329	/nfs/dbraw/zinc/27/23/29/483272329.db2.gz	GCCSGSNBCQKYOG-GXFFZTMASA-N	1	0	278.381	1.744	50	0		CDAARO
Cc1noc(CN2CC[NH+](C[C@H]3CC=CCC3)CC2)n1	ZINC000096489592	534409100	/nfs/dbraw/zinc/40/91/00/534409100.db2.gz	ZMYUAGLBHMFJNI-AWEZNQCLSA-N	1	0	276.384	1.852	50	0		CDAARO
Cn1c(CC[NH3+])nnc1SC[C@@H](O)c1ccccc1	ZINC000426711484	534683250	/nfs/dbraw/zinc/68/32/50/534683250.db2.gz	PQGOLIQTLVOBGF-LLVKDONJSA-N	1	0	278.381	1.142	50	0		CDAARO
COCCNC(=O)C1CC[NH+](Cc2ccc(C)cc2)CC1	ZINC000020102902	523889801	/nfs/dbraw/zinc/88/98/01/523889801.db2.gz	WIPBKCDZCHDVRU-UHFFFAOYSA-N	1	0	290.407	1.970	50	0		CDAARO
Cc1nnc(NC[C@H]2C[N@@H+](C)CCN2C)c2ccccc12	ZINC000068806721	526371236	/nfs/dbraw/zinc/37/12/36/526371236.db2.gz	SDXJTSRVBLNNCT-ZDUSSCGKSA-N	1	0	285.395	1.596	50	0		CDAARO
C(CN1CCOC[C@@H]1C1CC1)C[N@@H+]1CCOC[C@@H]1C1CC1	ZINC000121562549	527481676	/nfs/dbraw/zinc/48/16/76/527481676.db2.gz	OBQUJAPAAQFGOA-IAGOWNOFSA-N	1	0	294.439	1.598	50	0		CDAARO
Cc1cc(C)cc(C(=O)NC[C@H]2C[N@@H+]3CCC[C@@H]3CO2)c1	ZINC000058345476	538377737	/nfs/dbraw/zinc/37/77/37/538377737.db2.gz	VXTUMJSMPBLLIC-CVEARBPZSA-N	1	0	288.391	1.896	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN(c2cc(N)cc[nH+]2)CC1	ZINC000071788753	567902104	/nfs/dbraw/zinc/90/21/04/567902104.db2.gz	APHXZTMJZUFEIV-UHFFFAOYSA-N	1	0	278.356	1.721	50	0		CDAARO
CC(C)[C@@H](CO)NCc1ncn(-c2ccccc2)n1	ZINC000097094650	567903986	/nfs/dbraw/zinc/90/39/86/567903986.db2.gz	LXMKXESSGPBVDJ-CYBMUJFWSA-N	1	0	260.341	1.374	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(O)([C@H]([NH3+])C2CCC2)CC1	ZINC000958528960	613974620	/nfs/dbraw/zinc/97/46/20/613974620.db2.gz	ZXYYMTGQUGHDTR-GFCCVEGCSA-N	1	0	284.400	1.876	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@](O)([C@@H]([NH3+])C2CCC2)C1	ZINC000958528662	613975580	/nfs/dbraw/zinc/97/55/80/613975580.db2.gz	YMVHQUHSTJPBGY-SWLSCSKDSA-N	1	0	284.400	1.876	50	0		CDAARO
C[C@@H]1[C@H](C)[NH2+]CCN1C(=O)C[C@H](O)c1cccc(F)c1	ZINC000888096333	617758767	/nfs/dbraw/zinc/75/87/67/617758767.db2.gz	AUXYOANJCDNZNL-WDMOLILDSA-N	1	0	280.343	1.458	50	0		CDAARO
CC[C@@H]1CN(CC[NH2+][C@H]2CCCn3ccnc32)CCO1	ZINC000888094085	617753026	/nfs/dbraw/zinc/75/30/26/617753026.db2.gz	GRBKHCWQYOAUPX-KGLIPLIRSA-N	1	0	278.400	1.418	50	0		CDAARO
C[C@@H]([NH2+]CCCNc1ccccc1)[C@H]1CN(C)CCN1C	ZINC000888098455	617761603	/nfs/dbraw/zinc/76/16/03/617761603.db2.gz	IZRWISSKDWSCMR-NVXWUHKLSA-N	1	0	290.455	1.713	50	0		CDAARO
C=CC(=O)N1C[C@@H]2C[N@@H+](C)[C@@H](c3ccccc3)[C@@H]2C1	ZINC000888102169	617767855	/nfs/dbraw/zinc/76/78/55/617767855.db2.gz	KZDDFIXKIUXDSX-LZWOXQAQSA-N	1	0	256.349	1.934	50	0		CDAARO
Nc1nc2c(c(N[C@@H]3C[C@H]3c3ccccc3)n1)CC[NH2+]CC2	ZINC000072462585	685326337	/nfs/dbraw/zinc/32/63/37/685326337.db2.gz	UMWWWVMXJWPVQY-DZGCQCFKSA-N	1	0	295.390	1.715	50	0		CDAARO
O=C(NCC[N@@H+]1CCCOCC1)c1nccc2ccccc21	ZINC000189375488	684331250	/nfs/dbraw/zinc/33/12/50/684331250.db2.gz	NZSNNVLVJLGRJM-UHFFFAOYSA-N	1	0	299.374	1.687	50	0		CDAARO
C[C@@H]([NH2+]CCCNc1ccccc1)c1cn(C)nn1	ZINC000863982476	684697095	/nfs/dbraw/zinc/69/70/95/684697095.db2.gz	OMZURAIFOYXPLJ-GFCCVEGCSA-N	1	0	259.357	1.968	50	0		CDAARO
[NH3+]C1CCN(Cc2ncoc2C2CCOCC2)CC1	ZINC000725325684	684864826	/nfs/dbraw/zinc/86/48/26/684864826.db2.gz	CQKJZZUYUGOIFH-UHFFFAOYSA-N	1	0	265.357	1.492	50	0		CDAARO
[NH3+]CCc1cc(=O)[nH]c(Cc2cc(F)cc(F)c2)n1	ZINC000023543252	684881665	/nfs/dbraw/zinc/88/16/65/684881665.db2.gz	UOIBDLOPACFDKW-UHFFFAOYSA-N	1	0	265.263	1.140	50	0		CDAARO
OCCN1CC[NH+](CCCc2cccc(Cl)c2)CC1	ZINC000019337288	684886597	/nfs/dbraw/zinc/88/65/97/684886597.db2.gz	HLMBIWBYSYUIAU-UHFFFAOYSA-N	1	0	282.815	1.883	50	0		CDAARO
CC[N@@H+]1CCC[C@@](C)(C(=O)NCCc2nnc(C)s2)C1	ZINC000095391661	684974936	/nfs/dbraw/zinc/97/49/36/684974936.db2.gz	XTOHTZYMFHOPNG-CQSZACIVSA-N	1	0	296.440	1.627	50	0		CDAARO
[NH3+]CCN(Cc1ccccc1)C(=O)c1n[nH]c2c1CCCC2	ZINC000184221119	685758940	/nfs/dbraw/zinc/75/89/40/685758940.db2.gz	KQNLVPRFVJKDOX-UHFFFAOYSA-N	1	0	298.390	1.890	50	0		CDAARO
Cc1nn2cc(CCNc3cc[nH+]c(CO)c3)nc2s1	ZINC000032498386	685814204	/nfs/dbraw/zinc/81/42/04/685814204.db2.gz	QCLVAGCCFVOVOY-UHFFFAOYSA-N	1	0	289.364	1.641	50	0		CDAARO
CCc1cc(NCCNC(C)=O)nc(N2CCCC2)[nH+]1	ZINC000065372720	685890978	/nfs/dbraw/zinc/89/09/78/685890978.db2.gz	UTIWGFZPSKPWPG-UHFFFAOYSA-N	1	0	277.372	1.187	50	0		CDAARO
C[N@H+](CCc1cn[nH]c1)[C@@H]1CCOC2(CCOCC2)C1	ZINC000077471647	685980268	/nfs/dbraw/zinc/98/02/68/685980268.db2.gz	PXCMTHQHWPMEHG-CQSZACIVSA-N	1	0	279.384	1.612	50	0		CDAARO
Cc1cc(C)c(C[NH2+][C@@H](C)CS(C)(=O)=O)cn1	ZINC000396978043	686051106	/nfs/dbraw/zinc/05/11/06/686051106.db2.gz	LMRDPQZWWDRBLC-NSHDSACASA-N	1	0	256.371	1.221	50	0		CDAARO
COc1ccccc1OCCN1CCC[C@@H]([NH2+]CCO)C1	ZINC000864097426	686310592	/nfs/dbraw/zinc/31/05/92/686310592.db2.gz	VHOAWWNQYAFFRA-CQSZACIVSA-N	1	0	294.395	1.120	50	0		CDAARO
OCC[C@@H]1CN(Cc2c[nH]cn2)CC[N@@H+]1C1CCCC1	ZINC000020598573	686735719	/nfs/dbraw/zinc/73/57/19/686735719.db2.gz	AEPPLCBRDDKYBC-OAHLLOKOSA-N	1	0	278.400	1.221	50	0		CDAARO
C[C@@H](O)c1nc2cc(NC(=O)C3([NH3+])CCCC3)ccc2[nH]1	ZINC000952977921	687560213	/nfs/dbraw/zinc/56/02/13/687560213.db2.gz	CSTMYVWNRWRFLC-SECBINFHSA-N	1	0	288.351	1.826	50	0		CDAARO
Cc1cccn2ncc(C(=O)NC[C@H](C(C)C)[NH+](C)C)c12	ZINC001772709416	1159443602	/nfs/dbraw/zinc/44/36/02/1159443602.db2.gz	JOGGQILXUAORSD-CQSZACIVSA-N	1	0	288.395	1.959	50	0		CDAARO
O[C@@H](Cn1cc(C[C@@H]2CC[NH2+]C2)nn1)c1ccccc1	ZINC000585135457	1164217993	/nfs/dbraw/zinc/21/79/93/1164217993.db2.gz	KSSICCQUBFAYRH-WFASDCNBSA-N	1	0	272.352	1.164	50	0		CDAARO
Cc1nc[nH]c1CN(CC[NH+](C)C)Cc1cccc(C)n1	ZINC001704326389	1177689048	/nfs/dbraw/zinc/68/90/48/1177689048.db2.gz	BNUYJGWFONWXRQ-UHFFFAOYSA-N	1	0	287.411	1.985	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3scnc3C)C[C@H]2O)[nH]n1	ZINC001704339500	1177695318	/nfs/dbraw/zinc/69/53/18/1177695318.db2.gz	JCTOVCIBKQMUOE-DGCLKSJQSA-N	1	0	292.408	1.518	50	0		CDAARO
CC[N@@H+]1CC[C@@H](N(C)S(=O)(=O)c2ccsc2)C1	ZINC000585081743	898697809	/nfs/dbraw/zinc/69/78/09/898697809.db2.gz	SHVYDQOAFWKEPP-SNVBAGLBSA-N	1	0	274.411	1.463	50	0		CDAARO
C[N@H+](CCOC(=O)C[C@@H]1COC(=O)C1)Cc1ccccc1	ZINC000585087037	898701289	/nfs/dbraw/zinc/70/12/89/898701289.db2.gz	ADWUKQAMRLCUOZ-AWEZNQCLSA-N	1	0	291.347	1.615	50	0		CDAARO
C[C@H](Cn1ccnc1)[NH2+]CC1(Cn2ccnc2)CC1	ZINC000821495615	925586891	/nfs/dbraw/zinc/58/68/91/925586891.db2.gz	OFJDXPXPQSLTFQ-CYBMUJFWSA-N	1	0	259.357	1.538	50	0		CDAARO
CCC[C@@H]1COCCN1C(=O)C[NH+]1CCCCCC1	ZINC000822812321	925650305	/nfs/dbraw/zinc/65/03/05/925650305.db2.gz	YICBAGCQNBRFEE-CQSZACIVSA-N	1	0	268.401	1.890	50	0		CDAARO
Cc1nonc1CN(C)C[C@H]1CC[N@H+](C)C1(C)C	ZINC000823719846	925721534	/nfs/dbraw/zinc/72/15/34/925721534.db2.gz	PPURGDJODSLFBK-LLVKDONJSA-N	1	0	252.362	1.540	50	0		CDAARO
CN(Cc1ccccc1C[NH+](C)C)C(=O)c1ccnn1C	ZINC000823712731	925723254	/nfs/dbraw/zinc/72/32/54/925723254.db2.gz	LVHRAGYSRJLKNC-UHFFFAOYSA-N	1	0	286.379	1.754	50	0		CDAARO
CNc1nc(NCC2([NH+](C)C)CCN(C)CC2)ncc1F	ZINC000824090528	925799087	/nfs/dbraw/zinc/79/90/87/925799087.db2.gz	HLCKDMVYDQTPHG-UHFFFAOYSA-N	1	0	296.394	1.095	50	0		CDAARO
CO[C@@H]1CCN(C(=O)CC[NH+]2CCCCCCC2)C1	ZINC000824300520	925815077	/nfs/dbraw/zinc/81/50/77/925815077.db2.gz	XHOSXKMVMYFADQ-CQSZACIVSA-N	1	0	268.401	1.890	50	0		CDAARO
CO[C@H]1COC[C@@H]1[NH2+]C1CCN(c2ccccc2F)CC1	ZINC000824506333	925828372	/nfs/dbraw/zinc/82/83/72/925828372.db2.gz	BPWCTVOHBOFGPD-HOCLYGCPSA-N	1	0	294.370	1.798	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)NCc1cccs1	ZINC000828029636	926026645	/nfs/dbraw/zinc/02/66/45/926026645.db2.gz	GKQLCCPITQYVKR-UHFFFAOYSA-N	1	0	290.392	1.785	50	0		CDAARO
O=C(NCC1CC[NH+](C[C@H]2CCOC2)CC1)c1ccon1	ZINC000828228829	926089602	/nfs/dbraw/zinc/08/96/02/926089602.db2.gz	YKQOLSLCIICCRV-CYBMUJFWSA-N	1	0	293.367	1.153	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+](CC[S@](C)=O)C1	ZINC000585079723	930852444	/nfs/dbraw/zinc/85/24/44/930852444.db2.gz	GJCCCJQGRZZWAK-JMERFSKESA-N	1	0	288.457	1.382	50	0		CDAARO
CON(C)CC[NH2+]Cc1c(C)nc2sc(C)cn12	ZINC000585118339	930979921	/nfs/dbraw/zinc/97/99/21/930979921.db2.gz	LBDKGXBYJXFJHO-UHFFFAOYSA-N	1	0	268.386	1.595	50	0		CDAARO
CN(C)c1[nH]c2ccc(NCc3cnn(C)c3)cc2[nH+]1	ZINC000585118530	930981682	/nfs/dbraw/zinc/98/16/82/930981682.db2.gz	SEHKPRQQHMVCMN-UHFFFAOYSA-N	1	0	270.340	1.975	50	0		CDAARO
Cc1ccnn1CC[N@H+](CCO)Cc1ccc(F)cc1	ZINC001529099909	968981833	/nfs/dbraw/zinc/98/18/33/968981833.db2.gz	HCSFJGBBIUGEFY-UHFFFAOYSA-N	1	0	277.343	1.825	50	0		CDAARO
CC(C)[C@H]1CN(C(=O)CC[NH3+])C[C@@H](c2ccccc2)O1	ZINC001529112928	968983676	/nfs/dbraw/zinc/98/36/76/968983676.db2.gz	VRLPEFPPBLCPSB-CABCVRRESA-N	1	0	276.380	1.960	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1cc(OC)nc(N)n1	ZINC001529171936	969001821	/nfs/dbraw/zinc/00/18/21/969001821.db2.gz	BAMGUNZWSMUNCA-SNVBAGLBSA-N	1	0	265.361	1.354	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1C1CN(CCc2nccn2C)C1	ZINC001506408341	975153161	/nfs/dbraw/zinc/15/31/61/975153161.db2.gz	RQDRUWANHBIPRO-ZDUSSCGKSA-N	1	0	262.401	1.521	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]CCC(=O)N1CCCC1	ZINC001506412755	975154227	/nfs/dbraw/zinc/15/42/27/975154227.db2.gz	OCWVQANVFLOWJN-CYBMUJFWSA-N	1	0	278.400	1.436	50	0		CDAARO
COCC[C@@H]1CCC[N@H+](CCn2c(=O)cc(C)[nH]c2=O)C1	ZINC001506425221	975159415	/nfs/dbraw/zinc/15/94/15/975159415.db2.gz	OFOOCUJTLUWCPS-ZDUSSCGKSA-N	1	0	295.383	1.006	50	0		CDAARO
CSCCC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@@H+]1C	ZINC000106661399	349446126	/nfs/dbraw/zinc/44/61/26/349446126.db2.gz	JCIWEEJIJKTWNZ-NWDGAFQWSA-N	1	0	256.415	1.825	50	0		CDAARO
O=C(NCC[NH2+]C1CCCCCC1)[C@H]1CCCOC1	ZINC000122238562	230394324	/nfs/dbraw/zinc/39/43/24/230394324.db2.gz	SZBBZJIKTBYMNI-ZDUSSCGKSA-N	1	0	268.401	1.842	50	0		CDAARO
Cn1c(SC[C@H]2CCOC2)nnc1C1CC[NH2+]CC1	ZINC000426551785	230422886	/nfs/dbraw/zinc/42/28/86/230422886.db2.gz	JZZNABBFDNBYCH-JTQLQIEISA-N	1	0	282.413	1.411	50	0		CDAARO
Cc1nccn1CC[NH2+][C@@H]1CCC(=O)N(CC2CC2)CC1	ZINC000584903726	341993992	/nfs/dbraw/zinc/99/39/92/341993992.db2.gz	SUVSDVHAMXVRMQ-OAHLLOKOSA-N	1	0	290.411	1.572	50	0		CDAARO
CC[N@@H+]1CC[C@H](CNC(=O)c2cn3c(cccc3C)n2)C1	ZINC000095954442	185041947	/nfs/dbraw/zinc/04/19/47/185041947.db2.gz	YDGLBICIDOSCHZ-CYBMUJFWSA-N	1	0	286.379	1.714	50	0		CDAARO
CCCS(=O)(=O)N[C@@H](C)C[N@@H+]1CCC[C@H](C)C1	ZINC000189151083	365577780	/nfs/dbraw/zinc/57/77/80/365577780.db2.gz	RARGNOWWILPFCH-RYUDHWBXSA-N	1	0	262.419	1.436	50	0		CDAARO
CC(C)(C)[C@@H](O)C[C@H](CO)[NH2+]Cc1cnn2ccccc12	ZINC000241301042	361752380	/nfs/dbraw/zinc/75/23/80/361752380.db2.gz	LPXKIEWONAQRQE-HIFRSBDPSA-N	1	0	291.395	1.582	50	0		CDAARO
CCOC(=O)c1nn(Cc2ccccc2)c2c1C[NH2+]CC2	ZINC000082810574	178313319	/nfs/dbraw/zinc/31/33/19/178313319.db2.gz	CEXVATWMVKJYID-UHFFFAOYSA-N	1	0	285.347	1.754	50	0		CDAARO
Cc1cccc(C)c1OCCOCC[N@H+](C)CCO	ZINC000002980663	342089104	/nfs/dbraw/zinc/08/91/04/342089104.db2.gz	BJBJBUIVGDONHF-UHFFFAOYSA-N	1	0	267.369	1.623	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)c1cccc(-c2ccoc2)c1	ZINC000195554006	342625852	/nfs/dbraw/zinc/62/58/52/342625852.db2.gz	NZFXMJRUQMOQPE-GJZGRUSLSA-N	1	0	286.331	1.663	50	0		CDAARO
CC(C)CCC(=O)N1CCN(C(=O)[C@@H]([NH3+])C(C)(C)C)CC1	ZINC000195543320	342626730	/nfs/dbraw/zinc/62/67/30/342626730.db2.gz	UBOFVBDEXYATMB-CQSZACIVSA-N	1	0	297.443	1.467	50	0		CDAARO
C[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccccc1F)[NH+](C)C	ZINC000252517134	361848686	/nfs/dbraw/zinc/84/86/86/361848686.db2.gz	AQMPYSMONIEUKG-KGYLQXTDSA-N	1	0	264.344	1.996	50	0		CDAARO
Cn1c(CN2CCCCCC2)nnc1[C@H]1C[C@@H]([NH3+])C1	ZINC000244641197	361855632	/nfs/dbraw/zinc/85/56/32/361855632.db2.gz	GLCJLMOYPQYWHZ-TXEJJXNPSA-N	1	0	263.389	1.396	50	0		CDAARO
CC(C)c1cc(C(=O)N2CCC[N@@H+]([C@H](C)CO)CC2)no1	ZINC000252496343	361847514	/nfs/dbraw/zinc/84/75/14/361847514.db2.gz	PHBOYVBICTWMKM-GFCCVEGCSA-N	1	0	295.383	1.327	50	0		CDAARO
CC(C)n1cnnc1CN1CCC[N@@H+]2CCC[C@H]2C1	ZINC000244873621	361867175	/nfs/dbraw/zinc/86/71/75/361867175.db2.gz	WTAUFWPNNXYVRM-ZDUSSCGKSA-N	1	0	263.389	1.529	50	0		CDAARO
C[NH+](C)Cc1ccc(C(=O)N2CCOCC(F)(F)C2)cn1	ZINC000368361345	282146229	/nfs/dbraw/zinc/14/62/29/282146229.db2.gz	BQDWSVGJHFUTMI-UHFFFAOYSA-N	1	0	299.321	1.251	50	0		CDAARO
CC[C@H]1CCCCN1C(=O)CSc1nc(N)cc(N)[nH+]1	ZINC000000418000	361897734	/nfs/dbraw/zinc/89/77/34/361897734.db2.gz	UZNQPMOFAJHIET-VIFPVBQESA-N	1	0	295.412	1.524	50	0		CDAARO
Cc1ccc2ccccc2c1Cn1cc(C[C@H]([NH3+])CO)nn1	ZINC000585134239	342215513	/nfs/dbraw/zinc/21/55/13/342215513.db2.gz	JNCQGGNAYQGDCU-AWEZNQCLSA-N	1	0	296.374	1.650	50	0		CDAARO
Cc1cccc(CCNC(=O)N2CC[C@H]([NH+](C)C)C2)n1	ZINC000350624285	539092528	/nfs/dbraw/zinc/09/25/28/539092528.db2.gz	BBFWQFRJCYFHOM-AWEZNQCLSA-N	1	0	276.384	1.278	50	0		CDAARO
C[N@H+](Cc1ccccc1)C1CCN(CCn2cnnc2)CC1	ZINC000670441519	539114235	/nfs/dbraw/zinc/11/42/35/539114235.db2.gz	DSGQJGOUDFLUTG-UHFFFAOYSA-N	1	0	299.422	1.875	50	0		CDAARO
CCCCNC(=O)[C@@H](C)N1C[C@@H](C)[N@@H+](CC)[C@@H](C)C1	ZINC000585116119	362043287	/nfs/dbraw/zinc/04/32/87/362043287.db2.gz	HRPZFKXUQZLWMC-HZSPNIEDSA-N	1	0	269.433	1.706	50	0		CDAARO
CCc1noc(CC)c1CC(=O)N1CC[NH2+]C[C@@H]1C	ZINC000126400817	187237647	/nfs/dbraw/zinc/23/76/47/187237647.db2.gz	HPGQGJIUHVJNKC-JTQLQIEISA-N	1	0	265.357	1.162	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CN(C(=O)c2coc3ccccc23)CCO1	ZINC000127891996	187338770	/nfs/dbraw/zinc/33/87/70/187338770.db2.gz	VKYPVMHZMBIJJK-HZMBPMFUSA-N	1	0	274.320	1.621	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)c2ccccc2N2CCOCC2)C1	ZINC000178329158	362242175	/nfs/dbraw/zinc/24/21/75/362242175.db2.gz	YUZQIOBNUKWUIV-CYBMUJFWSA-N	1	0	289.379	1.087	50	0		CDAARO
C/C(=C/c1ccccc1)C[NH2+]CC1(C(N)=O)CCOCC1	ZINC000089262175	362308924	/nfs/dbraw/zinc/30/89/24/362308924.db2.gz	ZDEQYPFYDRLTFM-KAMYIIQDSA-N	1	0	288.391	1.962	50	0		CDAARO
COc1cccc(/C=C/C(=O)N2CC[N@H+](C)C[C@H]2C)c1	ZINC000089937743	362323579	/nfs/dbraw/zinc/32/35/79/362323579.db2.gz	BERXWLLLFVNROO-SBDDDAINSA-N	1	0	274.364	1.871	50	0		CDAARO
COc1cc(CN2CCC[NH2+]CC2)cc2c1OCO2	ZINC000097162582	185552962	/nfs/dbraw/zinc/55/29/62/185552962.db2.gz	FGBWSAQQFIGHQV-UHFFFAOYSA-N	1	0	264.325	1.219	50	0		CDAARO
C[C@@H]1CC[N@H+](C[C@H](O)COC(C)(C)C)CCS1	ZINC000192172379	362612624	/nfs/dbraw/zinc/61/26/24/362612624.db2.gz	FIQNDXGUDAJWIW-NEPJUHHUSA-N	1	0	261.431	1.990	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+]Cc1cnc2cnccn12	ZINC000097237849	185571441	/nfs/dbraw/zinc/57/14/41/185571441.db2.gz	IBHUEMCFLVIGKJ-UHFFFAOYSA-N	1	0	262.313	1.018	50	0		CDAARO
Cc1sc2nc(N3CC[NH2+]CC3)n3ncnc3c2c1C	ZINC000015083497	282484937	/nfs/dbraw/zinc/48/49/37/282484937.db2.gz	ZJCOOGAGGJZPQZ-UHFFFAOYSA-N	1	0	288.380	1.365	50	0		CDAARO
C[NH2+][C@H](C)c1nc2ccccc2c(=O)n1CCOC	ZINC000019927551	348746249	/nfs/dbraw/zinc/74/62/49/348746249.db2.gz	KHTIJJLXANRNJH-SNVBAGLBSA-N	1	0	261.325	1.323	50	0		CDAARO
O=C(NCC[C@H]1CC[NH2+]C1)c1cccc2c1OCCO2	ZINC000110794423	349172109	/nfs/dbraw/zinc/17/21/09/349172109.db2.gz	XUKVZSLABKGNRS-LLVKDONJSA-N	1	0	276.336	1.187	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C(=O)c1csc(N)n1	ZINC000584896387	349357528	/nfs/dbraw/zinc/35/75/28/349357528.db2.gz	ZMJJJHICCBJMLW-UHFFFAOYSA-N	1	0	282.413	1.502	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)c2ccc(-c3cncc(=O)[nH]3)cc2)C1	ZINC000584892416	349352073	/nfs/dbraw/zinc/35/20/73/349352073.db2.gz	KGXUSYNZZLQZSE-LLVKDONJSA-N	1	0	298.346	1.270	50	0		CDAARO
Cc1cc(C(=O)N2CCC[C@H]([NH+](C)C)C2)cc(C)n1	ZINC000584892976	349352643	/nfs/dbraw/zinc/35/26/43/349352643.db2.gz	ATMLJOOEPUEKJS-AWEZNQCLSA-N	1	0	261.369	1.865	50	0		CDAARO
CNC(=O)[C@@H]([NH2+]C1CSCCSC1)c1ccccc1	ZINC000584895316	349355761	/nfs/dbraw/zinc/35/57/61/349355761.db2.gz	HXTQEUNRCYCWEH-ZDUSSCGKSA-N	1	0	296.461	1.912	50	0		CDAARO
COCc1cc(CNC(=O)[C@@H]2CCCCC[N@@H+]2C)[nH]n1	ZINC000091289094	180122343	/nfs/dbraw/zinc/12/23/43/180122343.db2.gz	PAPALQOJCYFDGF-ZDUSSCGKSA-N	1	0	280.372	1.047	50	0		CDAARO
CC[C@@]1(CO)CCC[N@H+](Cc2[nH]cc(C)c(=O)c2C)C1	ZINC000091462095	180162493	/nfs/dbraw/zinc/16/24/93/180162493.db2.gz	AXQRRBFEKUJFMT-MRXNPFEDSA-N	1	0	278.396	1.976	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@@H]1NS(=O)(=O)c1ccc(F)c(F)c1	ZINC000091496881	180172650	/nfs/dbraw/zinc/17/26/50/180172650.db2.gz	XNKUWXHTCCQXHL-UFBFGSQYSA-N	1	0	290.335	1.384	50	0		CDAARO
CCO[C@@H]1C[C@@H](O)C12CC[NH+](C[C@H](O)CC)CC2	ZINC000110618679	350203810	/nfs/dbraw/zinc/20/38/10/350203810.db2.gz	OEOHHUKMKDUVPJ-JHJVBQTASA-N	1	0	257.374	1.009	50	0		CDAARO
CCOc1cc(C[NH2+]C[C@@H]2CN(C)CCO2)ccc1OC	ZINC000105472496	186058695	/nfs/dbraw/zinc/05/86/95/186058695.db2.gz	XKMYGHPFQFFLRX-CQSZACIVSA-N	1	0	294.395	1.514	50	0		CDAARO
CCn1nc(CC(C)C)cc1C(=O)N1[C@@H]2CC[C@H]1C[NH2+]C2	ZINC000092022234	180307968	/nfs/dbraw/zinc/30/79/68/180307968.db2.gz	JHYLPCMAGIYMIA-OKILXGFUSA-N	1	0	290.411	1.678	50	0		CDAARO
O=C(CCN1CCSC1=O)N[C@H]1CC[N@@H+]2CCCC[C@H]12	ZINC000106079202	186101159	/nfs/dbraw/zinc/10/11/59/186101159.db2.gz	PJPHHROYLBXCJW-NWDGAFQWSA-N	1	0	297.424	1.288	50	0		CDAARO
CC(C)C[N@@H+]1CCN(Cc2ccncc2)C[C@H]1CCO	ZINC000106980026	186154619	/nfs/dbraw/zinc/15/46/19/186154619.db2.gz	VUSIRGSVBFXBFO-MRXNPFEDSA-N	1	0	277.412	1.606	50	0		CDAARO
COC(=O)Cn1cc(C[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)nn1	ZINC000108465364	186218606	/nfs/dbraw/zinc/21/86/06/186218606.db2.gz	ZLVQHAVNPPONMD-NTZNESFSSA-N	1	0	280.372	1.365	50	0		CDAARO
O=C(Nc1ccc(Br)cc1)N1CC[NH2+]CC1	ZINC000041458028	362985370	/nfs/dbraw/zinc/98/53/70/362985370.db2.gz	HRFZUFHAHQHMAY-UHFFFAOYSA-N	1	0	284.157	1.886	50	0		CDAARO
Cc1ccc(CC(=O)N[C@@H](C)[C@@H]2CCCC[NH2+]2)cn1	ZINC000583651844	366018231	/nfs/dbraw/zinc/01/82/31/366018231.db2.gz	UGDHREFFTITJIN-JSGCOSHPSA-N	1	0	261.369	1.579	50	0		CDAARO
C[C@@H]1COCC[C@H]1CNC(=O)NC[C@H]1CCCC[N@H+](C)C1	ZINC000624048509	351394461	/nfs/dbraw/zinc/39/44/61/351394461.db2.gz	NMKPLCHOVHEICF-KFWWJZLASA-N	1	0	297.443	1.690	50	0		CDAARO
COc1ccccc1NC(=O)N1CCC[N@H+](C)CC1	ZINC000012553315	358486147	/nfs/dbraw/zinc/48/61/47/358486147.db2.gz	ROCFNEHQZZBYAU-UHFFFAOYSA-N	1	0	263.341	1.865	50	0		CDAARO
CC(C)(CO)[NH2+]C[C@@H](O)COc1ccccc1Cl	ZINC000002699723	355979109	/nfs/dbraw/zinc/97/91/09/355979109.db2.gz	CLOGYYNFRDLIGB-SNVBAGLBSA-N	1	0	273.760	1.440	50	0		CDAARO
CC(C)(CO)[NH2+]C[C@H](O)COc1ccccc1Cl	ZINC000002699722	355979211	/nfs/dbraw/zinc/97/92/11/355979211.db2.gz	CLOGYYNFRDLIGB-JTQLQIEISA-N	1	0	273.760	1.440	50	0		CDAARO
COCCNC(=S)N1CC[NH+](C2CCCCC2)CC1	ZINC000002872665	355985535	/nfs/dbraw/zinc/98/55/35/355985535.db2.gz	XSAYZLQNVWFUTK-UHFFFAOYSA-N	1	0	285.457	1.458	50	0		CDAARO
COC(=O)[C@H](CCCC[NH3+])NC(=O)c1ccccc1	ZINC000001640065	355942951	/nfs/dbraw/zinc/94/29/51/355942951.db2.gz	RNFLYGMDYGDLQG-LBPRGKRZSA-N	1	0	264.325	1.087	50	0		CDAARO
CN1CCC2(CC[NH+](C3CCOCC3)CC2)CCC1=O	ZINC000584901501	355956417	/nfs/dbraw/zinc/95/64/17/355956417.db2.gz	QDINFRPBGULESE-UHFFFAOYSA-N	1	0	280.412	1.890	50	0		CDAARO
CCOC(CC[NH2+]C[C@@H](O)C(F)(F)F)OCC	ZINC000004092410	356018193	/nfs/dbraw/zinc/01/81/93/356018193.db2.gz	PUWYVRMSYNFZKC-MRVPVSSYSA-N	1	0	259.268	1.288	50	0		CDAARO
CC[NH2+]C[C@@H](O)COCc1ccc(OC)c(OC)c1	ZINC000002641503	356092680	/nfs/dbraw/zinc/09/26/80/356092680.db2.gz	AVORDRCSIJEREN-GFCCVEGCSA-N	1	0	269.341	1.191	50	0		CDAARO
CCOc1ccc(C[NH2+]CCO)cc1Br	ZINC000010473823	356259051	/nfs/dbraw/zinc/25/90/51/356259051.db2.gz	PVRLEPZDIKSJLK-UHFFFAOYSA-N	1	0	274.158	1.930	50	0		CDAARO
Cc1ccc(C[N@H+](C)CCn2nc3ccccn3c2=O)cc1	ZINC000032777999	356363689	/nfs/dbraw/zinc/36/36/89/356363689.db2.gz	DLDQFONUQIHYSB-UHFFFAOYSA-N	1	0	296.374	1.936	50	0		CDAARO
CC(C)[C@H]([NH2+]CC(=O)NC(N)=O)c1ccc(Cl)cc1	ZINC000014898104	356399592	/nfs/dbraw/zinc/39/95/92/356399592.db2.gz	ZOBXBWBJIXHSES-LBPRGKRZSA-N	1	0	283.759	1.822	50	0		CDAARO
Cc1cc(S(C)(=O)=O)ccc1N1CC[NH2+][C@@H](C)C1	ZINC000015443248	356416577	/nfs/dbraw/zinc/41/65/77/356416577.db2.gz	BWDYUGMPCHGURQ-NSHDSACASA-N	1	0	268.382	1.197	50	0		CDAARO
CN(C)c1ccc(C(=O)NCC[C@@H]2CCCC[N@@H+]2C)cn1	ZINC000015074159	356405315	/nfs/dbraw/zinc/40/53/15/356405315.db2.gz	RIGQQFGZANSPRS-AWEZNQCLSA-N	1	0	290.411	1.752	50	0		CDAARO
CCc1ccc(O[C@H](C)C(=O)N2CC[NH2+]CC2)cc1	ZINC000019510447	356488571	/nfs/dbraw/zinc/48/85/71/356488571.db2.gz	ZJSXWPUTGNHGRN-GFCCVEGCSA-N	1	0	262.353	1.448	50	0		CDAARO
COc1ccc(NC(=O)CC[NH+]2CCN(C)CC2)cc1	ZINC000019590022	356493516	/nfs/dbraw/zinc/49/35/16/356493516.db2.gz	DNFWIHUTQWOVCR-UHFFFAOYSA-N	1	0	277.368	1.271	50	0		CDAARO
Cc1c(C)n(C[C@@H](O)CN2CC[NH2+]CC2)c2ccccc12	ZINC000019735428	356497881	/nfs/dbraw/zinc/49/78/81/356497881.db2.gz	WYHXAZHFQHMALD-HNNXBMFYSA-N	1	0	287.407	1.524	50	0		CDAARO
O=C(C[NH2+]C[C@@H]1CCCO1)Nc1ccc(F)cc1	ZINC000020055608	356523911	/nfs/dbraw/zinc/52/39/11/356523911.db2.gz	OUQNNAPDHBVYRR-LBPRGKRZSA-N	1	0	252.289	1.533	50	0		CDAARO
CN1CC[NH+](CCCCOc2ccccc2CO)CC1	ZINC000022995817	356626201	/nfs/dbraw/zinc/62/62/01/356626201.db2.gz	GDBWRHHCEPPMRK-UHFFFAOYSA-N	1	0	278.396	1.585	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COCc2ccc(C)cc2)CC1	ZINC000023114584	356627954	/nfs/dbraw/zinc/62/79/54/356627954.db2.gz	XSMDWQCZZRUWPK-KRWDZBQOSA-N	1	0	292.423	1.510	50	0		CDAARO
C[C@H]1C[N@H+](C)C[C@@H]1NS(=O)(=O)Cc1cccc(F)c1	ZINC000078899070	538477057	/nfs/dbraw/zinc/47/70/57/538477057.db2.gz	SQRLRIPLTKSQCW-GWCFXTLKSA-N	1	0	286.372	1.195	50	0		CDAARO
CC(C)(C)OC(=O)N[C@@]1(C(F)(F)F)CC[NH2+]C1	ZINC000025336426	356673060	/nfs/dbraw/zinc/67/30/60/356673060.db2.gz	CBRWRWRFOZZKCN-VIFPVBQESA-N	1	0	254.252	1.806	50	0		CDAARO
O=C(C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1)NC(=O)NC1CC1	ZINC000025411067	356674093	/nfs/dbraw/zinc/67/40/93/356674093.db2.gz	XFOVAHPTPXAMRY-VXGBXAGGSA-N	1	0	279.384	1.487	50	0		CDAARO
CCCNC(=O)NC(=O)CN(Cc1ccco1)C1CC1	ZINC000026928218	356701516	/nfs/dbraw/zinc/70/15/16/356701516.db2.gz	IXAGGZXNNHOXTF-UHFFFAOYSA-N	1	0	279.340	1.480	50	0		CDAARO
Nc1nccnc1C(=O)Nc1ccc(C[NH+]2CCCC2)cc1	ZINC000028176282	356717629	/nfs/dbraw/zinc/71/76/29/356717629.db2.gz	VWXIGRSZXQGWQT-UHFFFAOYSA-N	1	0	297.362	1.907	50	0		CDAARO
[NH3+]CCC(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000269131891	356804865	/nfs/dbraw/zinc/80/48/65/356804865.db2.gz	VOQHVMPHQQEOTA-ZIAGYGMSSA-N	1	0	262.353	1.450	50	0		CDAARO
Cc1nccn1CC1CCN(c2cc[nH+]c(CO)c2)CC1	ZINC000032511755	356781782	/nfs/dbraw/zinc/78/17/82/356781782.db2.gz	CORXMBGJKJBKLK-UHFFFAOYSA-N	1	0	286.379	1.995	50	0		CDAARO
CC(C)(CN1CCOCC1)C[N@@H+]1CCOC2(CCCC2)C1	ZINC000032581058	356782637	/nfs/dbraw/zinc/78/26/37/356782637.db2.gz	WXTKKBXJDJGAKF-UHFFFAOYSA-N	1	0	296.455	1.990	50	0		CDAARO
[NH3+]CCc1cn(Cc2cc(F)c(F)cc2F)nn1	ZINC000036719720	356878817	/nfs/dbraw/zinc/87/88/17/356878817.db2.gz	UAMSYHLUVXZPJH-UHFFFAOYSA-N	1	0	256.231	1.245	50	0		CDAARO
Nc1cc(C(F)(F)F)ccc1N1CC[NH+](CCO)CC1	ZINC000035609598	356842088	/nfs/dbraw/zinc/84/20/88/356842088.db2.gz	VSSSBYVDJBODTK-UHFFFAOYSA-N	1	0	289.301	1.402	50	0		CDAARO
C[NH+](C)[C@@H]1CC=CC(=O)N(Cc2ccccc2)C1=O	ZINC000045069498	363571658	/nfs/dbraw/zinc/57/16/58/363571658.db2.gz	GOGKOMXYTKJKTQ-CYBMUJFWSA-N	1	0	258.321	1.432	50	0		CDAARO
Cn1cc(CC[NH2+][C@@H](CO)c2c(F)cccc2F)cn1	ZINC000272959780	363574306	/nfs/dbraw/zinc/57/43/06/363574306.db2.gz	ANCTUNYSMGUCQD-ZDUSSCGKSA-N	1	0	281.306	1.564	50	0		CDAARO
CCCCC[N@@H+]1CCC[C@@H](Cn2cc(CCO)nn2)C1	ZINC000048234122	357175550	/nfs/dbraw/zinc/17/55/50/357175550.db2.gz	ZRRJPOJHLUYCBG-CQSZACIVSA-N	1	0	280.416	1.715	50	0		CDAARO
Cc1ccc(O[C@H](C)C(=O)N2CC[NH2+]CC2)c(Cl)c1	ZINC000054351342	357318487	/nfs/dbraw/zinc/31/84/87/357318487.db2.gz	PRBDSCTYSBRFOE-LLVKDONJSA-N	1	0	282.771	1.848	50	0		CDAARO
C[C@@H]1C[N@@H+]2CCC[C@H]2CN1S(=O)(=O)Cc1ccccc1	ZINC000247319853	357440441	/nfs/dbraw/zinc/44/04/41/357440441.db2.gz	ONZYZNXQYYPWSN-HIFRSBDPSA-N	1	0	294.420	1.685	50	0		CDAARO
COc1ccc(Br)cc1C[C@H](C[NH3+])CO	ZINC000063065246	357502581	/nfs/dbraw/zinc/50/25/81/357502581.db2.gz	TWGSZHOFHRHTRB-MRVPVSSYSA-N	1	0	274.158	1.567	50	0		CDAARO
COC(=O)C(C)(C)NC(=O)CC[C@H]1CCCC[N@@H+]1C	ZINC000065381507	357534216	/nfs/dbraw/zinc/53/42/16/357534216.db2.gz	SKMSIBVDQCQPGL-LLVKDONJSA-N	1	0	270.373	1.319	50	0		CDAARO
Nc1nnc(CC[NH2+]C2Cc3ccccc3C2)s1	ZINC000065394245	357535875	/nfs/dbraw/zinc/53/58/75/357535875.db2.gz	JVBODIUMOPTNGV-UHFFFAOYSA-N	1	0	260.366	1.420	50	0		CDAARO
COC[C@H](C)[NH2+]CCC(=O)Nc1ccc(OC)cc1C	ZINC000065397413	357537145	/nfs/dbraw/zinc/53/71/45/357537145.db2.gz	FGAMYUUPNWOGAB-LBPRGKRZSA-N	1	0	280.368	1.957	50	0		CDAARO
Cc1cc(C)n2ncc(CN3CC[C@H]4CC[C@@H](C3)[NH2+]4)c2n1	ZINC000065408519	357539363	/nfs/dbraw/zinc/53/93/63/357539363.db2.gz	FXMIRDSNSYQLDD-CABCVRRESA-N	1	0	285.395	1.672	50	0		CDAARO
CCN(C)Cc1n[nH]c(=O)n1-c1cc(OC)ccc1OC	ZINC000065459869	357542271	/nfs/dbraw/zinc/54/22/71/357542271.db2.gz	YUUCOUKNIUHSED-UHFFFAOYSA-N	1	0	292.339	1.030	50	0		CDAARO
C[C@H](CO)[NH2+]C1CCN(C(=O)NC2CCCCC2)CC1	ZINC000065488173	357544809	/nfs/dbraw/zinc/54/48/09/357544809.db2.gz	JRHNJHULBRTRDV-GFCCVEGCSA-N	1	0	283.416	1.464	50	0		CDAARO
CCN(CC)S(=O)(=O)NCC[C@H]1CCC[N@H+](CC)C1	ZINC000067821740	357630041	/nfs/dbraw/zinc/63/00/41/357630041.db2.gz	HWSXUVWNUBTNJX-CYBMUJFWSA-N	1	0	291.461	1.285	50	0		CDAARO
COc1ccc2[nH]c(C[NH2+][C@H](C)Cn3ccnc3)nc2c1	ZINC000067724485	357621447	/nfs/dbraw/zinc/62/14/47/357621447.db2.gz	SLHJFNVHNOGVOR-LLVKDONJSA-N	1	0	285.351	1.946	50	0		CDAARO
COc1ncnc(N)c1C[NH2+]C[C@H](C)c1c(C)noc1C	ZINC000095434251	357655167	/nfs/dbraw/zinc/65/51/67/357655167.db2.gz	SZAOFEYZYRYGPW-QMMMGPOBSA-N	1	0	291.355	1.566	50	0		CDAARO
C[C@@H](C1CCN(Cc2ncc[nH]2)CC1)[NH+]1CCOCC1	ZINC000072474381	357838156	/nfs/dbraw/zinc/83/81/56/357838156.db2.gz	SXXZNGRNXDTNAN-ZDUSSCGKSA-N	1	0	278.400	1.342	50	0		CDAARO
Cc1cc(C)n(C2CN(c3ncnc4c3CC[NH2+]CC4)C2)n1	ZINC000072481669	357838960	/nfs/dbraw/zinc/83/89/60/357838960.db2.gz	YLLSRHRUOLTFRZ-UHFFFAOYSA-N	1	0	298.394	1.039	50	0		CDAARO
COC(=O)[C@H]1[C@H](O)CCCN1Cc1ccc(F)c(C)c1	ZINC000188781502	357888913	/nfs/dbraw/zinc/88/89/13/357888913.db2.gz	QRESKCTYKULCBG-ZIAGYGMSSA-N	1	0	281.327	1.632	50	0		CDAARO
C[C@H]1OCC[C@H]1S(=O)(=O)Cc1cn2ccccc2n1	ZINC000097021095	357914248	/nfs/dbraw/zinc/91/42/48/357914248.db2.gz	WDWUPISBBZKCFB-ZYHUDNBSSA-N	1	0	280.349	1.427	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@H]2CCCC[C@H]2O)s1	ZINC000097102610	357972087	/nfs/dbraw/zinc/97/20/87/357972087.db2.gz	QWRCKNHABXQISK-WDEREUQCSA-N	1	0	269.366	1.928	50	0		CDAARO
C[C@@H]([NH2+]CCS(=O)(=O)c1ccccc1)[C@H]1CCCO1	ZINC000097108727	357983780	/nfs/dbraw/zinc/98/37/80/357983780.db2.gz	URJHRYJJCKRWBM-TZMCWYRMSA-N	1	0	283.393	1.617	50	0		CDAARO
C[C@@H]([NH2+]CCNS(=O)(=O)c1ccccc1)[C@H]1CCCO1	ZINC000097108751	357984358	/nfs/dbraw/zinc/98/43/58/357984358.db2.gz	LYQBXOXWASLSHF-TZMCWYRMSA-N	1	0	298.408	1.122	50	0		CDAARO
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[N@H+](C)CC1	ZINC000097109704	357984756	/nfs/dbraw/zinc/98/47/56/357984756.db2.gz	VRXBYAYJWNKVCI-NSHDSACASA-N	1	0	285.388	1.064	50	0		CDAARO
CC[C@@H](CO)N1CCN(c2nccnc2OC(C)C)CC1	ZINC000097140735	357995644	/nfs/dbraw/zinc/99/56/44/357995644.db2.gz	SDBLXXKJAZPZKM-ZDUSSCGKSA-N	1	0	294.399	1.157	50	0		CDAARO
OCC[NH+]1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000019606790	358106895	/nfs/dbraw/zinc/10/68/95/358106895.db2.gz	FKKUSABLFDJVKR-UHFFFAOYSA-N	1	0	288.313	1.815	50	0		CDAARO
Cc1nccn1CCCCNC(=O)c1ccc(O)cc1O	ZINC000097059441	358138566	/nfs/dbraw/zinc/13/85/66/358138566.db2.gz	FRICLXIUKLHAGQ-UHFFFAOYSA-N	1	0	289.335	1.813	50	0		CDAARO
O=C(NCc1ccc(C[NH+]2CCCC2)cc1)c1cn[nH]n1	ZINC000193719030	358319531	/nfs/dbraw/zinc/31/95/31/358319531.db2.gz	ZHWLBXORQVZPLU-UHFFFAOYSA-N	1	0	285.351	1.331	50	0		CDAARO
COc1cccc([C@H](C[NH2+]CC(=O)NC(C)C)N(C)C)c1	ZINC000020070526	358321027	/nfs/dbraw/zinc/32/10/27/358321027.db2.gz	MCDIFBWQRPZJFQ-HNNXBMFYSA-N	1	0	293.411	1.412	50	0		CDAARO
C[C@H]([NH2+][C@H]1CCN(c2ccccc2)C1=O)[C@@H]1CCCO1	ZINC000195560762	358564358	/nfs/dbraw/zinc/56/43/58/358564358.db2.gz	IDYYTJXAGAFCHE-QEJZJMRPSA-N	1	0	274.364	1.949	50	0		CDAARO
C[C@H](O)C[NH2+]CCNCc1cccc2ccccc21	ZINC000095098705	358678454	/nfs/dbraw/zinc/67/84/54/358678454.db2.gz	ARHZSUTUKFGWGB-ZDUSSCGKSA-N	1	0	258.365	1.900	50	0		CDAARO
CN(Cc1ccc2nonc2c1)C(=O)C[C@H]1CCC[N@@H+]1C	ZINC000097522555	358781627	/nfs/dbraw/zinc/78/16/27/358781627.db2.gz	PVLVAEWMCWSMSI-GFCCVEGCSA-N	1	0	288.351	1.666	50	0		CDAARO
C[NH+](C)[C@H]1CN(Cc2ccc(F)cc2Cl)C[C@@H]1O	ZINC000097660523	358791008	/nfs/dbraw/zinc/79/10/08/358791008.db2.gz	DAERVMLOCSWLSO-STQMWFEESA-N	1	0	272.751	1.586	50	0		CDAARO
CCc1ccc(CN2C[C@H](O)[C@@H]([NH+]3CCCC3)C2)nc1	ZINC000214952972	358864476	/nfs/dbraw/zinc/86/44/76/358864476.db2.gz	ANGMKZRSHKFSPQ-HOTGVXAUSA-N	1	0	275.396	1.285	50	0		CDAARO
CN(CCc1ccccn1)c1cc(C2CC([NH3+])C2)nc(N)n1	ZINC000219073706	359077794	/nfs/dbraw/zinc/07/77/94/359077794.db2.gz	YDMDOJNXJVDPMP-UHFFFAOYSA-N	1	0	298.394	1.337	50	0		CDAARO
C[NH+](C)[C@H]1[C@@H]2CC[C@H]1CN(C(=O)c1ccc3nccn3c1)C2	ZINC000219912220	359137325	/nfs/dbraw/zinc/13/73/25/359137325.db2.gz	INBKPMLYZHHBFW-VIKVFOODSA-N	1	0	298.390	1.747	50	0		CDAARO
C[C@@H](c1ccncn1)N(C)C(=O)C[N@H+](C)C1CCCC1	ZINC000223153468	359404076	/nfs/dbraw/zinc/40/40/76/359404076.db2.gz	UILDBPJOLLNSJG-LBPRGKRZSA-N	1	0	276.384	1.870	50	0		CDAARO
CC(C)[NH+]1CCN(CCCN(C)Cc2ncc[nH]2)CC1	ZINC000408518982	359911851	/nfs/dbraw/zinc/91/18/51/359911851.db2.gz	PFYBDJOWSMGKAJ-UHFFFAOYSA-N	1	0	279.432	1.258	50	0		CDAARO
Cc1nnc([C@@H](C)N2CCCC[C@H]2Cn2cncn2)o1	ZINC000257365803	359946447	/nfs/dbraw/zinc/94/64/47/359946447.db2.gz	OTAKOOIBMYMHGI-PWSUYJOCSA-N	1	0	276.344	1.585	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1ccccc1OC	ZINC000033834817	360216572	/nfs/dbraw/zinc/21/65/72/360216572.db2.gz	UHCGCOWDMZJDOC-LBPRGKRZSA-N	1	0	262.353	1.909	50	0		CDAARO
CC[C@@]1(O)CCOC2(CC[NH+](Cc3cnn(C)c3)CC2)C1	ZINC000409419920	360227503	/nfs/dbraw/zinc/22/75/03/360227503.db2.gz	RXQARLTUTUDDSS-OAHLLOKOSA-N	1	0	293.411	1.706	50	0		CDAARO
Cn1ccnc1C(=O)N1CCC(CC2CC2)([NH+](C)C)CC1	ZINC000409421402	360230121	/nfs/dbraw/zinc/23/01/21/360230121.db2.gz	KEKSHRFVEGXRPJ-UHFFFAOYSA-N	1	0	290.411	1.757	50	0		CDAARO
CC(C)(C(=O)NCCCOc1cccnc1)[NH+]1CCCC1	ZINC000426489562	360570239	/nfs/dbraw/zinc/57/02/39/360570239.db2.gz	BNVCWUNFNGWDDJ-UHFFFAOYSA-N	1	0	291.395	1.841	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CC(=O)N1CC(c2ccncc2)C1	ZINC000426399018	360663246	/nfs/dbraw/zinc/66/32/46/360663246.db2.gz	KQKAPHKPNKWFIW-HNNXBMFYSA-N	1	0	273.380	1.882	50	0		CDAARO
Cc1c(N)ncnc1-c1ccc(N2CC[NH2+]CC2)cc1	ZINC000426395997	360663929	/nfs/dbraw/zinc/66/39/29/360663929.db2.gz	RYJBWMYSIPOIRQ-UHFFFAOYSA-N	1	0	269.352	1.274	50	0		CDAARO
Cn1nccc1CSc1nnc(C2CC[NH2+]CC2)n1C	ZINC000426412329	360666112	/nfs/dbraw/zinc/66/61/12/360666112.db2.gz	CZWZSSJICLMRIH-UHFFFAOYSA-N	1	0	292.412	1.308	50	0		CDAARO
C[NH2+]Cc1nnc(SC[C@H](O)c2ccccc2)n1C	ZINC000426711961	360698904	/nfs/dbraw/zinc/69/89/04/360698904.db2.gz	BPNGVNCBADWIGL-NSHDSACASA-N	1	0	278.381	1.360	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)/C=C/c2ccc3c(c2)CCO3)C1	ZINC000178997311	189160501	/nfs/dbraw/zinc/16/05/01/189160501.db2.gz	HLDPLAFFVBHGKT-KQIUPUNMSA-N	1	0	286.375	1.703	50	0		CDAARO
Cc1cc(C(=O)N2CC[N@@H+]3CCC[C@@H]3C2)cc(=O)[nH]1	ZINC000180285296	189248763	/nfs/dbraw/zinc/24/87/63/189248763.db2.gz	ZSHVJXATQYMCPJ-GFCCVEGCSA-N	1	0	261.325	1.016	50	0		CDAARO
Cc1ccc(S(=O)(=O)N(C)C2CC[NH2+]CC2)cc1F	ZINC000036300083	361491358	/nfs/dbraw/zinc/49/13/58/361491358.db2.gz	FRBWVNKQCBIMGI-UHFFFAOYSA-N	1	0	286.372	1.507	50	0		CDAARO
O=C(c1ccc(F)c(F)c1F)N1CCC[NH2+]CC1	ZINC000019679994	364079989	/nfs/dbraw/zinc/07/99/89/364079989.db2.gz	LATRNFMBVGMHBB-UHFFFAOYSA-N	1	0	258.243	1.539	50	0		CDAARO
CC[N@@H+]1CC[C@@H](N(C)Cc2c[nH]c(C(=O)OC)c2)[C@H](C)C1	ZINC000093639463	364440068	/nfs/dbraw/zinc/44/00/68/364440068.db2.gz	KQLCPLWCBAMGBO-IUODEOHRSA-N	1	0	293.411	1.963	50	0		CDAARO
Cn1cc(C[NH2+][C@@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000035009558	364614511	/nfs/dbraw/zinc/61/45/11/364614511.db2.gz	WEEJQZNWSNFNGV-MRXNPFEDSA-N	1	0	270.380	1.784	50	0		CDAARO
COC[C@H](C)[NH2+]Cc1cc(OC)c(OC)cc1OC	ZINC000004685526	364814469	/nfs/dbraw/zinc/81/44/69/364814469.db2.gz	HOSKYBXXSQYAGF-JTQLQIEISA-N	1	0	269.341	1.837	50	0		CDAARO
Cc1cccc(S(=O)(=O)N2CCC[C@@H]([NH3+])C2)c1F	ZINC000193224708	189637635	/nfs/dbraw/zinc/63/76/35/189637635.db2.gz	QPQJKDKEYKCXIH-SNVBAGLBSA-N	1	0	272.345	1.246	50	0		CDAARO
CCc1cccc(S(=O)(=O)N[C@@H]2CCC[NH2+][C@@H]2C)c1	ZINC000193454364	189643553	/nfs/dbraw/zinc/64/35/53/189643553.db2.gz	LWXQGQWHZHHIOO-BXUZGUMPSA-N	1	0	282.409	1.668	50	0		CDAARO
C[N@H+](CCNC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)C1CC1	ZINC000089917523	366966377	/nfs/dbraw/zinc/96/63/77/366966377.db2.gz	SWCPTBHNEWPFRO-XQQFMLRXSA-N	1	0	281.400	1.193	50	0		CDAARO
CCCCNc1cc(N2CCO[C@H](COC)C2)nc(N)n1	ZINC000252484482	367568146	/nfs/dbraw/zinc/56/81/46/367568146.db2.gz	FXMLSGVYCIZGJE-NSHDSACASA-N	1	0	295.387	1.122	50	0		CDAARO
CCN(CCC[NH+]1CCCC1)C(=O)c1cccc(=O)[nH]1	ZINC000286389165	368810928	/nfs/dbraw/zinc/81/09/28/368810928.db2.gz	CSKAMGJWWYZJQY-UHFFFAOYSA-N	1	0	277.368	1.735	50	0		CDAARO
O=C(Cc1cccnc1)N1CCC([C@@H]2CC[NH2+]C2)CC1	ZINC000290065301	369772390	/nfs/dbraw/zinc/77/23/90/369772390.db2.gz	HXHGECYLGYBLCQ-OAHLLOKOSA-N	1	0	273.380	1.472	50	0		CDAARO
O=C(NC1CC[NH2+]CC1)c1ccc(Br)cc1	ZINC000003110864	372352753	/nfs/dbraw/zinc/35/27/53/372352753.db2.gz	YDRDRXRPLQKACJ-UHFFFAOYSA-N	1	0	283.169	1.931	50	0		CDAARO
C[NH+]1CCN([C@H]2CCN(C(=O)Cc3ccsc3)C2)CC1	ZINC000299759737	372747397	/nfs/dbraw/zinc/74/73/97/372747397.db2.gz	RAECCSKRTOZUBK-AWEZNQCLSA-N	1	0	293.436	1.139	50	0		CDAARO
Cc1ncsc1CCCNC(=O)[C@@H]([NH3+])C(C)(C)C	ZINC000299764811	372749079	/nfs/dbraw/zinc/74/90/79/372749079.db2.gz	MEOLVIWQTHJUAX-LLVKDONJSA-N	1	0	269.414	1.874	50	0		CDAARO
CO[C@H]1CC[C@@]2(OC)CC[N@H+](Cc3ncc[nH]3)[C@H]2C1	ZINC000299785519	372761801	/nfs/dbraw/zinc/76/18/01/372761801.db2.gz	TWGKBZIUHHKOMK-SGMGOOAPSA-N	1	0	265.357	1.568	50	0		CDAARO
O[C@]1(C[NH2+][C@H]2CCN(Cc3ccccc3)C2)CCSC1	ZINC000107515688	412800349	/nfs/dbraw/zinc/80/03/49/412800349.db2.gz	VKTZYAJZIOAOCW-HOTGVXAUSA-N	1	0	292.448	1.719	50	0		CDAARO
COc1cncc(/C=C/CC[N@H+](C)CCCO)c1	ZINC000582000225	373489539	/nfs/dbraw/zinc/48/95/39/373489539.db2.gz	DIYJVJFJNXANMW-ZZXKWVIFSA-N	1	0	250.342	1.808	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)Cc2cccc(Cl)c2)C[C@H]1CO	ZINC000253408599	373711612	/nfs/dbraw/zinc/71/16/12/373711612.db2.gz	KWUSJLIFRHXDKS-GXTWGEPZSA-N	1	0	296.798	1.263	50	0		CDAARO
Cc1ccccc1[C@@H]1C[C@@H]1C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000246568996	189929627	/nfs/dbraw/zinc/92/96/27/189929627.db2.gz	BHEQMCGDGXCKAM-QEJZJMRPSA-N	1	0	258.365	1.906	50	0		CDAARO
CC1(C)CCCN1C(=O)NCC[N@@H+]1CCCOCC1	ZINC000253426358	373734547	/nfs/dbraw/zinc/73/45/47/373734547.db2.gz	ZMEUSBSDLLQIAI-UHFFFAOYSA-N	1	0	269.389	1.293	50	0		CDAARO
COCC[NH+]1CCN(C/C=C\c2ccccc2)CC1	ZINC000103342265	373960072	/nfs/dbraw/zinc/96/00/72/373960072.db2.gz	JDWUFWHBBLRTRQ-YVMONPNESA-N	1	0	260.381	1.964	50	0		CDAARO
COc1ccc(S(=O)(=O)N2CCC[C@@H]([C@@H](C)[NH3+])C2)cc1	ZINC000111713144	374201545	/nfs/dbraw/zinc/20/15/45/374201545.db2.gz	DQMSATPTOWMMNV-VXGBXAGGSA-N	1	0	298.408	1.443	50	0		CDAARO
Cc1ccccc1CSCC(=O)NC[C@]1(O)CC[NH2+]C1	ZINC000252494853	189977829	/nfs/dbraw/zinc/97/78/29/189977829.db2.gz	OGQISZJDDGBKGO-HNNXBMFYSA-N	1	0	294.420	1.069	50	0		CDAARO
OCCC1([NH2+]Cc2ccc(F)c(F)c2)CCOCC1	ZINC000095416743	374917798	/nfs/dbraw/zinc/91/77/98/374917798.db2.gz	LNNYRSDTTOALGM-UHFFFAOYSA-N	1	0	271.307	1.986	50	0		CDAARO
NC(=O)C1(C[NH2+]C2CCCCCCC2)CCOCC1	ZINC000095420242	374920970	/nfs/dbraw/zinc/92/09/70/374920970.db2.gz	SZVNBLRFVCJOPG-UHFFFAOYSA-N	1	0	268.401	1.971	50	0		CDAARO
CC(C)(C)OCCC[N@@H+]1CC[C@H](CN2CCOCC2)C1	ZINC000095410508	374912938	/nfs/dbraw/zinc/91/29/38/374912938.db2.gz	BYOHIKKESOOZNK-HNNXBMFYSA-N	1	0	284.444	1.846	50	0		CDAARO
C[C@@H](CCc1ccc(O)cc1)[NH2+]CC(=O)N1CCOCC1	ZINC000097085167	375146630	/nfs/dbraw/zinc/14/66/30/375146630.db2.gz	OWYFOXSAVVXHKV-ZDUSSCGKSA-N	1	0	292.379	1.162	50	0		CDAARO
C[C@H](CCNC(=O)N1CCC[C@H](O)C1)[NH+]1CCCCC1	ZINC000097108164	375148655	/nfs/dbraw/zinc/14/86/55/375148655.db2.gz	XKZYTXHJPVWKCQ-KGLIPLIRSA-N	1	0	283.416	1.417	50	0		CDAARO
COCCC[NH2+]C[C@H](O)COc1ccc(C)cc1	ZINC000002646762	375285895	/nfs/dbraw/zinc/28/58/95/375285895.db2.gz	KEQGARUODFIGHT-ZDUSSCGKSA-N	1	0	253.342	1.361	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)/C=C\c2c(F)cccc2F)C1	ZINC000493287289	375434542	/nfs/dbraw/zinc/43/45/42/375434542.db2.gz	BZAJKQZYFPENSF-WBSSQXGSSA-N	1	0	252.264	1.538	50	0		CDAARO
Cc1cc(S(=O)(=O)N2CC[C@H]3C[NH2+]C[C@H]32)c(C)s1	ZINC000036265608	375819508	/nfs/dbraw/zinc/81/95/08/375819508.db2.gz	TXVQXKPLJTXTDO-WDEREUQCSA-N	1	0	286.422	1.347	50	0		CDAARO
CCn1nc(C[NH2+][C@H]2CCNC(=O)CC2)c2ccccc21	ZINC000396749440	375829945	/nfs/dbraw/zinc/82/99/45/375829945.db2.gz	PCNFMZUADDYYFI-GFCCVEGCSA-N	1	0	286.379	1.815	50	0		CDAARO
C[N@H+](CCN1CCOC1=O)[C@@H]1Cc2ccccc2[C@H]1O	ZINC000241590507	376019775	/nfs/dbraw/zinc/01/97/75/376019775.db2.gz	PFKVXLHPNBMHBA-ZIAGYGMSSA-N	1	0	276.336	1.029	50	0		CDAARO
C[C@H](NC(=O)N[C@@H]1CCCC[C@H]1CO)C(C)(C)C[NH+](C)C	ZINC000246340550	376634285	/nfs/dbraw/zinc/63/42/85/376634285.db2.gz	OKKCTEDQBMDOSK-MELADBBJSA-N	1	0	299.459	1.813	50	0		CDAARO
O=C(c1n[nH]c2c1C[NH2+]CC2)N1CCCc2ccccc21	ZINC000042783813	284596975	/nfs/dbraw/zinc/59/69/75/284596975.db2.gz	FMLCALSTIRSVGN-UHFFFAOYSA-N	1	0	282.347	1.648	50	0		CDAARO
CC[NH+](CC)[C@H](CNc1ccc2nnnn2n1)CC(C)C	ZINC000012734668	377538369	/nfs/dbraw/zinc/53/83/69/377538369.db2.gz	VPSTZXCQWKJHEP-LBPRGKRZSA-N	1	0	291.403	1.688	50	0		CDAARO
C[N@@H+]1CCC[C@H](CNC(=O)c2cnc3ccccc3n2)C1	ZINC000170981313	378073758	/nfs/dbraw/zinc/07/37/58/378073758.db2.gz	NTATWGMGUYWZGN-GFCCVEGCSA-N	1	0	284.363	1.701	50	0		CDAARO
CC[NH+](CC)C[C@]1(O)CCCN(CC(C)(C)C)C1=O	ZINC000012751815	378665483	/nfs/dbraw/zinc/66/54/83/378665483.db2.gz	LFDDIBNWWGKNDC-OAHLLOKOSA-N	1	0	270.417	1.728	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](NC(=O)c2cccc(-c3ncc[nH]3)c2)C1	ZINC000071405623	379587638	/nfs/dbraw/zinc/58/76/38/379587638.db2.gz	SWMFNGTZABULTQ-CHWSQXEVSA-N	1	0	270.336	1.686	50	0		CDAARO
C[C@H]1COC2(CC[NH+](CCC(=O)NC(C)(C)C)CC2)O1	ZINC000096414910	256765322	/nfs/dbraw/zinc/76/53/22/256765322.db2.gz	VMBZJOQTVWESPD-LBPRGKRZSA-N	1	0	284.400	1.519	50	0		CDAARO
Cc1cccc(C(=O)N2CCC(OCCC[NH3+])CC2)c1	ZINC000094070868	184753722	/nfs/dbraw/zinc/75/37/22/184753722.db2.gz	GFRJDHGJCWHMEL-UHFFFAOYSA-N	1	0	276.380	1.965	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)Cc2ccc(F)c(F)c2)C1	ZINC000095045479	184922994	/nfs/dbraw/zinc/92/29/94/184922994.db2.gz	JRDCQEUGNIRSEV-JTQLQIEISA-N	1	0	254.280	1.315	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)c2cn3cc(Cl)ccc3n2)CC1	ZINC000072144152	390240820	/nfs/dbraw/zinc/24/08/20/390240820.db2.gz	MEWKPAGCPBSYST-LLVKDONJSA-N	1	0	292.770	1.941	50	0		CDAARO
O=C1NC(=O)[C@]2(CCC[N@H+](Cc3ccccc3)C2)N1	ZINC000037325818	390413241	/nfs/dbraw/zinc/41/32/41/390413241.db2.gz	CRGSUMHEXUMJFZ-CQSZACIVSA-N	1	0	259.309	1.701	50	0		CDAARO
CNc1ccc(C(=O)N2CC[C@]3(C2)CCC[NH2+]C3)cc1	ZINC000067741267	390576162	/nfs/dbraw/zinc/57/61/62/390576162.db2.gz	XEAOVDSVYDQJQE-MRXNPFEDSA-N	1	0	273.380	1.944	50	0		CDAARO
CC1=C[C@H](C)[C@@H]2C(=O)N(c3ccc[n+](C)c3)C(=O)[C@@H]2C1	ZINC000086001051	390864755	/nfs/dbraw/zinc/86/47/55/390864755.db2.gz	UYHYCNHHAGZKQZ-YUTCNCBUSA-N	1	0	271.340	1.603	50	0		CDAARO
CC(C)[C@H](O)C[NH2+][C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000123922655	390912535	/nfs/dbraw/zinc/91/25/35/390912535.db2.gz	PQFLYWSABRDLHG-SWLSCSKDSA-N	1	0	274.368	1.935	50	0		CDAARO
CCCc1nnc(NC[C@H]2CN(C)CCO2)s1	ZINC000152338595	391364476	/nfs/dbraw/zinc/36/44/76/391364476.db2.gz	LZPZBKBWBMCQTO-VIFPVBQESA-N	1	0	256.375	1.233	50	0		CDAARO
CC[NH+](CC)CC(=O)N[C@H](C(=O)OC)C(C)(C)C	ZINC000096417867	391484177	/nfs/dbraw/zinc/48/41/77/391484177.db2.gz	ZQQCCUMGZQLDMQ-LLVKDONJSA-N	1	0	258.362	1.032	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@H]([N@@H+]2CC[C@H](CCO)C2)C1	ZINC000259868097	391510494	/nfs/dbraw/zinc/51/04/94/391510494.db2.gz	MYACVXPGFGZZNB-CHWSQXEVSA-N	1	0	284.400	1.700	50	0		CDAARO
CN(C)c1cccc(C(=O)N(C)C2CC[NH+](C)CC2)c1	ZINC000033019514	391971739	/nfs/dbraw/zinc/97/17/39/391971739.db2.gz	BFJYWPFWYNTOQP-UHFFFAOYSA-N	1	0	275.396	1.919	50	0		CDAARO
COCCNC(=O)[C@@H]1CC[C@H](C)[N@H+](Cc2cccnc2)C1	ZINC000096403444	393178464	/nfs/dbraw/zinc/17/84/64/393178464.db2.gz	HRAOFMBZFWIFNZ-DZGCQCFKSA-N	1	0	291.395	1.445	50	0		CDAARO
CC(C)N1CC[C@@H](N2CC[NH+]([C@H]3CCSC3)CC2)C1=O	ZINC000095413187	393147981	/nfs/dbraw/zinc/14/79/81/393147981.db2.gz	UEFYFJSKNHXYFR-UONOGXRCSA-N	1	0	297.468	1.119	50	0		CDAARO
COCc1nc(C)cc(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)n1	ZINC000240555621	140263146	/nfs/dbraw/zinc/26/31/46/140263146.db2.gz	GWQJRYQPRPJXTE-STQMWFEESA-N	1	0	276.384	1.970	50	0		CDAARO
COc1ccc(OCCC[NH3+])c(C(=O)N(C)C(C)C)c1	ZINC000299799085	286345909	/nfs/dbraw/zinc/34/59/09/286345909.db2.gz	VDGLZBYBMSTDMF-UHFFFAOYSA-N	1	0	280.368	1.903	50	0		CDAARO
COCCCNC(=O)C[N@@H+]1[C@H](C)C[C@H]2CCCC[C@H]21	ZINC000247474399	292357733	/nfs/dbraw/zinc/35/77/33/292357733.db2.gz	JOAGZIFPDGPINK-MGPQQGTHSA-N	1	0	268.401	1.792	50	0		CDAARO
O=C1OCC[C@@H]1C1(O)CC[NH+](Cc2ccccc2)CC1	ZINC000004794410	170018507	/nfs/dbraw/zinc/01/85/07/170018507.db2.gz	LSABJPIDIAERGU-AWEZNQCLSA-N	1	0	275.348	1.577	50	0		CDAARO
CC(CO)(CO)[NH2+]Cc1ccc(Cl)cc1Cl	ZINC000005902524	170152609	/nfs/dbraw/zinc/15/26/09/170152609.db2.gz	IPTQQFKHDVTKBT-UHFFFAOYSA-N	1	0	264.152	1.826	50	0		CDAARO
COc1ccc(CCC(=O)N2CCC[N@H+](C)CC2)cc1	ZINC000006730771	170235102	/nfs/dbraw/zinc/23/51/02/170235102.db2.gz	UOFUMNWXAWHQHL-UHFFFAOYSA-N	1	0	276.380	1.792	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)Cc2ccccc2F)CC1	ZINC000006731172	170235519	/nfs/dbraw/zinc/23/55/19/170235519.db2.gz	XLLLLROEDACPGP-UHFFFAOYSA-N	1	0	250.317	1.532	50	0		CDAARO
Cn1ncc(Cl)c1C(=O)NCC[NH+]1CCCCC1	ZINC000006731414	170235534	/nfs/dbraw/zinc/23/55/34/170235534.db2.gz	AZULLFDBEQKOJS-UHFFFAOYSA-N	1	0	270.764	1.289	50	0		CDAARO
CCOc1cccc(C(=O)N2CCC[N@H+](C)CC2)c1	ZINC000006742277	170238055	/nfs/dbraw/zinc/23/80/55/170238055.db2.gz	CSJODOLFACJFGN-UHFFFAOYSA-N	1	0	262.353	1.863	50	0		CDAARO
Cc1ccccc1C[N@@H+](C)[C@H](C)C(=O)N1CCNC1=O	ZINC000007681059	170297167	/nfs/dbraw/zinc/29/71/67/170297167.db2.gz	VFFYFBNAJYXQBW-GFCCVEGCSA-N	1	0	275.352	1.367	50	0		CDAARO
[NH3+]C[C@@H](c1ccco1)S(=O)(=O)c1ccc(F)cc1	ZINC000008031065	170315071	/nfs/dbraw/zinc/31/50/71/170315071.db2.gz	URJQPAUTQSLYPA-LBPRGKRZSA-N	1	0	269.297	1.892	50	0		CDAARO
Cc1cc(OC[C@H](O)CN2CC[NH2+]CC2)ccc1Cl	ZINC000019668822	170835215	/nfs/dbraw/zinc/83/52/15/170835215.db2.gz	QMRKKKCMCLNBJV-GFCCVEGCSA-N	1	0	284.787	1.293	50	0		CDAARO
Brc1ccccc1OCCN1CC[NH2+]CC1	ZINC000020267767	171123896	/nfs/dbraw/zinc/12/38/96/171123896.db2.gz	WIXATDRNTOHVOD-UHFFFAOYSA-N	1	0	285.185	1.733	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)Nc2nccs2)CC1	ZINC000020595197	171263933	/nfs/dbraw/zinc/26/39/33/171263933.db2.gz	RWBXIWGLJMTHNL-UHFFFAOYSA-N	1	0	268.386	1.109	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)Nc2cccc(C)c2)CC1	ZINC000020595169	171264110	/nfs/dbraw/zinc/26/41/10/171264110.db2.gz	HVIIWQBGWHUZRD-UHFFFAOYSA-N	1	0	275.396	1.961	50	0		CDAARO
C[NH+]1CCN(CCCNC(=O)c2cccc(Cl)c2)CC1	ZINC000020819548	171273744	/nfs/dbraw/zinc/27/37/44/171273744.db2.gz	UYOXKXUXFHOHBS-UHFFFAOYSA-N	1	0	295.814	1.707	50	0		CDAARO
C[C@H](CCc1ccccc1)[NH+]1CCN(CCO)CC1	ZINC000022045046	171350522	/nfs/dbraw/zinc/35/05/22/171350522.db2.gz	YRFPLIZPAQGWFA-OAHLLOKOSA-N	1	0	262.397	1.618	50	0		CDAARO
CCCn1nccc1C(=O)NCC[NH+](CC)CC	ZINC000028222527	171551070	/nfs/dbraw/zinc/55/10/70/171551070.db2.gz	UUKDVBKBELZMNT-UHFFFAOYSA-N	1	0	252.362	1.365	50	0		CDAARO
CCNC(=O)N1CCCC2(CC[NH+](C)CC2)CC1	ZINC000067673848	175782391	/nfs/dbraw/zinc/78/23/91/175782391.db2.gz	BTSIYRBNCCHGSW-UHFFFAOYSA-N	1	0	253.390	1.914	50	0		CDAARO
CCCOC[C@H]1CCN(Cc2cc3n(n2)CCC[NH2+]C3)C1	ZINC000072146255	176325047	/nfs/dbraw/zinc/32/50/47/176325047.db2.gz	GACIHZMKKKFYTL-AWEZNQCLSA-N	1	0	292.427	1.625	50	0		CDAARO
CCc1ccc(CN2CCOC[C@H](C[NH+](C)C)C2)nc1	ZINC000072156308	176328622	/nfs/dbraw/zinc/32/86/22/176328622.db2.gz	VGHUQYKTXZQCHA-OAHLLOKOSA-N	1	0	277.412	1.654	50	0		CDAARO
CN(Cc1nc2cc(F)ccc2[nH]1)C[C@]1(O)CCC[NH2+]C1	ZINC000077322593	177253062	/nfs/dbraw/zinc/25/30/62/177253062.db2.gz	PAEXSTJWCYBDJZ-HNNXBMFYSA-N	1	0	292.358	1.248	50	0		CDAARO
CCCCc1ccc(CN2C[C@H]([NH3+])C[C@H]2C(=O)NC)s1	ZINC000077376380	177260217	/nfs/dbraw/zinc/26/02/17/177260217.db2.gz	AHEPTHWFGBLJKE-RISCZKNCSA-N	1	0	295.452	1.738	50	0		CDAARO
O[C@H]1COCC[N@H+](Cc2ccc(-c3cc[nH]n3)s2)C1	ZINC000077379687	177260686	/nfs/dbraw/zinc/26/06/86/177260686.db2.gz	HXFUZYZAXKJWSY-SNVBAGLBSA-N	1	0	279.365	1.331	50	0		CDAARO
CC[NH+](CC)[C@H](C)CNC(=O)N[C@@H]1CCCSC1	ZINC000096452321	262515787	/nfs/dbraw/zinc/51/57/87/262515787.db2.gz	JLMYIMPARLBPPZ-VXGBXAGGSA-N	1	0	273.446	1.912	50	0		CDAARO
C[NH+](C)CCN1C(=O)C[C@H]2Sc3ccccc3N=C21	ZINC000020030889	273795696	/nfs/dbraw/zinc/79/56/96/273795696.db2.gz	OAIXWUCWUDXCDX-GFCCVEGCSA-N	1	0	275.377	1.985	50	0		CDAARO
C[NH+]1CCC(N2CCC[C@@H](NC(=O)c3ccco3)C2)CC1	ZINC000011842608	277027246	/nfs/dbraw/zinc/02/72/46/277027246.db2.gz	MOPMUDJVYWNDED-CYBMUJFWSA-N	1	0	291.395	1.568	50	0		CDAARO
CC(C)C[C@H](C[NH3+])NS(=O)(=O)N(C)C1CCCCC1	ZINC000111829877	279141639	/nfs/dbraw/zinc/14/16/39/279141639.db2.gz	ZUGBBWPTYCMJNJ-GFCCVEGCSA-N	1	0	291.461	1.459	50	0		CDAARO
O=C1CC2(CC[NH+](Cc3ccccc3)CC2)CC(=O)N1	ZINC000001705548	280248854	/nfs/dbraw/zinc/24/88/54/280248854.db2.gz	MZOUQZZYZKEBKL-UHFFFAOYSA-N	1	0	272.348	1.705	50	0		CDAARO
Cc1cc(C)n2nc(C(=O)N3[C@@H]4CC[C@H]3C[NH2+]CC4)cc2n1	ZINC000097694699	280452216	/nfs/dbraw/zinc/45/22/16/280452216.db2.gz	SCXHSSSFYXPNJD-OLZOCXBDSA-N	1	0	299.378	1.313	50	0		CDAARO
CC1(C)CCC[C@@H]([NH2+]C2CCN(S(C)(=O)=O)CC2)C1	ZINC000067846906	281012112	/nfs/dbraw/zinc/01/21/12/281012112.db2.gz	QUWBTSVIOZKVMZ-CYBMUJFWSA-N	1	0	288.457	1.969	50	0		CDAARO
Cc1c(C(=O)N(CC[NH+](C)C)C[C@H]2CCCO2)ccn1C	ZINC000195245086	300914668	/nfs/dbraw/zinc/91/46/68/300914668.db2.gz	YZFZVPSAHGYCQH-CQSZACIVSA-N	1	0	293.411	1.516	50	0		CDAARO
Cc1c[nH]c(CN(C)C(=O)NCC2([NH+](C)C)CCCC2)n1	ZINC000534588163	328316608	/nfs/dbraw/zinc/31/66/08/328316608.db2.gz	BFPBYNXMEUWTHE-UHFFFAOYSA-N	1	0	293.415	1.734	50	0		CDAARO
Cc1cccc([C@@H](CNC(=O)c2cn[nH]c2)[NH+](C)C)c1	ZINC000534592240	328318629	/nfs/dbraw/zinc/31/86/29/328318629.db2.gz	NODQIWFJVFTYOI-CQSZACIVSA-N	1	0	272.352	1.751	50	0		CDAARO
COc1cccc(-c2cc(CNC(=O)[C@H]3C=CC[NH2+]3)no2)c1	ZINC000534645493	328330850	/nfs/dbraw/zinc/33/08/50/328330850.db2.gz	YYCMBCIMSBXXTP-CQSZACIVSA-N	1	0	299.330	1.494	50	0		CDAARO
C[C@@H](C[NH+]1CCCCC1)C(=O)NCCc1ncc[nH]1	ZINC000534636205	328333804	/nfs/dbraw/zinc/33/38/04/328333804.db2.gz	OMSRGHUTQYTWKS-LBPRGKRZSA-N	1	0	264.373	1.190	50	0		CDAARO
CCCc1nc(C[NH2+][C@@H]2CCNC(=O)CC2)cs1	ZINC000534640837	328335930	/nfs/dbraw/zinc/33/59/30/328335930.db2.gz	OILHCIWKSVLWOJ-JTQLQIEISA-N	1	0	267.398	1.854	50	0		CDAARO
Cc1ccccc1[C@H](CNC(=O)C1(C)COC1)[NH+](C)C	ZINC000534654315	328338782	/nfs/dbraw/zinc/33/87/82/328338782.db2.gz	MUCQXEDJWHCHFF-AWEZNQCLSA-N	1	0	276.380	1.750	50	0		CDAARO
O=C(NCCc1nccc(-c2ccccc2)n1)[C@H]1C=CC[NH2+]1	ZINC000534667753	328346033	/nfs/dbraw/zinc/34/60/33/328346033.db2.gz	IDZHJSXQTJIJHZ-OAHLLOKOSA-N	1	0	294.358	1.330	50	0		CDAARO
Cc1ccn2nc(C(=O)N3CCC[C@@H]([NH3+])C3)cc2c1	ZINC000534662455	328350429	/nfs/dbraw/zinc/35/04/29/328350429.db2.gz	BRZDWAPSISNBHG-LLVKDONJSA-N	1	0	258.325	1.206	50	0		CDAARO
C[C@H](CCn1cccn1)[NH2+]Cc1nnc2ccccn21	ZINC000097376796	323208312	/nfs/dbraw/zinc/20/83/12/323208312.db2.gz	GQKJLTMDMTYQJY-GFCCVEGCSA-N	1	0	270.340	1.494	50	0		CDAARO
COc1ccc2c(c1)C[C@H]([NH2+]CCn1cncn1)CC2	ZINC000382035638	328450586	/nfs/dbraw/zinc/45/05/86/328450586.db2.gz	SXFAMCMREFOWAR-CQSZACIVSA-N	1	0	272.352	1.434	50	0		CDAARO
O=C([O-])CC[C@@]12C[NH2+]C[C@H]1CN(Cc1ccsc1)C2	ZINC001772700510	1159436671	/nfs/dbraw/zinc/43/66/71/1159436671.db2.gz	FXJQHCWEJKENTJ-JSGCOSHPSA-N	1	0	280.393	1.634	50	0		CDAARO
C[C@H](C[NH2+]C(C1CC1)C1CC1)N1CCOC[C@@H]1C	ZINC000108115193	482449899	/nfs/dbraw/zinc/44/98/99/482449899.db2.gz	QABMJDGBHGTZNB-NEPJUHHUSA-N	1	0	252.402	1.874	50	0		CDAARO
CC(C)(C)[C@@H](Cn1ccnc1)NC(=O)CCn1cncn1	ZINC000670434628	482970173	/nfs/dbraw/zinc/97/01/73/482970173.db2.gz	NZJMGIKYMDOPTF-GFCCVEGCSA-N	1	0	290.371	1.096	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CCc2noc(C3CC3)n2)n1	ZINC000670442285	482990264	/nfs/dbraw/zinc/99/02/64/482990264.db2.gz	GCLSXJDESUOGEY-LLVKDONJSA-N	1	0	289.383	1.981	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](c2ncnn2CC(F)(F)F)C1	ZINC000670444985	482994595	/nfs/dbraw/zinc/99/45/95/482994595.db2.gz	HLHWCAVAIXUAFH-JTQLQIEISA-N	1	0	292.305	1.666	50	0		CDAARO
C[C@H]1CCC[N@H+](CC(=O)NCc2ccc3[nH]cnc3c2)C1	ZINC000670446189	482995778	/nfs/dbraw/zinc/99/57/78/482995778.db2.gz	XFVAFNXYSVUGFH-LBPRGKRZSA-N	1	0	286.379	1.911	50	0		CDAARO
CC(C)[C@@H](CNC(=O)c1cc(O)ccc1N)[NH+]1CCCC1	ZINC000670451318	483013376	/nfs/dbraw/zinc/01/33/76/483013376.db2.gz	BAGREOQKKBONCA-OAHLLOKOSA-N	1	0	291.395	1.825	50	0		CDAARO
O=C(NCCCc1nc2cc(Cl)ccc2[nH]1)[C@@H]1CC[NH2+]1	ZINC000670453895	483023560	/nfs/dbraw/zinc/02/35/60/483023560.db2.gz	LTDKYZLYQPPANU-NSHDSACASA-N	1	0	292.770	1.627	50	0		CDAARO
O=C1N[C@H]2CCC[C@@H]1C[N@H+](CCOCc1ccccc1)C2	ZINC000670456846	483035810	/nfs/dbraw/zinc/03/58/10/483035810.db2.gz	GSQUPMBRQDHAII-CVEARBPZSA-N	1	0	288.391	1.804	50	0		CDAARO
C[NH+](C)CCN1CCN(Cc2ccc(Cl)o2)CCC1=O	ZINC000670457194	483037492	/nfs/dbraw/zinc/03/74/92/483037492.db2.gz	DVQQEUZYNFYCHT-UHFFFAOYSA-N	1	0	299.802	1.529	50	0		CDAARO
COc1ccc2ncn([C@H]3CC[C@@H]([NH3+])CC3)c(=O)c2c1	ZINC000670458835	483040849	/nfs/dbraw/zinc/04/08/49/483040849.db2.gz	QCCLEXYNWDBRKA-PHIMTYICSA-N	1	0	273.336	1.848	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CN(C)Cc2cnc(N)s2)C1	ZINC000670466650	483056855	/nfs/dbraw/zinc/05/68/55/483056855.db2.gz	VTRXNYZEMBHRGK-NSHDSACASA-N	1	0	284.429	1.125	50	0		CDAARO
CCn1ccnc1C[NH2+]CCCNc1ncccn1	ZINC000083474379	483173112	/nfs/dbraw/zinc/17/31/12/483173112.db2.gz	ZAJIHHAFXJIDHM-UHFFFAOYSA-N	1	0	260.345	1.285	50	0		CDAARO
OCc1ccc(C[NH2+]C[C@@H](O)c2ccc(F)cc2F)o1	ZINC000084344262	483272804	/nfs/dbraw/zinc/27/28/04/483272804.db2.gz	YIJAOIWSMFUSFG-CQSZACIVSA-N	1	0	283.274	1.873	50	0		CDAARO
CC[NH+](CC)CCNC(=O)CC1=C2CCCC[C@@H]2NC1=O	ZINC000581793657	1161981118	/nfs/dbraw/zinc/98/11/18/1161981118.db2.gz	OIAIHUITLRXION-AWEZNQCLSA-N	1	0	293.411	1.204	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)c2ccc(OCC3CC3)cc2)C1	ZINC000178546055	527216731	/nfs/dbraw/zinc/21/67/31/527216731.db2.gz	BJZMOVOPVZHKGI-ZDUSSCGKSA-N	1	0	274.364	1.896	50	0		CDAARO
Cn1cc(C[NH2+]CCC(=O)NC2CCCCC2)cn1	ZINC000097159103	567905005	/nfs/dbraw/zinc/90/50/05/567905005.db2.gz	KLKLJGWTCCLKBY-UHFFFAOYSA-N	1	0	264.373	1.349	50	0		CDAARO
CC(C)[C@@H](C[NH2+][C@@H]1CS(=O)(=O)C[C@H]1O)c1ccccc1	ZINC000904217911	626222809	/nfs/dbraw/zinc/22/28/09/626222809.db2.gz	WDBIGBLKAPCPJQ-RBSFLKMASA-N	1	0	297.420	1.174	50	0		CDAARO
CN1C[C@@]2(CCC[N@H+](CCc3ccccn3)CC2)OC1=O	ZINC000072145598	688479527	/nfs/dbraw/zinc/47/95/27/688479527.db2.gz	ZSJDNUCMRIUBBD-INIZCTEOSA-N	1	0	289.379	1.931	50	0		CDAARO
Cc1nc(-c2nc(-c3c(C)ncc4c3CC[NH2+]C4)no2)c[nH]1	ZINC000019838044	688865916	/nfs/dbraw/zinc/86/59/16/688865916.db2.gz	UMWKEVMMAMPBNJ-UHFFFAOYSA-N	1	0	296.334	1.784	50	0		CDAARO
Cc1cc(F)cc(N2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)n1	ZINC000952992874	688883019	/nfs/dbraw/zinc/88/30/19/688883019.db2.gz	SIRQJNBZEMRSSZ-ZIAGYGMSSA-N	1	0	279.359	1.565	50	0		CDAARO
C[NH+](C)C[C@@H]1COC2(CCCC2)CN1C(=O)NCC1CC1	ZINC000864096557	694250766	/nfs/dbraw/zinc/25/07/66/694250766.db2.gz	FRMKYCYDDYGUEQ-CQSZACIVSA-N	1	0	295.427	1.681	50	0		CDAARO
NC(=O)[C@H]1CCC[N@@H+]([C@@H]2CCc3ccccc3C2)C1	ZINC000000757608	694640426	/nfs/dbraw/zinc/64/04/26/694640426.db2.gz	KAFBBKJAOLFKCB-LSDHHAIUSA-N	1	0	258.365	1.741	50	0		CDAARO
COC(=O)c1ccc(N2CCO[C@@H](CC[NH+](C)C)C2)nc1	ZINC000039460768	693344195	/nfs/dbraw/zinc/34/41/95/693344195.db2.gz	PJPVGYXFEQOKKQ-ZDUSSCGKSA-N	1	0	293.367	1.025	50	0		CDAARO
C[C@H](C[NH+]1CCCCCC1)NC(=O)Cc1cc[nH]n1	ZINC000185442575	693407485	/nfs/dbraw/zinc/40/74/85/693407485.db2.gz	BUJBGYHNKYOCMK-GFCCVEGCSA-N	1	0	264.373	1.333	50	0		CDAARO
Cc1cc(N(C)CCC[C@@H]2CCCO2)nc(N)[nH+]1	ZINC000032561086	694755940	/nfs/dbraw/zinc/75/59/40/694755940.db2.gz	PYBSAURLXYROQA-LLVKDONJSA-N	1	0	250.346	1.763	50	0		CDAARO
OC[C@@H]1CCCCN1CC[NH2+]Cc1ccc(F)cc1F	ZINC000952964832	695156164	/nfs/dbraw/zinc/15/61/64/695156164.db2.gz	QPPGXEXWHAFUJV-AWEZNQCLSA-N	1	0	284.350	1.901	50	0		CDAARO
Cc1cc(N2C[C@@H]3CCCN3C(=O)[C@H]2C)nc(N(C)C)[nH+]1	ZINC001772712023	1159445168	/nfs/dbraw/zinc/44/51/68/1159445168.db2.gz	KDOPMZKUIIJDIG-NEPJUHHUSA-N	1	0	289.383	1.051	50	0		CDAARO
CC(=O)c1cnc(N(C)C[C@@]2(C)CC[N@H+](C)C2)nc1C	ZINC001704306021	1177682626	/nfs/dbraw/zinc/68/26/26/1177682626.db2.gz	ZKRTWJLJCWENTF-HNNXBMFYSA-N	1	0	276.384	1.766	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1C1CN(C(=O)C[NH+]2CCCCCC2)C1	ZINC000952990109	723659574	/nfs/dbraw/zinc/65/95/74/723659574.db2.gz	GBQQOBJCIXULPV-OAHLLOKOSA-N	1	0	293.455	1.948	50	0		CDAARO
O=C(C[C@@H]1CCCOC1)N1CC[NH+](C2CCOCC2)CC1	ZINC000193430956	723080301	/nfs/dbraw/zinc/08/03/01/723080301.db2.gz	QDXSUNDBOQQVOI-AWEZNQCLSA-N	1	0	296.411	1.126	50	0		CDAARO
CCOC(=O)N1CCC([NH+]2CCSCC2)CC1	ZINC000003683610	723149100	/nfs/dbraw/zinc/14/91/00/723149100.db2.gz	HSGIZBPSEWDOMU-UHFFFAOYSA-N	1	0	258.387	1.656	50	0		CDAARO
C[NH+](C)CCCNC(=O)[C@@H]1CC(c2ccc(F)cc2)=NO1	ZINC000020602423	723655396	/nfs/dbraw/zinc/65/53/96/723655396.db2.gz	RQAPWBFKVNMFQD-AWEZNQCLSA-N	1	0	293.342	1.387	50	0		CDAARO
CC[N@@H+]1CCC[C@H](NC(=O)c2cnc(C)nc2C)C1	ZINC000180278758	899483909	/nfs/dbraw/zinc/48/39/09/899483909.db2.gz	RJBZJEZKLJSBGH-LBPRGKRZSA-N	1	0	262.357	1.308	50	0		CDAARO
CCN1CCCn2nc([C@@H]3CCC[NH2+]C3)cc2C1=O	ZINC000675008693	899861509	/nfs/dbraw/zinc/86/15/09/899861509.db2.gz	IOCZNBPRSGDQQI-LLVKDONJSA-N	1	0	262.357	1.216	50	0		CDAARO
Cc1nc(CO[C@H]2CCC[N@@H+](C3CCC3)C2)no1	ZINC000675017374	899870643	/nfs/dbraw/zinc/87/06/43/899870643.db2.gz	UUVFMXZSSPGSDC-LBPRGKRZSA-N	1	0	251.330	1.912	50	0		CDAARO
O=C(Nc1c(F)cccc1F)N1CC[N@@H+]2CC[C@H]1C2	ZINC000952848905	910404801	/nfs/dbraw/zinc/40/48/01/910404801.db2.gz	KXUJTLZEIMBUOM-VIFPVBQESA-N	1	0	267.279	1.887	50	0		CDAARO
CCCO[C@H]1CCC[N@H+](Cc2c(CO)cnc(C)c2O)C1	ZINC000952860331	910412403	/nfs/dbraw/zinc/41/24/03/910412403.db2.gz	MKVZBHMHZBFOLA-AWEZNQCLSA-N	1	0	294.395	1.979	50	0		CDAARO
CCCc1nc(NCC[N@@H+]2CCCC[C@@H]2CO)no1	ZINC000952871785	910425367	/nfs/dbraw/zinc/42/53/67/910425367.db2.gz	BELCGMKBHQEKFA-LLVKDONJSA-N	1	0	268.361	1.281	50	0		CDAARO
c1ccc(C[C@@H]2CN(c3cnccn3)CC[NH2+]2)cc1	ZINC000952993667	910540378	/nfs/dbraw/zinc/54/03/78/910540378.db2.gz	JYXCOZCFRNUPHL-CQSZACIVSA-N	1	0	254.337	1.498	50	0		CDAARO
CCCc1cc(C(=O)N2CC[C@@H]([NH3+])[C@@H](OC)C2)ccn1	ZINC000071770994	936648050	/nfs/dbraw/zinc/64/80/50/936648050.db2.gz	DVWTZGZKHYBZOL-KGLIPLIRSA-N	1	0	277.368	1.222	50	0		CDAARO
C[C@@H](CS(C)(=O)=O)[NH2+]Cc1ccc2nsnc2c1	ZINC000821381929	925580481	/nfs/dbraw/zinc/58/04/81/925580481.db2.gz	NEZNREPDUZJRQT-QMMMGPOBSA-N	1	0	285.394	1.214	50	0		CDAARO
CC[C@H](NC(=O)CN1CC[NH+](CC)CC1)c1cccnc1	ZINC000822662306	925642719	/nfs/dbraw/zinc/64/27/19/925642719.db2.gz	JLQIOQWRGILXCA-HNNXBMFYSA-N	1	0	290.411	1.286	50	0		CDAARO
CC[NH+](CC)CC(=O)Nc1ccc(OC)c2nonc21	ZINC000823072385	925666624	/nfs/dbraw/zinc/66/66/24/925666624.db2.gz	AGWCYVHTPXKGAS-UHFFFAOYSA-N	1	0	278.312	1.512	50	0		CDAARO
CCSCC[N@@H+]1C[C@H](O)[C@@H](N2CCCCC2)C1	ZINC000823422207	925695041	/nfs/dbraw/zinc/69/50/41/925695041.db2.gz	RYSKRWTUJURMDT-STQMWFEESA-N	1	0	258.431	1.271	50	0		CDAARO
Cc1cc(C)c(C[NH2+][C@H](C)CN(C)CCO)cn1	ZINC000828760188	926186288	/nfs/dbraw/zinc/18/62/88/926186288.db2.gz	ZBKVHPBDSDJPMV-CYBMUJFWSA-N	1	0	251.374	1.101	50	0		CDAARO
CCn1ncc(C)c1NC(=O)[C@@H]1CCC[N@H+](CCOC)C1	ZINC001529099913	968981938	/nfs/dbraw/zinc/98/19/38/968981938.db2.gz	HMKSXSDYXRQGBU-CYBMUJFWSA-N	1	0	294.399	1.508	50	0		CDAARO
COc1ncc(C[N@H+](C)[C@@H]2C[C@@H]3C[C@H](O)C[C@@H]3C2)cn1	ZINC001529168006	969002146	/nfs/dbraw/zinc/00/21/46/969002146.db2.gz	TZVMRFUJVMINFL-KPWCQOOUSA-N	1	0	277.368	1.467	50	0		CDAARO
COc1ncc(CN2CCC[N@@H+](C3CCCC3)CC2)cn1	ZINC001506400199	975149454	/nfs/dbraw/zinc/14/94/54/975149454.db2.gz	VBWXBJDTFVICKZ-UHFFFAOYSA-N	1	0	290.411	1.936	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C(=O)c1cccc(=O)[nH]1	ZINC001506407966	975152689	/nfs/dbraw/zinc/15/26/89/975152689.db2.gz	AFOAZGUUPRMLAP-UHFFFAOYSA-N	1	0	277.368	1.734	50	0		CDAARO
Cc1ccc(N2CCN([C@H]3C[NH+]4CCC3CC4)CC2)nc1	ZINC001506418595	975157248	/nfs/dbraw/zinc/15/72/48/975157248.db2.gz	SUYQYBKQUUISJA-INIZCTEOSA-N	1	0	286.423	1.606	50	0		CDAARO
CCN(C)C[C@H](C)[NH2+]CCn1nc(C)c(C)c1C	ZINC001506430933	975161888	/nfs/dbraw/zinc/16/18/88/975161888.db2.gz	ZREKGHVIQZFTSF-NSHDSACASA-N	1	0	252.406	1.738	50	0		CDAARO
CNC(=O)[C@H]([NH2+]C1CCC(C(=O)OC)CC1)C(C)C	ZINC000190460402	342453101	/nfs/dbraw/zinc/45/31/01/342453101.db2.gz	HXHFFLKTMWFBNQ-HTAVTVPLSA-N	1	0	270.373	1.078	50	0		CDAARO
[NH3+]CC1CCN(C(=O)CCc2ccc(F)cc2)CC1	ZINC000096482497	230380480	/nfs/dbraw/zinc/38/04/80/230380480.db2.gz	YOVZIIXIFMQVNY-UHFFFAOYSA-N	1	0	264.344	1.956	50	0		CDAARO
c1ccc(C[N@@H+]2CC[C@@H](Nc3ncncn3)C2)cc1	ZINC000220558136	230397625	/nfs/dbraw/zinc/39/76/25/230397625.db2.gz	NRDNBSPYHRNLDR-CYBMUJFWSA-N	1	0	255.325	1.558	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@@H]([NH2+]C(C)C)CN1Cc1ccccc1	ZINC000206133752	342514185	/nfs/dbraw/zinc/51/41/85/342514185.db2.gz	OLDYJOJERKPHHP-CVEARBPZSA-N	1	0	289.423	1.764	50	0		CDAARO
COC(=O)c1ccc(C[N@@H+]2CCC[C@H]2Cn2ccnc2)[nH]1	ZINC000095940818	185036429	/nfs/dbraw/zinc/03/64/29/185036429.db2.gz	RJJXGQARFGJMQW-ZDUSSCGKSA-N	1	0	288.351	1.662	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@H]([NH2+][C@@H]1CCOC1)C1CC1	ZINC000095968381	185047045	/nfs/dbraw/zinc/04/70/45/185047045.db2.gz	OPAANOLSBPJTJP-NEPJUHHUSA-N	1	0	270.373	1.668	50	0		CDAARO
C[C@H](C[C@@H](O)c1cccs1)[NH2+]Cc1cnnn1C	ZINC000095978229	185052290	/nfs/dbraw/zinc/05/22/90/185052290.db2.gz	GJPLLFMZTWDSRY-MWLCHTKSSA-N	1	0	266.370	1.478	50	0		CDAARO
CCc1ncnc(NC2CC[NH+]([C@H]3CCOC3)CC2)c1F	ZINC000095981613	185053998	/nfs/dbraw/zinc/05/39/98/185053998.db2.gz	CFQDCJHMNYWHKY-LBPRGKRZSA-N	1	0	294.374	1.843	50	0		CDAARO
Cc1cccc(C(C)(C)[NH2+]CC(=O)N2CCOCC2)c1	ZINC000095985282	185055209	/nfs/dbraw/zinc/05/52/09/185055209.db2.gz	PMDRXPBFJIAEHZ-UHFFFAOYSA-N	1	0	276.380	1.679	50	0		CDAARO
CNC(=O)c1cccc(CC[NH2+][C@@H]2CCO[C@H](C)C2)c1	ZINC000095983905	185055701	/nfs/dbraw/zinc/05/57/01/185055701.db2.gz	JAMKRJZZBLBZTF-IUODEOHRSA-N	1	0	276.380	1.746	50	0		CDAARO
C[C@H]([NH2+]CCCNS(C)(=O)=O)c1cccc(F)c1F	ZINC000095986048	185056103	/nfs/dbraw/zinc/05/61/03/185056103.db2.gz	CCJKEXVYKUAIGD-VIFPVBQESA-N	1	0	292.351	1.555	50	0		CDAARO
O[C@H]1CCC[C@@H]1C[NH2+]C1CCN(c2nccs2)CC1	ZINC000095990358	185057431	/nfs/dbraw/zinc/05/74/31/185057431.db2.gz	AXMRKGQFHUAROT-YPMHNXCESA-N	1	0	281.425	1.863	50	0		CDAARO
c1cnn(CCC2CC[NH+](C[C@@H]3COCCO3)CC2)c1	ZINC000241081849	361750365	/nfs/dbraw/zinc/75/03/65/361750365.db2.gz	YRAXYEBGKAGZFL-OAHLLOKOSA-N	1	0	279.384	1.401	50	0		CDAARO
C[C@H](O)CNC(=O)NC[C@@H]1CCC[N@@H+]1C1CCCCC1	ZINC000241316778	361752504	/nfs/dbraw/zinc/75/25/04/361752504.db2.gz	LUVIPHYJBKHWLL-JSGCOSHPSA-N	1	0	283.416	1.464	50	0		CDAARO
C[C@@H](O)C[N@@H+]1CCN(C(=O)CCC2CCC2)[C@@H](C)C1	ZINC000242038580	361754813	/nfs/dbraw/zinc/75/48/13/361754813.db2.gz	VMGVFZZNWFPMLZ-QWHCGFSZSA-N	1	0	268.401	1.480	50	0		CDAARO
CCOP(=O)(C[C@@H]([NH3+])[S@](=O)CC)OCC	ZINC000242495707	361758601	/nfs/dbraw/zinc/75/86/01/361758601.db2.gz	GMZBZXWOSQIQKN-VXJOIVPMSA-N	1	0	257.292	1.306	50	0		CDAARO
CCc1nn(C)cc1C[NH2+][C@H]1CCCC[C@H]1C(N)=O	ZINC000195562091	342628604	/nfs/dbraw/zinc/62/86/04/342628604.db2.gz	AOCJHKJULSZKFI-YPMHNXCESA-N	1	0	264.373	1.116	50	0		CDAARO
Cc1cc(C[NH2+][C@@H]2CCCCC[C@@H]2C(N)=O)no1	ZINC000195571239	342628815	/nfs/dbraw/zinc/62/88/15/342628815.db2.gz	MZGASURYIROXQG-NWDGAFQWSA-N	1	0	251.330	1.507	50	0		CDAARO
CC(=O)N(C)[C@@H]1CC[N@H+](CCn2cnc3ccccc32)C1	ZINC000244626682	361854861	/nfs/dbraw/zinc/85/48/61/361854861.db2.gz	FQNXEMJDIHBJLQ-CQSZACIVSA-N	1	0	286.379	1.589	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1CCN(Cc1nnc(-c3cccnc3)o1)C2	ZINC000244691928	361857392	/nfs/dbraw/zinc/85/73/92/361857392.db2.gz	JLMIEYWMYPMCQQ-UONOGXRCSA-N	1	0	299.378	1.800	50	0		CDAARO
CC[N@H+](CCN1CCCC1=O)C[C@H](O)c1cccc(O)c1	ZINC000244764068	361862005	/nfs/dbraw/zinc/86/20/05/361862005.db2.gz	PAWMVOAHFJSOOQ-HNNXBMFYSA-N	1	0	292.379	1.370	50	0		CDAARO
CCC1=NO[C@H](C[NH+]2CCC(Oc3ncccn3)CC2)C1	ZINC000244852904	361866505	/nfs/dbraw/zinc/86/65/05/361866505.db2.gz	VBJNHJUVIQCONO-AWEZNQCLSA-N	1	0	290.367	1.875	50	0		CDAARO
Cc1cc(-c2ccccc2)nc(CN2CC[C@H]([NH3+])C2)n1	ZINC000244718798	361858701	/nfs/dbraw/zinc/85/87/01/361858701.db2.gz	LQZFMJVTFURXJM-AWEZNQCLSA-N	1	0	268.364	1.985	50	0		CDAARO
CCN(CC)CC[N@@H+]1CCCC[C@H]1[C@H]1CNC(=O)C1	ZINC000097235664	342205573	/nfs/dbraw/zinc/20/55/73/342205573.db2.gz	QMOSCNVCYPKZRJ-KGLIPLIRSA-N	1	0	267.417	1.319	50	0		CDAARO
O=C(OCCNc1ncccn1)c1ccn2c[nH+]cc2c1	ZINC000097034296	185157544	/nfs/dbraw/zinc/15/75/44/185157544.db2.gz	ROWIVAXSAQCJDV-UHFFFAOYSA-N	1	0	283.291	1.393	50	0		CDAARO
COc1ccccc1C[C@@](C)(CO)[NH2+]CC(=O)NC(C)C	ZINC000585139251	342216527	/nfs/dbraw/zinc/21/65/27/342216527.db2.gz	CKUISBAUFDHYDN-INIZCTEOSA-N	1	0	294.395	1.103	50	0		CDAARO
COc1cc(C)ccc1OCCC(=O)N1CC[NH2+]C[C@@H]1C	ZINC000125773550	187199503	/nfs/dbraw/zinc/19/95/03/187199503.db2.gz	ZQQBAERYUBHDEE-ZDUSSCGKSA-N	1	0	292.379	1.593	50	0		CDAARO
Cn1ccnc1NC(=O)c1ccc(C[NH+](C)C)cc1	ZINC000082287740	342375748	/nfs/dbraw/zinc/37/57/48/342375748.db2.gz	NJXXUSYNAGVHJU-UHFFFAOYSA-N	1	0	258.325	1.156	50	0		CDAARO
O=C1CC2(CC[NH+](Cc3ccccc3)CC2)OC1=O	ZINC000019865849	343333718	/nfs/dbraw/zinc/33/37/18/343333718.db2.gz	HSVWZCRVWDQKOQ-UHFFFAOYSA-N	1	0	259.305	1.537	50	0		CDAARO
CN(CCn1cncn1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000096445749	529940878	/nfs/dbraw/zinc/94/08/78/529940878.db2.gz	VOCYRZSQJDMKQX-QGZVFWFLSA-N	1	0	299.422	1.875	50	0		CDAARO
C[C@@H]1c2ccccc2O[C@H]1C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179092459	362254030	/nfs/dbraw/zinc/25/40/30/362254030.db2.gz	BTSHEEACKOTCNJ-JTNHKYCSSA-N	1	0	260.337	1.371	50	0		CDAARO
O=C(Cc1cccnc1)N1CCCN(c2cc[nH+]cc2)CC1	ZINC000640445266	362289435	/nfs/dbraw/zinc/28/94/35/362289435.db2.gz	HZPCAPQODRCZEO-UHFFFAOYSA-N	1	0	296.374	1.758	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@@H]1CCC[C@H]1[NH3+]	ZINC000085375776	179044089	/nfs/dbraw/zinc/04/40/89/179044089.db2.gz	CNHBDSSILIVBOA-NXEZZACHSA-N	1	0	253.371	1.537	50	0		CDAARO
CCc1nc(C[NH2+]CC2(C(N)=O)CCOCC2)cs1	ZINC000086250459	179255498	/nfs/dbraw/zinc/25/54/98/179255498.db2.gz	OAHFDAMTWGBNOU-UHFFFAOYSA-N	1	0	283.397	1.077	50	0		CDAARO
C[NH+](C)CCN(Cc1ccco1)C(=O)[C@H]1CCCOC1	ZINC000088230010	179568136	/nfs/dbraw/zinc/56/81/36/179568136.db2.gz	IXOMVIKUISAPRO-ZDUSSCGKSA-N	1	0	280.368	1.596	50	0		CDAARO
CO[C@@H]1c2ccccc2C(=O)N1CC[NH+]1CCCC1	ZINC000027103965	348746295	/nfs/dbraw/zinc/74/62/95/348746295.db2.gz	RWZMTCXOCBZGSH-OAHLLOKOSA-N	1	0	260.337	1.883	50	0		CDAARO
CC1(C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)OCCO1	ZINC000089920645	179883061	/nfs/dbraw/zinc/88/30/61/179883061.db2.gz	YMUXLZNBGWONJL-UONOGXRCSA-N	1	0	269.385	1.765	50	0		CDAARO
COc1ccc2ncn(CC[C@@H](C)[NH+](C)C)c(=O)c2c1	ZINC000584891172	349350517	/nfs/dbraw/zinc/35/05/17/349350517.db2.gz	ZRWJBARQCWIZIE-LLVKDONJSA-N	1	0	275.352	1.745	50	0		CDAARO
Cc1ccoc1C(=O)NCC[N@@H+]1CCC[C@@H](CO)C1	ZINC000584895211	349355074	/nfs/dbraw/zinc/35/50/74/349355074.db2.gz	CDYDVXWUOFNMSR-GFCCVEGCSA-N	1	0	266.341	1.022	50	0		CDAARO
Cc1cc(Cl)cc2c1NC(=O)CN(CC[NH+](C)C)C2=O	ZINC000584898043	349359626	/nfs/dbraw/zinc/35/96/26/349359626.db2.gz	UCDKYKUKAWOSMA-UHFFFAOYSA-N	1	0	295.770	1.604	50	0		CDAARO
C[C@@H]1CC[C@H](C)CN1C(=O)c1csc(CC[NH3+])n1	ZINC000090957673	180074577	/nfs/dbraw/zinc/07/45/77/180074577.db2.gz	YAKONPXDDHMXPC-VHSXEESVSA-N	1	0	267.398	1.905	50	0		CDAARO
Cc1n[nH]c(CN2C[C@H]([NH3+])[C@@H](C3CC3)C2)c1Cl	ZINC000091460153	180161752	/nfs/dbraw/zinc/16/17/52/180161752.db2.gz	KGADXLOGIRENHV-ZJUUUORDSA-N	1	0	254.765	1.541	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@H]1NC(=O)c1cc(F)ccc1F	ZINC000091496489	180171928	/nfs/dbraw/zinc/17/19/28/180171928.db2.gz	MKIJMIQMGVEXRM-QPUJVOFHSA-N	1	0	254.280	1.835	50	0		CDAARO
O=c1cc(C[NH2+]C2CCOCC2)[nH]c2ccc(F)cc12	ZINC000091526833	180178649	/nfs/dbraw/zinc/17/86/49/180178649.db2.gz	URJOVYIONFXGRN-UHFFFAOYSA-N	1	0	276.311	1.936	50	0		CDAARO
Cc1cnc(N)nc1NCCCCC[NH+]1CCOCC1	ZINC000091626073	180210414	/nfs/dbraw/zinc/21/04/14/180210414.db2.gz	OPGBSKLKHCPVQN-UHFFFAOYSA-N	1	0	279.388	1.282	50	0		CDAARO
CCc1[nH+]c(N)nc(NCCSc2nccn2C)c1C	ZINC000091644723	180215031	/nfs/dbraw/zinc/21/50/31/180215031.db2.gz	GDCYNRNQKAGXPX-UHFFFAOYSA-N	1	0	292.412	1.867	50	0		CDAARO
Cc1cc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)cs1	ZINC000091665478	180220722	/nfs/dbraw/zinc/22/07/22/180220722.db2.gz	DSMTURFYRUTMQV-NEPJUHHUSA-N	1	0	250.367	1.866	50	0		CDAARO
CCn1nc(C(C)C)cc1C(=O)N1CC[C@@H]([NH3+])C1	ZINC000091665564	180220723	/nfs/dbraw/zinc/22/07/23/180220723.db2.gz	QRKSTZRBOUOCOG-SNVBAGLBSA-N	1	0	250.346	1.200	50	0		CDAARO
CCC[C@H]1CN(Cc2nccn2CCOC)C[C@@H]1[NH+](C)C	ZINC000091831084	180266175	/nfs/dbraw/zinc/26/61/75/180266175.db2.gz	RZXAGIYHSRQSBT-GJZGRUSLSA-N	1	0	294.443	1.692	50	0		CDAARO
CCC[C@H]1CN(CC(C)(C)[NH3+])C[C@@H]1NC(=O)C(C)(C)C	ZINC000091987205	180298856	/nfs/dbraw/zinc/29/88/56/180298856.db2.gz	SOSYTTDQUYJUIG-STQMWFEESA-N	1	0	283.460	1.987	50	0		CDAARO
COC[C@@H](C)NC(=O)C[N@H+](C)[C@H](C)c1ccccc1	ZINC000106620320	186129488	/nfs/dbraw/zinc/12/94/88/186129488.db2.gz	JAVKHYNAMKBZMA-CHWSQXEVSA-N	1	0	264.369	1.831	50	0		CDAARO
C[C@H](CCc1cccc(F)c1)[N@@H+]1CCO[C@@H](C(N)=O)C1	ZINC000108467026	186218975	/nfs/dbraw/zinc/21/89/75/186218975.db2.gz	OXSADRJXEUTUSC-BXUZGUMPSA-N	1	0	280.343	1.333	50	0		CDAARO
CS(=O)(=O)CC[N@@H+]1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000110642303	186309108	/nfs/dbraw/zinc/30/91/08/186309108.db2.gz	UHLAUJUTUFGHET-LSDHHAIUSA-N	1	0	297.420	1.619	50	0		CDAARO
CS[C@@H]1CCC[C@H]1[N@H+](C)CC(=O)N1CCOCC1	ZINC000110642580	186309150	/nfs/dbraw/zinc/30/91/50/186309150.db2.gz	PRPJFNRITHLYGP-VXGBXAGGSA-N	1	0	272.414	1.061	50	0		CDAARO
Cn1nccc1C[NH2+][C@@H]1CCC[C@H]1NC(=O)OC(C)(C)C	ZINC000122896058	187058138	/nfs/dbraw/zinc/05/81/38/187058138.db2.gz	WGQOAFFFPSMXRI-CHWSQXEVSA-N	1	0	294.399	1.956	50	0		CDAARO
C[C@@H](CN1CCOCC1)[NH2+]Cc1ccc(F)cc1	ZINC000036932702	363295115	/nfs/dbraw/zinc/29/51/15/363295115.db2.gz	AXEUCEAMXZKXNA-LBPRGKRZSA-N	1	0	252.333	1.636	50	0		CDAARO
Fc1ccc(C[NH2+]CCCN2CCOCC2)cc1	ZINC000002380313	355968391	/nfs/dbraw/zinc/96/83/91/355968391.db2.gz	GYOBGFHXRZIXEL-UHFFFAOYSA-N	1	0	252.333	1.638	50	0		CDAARO
COc1ccc(/C(C)=C\C(=O)N2CC[C@H]([NH3+])C2)cc1	ZINC000255297614	356037319	/nfs/dbraw/zinc/03/73/19/356037319.db2.gz	RJXXZIVZWFZZMT-FUWURINLSA-N	1	0	260.337	1.658	50	0		CDAARO
[NH3+][C@@H]1Cc2ccc(I)cc2C1	ZINC000006094103	356067472	/nfs/dbraw/zinc/06/74/72/356067472.db2.gz	BIHPYCDDPGNWQO-SECBINFHSA-N	1	0	259.090	1.717	50	0	in-vitro	CDAARO
COc1ccc([C@H](C)[NH2+]CC(C)(C)C(N)=O)c(F)c1	ZINC000097370943	356089099	/nfs/dbraw/zinc/08/90/99/356089099.db2.gz	GXHZKXOAXQLEPJ-VIFPVBQESA-N	1	0	268.332	1.996	50	0		CDAARO
CC(C)[N@H+](CC(=O)NC(=O)NC(C)(C)C)C1CC1	ZINC000032777893	356363992	/nfs/dbraw/zinc/36/39/92/356363992.db2.gz	WVTTUGTXBVPRLW-UHFFFAOYSA-N	1	0	255.362	1.484	50	0		CDAARO
COc1ccccc1C[NH2+]CCNC(=O)c1ccncc1	ZINC000004498081	356369933	/nfs/dbraw/zinc/36/99/33/356369933.db2.gz	URKRLAUMSRYCKG-UHFFFAOYSA-N	1	0	285.347	1.610	50	0		CDAARO
CCC[NH+]1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC000016605736	356443012	/nfs/dbraw/zinc/44/30/12/356443012.db2.gz	JSXWJZLVNYHUNS-UHFFFAOYSA-N	1	0	250.317	1.994	50	0		CDAARO
COc1cc(OC)c(OC)cc1CN1CC[NH2+]CC1	ZINC000019735173	356498403	/nfs/dbraw/zinc/49/84/03/356498403.db2.gz	SXEQVYYQWYPXLG-UHFFFAOYSA-N	1	0	266.341	1.118	50	0	in-vitro	CDAARO
C[N@@H+]1CCC[C@H](N2CCN(c3ccccc3)CC2)C1	ZINC000019774148	356501920	/nfs/dbraw/zinc/50/19/20/356501920.db2.gz	KRDOHUGSALCVFQ-INIZCTEOSA-N	1	0	259.397	1.903	50	0		CDAARO
CCN1CC[NH+](C2CCN(C(=O)c3ccco3)CC2)CC1	ZINC000019888794	356514535	/nfs/dbraw/zinc/51/45/35/356514535.db2.gz	AVKGJDSZWUVPCH-UHFFFAOYSA-N	1	0	291.395	1.522	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COc2cccc(OC)c2)CC1	ZINC000019901678	356515085	/nfs/dbraw/zinc/51/50/85/356515085.db2.gz	QQWBSPJJCODTEG-AWEZNQCLSA-N	1	0	294.395	1.072	50	0		CDAARO
C[NH+]1CCC(NC(=O)N2CCc3ccccc3C2)CC1	ZINC000043180638	356544165	/nfs/dbraw/zinc/54/41/65/356544165.db2.gz	WMYPAJJOXVGUDX-UHFFFAOYSA-N	1	0	273.380	1.849	50	0		CDAARO
[NH3+]CCCC(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000037822439	356542707	/nfs/dbraw/zinc/54/27/07/356542707.db2.gz	YJNIPSFJTFWNCE-ZDUSSCGKSA-N	1	0	282.771	1.979	50	0		CDAARO
[NH3+]CCc1ccc(I)s1	ZINC000021951040	356592703	/nfs/dbraw/zinc/59/27/03/356592703.db2.gz	TWYXLBKLMOEGFD-UHFFFAOYSA-N	1	0	253.108	1.854	50	0		CDAARO
CCCC[N@H+](C)[C@H](C(=O)NC(N)=O)c1ccccc1	ZINC000023696694	356648108	/nfs/dbraw/zinc/64/81/08/356648108.db2.gz	VVLUKIWZJWHVJI-LBPRGKRZSA-N	1	0	263.341	1.655	50	0		CDAARO
CCC[NH+]1CCC(N2CCN(c3ncccn3)CC2)CC1	ZINC000023283336	356639057	/nfs/dbraw/zinc/63/90/57/356639057.db2.gz	WUCCJQNOSQHLCI-UHFFFAOYSA-N	1	0	289.427	1.473	50	0		CDAARO
C[NH+](C)Cc1ccccc1CNC(=O)C1=COCCO1	ZINC000024084466	356652626	/nfs/dbraw/zinc/65/26/26/356652626.db2.gz	VKRBJYBKMOMCDW-UHFFFAOYSA-N	1	0	276.336	1.253	50	0		CDAARO
O=C([C@H]1CC12CC[NH2+]CC2)N(CCO)C1CCCCC1	ZINC000070254057	356742413	/nfs/dbraw/zinc/74/24/13/356742413.db2.gz	QAAUOPYAPGHVKA-CQSZACIVSA-N	1	0	280.412	1.530	50	0		CDAARO
Cc1cc(Br)cn2cc(CC[NH3+])nc12	ZINC000036243543	356867598	/nfs/dbraw/zinc/86/75/98/356867598.db2.gz	IPCVGTYJIGMZLX-UHFFFAOYSA-N	1	0	254.131	1.906	50	0		CDAARO
Cc1noc(C)c1S(=O)(=O)NCC1([NH3+])CCCCC1	ZINC000036266670	356868913	/nfs/dbraw/zinc/86/89/13/356868913.db2.gz	STUUZZKIVWAVQP-UHFFFAOYSA-N	1	0	287.385	1.231	50	0		CDAARO
[NH3+][C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000054918280	357326440	/nfs/dbraw/zinc/32/64/40/357326440.db2.gz	JGZOEQPCTDHQRN-HNNXBMFYSA-N	1	0	254.333	1.873	50	0		CDAARO
OCc1ccccc1CN1CC[NH+](C[C@H]2CCOC2)CC1	ZINC000063833528	357517914	/nfs/dbraw/zinc/51/79/14/357517914.db2.gz	QFNPDDQUQBFPKE-OAHLLOKOSA-N	1	0	290.407	1.333	50	0		CDAARO
CC[N@H+](CCN1CCOCC1)Cc1cccc2c1OCO2	ZINC000065371586	357532297	/nfs/dbraw/zinc/53/22/97/357532297.db2.gz	CAAQFMYKPORZBA-UHFFFAOYSA-N	1	0	292.379	1.569	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]Cc2[nH]nc3c2CCC3)n1	ZINC000067743080	357623367	/nfs/dbraw/zinc/62/33/67/357623367.db2.gz	YVCQDDOWOYOPJL-LLVKDONJSA-N	1	0	273.384	1.890	50	0		CDAARO
[NH3+][C@@H]1CCCN(c2nc(-c3ccccc3)cc(=O)[nH]2)C1	ZINC000067172890	357596755	/nfs/dbraw/zinc/59/67/55/357596755.db2.gz	JPHBDCPARAXLQA-GFCCVEGCSA-N	1	0	270.336	1.364	50	0		CDAARO
Cc1c2cc(F)ccc2[nH]c1CN1CCO[C@@H](C[NH3+])C1	ZINC000067559206	357613199	/nfs/dbraw/zinc/61/31/99/357613199.db2.gz	UQGAYEWVXOWPEK-LBPRGKRZSA-N	1	0	277.343	1.775	50	0		CDAARO
Cc1cc(C(=O)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)[nH]n1	ZINC000067883777	357634632	/nfs/dbraw/zinc/63/46/32/357634632.db2.gz	WQGLZNBLIDAAAU-ZDUSSCGKSA-N	1	0	278.400	1.816	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)Nc2ccc(Oc3nn[nH]n3)cc2)C1	ZINC000072426589	357835136	/nfs/dbraw/zinc/83/51/36/357835136.db2.gz	SCLWUQMKTYMKAO-DTWKUNHWSA-N	1	0	288.311	1.058	50	0		CDAARO
CCc1cc(N[C@@H]2CC[NH2+]C[C@H]2O)n2nc(C)c(C)c2n1	ZINC000072456756	357837394	/nfs/dbraw/zinc/83/73/94/357837394.db2.gz	CIFKXQZFXXHHOP-CHWSQXEVSA-N	1	0	289.383	1.043	50	0		CDAARO
CO[C@@H](C)C(=O)N1CC[N@H+](C)CC12CCCCC2	ZINC000098016488	358088290	/nfs/dbraw/zinc/08/82/90/358088290.db2.gz	ZAYOFAFSGFHPSQ-LBPRGKRZSA-N	1	0	254.374	1.498	50	0		CDAARO
CCC[C@@H]1CN(Cc2[nH]cnc2C)C[C@H]1[NH+](C)C	ZINC000082156202	358149313	/nfs/dbraw/zinc/14/93/13/358149313.db2.gz	GVNYHODVNDPMCV-TZMCWYRMSA-N	1	0	250.390	1.880	50	0		CDAARO
CNC(=O)[C@@H]1CCC[N@H+](Cc2cn3cc(C)ccc3n2)C1	ZINC000084075726	358224606	/nfs/dbraw/zinc/22/46/06/358224606.db2.gz	HBAAEEGJZNUOAT-CYBMUJFWSA-N	1	0	286.379	1.601	50	0		CDAARO
CCOC(=O)[C@]1(C(C)C)CC[N@H+](Cc2nccn2C)C1	ZINC000194874032	358543617	/nfs/dbraw/zinc/54/36/17/358543617.db2.gz	KAYURZQWTIVROX-OAHLLOKOSA-N	1	0	279.384	1.831	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N1CC[C@@H](C)C[C@H](C)C1	ZINC000195554724	358557538	/nfs/dbraw/zinc/55/75/38/358557538.db2.gz	ZNIDWQFCRZJEFR-WOPDTQHZSA-N	1	0	258.431	1.961	50	0		CDAARO
c1cc(N2CCC([NH+]3CCSCC3)CC2)ncn1	ZINC000095364658	358686553	/nfs/dbraw/zinc/68/65/53/358686553.db2.gz	MJTFVBMWGRJTAV-UHFFFAOYSA-N	1	0	264.398	1.494	50	0		CDAARO
CC(C)c1nnc(N2CC[C@@]3(O)CC[NH2+]C[C@H]3C2)s1	ZINC000095368597	358687614	/nfs/dbraw/zinc/68/76/14/358687614.db2.gz	WXFZVSWVRFIALO-GWCFXTLKSA-N	1	0	282.413	1.212	50	0		CDAARO
CCCc1nnc(N2CC[NH+](CC3CC3)CC2)o1	ZINC000095372454	358688768	/nfs/dbraw/zinc/68/87/68/358688768.db2.gz	BBMVXFVSVLANNL-UHFFFAOYSA-N	1	0	250.346	1.554	50	0		CDAARO
CCc1cnc(N2CCCO[C@@H](C[NH+]3CCCC3)C2)nc1	ZINC000095386049	358691270	/nfs/dbraw/zinc/69/12/70/358691270.db2.gz	KWBOAMPWOSZIHN-HNNXBMFYSA-N	1	0	290.411	1.730	50	0		CDAARO
Cc1n[nH]c(C)c1CNC(=O)CC[C@H]1CCCC[N@H+]1C	ZINC000095389025	358691995	/nfs/dbraw/zinc/69/19/95/358691995.db2.gz	HKLNMGGJRPQQKY-CYBMUJFWSA-N	1	0	278.400	1.907	50	0		CDAARO
CC(C)c1ccnc(N[C@H]2COC[C@@H]2[NH+]2CCCC2)n1	ZINC000095390722	358692245	/nfs/dbraw/zinc/69/22/45/358692245.db2.gz	HNGJPJZMXYKCOO-KBPBESRZSA-N	1	0	276.384	1.875	50	0		CDAARO
O[C@H]1CN(Cc2ccnc3ccccc23)C[C@@H]1[NH+]1CCCC1	ZINC000097217694	358758991	/nfs/dbraw/zinc/75/89/91/358758991.db2.gz	BOAYBQIMUYEXPO-ROUUACIJSA-N	1	0	297.402	1.876	50	0		CDAARO
c1nc(N2CCCC2)ncc1CN1C[C@@H]2CC[C@H]1C[NH2+]C2	ZINC000097294824	358765211	/nfs/dbraw/zinc/76/52/11/358765211.db2.gz	KPMVJIDMOGWOEL-HIFRSBDPSA-N	1	0	287.411	1.261	50	0		CDAARO
CC(C)([NH3+])C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000040923863	358825439	/nfs/dbraw/zinc/82/54/39/358825439.db2.gz	DKPQMJJWJNHACA-GFCCVEGCSA-N	1	0	266.316	1.463	50	0		CDAARO
Nc1cccc(C(=O)N2CCC[N@@H+](C3CCCC3)CC2)n1	ZINC000215136163	358876054	/nfs/dbraw/zinc/87/60/54/358876054.db2.gz	JFZCLPICQUBNKT-UHFFFAOYSA-N	1	0	288.395	1.754	50	0		CDAARO
CN1CCC[C@H]([N@H+](C)CCCNC(=O)OC(C)(C)C)C1=O	ZINC000095466130	358927293	/nfs/dbraw/zinc/92/72/93/358927293.db2.gz	BQIJHKFTWRLBNT-LBPRGKRZSA-N	1	0	299.415	1.454	50	0		CDAARO
CNC(=S)N1CCC[N@H+](CCc2ccncc2)CC1	ZINC000012321398	358984524	/nfs/dbraw/zinc/98/45/24/358984524.db2.gz	XBWUCVOMHQHGSR-UHFFFAOYSA-N	1	0	278.425	1.136	50	0		CDAARO
O=C(O[C@@H]1C[NH+]2CCC1CC2)[C@@H]1COc2ccccc2O1	ZINC000000108981	359097890	/nfs/dbraw/zinc/09/78/90/359097890.db2.gz	MUWXMGFHWUUUDA-CABCVRRESA-N	1	0	289.331	1.464	50	0		CDAARO
CC(C)Nc1nc(NC(C)C)nc(N(C)n2cnnc2)n1	ZINC000000305836	359468842	/nfs/dbraw/zinc/46/88/42/359468842.db2.gz	MLMUDYHPPDQANN-UHFFFAOYSA-N	1	0	291.363	1.003	50	0		CDAARO
CCCn1cnnc1CNC(=O)C[NH+]1CCCCCC1	ZINC000223918613	359472016	/nfs/dbraw/zinc/47/20/16/359472016.db2.gz	JLKXQQMLMLJKEY-UHFFFAOYSA-N	1	0	279.388	1.180	50	0		CDAARO
CN(C)C(=O)[C@@H]1C[N@H+](Cc2cccc(Cl)c2)C[C@H]1CO	ZINC000257193795	359605405	/nfs/dbraw/zinc/60/54/05/359605405.db2.gz	ZSSDJAXXZZMDLA-GXTWGEPZSA-N	1	0	296.798	1.469	50	0		CDAARO
CCOC(=O)c1ccc(C[NH2+][C@H]2CCO[C@@H]2C)o1	ZINC000095988514	359709828	/nfs/dbraw/zinc/70/98/28/359709828.db2.gz	DHIMOWMCXLTHOJ-KOLCDFICSA-N	1	0	253.298	1.723	50	0		CDAARO
C[C@@H]1CCCC[C@H]1OCC[NH2+][C@H]1CCc2ncnn2C1	ZINC000257365869	359946837	/nfs/dbraw/zinc/94/68/37/359946837.db2.gz	XMNATQXWAPVZJM-HZSPNIEDSA-N	1	0	278.400	1.778	50	0		CDAARO
C[C@@H](c1nc(C2CC2)no1)N1CCC[C@H]1Cn1cncn1	ZINC000257365643	359946853	/nfs/dbraw/zinc/94/68/53/359946853.db2.gz	CWFSIMMKDLUNGB-JQWIXIFHSA-N	1	0	288.355	1.764	50	0		CDAARO
Cc1cc(C(=O)CN2CCC[C@H](O)C2)c(C)n1C	ZINC000032797152	360019467	/nfs/dbraw/zinc/01/94/67/360019467.db2.gz	OWHQNPQSOIECAQ-LBPRGKRZSA-N	1	0	250.342	1.281	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@@H]1CCCN(C(=O)c2cn(C)cn2)C1	ZINC000409421075	360230607	/nfs/dbraw/zinc/23/06/07/360230607.db2.gz	FDGAAZLEZBJQDB-CYBMUJFWSA-N	1	0	287.367	1.711	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)c1ccnc(C)n1	ZINC000247983389	360291180	/nfs/dbraw/zinc/29/11/80/360291180.db2.gz	YESNXVJKPXCWRR-LSDHHAIUSA-N	1	0	288.395	1.874	50	0		CDAARO
Cc1ccc(OCCS(=O)(=O)N2CCC[C@@H]([NH3+])C2)cc1	ZINC000426477463	360567463	/nfs/dbraw/zinc/56/74/63/360567463.db2.gz	WYNSDUZFJZJLCV-CYBMUJFWSA-N	1	0	298.408	1.127	50	0		CDAARO
[NH3+]CCOc1cccc(C(=O)NCC[C@H]2CCCOC2)c1	ZINC000426677395	360695441	/nfs/dbraw/zinc/69/54/41/360695441.db2.gz	FZEVFYJLZCUQSC-CYBMUJFWSA-N	1	0	292.379	1.571	50	0		CDAARO
COCc1nc(C)c(CNC(=O)[C@@H](C)[NH+](C)C)s1	ZINC000426383690	360661057	/nfs/dbraw/zinc/66/10/57/360661057.db2.gz	AJSIHJCLDGNFTB-SECBINFHSA-N	1	0	271.386	1.164	50	0		CDAARO
CC(C)c1ncc(Cl)c(C(=O)N2CC[C@H](C[NH3+])C2)n1	ZINC000178519285	189123108	/nfs/dbraw/zinc/12/31/08/189123108.db2.gz	BAOUVWAJRNTLJM-SECBINFHSA-N	1	0	282.775	1.674	50	0		CDAARO
CCc1nccc(C[N@@H+]2CC[C@]3(OC)CC[C@@H](O)C[C@H]23)n1	ZINC000426431090	360669211	/nfs/dbraw/zinc/66/92/11/360669211.db2.gz	QGTKKECMGMHRKL-IJEWVQPXSA-N	1	0	291.395	1.543	50	0		CDAARO
C[NH+]1CCC(CC(=O)N2CC(c3ccncc3)C2)CC1	ZINC000426493277	360676365	/nfs/dbraw/zinc/67/63/65/360676365.db2.gz	SVKLPGQCEQAHRL-UHFFFAOYSA-N	1	0	273.380	1.739	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)Cc2cc(F)ccc2F)C1	ZINC000178987586	189159620	/nfs/dbraw/zinc/15/96/20/189159620.db2.gz	WLSHAHXVBUHLFS-JTQLQIEISA-N	1	0	268.307	1.575	50	0		CDAARO
CC(C)c1cc(CNC(=O)N2CC[C@@H](C[NH+](C)C)C2)on1	ZINC000130007451	360904959	/nfs/dbraw/zinc/90/49/59/360904959.db2.gz	MMGABJGQOQOZLU-LBPRGKRZSA-N	1	0	294.399	1.891	50	0		CDAARO
CCO[C@@H](C)c1nc(C)c(C(=O)N(C)[C@@H]2CC[NH2+]C2)s1	ZINC000299740028	200852534	/nfs/dbraw/zinc/85/25/34/200852534.db2.gz	USSVKWJDKLVXGE-WDEREUQCSA-N	1	0	297.424	1.983	50	0		CDAARO
CS(=O)(=O)[C@H]1CCCC[C@@H]1[NH2+]Cc1ccoc1	ZINC000182555416	189327953	/nfs/dbraw/zinc/32/79/53/189327953.db2.gz	ZCHVZBWYEMJQRL-RYUDHWBXSA-N	1	0	257.355	1.725	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC2CC[NH2+]CC2)c(Cl)c1	ZINC000036286069	361424781	/nfs/dbraw/zinc/42/47/81/361424781.db2.gz	ILIFRYPCSXJUQQ-UHFFFAOYSA-N	1	0	288.800	1.679	50	0		CDAARO
Nc1cc(N)[nH+]c(SCC(=O)NC2CCCCC2)n1	ZINC000000305384	364165052	/nfs/dbraw/zinc/16/50/52/364165052.db2.gz	QMGXWQDPXHDCEV-UHFFFAOYSA-N	1	0	281.385	1.182	50	0		CDAARO
C[C@@H]1C[NH+](CCCCNC(=O)[C@H]2CCCOC2)C[C@@H](C)O1	ZINC000195537289	189677352	/nfs/dbraw/zinc/67/73/52/189677352.db2.gz	JOEOGIXRYNCBEB-KFWWJZLASA-N	1	0	298.427	1.419	50	0		CDAARO
c1cc(C[NH2+]CCOc2ccc3c(c2)OCO3)c[nH]1	ZINC000089807661	366937793	/nfs/dbraw/zinc/93/77/93/366937793.db2.gz	IVXHRAFIPOJRIP-UHFFFAOYSA-N	1	0	260.293	1.912	50	0		CDAARO
COC(=O)N1CCC[C@@H]([NH2+][C@@H](C)CCn2cccn2)C1	ZINC000097049724	283899118	/nfs/dbraw/zinc/89/91/18/283899118.db2.gz	VFKWOTXCTXWHKI-QWHCGFSZSA-N	1	0	280.372	1.482	50	0		CDAARO
CCc1noc(CN(C)C(=O)[C@@H]2C[C@H]3CCCC[C@H]3[NH2+]2)n1	ZINC000252512216	367682983	/nfs/dbraw/zinc/68/29/83/367682983.db2.gz	OCVGDLWYOLZNKY-UTUOFQBUSA-N	1	0	292.383	1.511	50	0		CDAARO
O=C(N[C@@H]1CC[N@H+](Cc2ccccc2)C1)N1CC=CC1	ZINC000630093340	367734575	/nfs/dbraw/zinc/73/45/75/367734575.db2.gz	KBMFOBAEDYKBMH-OAHLLOKOSA-N	1	0	271.364	1.842	50	0		CDAARO
CCOc1cc(N2C[C@@H]3CCC[N@@H+]3C[C@H]2C)ncn1	ZINC000252585948	368171464	/nfs/dbraw/zinc/17/14/64/368171464.db2.gz	MJZDZZNIWDKGKD-NEPJUHHUSA-N	1	0	262.357	1.548	50	0		CDAARO
Cc1c[nH]c(CN(C)c2nc(C)nc3c2CC[NH2+]CC3)n1	ZINC000063871202	370914936	/nfs/dbraw/zinc/91/49/36/370914936.db2.gz	ZMYPDZCGGRDKSP-UHFFFAOYSA-N	1	0	286.383	1.141	50	0		CDAARO
CN1CC[NH+](C[C@H]2CCCN(Cc3nccs3)C2)CC1	ZINC000367622493	369201712	/nfs/dbraw/zinc/20/17/12/369201712.db2.gz	IFYWRZKSGNZWCX-CQSZACIVSA-N	1	0	294.468	1.603	50	0		CDAARO
CC1CCC([NH+]2CCN(CCOCCO)CC2)CC1	ZINC000019636376	369770804	/nfs/dbraw/zinc/77/08/04/369770804.db2.gz	WMNULLWCFTYVNE-UHFFFAOYSA-N	1	0	270.417	1.192	50	0		CDAARO
COCC[NH+]1CCC(CN(C)c2nnc(C)s2)CC1	ZINC000670437307	482976240	/nfs/dbraw/zinc/97/62/40/482976240.db2.gz	RZKVXPHQXATTKS-UHFFFAOYSA-N	1	0	284.429	1.641	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2ccc(Br)cc2)C1	ZINC000042317176	372343857	/nfs/dbraw/zinc/34/38/57/372343857.db2.gz	ZHJQXMFKXUEQEM-LLVKDONJSA-N	1	0	255.159	1.982	50	0		CDAARO
COC(=O)[C@@H]1CN(CCC[NH+]2CCCCC2)C[C@@H](C)O1	ZINC000097100757	541887010	/nfs/dbraw/zinc/88/70/10/541887010.db2.gz	ZSENEEDQGKTVBR-KGLIPLIRSA-N	1	0	284.400	1.125	50	0		CDAARO
C[C@@H]1C[N@@H+]2CCCC[C@H]2CN1C(=O)COCC1CC1	ZINC000253390638	373682181	/nfs/dbraw/zinc/68/21/81/373682181.db2.gz	QLQPAYDDKVQPOX-OCCSQVGLSA-N	1	0	266.385	1.498	50	0		CDAARO
O=C(N[C@H]1CCC[NH2+]C1)c1ccc(F)c(F)c1F	ZINC000084609361	374062747	/nfs/dbraw/zinc/06/27/47/374062747.db2.gz	VGWKDULMXGMTPO-ZETCQYMHSA-N	1	0	258.243	1.586	50	0		CDAARO
C[C@H](NC(=O)C[NH+]1CCCC1)c1nc2ccccc2[nH]1	ZINC000252484421	189975723	/nfs/dbraw/zinc/97/57/23/189975723.db2.gz	FVTLOGJCFUUUBI-NSHDSACASA-N	1	0	272.352	1.836	50	0		CDAARO
C1=CC[C@H](C[N@H+]2CC[C@H](CN3CCOCC3)C2)CC1	ZINC000093664012	374775874	/nfs/dbraw/zinc/77/58/74/374775874.db2.gz	MSTSDPOUJXITSU-JKSUJKDBSA-N	1	0	264.413	1.997	50	0		CDAARO
C[C@H](C[NH2+][C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C)N1CCOC[C@@H]1C	ZINC000108490403	412830565	/nfs/dbraw/zinc/83/05/65/412830565.db2.gz	OCUWOJHJGIJUTM-CWVYHPPDSA-N	1	0	296.455	1.889	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1Nc1cc(C2CC2)ncn1	ZINC000095376329	374893239	/nfs/dbraw/zinc/89/32/39/374893239.db2.gz	XDDCMCJGGNMZPQ-STQMWFEESA-N	1	0	262.357	1.485	50	0		CDAARO
C[C@H](CCc1ccccc1)C[NH2+]CCS(C)(=O)=O	ZINC000095450152	374949302	/nfs/dbraw/zinc/94/93/02/374949302.db2.gz	BPPSMZKQQKVGNA-CYBMUJFWSA-N	1	0	269.410	1.890	50	0		CDAARO
Cn1cc(NC(=O)c2ccnc(OCC[NH+](C)C)c2)cn1	ZINC000095451431	374952248	/nfs/dbraw/zinc/95/22/48/374952248.db2.gz	QUFKFYDDDKHMSY-UHFFFAOYSA-N	1	0	289.339	1.008	50	0		CDAARO
CN(C[C@@H]1CCC[N@@H+]1CCOCCO)c1ccccc1	ZINC000095399800	374905476	/nfs/dbraw/zinc/90/54/76/374905476.db2.gz	AAXDATKAVSWBPZ-INIZCTEOSA-N	1	0	278.396	1.596	50	0		CDAARO
CC(C)C[NH+]1CCN([C@H]2CCCN(C(C)C)C2=O)CC1	ZINC000095963653	375042614	/nfs/dbraw/zinc/04/26/14/375042614.db2.gz	GIUZJTSKNFJIDE-HNNXBMFYSA-N	1	0	281.444	1.659	50	0		CDAARO
COC[C@@H](O)C[N@H+](C)[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000096406962	375097533	/nfs/dbraw/zinc/09/75/33/375097533.db2.gz	POXWKYDMCKRORJ-LSDHHAIUSA-N	1	0	292.379	1.121	50	0		CDAARO
CCC(=O)NCc1ccccc1C[N@@H+]1CCC[C@@H]1CO	ZINC000097238406	375157960	/nfs/dbraw/zinc/15/79/60/375157960.db2.gz	GDFXCEZQILFABP-OAHLLOKOSA-N	1	0	276.380	1.670	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1csc(-c2ccncc2)n1	ZINC000003108068	375542154	/nfs/dbraw/zinc/54/21/54/375542154.db2.gz	JTEUPZGLAKUYPM-UHFFFAOYSA-N	1	0	290.392	1.887	50	0		CDAARO
CCn1cc(NC(=O)N[C@H](C)C[NH+](CC)CC)cn1	ZINC000058014228	375634360	/nfs/dbraw/zinc/63/43/60/375634360.db2.gz	LXOFQKPBSSUPAQ-LLVKDONJSA-N	1	0	267.377	1.755	50	0		CDAARO
O[C@@H](Cn1cccn1)C[N@@H+]1CCC[C@H]2CCCC[C@H]21	ZINC000242167639	376021626	/nfs/dbraw/zinc/02/16/26/376021626.db2.gz	WYEWAMXNQLJOHG-RBSFLKMASA-N	1	0	263.385	1.899	50	0		CDAARO
Cn1cc(CNC(=O)N2CC[C@@H]([NH+]3CCCCC3)C2)cn1	ZINC000264607598	190122668	/nfs/dbraw/zinc/12/26/68/190122668.db2.gz	OTYWTVNVCMRHKQ-CQSZACIVSA-N	1	0	291.399	1.190	50	0		CDAARO
Cc1n[nH]c(C)c1CCCN[C@@H]1CC[NH2+]C1(C)C	ZINC000067756356	377235872	/nfs/dbraw/zinc/23/58/72/377235872.db2.gz	OKIKBJTWSHRQDW-CYBMUJFWSA-N	1	0	250.390	1.689	50	0		CDAARO
COc1csc(C(=O)N2CC[C@@H]([NH3+])C[C@H]2C)c1	ZINC000124749325	256852085	/nfs/dbraw/zinc/85/20/85/256852085.db2.gz	DMHRNJCIUZIWTM-RKDXNWHRSA-N	1	0	254.355	1.709	50	0		CDAARO
COc1csc(C(=O)N2CC[C@H]([NH3+])C[C@@H]2C)c1	ZINC000124750010	256853061	/nfs/dbraw/zinc/85/30/61/256853061.db2.gz	DMHRNJCIUZIWTM-IUCAKERBSA-N	1	0	254.355	1.709	50	0		CDAARO
COC[C@H]([NH2+]CCc1ccc2c(c1)OCO2)C1CC1	ZINC000095419497	184975449	/nfs/dbraw/zinc/97/54/49/184975449.db2.gz	NRCMVBWXMTUURX-ZDUSSCGKSA-N	1	0	263.337	1.972	50	0		CDAARO
CC(C)N(C)C(=O)[C@@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000015075560	390214363	/nfs/dbraw/zinc/21/43/63/390214363.db2.gz	QZVWUVOWIRTPSF-CQSZACIVSA-N	1	0	281.444	1.659	50	0		CDAARO
CCOC(=O)[C@H]1CC[C@H]([NH3+])[C@H](NC(=O)OC(C)(C)C)C1	ZINC000034865846	390405580	/nfs/dbraw/zinc/40/55/80/390405580.db2.gz	STWAQGKVYHZJCJ-GARJFASQSA-N	1	0	286.372	1.570	50	0		CDAARO
FC(F)(F)c1nc2nccc([C@@H]3CCC[NH2+]C3)n2n1	ZINC000035605726	390408259	/nfs/dbraw/zinc/40/82/59/390408259.db2.gz	WHXSSDSWOIFQJL-SSDOTTSWSA-N	1	0	271.246	1.610	50	0		CDAARO
C[C@@H](C(=O)N(C)CCC(=O)NC1CC1)[NH+]1CCCCCC1	ZINC000095404290	390463099	/nfs/dbraw/zinc/46/30/99/390463099.db2.gz	LPMYPUAJWMEKOU-ZDUSSCGKSA-N	1	0	295.427	1.378	50	0		CDAARO
CC(C)(C)c1n[nH]cc1C[NH2+]CCCN1CCCC1=O	ZINC000097159555	390801163	/nfs/dbraw/zinc/80/11/63/390801163.db2.gz	PTGSDBISRHXPBM-UHFFFAOYSA-N	1	0	278.400	1.809	50	0		CDAARO
CO[C@H](C[N@@H+]1C[C@@H](O)C[C@@H]1CO)c1ccc(Cl)cc1	ZINC000241383453	391333295	/nfs/dbraw/zinc/33/32/95/391333295.db2.gz	MVLKNDFMRJKBSU-HZSPNIEDSA-N	1	0	285.771	1.455	50	0		CDAARO
NC(=O)c1ccc(-c2ccc(F)c3c2O[C@H](C[NH3+])C3)cc1	ZINC000299799976	391721395	/nfs/dbraw/zinc/72/13/95/391721395.db2.gz	YBJQWECKZANSOB-NSHDSACASA-N	1	0	286.306	1.854	50	0		CDAARO
CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)[C@H]1CCC[NH2+]C1	ZINC000246755478	131096641	/nfs/dbraw/zinc/09/66/41/131096641.db2.gz	PUWPONPSXPYXNB-HZSPNIEDSA-N	1	0	282.428	1.944	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)c1ccccc1C(F)(F)F	ZINC000036235638	392394794	/nfs/dbraw/zinc/39/47/94/392394794.db2.gz	AUGHTEKCNYRFDI-QWRGUYRKSA-N	1	0	288.269	1.422	50	0		CDAARO
CC(C)[N@@H+](CC(=O)N1CCN(C)CC1)C[C@@H]1C[C@@H]1C	ZINC000093193984	393118344	/nfs/dbraw/zinc/11/83/44/393118344.db2.gz	MFJCFWOMZNGVGY-KBPBESRZSA-N	1	0	267.417	1.127	50	0		CDAARO
C[C@H]([NH2+]C[C@@H]1CN(C)CCN1C)c1ccccc1N(C)C	ZINC000093945020	393132367	/nfs/dbraw/zinc/13/23/67/393132367.db2.gz	YMQXQUKAMNASFG-LSDHHAIUSA-N	1	0	290.455	1.649	50	0		CDAARO
CCN1CC[NH+](C[C@H](C)CNc2nc(C)cnc2C)CC1	ZINC000195575054	393305110	/nfs/dbraw/zinc/30/51/10/393305110.db2.gz	KWPKFMFAXUPTGU-CYBMUJFWSA-N	1	0	291.443	1.779	50	0		CDAARO
Cc1cc(Nc2ccccc2)nc(N2CC[NH2+]CC2)n1	ZINC000084656793	135033764	/nfs/dbraw/zinc/03/37/64/135033764.db2.gz	VCNGEWKXXBBLMN-UHFFFAOYSA-N	1	0	269.352	1.938	50	0		CDAARO
COc1cccc2c1CC[C@H]2[NH2+][C@@H]1CCCNC1=O	ZINC000095421368	147114406	/nfs/dbraw/zinc/11/44/06/147114406.db2.gz	XPUSFAWKQLEPJN-CHWSQXEVSA-N	1	0	260.337	1.551	50	0		CDAARO
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178530036	148064813	/nfs/dbraw/zinc/06/48/13/148064813.db2.gz	IBCFTXKFLAADGC-NXEZZACHSA-N	1	0	284.306	1.539	50	0		CDAARO
Cn1cc(CCC[NH2+][C@H]2CCCC[C@@H]2S(C)(=O)=O)cn1	ZINC000182767978	148265754	/nfs/dbraw/zinc/26/57/54/148265754.db2.gz	WLNSXVGBLRFKGU-KBPBESRZSA-N	1	0	299.440	1.298	50	0		CDAARO
COc1ccc(N2C(=O)C[C@H]([NH2+]C(C)C)C2=O)cc1	ZINC000004898769	170037693	/nfs/dbraw/zinc/03/76/93/170037693.db2.gz	YOYGBCWYYDSYND-LBPRGKRZSA-N	1	0	262.309	1.325	50	0		CDAARO
COC[C@H](C)[NH2+]Cc1cc2c(c(OC)c1)OCO2	ZINC000004997034	170052202	/nfs/dbraw/zinc/05/22/02/170052202.db2.gz	UMVNCRDEPAFGAI-VIFPVBQESA-N	1	0	253.298	1.548	50	0		CDAARO
C[NH+](C)CCNC(=O)c1ccc(Br)cc1	ZINC000005027171	170057834	/nfs/dbraw/zinc/05/78/34/170057834.db2.gz	FZLBXEXCEQMSAD-UHFFFAOYSA-N	1	0	271.158	1.741	50	0		CDAARO
[NH3+]C[C@H](c1cccnc1)S(=O)(=O)c1ccc(F)cc1	ZINC000008031085	170315251	/nfs/dbraw/zinc/31/52/51/170315251.db2.gz	BANHAGSXTBSCPV-CYBMUJFWSA-N	1	0	280.324	1.694	50	0		CDAARO
COc1ccc(OC)c(NC(=O)C[NH2+]C(C)C)c1	ZINC000012807620	170512493	/nfs/dbraw/zinc/51/24/93/170512493.db2.gz	GAPHMBMVIAPZNM-UHFFFAOYSA-N	1	0	252.314	1.640	50	0		CDAARO
CC(C)OCCC[NH2+]Cc1ccc2c(c1)n(C)c(=O)n2C	ZINC000013721883	170582152	/nfs/dbraw/zinc/58/21/52/170582152.db2.gz	MMBGKZYQGABNGW-UHFFFAOYSA-N	1	0	291.395	1.782	50	0		CDAARO
Cc1[nH+]c(N2CCCC2)nc(NCCn2cncn2)c1C	ZINC000534663973	411829441	/nfs/dbraw/zinc/82/94/41/411829441.db2.gz	NFEZEYDZHGENSS-UHFFFAOYSA-N	1	0	287.371	1.397	50	0		CDAARO
CC[NH+]1CCN(CCOc2ccc(C(C)=O)cc2)CC1	ZINC000020389822	171178897	/nfs/dbraw/zinc/17/88/97/171178897.db2.gz	QNRULHVDZJOOSM-UHFFFAOYSA-N	1	0	276.380	1.906	50	0		CDAARO
C[NH+](C)Cc1cccc(C(=O)N2CCCOCC2)c1	ZINC000020454172	171208288	/nfs/dbraw/zinc/20/82/88/171208288.db2.gz	ORXCVCQATGWKOP-UHFFFAOYSA-N	1	0	262.353	1.611	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)Nc2ccc(Cl)cn2)CC1	ZINC000020595167	171264191	/nfs/dbraw/zinc/26/41/91/171264191.db2.gz	LUOXYROIDNQBGF-UHFFFAOYSA-N	1	0	296.802	1.701	50	0		CDAARO
CCCC[N@H+](C)CCn1c(=O)c2cccnc2[nH]c1=S	ZINC000020618245	171267972	/nfs/dbraw/zinc/26/79/72/171267972.db2.gz	CSCNRDVQEXSKAP-UHFFFAOYSA-N	1	0	292.408	1.812	50	0		CDAARO
C[NH+](C)CCN1C(=O)[C@H]2CC=C(Cl)C[C@@H]2C1=O	ZINC000020841199	171275652	/nfs/dbraw/zinc/27/56/52/171275652.db2.gz	ZDJWLMQGBPGACF-UWVGGRQHSA-N	1	0	256.733	1.066	50	0		CDAARO
O=C1c2ccccc2C(=O)N1CCC[N@H+]1CCC[C@@H](O)C1	ZINC000020941846	171282129	/nfs/dbraw/zinc/28/21/29/171282129.db2.gz	BVCIOXLIVIATCZ-GFCCVEGCSA-N	1	0	288.347	1.129	50	0		CDAARO
Cc1nn(C)cc1CN1CC[N@@H+](CC(C)C)[C@@H](CCO)C1	ZINC000020996473	171284422	/nfs/dbraw/zinc/28/44/22/171284422.db2.gz	VKIZFUQOLCLIOO-INIZCTEOSA-N	1	0	294.443	1.253	50	0		CDAARO
COc1cccc(OC)c1OCCN1CC[NH+](C)CC1	ZINC000022037098	171350249	/nfs/dbraw/zinc/35/02/49/171350249.db2.gz	NCQJYBKGVGRVTL-UHFFFAOYSA-N	1	0	280.368	1.330	50	0		CDAARO
O=C(CC[NH+]1CCC(O)CC1)Nc1ccccc1F	ZINC000022199062	171371997	/nfs/dbraw/zinc/37/19/97/171371997.db2.gz	YWFXDQLOLJCULW-UHFFFAOYSA-N	1	0	266.316	1.611	50	0		CDAARO
CC(C)Oc1ccc(C[N@H+](C)[C@@H]2COC[C@H]2O)cc1	ZINC000285685972	196365737	/nfs/dbraw/zinc/36/57/37/196365737.db2.gz	VCKIHJNEKRGSNR-HUUCEWRRSA-N	1	0	265.353	1.665	50	0		CDAARO
O=S(=O)(NC[C@@H]1CCCC[NH2+]1)c1cc(F)ccc1F	ZINC000037377304	173166120	/nfs/dbraw/zinc/16/61/20/173166120.db2.gz	JVYSNRMXQBRXTC-JTQLQIEISA-N	1	0	290.335	1.385	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC[NH2+]CC2)cc1F	ZINC000037463910	173225584	/nfs/dbraw/zinc/22/55/84/173225584.db2.gz	UMIDBWXAZDDWBB-UHFFFAOYSA-N	1	0	272.345	1.118	50	0		CDAARO
O[C@H](C[NH2+]Cc1cccnc1)COc1ccc(F)cc1	ZINC000037850952	173803457	/nfs/dbraw/zinc/80/34/57/173803457.db2.gz	ZJIDUPYDYNOSHQ-CQSZACIVSA-N	1	0	276.311	1.750	50	0		CDAARO
O=C(C[NH+]1CCCC1)N1CCC(c2ccccc2)=N1	ZINC000040465708	174274345	/nfs/dbraw/zinc/27/43/45/174274345.db2.gz	AKDFGVIIQJWZQT-UHFFFAOYSA-N	1	0	257.337	1.719	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1cc(-c2ccco2)on1	ZINC000040641730	174364286	/nfs/dbraw/zinc/36/42/86/174364286.db2.gz	FYHNBDGZCGXRJW-UHFFFAOYSA-N	1	0	263.297	1.616	50	0		CDAARO
Brc1cccnc1OC1CC[NH2+]CC1	ZINC000051865726	175526647	/nfs/dbraw/zinc/52/66/47/175526647.db2.gz	SZFPVHIFVPFUKO-UHFFFAOYSA-N	1	0	257.131	1.975	50	0		CDAARO
Cc1cc(C(=O)NCCNc2cc(C)cc[nH+]2)[nH]n1	ZINC000071747969	176258729	/nfs/dbraw/zinc/25/87/29/176258729.db2.gz	TXSPVMFZWDHITN-UHFFFAOYSA-N	1	0	259.313	1.263	50	0		CDAARO
Cc1c(CN2CC([N@H+]3CCCC[C@H]3C)C2)cnn1C	ZINC000072140084	176323094	/nfs/dbraw/zinc/32/30/94/176323094.db2.gz	SIBJDFIPYPYKTK-GFCCVEGCSA-N	1	0	262.401	1.787	50	0		CDAARO
COCCCNc1nc(-c2cccnc2)nc2c1C[NH2+]C2	ZINC000072140540	176323567	/nfs/dbraw/zinc/32/35/67/176323567.db2.gz	SFGUEACHTUQBLV-UHFFFAOYSA-N	1	0	285.351	1.590	50	0		CDAARO
CC[C@@H]1CN(Cc2cccnc2N)CC[N@@H+]1C(C)C	ZINC000072154080	176328007	/nfs/dbraw/zinc/32/80/07/176328007.db2.gz	IEWQSWNCRXZRAE-CQSZACIVSA-N	1	0	262.401	1.968	50	0		CDAARO
COC[C@H](C)Nc1nc(-c2ccccn2)nc2c1CC[NH2+]C2	ZINC000072166213	176331920	/nfs/dbraw/zinc/33/19/20/176331920.db2.gz	SHLCQNKLUXZCGQ-NSHDSACASA-N	1	0	299.378	1.631	50	0		CDAARO
[NH3+]CC(=O)N[C@@H]1CCCN(Cc2ccc(Cl)cc2)C1	ZINC000072409824	176398527	/nfs/dbraw/zinc/39/85/27/176398527.db2.gz	AVEBHFIVNGVUPB-CYBMUJFWSA-N	1	0	281.787	1.379	50	0		CDAARO
O[C@@H](CNc1ncnc2c1CC[NH2+]CC2)c1ccccc1	ZINC000072435523	176403227	/nfs/dbraw/zinc/40/32/27/176403227.db2.gz	RRYQCJCMTVHWNI-HNNXBMFYSA-N	1	0	284.363	1.310	50	0		CDAARO
COc1ccc2[nH]c(C(=O)N3C[C@@H]4CC[N@H+](C)[C@@H]4C3)cc2c1	ZINC000077505256	177275829	/nfs/dbraw/zinc/27/58/29/177275829.db2.gz	WYPLOCKYYDWAJM-MEDUHNTESA-N	1	0	299.374	1.953	50	0		CDAARO
CCCN(C(=O)Cc1ccccc1OC)[C@H]1CC[NH2+]C1	ZINC000037540018	260114213	/nfs/dbraw/zinc/11/42/13/260114213.db2.gz	LEXRBRUTKQNQQF-AWEZNQCLSA-N	1	0	276.380	1.838	50	0		CDAARO
COc1ccnc(C[N@H+](C)CC2CCOCC2)c1OC	ZINC000191031164	262188432	/nfs/dbraw/zinc/18/84/32/262188432.db2.gz	KMXDRSMWOSXENV-UHFFFAOYSA-N	1	0	280.368	1.957	50	0		CDAARO
CC(C)(C)OC(=O)CN1c2ccccc2CC[C@H]([NH3+])C1=O	ZINC000053112900	277178217	/nfs/dbraw/zinc/17/82/17/277178217.db2.gz	QTEDVVHLTMELTB-LBPRGKRZSA-N	1	0	290.363	1.635	50	0	in-vitro	CDAARO
CC(C)(C)OC(=O)N1CCN(C[C@H]2CCC[NH2+]C2)CC1	ZINC000040457335	277188217	/nfs/dbraw/zinc/18/82/17/277188217.db2.gz	LCBUIDRWWNJXKR-ZDUSSCGKSA-N	1	0	283.416	1.539	50	0		CDAARO
COC(=O)CC[N@@H+]1CCNC(=O)C[C@@H]1c1ccccc1	ZINC000089400824	277318716	/nfs/dbraw/zinc/31/87/16/277318716.db2.gz	NZLDYWYAGNAYSY-CYBMUJFWSA-N	1	0	276.336	1.113	50	0		CDAARO
CS[C@H]1CCC[C@H]1[N@H+](C)CCN1C(=O)CCC1=O	ZINC000096441747	278162256	/nfs/dbraw/zinc/16/22/56/278162256.db2.gz	NVAOHARBGMASTR-MNOVXSKESA-N	1	0	270.398	1.351	50	0		CDAARO
CC(C)(C)OC(=O)NC1CC[NH+](CC(N)=S)CC1	ZINC000060276667	278425759	/nfs/dbraw/zinc/42/57/59/278425759.db2.gz	FFBXGQRKTUFOBS-UHFFFAOYSA-N	1	0	273.402	1.262	50	0		CDAARO
CC(C)Oc1ccc2c(c1)C(=O)NC1(CC[NH2+]CC1)O2	ZINC000261494967	279728930	/nfs/dbraw/zinc/72/89/30/279728930.db2.gz	YLBZPEVIKKRAOX-UHFFFAOYSA-N	1	0	276.336	1.676	50	0		CDAARO
[NH3+][C@@H](CC(F)F)C(=O)Nc1cnn(-c2ccccn2)c1	ZINC000520819500	281057743	/nfs/dbraw/zinc/05/77/43/281057743.db2.gz	CEDHXEGXKSSXQO-VIFPVBQESA-N	1	0	281.266	1.188	50	0		CDAARO
C[C@@H]1CN(C(=O)/C=C\c2ccc(-n3ccnc3)cc2)CC[NH2+]1	ZINC000254956024	289346968	/nfs/dbraw/zinc/34/69/68/289346968.db2.gz	ZMZFMPKMHBFPGQ-HJHHMULASA-N	1	0	296.374	1.706	50	0		CDAARO
CC[NH+](CC)CC[C@@H](CO)NC(=O)c1c[nH]cc1C	ZINC000571194811	294386789	/nfs/dbraw/zinc/38/67/89/294386789.db2.gz	PYSRULZPXZTBOI-LBPRGKRZSA-N	1	0	267.373	1.146	50	0		CDAARO
COc1cccc([C@@]2(O)CC[S@@](=O)C[C@@H]2C[NH+](C)C)c1	ZINC000000347489	295322729	/nfs/dbraw/zinc/32/27/29/295322729.db2.gz	SMRSCUYCLLYTCF-KPHUOKFYSA-N	1	0	297.420	1.213	50	0		CDAARO
c1coc(CN2CCC([NH2+]CCn3cncn3)CC2)c1	ZINC000534584081	328310406	/nfs/dbraw/zinc/31/04/06/328310406.db2.gz	LXLVZZRIRSUSPI-UHFFFAOYSA-N	1	0	275.356	1.125	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)c2ccn(C)c2C)CC1	ZINC000534585543	328315265	/nfs/dbraw/zinc/31/52/65/328315265.db2.gz	ZJXINYNCOKCKJO-UHFFFAOYSA-N	1	0	263.385	1.938	50	0		CDAARO
O=C(NCc1ccc2c(c1)CCCC2)[C@H]1C=CC[NH2+]1	ZINC000534591653	328318240	/nfs/dbraw/zinc/31/82/40/328318240.db2.gz	ZOGMVGDPXZLLQN-OAHLLOKOSA-N	1	0	256.349	1.710	50	0		CDAARO
C[C@H](CCNC(=O)N1CC(Oc2ccccc2)C1)[NH+](C)C	ZINC000534646553	328330134	/nfs/dbraw/zinc/33/01/34/328330134.db2.gz	RFLOLHFXVDXTHR-CYBMUJFWSA-N	1	0	291.395	1.799	50	0		CDAARO
O=C(c1cnc(C2CC2)nc1)N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000534651828	328337640	/nfs/dbraw/zinc/33/76/40/328337640.db2.gz	PUJSAGMVYFUUSO-KPWCQOOUSA-N	1	0	284.363	1.176	50	0		CDAARO
CCOc1ccnc(N2CCC[C@@]3(CC[NH2+]C3)C2)n1	ZINC000534652967	328338279	/nfs/dbraw/zinc/33/82/79/328338279.db2.gz	BKGBSPWNHWWMQN-AWEZNQCLSA-N	1	0	262.357	1.455	50	0		CDAARO
CC(C)c1nc(CN(C)C(=O)C[C@@H]2C[NH2+]CCO2)cs1	ZINC000534647915	328343124	/nfs/dbraw/zinc/34/31/24/328343124.db2.gz	LVGUVVACHWUSKX-GFCCVEGCSA-N	1	0	297.424	1.603	50	0		CDAARO
CCS(=O)(=O)NC[C@H](C)[NH2+]C1(c2ccc(C)cc2)CC1	ZINC000534658231	328341255	/nfs/dbraw/zinc/34/12/55/328341255.db2.gz	INXYGEMOKYGDQN-ZDUSSCGKSA-N	1	0	296.436	1.902	50	0		CDAARO
COCc1nc2n(n1)C[C@@H]([NH2+]CCC(C)(C)C)CC2	ZINC000097103961	323207568	/nfs/dbraw/zinc/20/75/68/323207568.db2.gz	QSIWHXFCYCTSBJ-NSHDSACASA-N	1	0	266.389	1.765	50	0		CDAARO
C[C@@H]([NH2+][C@@H](C)C(=O)NC[C@H]1CCCO1)C1CCOCC1	ZINC000252486254	323575247	/nfs/dbraw/zinc/57/52/47/323575247.db2.gz	HDPGLGYLVYQNEE-MBNYWOFBSA-N	1	0	284.400	1.075	50	0		CDAARO
C[C@H](NC(=O)[C@@H]1CCCOC1)C(C)(C)C[NH+](C)C	ZINC000096449595	533709116	/nfs/dbraw/zinc/70/91/16/533709116.db2.gz	LXCAXPVEVGKZDE-NWDGAFQWSA-N	1	0	256.390	1.506	50	0		CDAARO
CCOC(=O)[C@H]1C[N@H+](C)C[C@H]1C(=O)c1ccccc1	ZINC000248322580	334298103	/nfs/dbraw/zinc/29/81/03/334298103.db2.gz	WQKWIFSBDCEQNX-OLZOCXBDSA-N	1	0	261.321	1.610	50	0		CDAARO
OC[C@]1(O)CCC[N@H+](Cc2ccccc2C2CC2)C1	ZINC000585087139	482823099	/nfs/dbraw/zinc/82/30/99/482823099.db2.gz	JSZRMEWMSXZHDO-INIZCTEOSA-N	1	0	261.365	1.883	50	0		CDAARO
Cc1ncsc1CN1C[C@H](O)[C@@H]([NH+]2CCCCC2)C1	ZINC000670461302	483045017	/nfs/dbraw/zinc/04/50/17/483045017.db2.gz	UZLHXZNDQUKHQP-STQMWFEESA-N	1	0	281.425	1.483	50	0		CDAARO
Nc1nc(CNC(=O)C[C@@H]([NH3+])c2ccccc2)cs1	ZINC000670463502	483053429	/nfs/dbraw/zinc/05/34/29/483053429.db2.gz	LWYVXHOKUHFQJX-LLVKDONJSA-N	1	0	276.365	1.432	50	0		CDAARO
CNC(=O)[C@@H]1CC[N@H+](CC(=O)NC2CCCCCCC2)C1	ZINC000670469605	483064601	/nfs/dbraw/zinc/06/46/01/483064601.db2.gz	UVNKOTZKPSNRSF-CYBMUJFWSA-N	1	0	295.427	1.283	50	0		CDAARO
Cc1ncc(C[NH2+]CC[S@@](C)=O)n1-c1ccccc1	ZINC000084041671	483236127	/nfs/dbraw/zinc/23/61/27/483236127.db2.gz	BNPNZHGDMZIGMS-IBGZPJMESA-N	1	0	277.393	1.649	50	0		CDAARO
Cc1ncsc1CC[N@H+](C)CCn1cccn1	ZINC000172537821	534795821	/nfs/dbraw/zinc/79/58/21/534795821.db2.gz	NBKSYVJYQOCBBI-UHFFFAOYSA-N	1	0	250.371	1.823	50	0		CDAARO
O=C(NC[C@@H](O)c1ccccc1Cl)[C@@]1(F)CC[NH2+]C1	ZINC000299739184	526489488	/nfs/dbraw/zinc/48/94/88/526489488.db2.gz	LQMIKYNNNXMUTA-DGCLKSJQSA-N	1	0	286.734	1.191	50	0		CDAARO
CC[NH+]1CCN([C@H](C)CNc2nc(C)cc(C)n2)CC1	ZINC000096453474	529152168	/nfs/dbraw/zinc/15/21/68/529152168.db2.gz	XIKKUULYBQSMSL-CQSZACIVSA-N	1	0	277.416	1.531	50	0		CDAARO
CC[C@H]1CN(C(=O)NCC[N@H+](C)C(C)C)CCS1	ZINC000096439890	529272775	/nfs/dbraw/zinc/27/27/75/529272775.db2.gz	OHLZLADTCIOJDT-LBPRGKRZSA-N	1	0	273.446	1.864	50	0		CDAARO
COCC[NH2+]CCOCCOc1cc(C)ccc1C	ZINC000002975005	538148769	/nfs/dbraw/zinc/14/87/69/538148769.db2.gz	KFCXBGZIVQIORE-UHFFFAOYSA-N	1	0	267.369	1.935	50	0		CDAARO
C[C@@H]([NH3+])c1cccc(S(=O)(=O)C(F)(F)F)c1	ZINC000114691314	538338506	/nfs/dbraw/zinc/33/85/06/538338506.db2.gz	XMXLRIGZCMVDGP-ZCFIWIBFSA-N	1	0	253.245	2.000	50	0		CDAARO
COc1ccc(S(=O)(=O)NC2CC[NH+](C)CC2)cc1C	ZINC000067604025	538410186	/nfs/dbraw/zinc/41/01/86/538410186.db2.gz	LSWXQJOMIMDADJ-UHFFFAOYSA-N	1	0	298.408	1.376	50	0		CDAARO
CC(C)(C)NC(=O)NCC1([NH3+])CCC(F)(F)CC1	ZINC000725255286	538451513	/nfs/dbraw/zinc/45/15/13/538451513.db2.gz	YPWNCLUFAWQMEP-UHFFFAOYSA-N	1	0	263.332	1.991	50	0		CDAARO
NC[C@@H]1CC[C@H]([C@@H]2CC[C@H](C(F)(F)F)NC2)C[NH2+]1	ZINC000757211940	574906513	/nfs/dbraw/zinc/90/65/13/574906513.db2.gz	JJIVXKCAOKVNDZ-ZRUFSTJUSA-N	1	0	265.323	1.244	50	0		CDAARO
CC1(C)OC[C@@H](c2cn(CCCCC[NH3+])nn2)O1	ZINC000958528056	614827993	/nfs/dbraw/zinc/82/79/93/614827993.db2.gz	RASYZPBITWCCPZ-NSHDSACASA-N	1	0	254.334	1.231	50	0		CDAARO
CCN(CCc1nc2c(cccc2C)[nH]1)C(=O)[C@@H]1CC[NH2+]1	ZINC000952971860	615060443	/nfs/dbraw/zinc/06/04/43/615060443.db2.gz	YHKKYNMSTCTPPE-ZDUSSCGKSA-N	1	0	286.379	1.624	50	0		CDAARO
CC[C@@H](C(=O)NC1(CO)CCCCC1)[N@H+](C)CC	ZINC000952974599	615380206	/nfs/dbraw/zinc/38/02/06/615380206.db2.gz	OJGPJRVIIQOUIY-LBPRGKRZSA-N	1	0	256.390	1.528	50	0		CDAARO
C[N@@H+]1C[C@@H](C(=O)N2CC=CCC2)[C@H](C(F)(F)F)C1	ZINC000952992018	616478449	/nfs/dbraw/zinc/47/84/49/616478449.db2.gz	HVGWLJGCGPURMA-NXEZZACHSA-N	1	0	262.275	1.515	50	0		CDAARO
Cc1cnn(C)c1CN1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000888095804	617757016	/nfs/dbraw/zinc/75/70/16/617757016.db2.gz	HDARODHULUSVGG-UHFFFAOYSA-N	1	0	250.390	1.691	50	0		CDAARO
Cc1cc(C)c2c(c1)N(C(=O)c1conc1C[NH3+])CCO2	ZINC000888096747	617759530	/nfs/dbraw/zinc/75/95/30/617759530.db2.gz	PANALANFAOAPEI-UHFFFAOYSA-N	1	0	287.319	1.789	50	0		CDAARO
Cn1cc([C@@H](O)C[NH2+][C@@H]2CC[C@H]3C[C@@H]2C3(C)C)cn1	ZINC000888098909	617762013	/nfs/dbraw/zinc/76/20/13/617762013.db2.gz	QWTVGVQKCSEMPI-FQUUOJAGSA-N	1	0	263.385	1.868	50	0		CDAARO
Cn1cc([C@H](O)C[NH2+][C@@H]2CC[C@H]3C[C@@H]2C3(C)C)cn1	ZINC000888098913	617762267	/nfs/dbraw/zinc/76/22/67/617762267.db2.gz	QWTVGVQKCSEMPI-IGQOVBAYSA-N	1	0	263.385	1.868	50	0		CDAARO
CC[N@H+]1[C@H](C)CN(c2ccnc(C(=O)OC)n2)C[C@@H]1C	ZINC000874435238	632390924	/nfs/dbraw/zinc/39/09/24/632390924.db2.gz	OJCMPCHDFPQORD-PHIMTYICSA-N	1	0	278.356	1.182	50	0		CDAARO
Cc1nccc(NC[C@H]2CC3(CO2)CC[NH2+]CC3)n1	ZINC000871659004	695373035	/nfs/dbraw/zinc/37/30/35/695373035.db2.gz	BLBQIGDHWHRWOJ-GFCCVEGCSA-N	1	0	262.357	1.356	50	0		CDAARO
CN1CCC([N@@H+]2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)CC1	ZINC000001193410	695392643	/nfs/dbraw/zinc/39/26/43/695392643.db2.gz	QTYUSVDINJAGQZ-KGLIPLIRSA-N	1	0	287.407	1.362	50	0		CDAARO
C[N@@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCS1	ZINC000887268503	695784878	/nfs/dbraw/zinc/78/48/78/695784878.db2.gz	NMEULACYEZDUFK-QJPTWQEYSA-N	1	0	254.399	1.577	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)c1cncnc1N)c1cccs1	ZINC000185395820	695833884	/nfs/dbraw/zinc/83/38/84/695833884.db2.gz	MXKRJNPWCPPYPK-SNVBAGLBSA-N	1	0	291.380	1.153	50	0		CDAARO
Cn1ccnc1C[NH2+]CCc1nc(-c2ccccn2)no1	ZINC000952970867	696087191	/nfs/dbraw/zinc/08/71/91/696087191.db2.gz	UBQVGLQISQCLKA-UHFFFAOYSA-N	1	0	284.323	1.197	50	0		CDAARO
O=C(NCc1nc[nH]n1)c1ccc([C@H]2CCC[NH2+]2)s1	ZINC000019743248	696107045	/nfs/dbraw/zinc/10/70/45/696107045.db2.gz	GKQZADPGZAGARN-MRVPVSSYSA-N	1	0	277.353	1.221	50	0		CDAARO
CO[C@@H]1CCC[C@@]12CCCN(C(=O)CCC[NH3+])C2	ZINC001704297346	1177678760	/nfs/dbraw/zinc/67/87/60/1177678760.db2.gz	NOJWUPSYSJWNCY-OCCSQVGLSA-N	1	0	254.374	1.533	50	0		CDAARO
CC(=O)c1cnc(N2CC[NH+](CC3CCC3)CC2)nc1C	ZINC001704312888	1177683188	/nfs/dbraw/zinc/68/31/88/1177683188.db2.gz	DNFXFRJRAFXGPF-UHFFFAOYSA-N	1	0	288.395	1.910	50	0		CDAARO
Cc1cc(C(N)=O)c(NCC[C@@H]2CCC[N@@H+](C)C2)nc1C	ZINC001704313378	1177685941	/nfs/dbraw/zinc/68/59/41/1177685941.db2.gz	OXAZKAKFOBKDGR-ZDUSSCGKSA-N	1	0	290.411	1.941	50	0		CDAARO
Oc1ccc(CC[N@@H+]2C[C@@H](Cc3ccccn3)[C@H](O)C2)cc1	ZINC001704338719	1177695970	/nfs/dbraw/zinc/69/59/70/1177695970.db2.gz	YFIZXMDHARSNQQ-CRAIPNDOSA-N	1	0	298.386	1.865	50	0		CDAARO
CC[N@H+](C)Cc1cc(=O)n2nc(SC)sc2n1	ZINC001704352408	1177698573	/nfs/dbraw/zinc/69/85/73/1177698573.db2.gz	YGHSLGLUUFBJQQ-UHFFFAOYSA-N	1	0	270.383	1.325	50	0		CDAARO
CCCCCOCC(=O)N1C[C@]2(C)C[NH+](C)C[C@@]2(C)C1	ZINC000585128844	1164215049	/nfs/dbraw/zinc/21/50/49/1164215049.db2.gz	PCDJFVFWJZGOFK-HOTGVXAUSA-N	1	0	282.428	1.993	50	0		CDAARO
C[C@H]1[C@H]2CCC[N@@H+]2CCN1CC(C)(C)CN1CCOCC1	ZINC000032565183	724029962	/nfs/dbraw/zinc/02/99/62/724029962.db2.gz	QATOXTAWNQLKAG-JKSUJKDBSA-N	1	0	295.471	1.513	50	0		CDAARO
Cc1n[nH]c(C)c1CCNC(=O)CC[C@@H](C)[NH+]1CCCC1	ZINC000426443080	724057135	/nfs/dbraw/zinc/05/71/35/724057135.db2.gz	WQUORPYSHSBISX-GFCCVEGCSA-N	1	0	292.427	1.950	50	0		CDAARO
Cc1nc[nH]c1CNC(=O)C(C)(C)[NH+]1CCCC1	ZINC000426575133	724118314	/nfs/dbraw/zinc/11/83/14/724118314.db2.gz	POIACFKLPRXFGE-UHFFFAOYSA-N	1	0	250.346	1.209	50	0		CDAARO
CO[C@@]1(C)C[C@@H](O)C12CC[NH+](C1CCOCC1)CC2	ZINC000091548816	724540444	/nfs/dbraw/zinc/54/04/44/724540444.db2.gz	PIBAZLVQLXAMJH-KGLIPLIRSA-N	1	0	269.385	1.417	50	0		CDAARO
Cc1nnc(CN2CCC([N@@H+]3CCC[C@@H](O)C3)CC2)s1	ZINC000299791643	724170029	/nfs/dbraw/zinc/17/00/29/724170029.db2.gz	DXYIDTIMFDNEPZ-CYBMUJFWSA-N	1	0	296.440	1.268	50	0		CDAARO
COc1cc(C[C@H](C)[NH+]2CCN(C)CC2)ccc1O	ZINC000022916997	725173590	/nfs/dbraw/zinc/17/35/90/725173590.db2.gz	UOFSOAVLFXFWPT-LBPRGKRZSA-N	1	0	264.369	1.579	50	0		CDAARO
CN(CC[NH+](C)C)Cc1coc2ccccc2c1=O	ZINC000022455085	725685991	/nfs/dbraw/zinc/68/59/91/725685991.db2.gz	JCIVBWGSRQCLKR-UHFFFAOYSA-N	1	0	260.337	1.786	50	0		CDAARO
O=c1cc(CN(C2CCC2)C2C[NH2+]C2)nc2sccn21	ZINC000695153138	898946517	/nfs/dbraw/zinc/94/65/17/898946517.db2.gz	MHVDRGUQLFLIDW-UHFFFAOYSA-N	1	0	290.392	1.082	50	0		CDAARO
C[C@@H]1CN(C[C@H](O)Cn2cccn2)CC[N@@H+]1C1CCCC1	ZINC000952884278	910458140	/nfs/dbraw/zinc/45/81/40/910458140.db2.gz	WVZKDIBFAUUOIR-ZBFHGGJFSA-N	1	0	292.427	1.193	50	0		CDAARO
CC[N@@H+]1CC[C@@H](CN(C)c2nccc(OC)n2)C1	ZINC000823104912	925672628	/nfs/dbraw/zinc/67/26/28/925672628.db2.gz	WYIREDUHHGWOGB-NSHDSACASA-N	1	0	250.346	1.263	50	0		CDAARO
CCS(=O)(=O)N[C@H](C[NH+]1CCCC1)C(C)(C)C	ZINC000823412715	925693359	/nfs/dbraw/zinc/69/33/59/925693359.db2.gz	LNFAQRQZKIYLCS-LLVKDONJSA-N	1	0	262.419	1.436	50	0		CDAARO
Cc1cc(CNC(=O)N2CCCC[C@H]2C[NH3+])cnc1C	ZINC000827267962	925937237	/nfs/dbraw/zinc/93/72/37/925937237.db2.gz	HMCMECAGAZIDID-AWEZNQCLSA-N	1	0	276.384	1.721	50	0		CDAARO
O=C(C1CCC1)N1CCC[N@H+](CCc2ncc[nH]2)CC1	ZINC000827939039	926004282	/nfs/dbraw/zinc/00/42/82/926004282.db2.gz	BXYNLYVUPHIABB-UHFFFAOYSA-N	1	0	276.384	1.287	50	0		CDAARO
O=C1NCCC[C@@]12CC[N@H+](Cc1cncn1C1CC1)C2	ZINC000219568910	930881175	/nfs/dbraw/zinc/88/11/75/930881175.db2.gz	BAIVRPWQNXUQPD-HNNXBMFYSA-N	1	0	274.368	1.320	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1nc(CCO)c(C)s1	ZINC000585092931	930923894	/nfs/dbraw/zinc/92/38/94/930923894.db2.gz	URLAZTRZYCDUJZ-GFCCVEGCSA-N	1	0	283.441	1.695	50	0		CDAARO
C[C@@H]1COC[C@@H]1[NH2+]CCN(C)C(=O)OC(C)(C)C	ZINC000688049551	934528163	/nfs/dbraw/zinc/52/81/63/934528163.db2.gz	RBWOHHXEFWJESD-MNOVXSKESA-N	1	0	258.362	1.478	50	0		CDAARO
CCn1ncc(C)c1NC(=O)c1ccc(CC[NH3+])cc1	ZINC001529100690	968981521	/nfs/dbraw/zinc/98/15/21/968981521.db2.gz	WCXQAEDNUJNPLX-UHFFFAOYSA-N	1	0	272.352	1.965	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CN1CCC2(COC(=O)O2)CC1	ZINC001529192544	969009456	/nfs/dbraw/zinc/00/94/56/969009456.db2.gz	XDFRJRPSWQEMBH-GFCCVEGCSA-N	1	0	268.357	1.472	50	0		CDAARO
C[N@H+](CC1(C)COC1)[C@H]1CCC(=O)N(CC2CC2)CC1	ZINC001506398335	975147786	/nfs/dbraw/zinc/14/77/86/975147786.db2.gz	YQOBMVBBVHEGFG-AWEZNQCLSA-N	1	0	280.412	1.746	50	0		CDAARO
COCC[N@@H+]1CC[C@H](C(=O)Nc2cnn(C(C)C)c2)C1	ZINC001506399321	975148911	/nfs/dbraw/zinc/14/89/11/975148911.db2.gz	DTDCOYRVPCHEEJ-LBPRGKRZSA-N	1	0	280.372	1.371	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1C1CN(CCN2CCCC2=O)C1	ZINC001506412741	975154278	/nfs/dbraw/zinc/15/42/78/975154278.db2.gz	NQBARRHITUPSCH-ZDUSSCGKSA-N	1	0	265.401	1.167	50	0		CDAARO
CCCN(CCc1ccccc1)C(=O)[C@@H]([NH3+])[C@@H](C)O	ZINC001506415348	975155856	/nfs/dbraw/zinc/15/58/56/975155856.db2.gz	XMJAECGXYSVMRI-OCCSQVGLSA-N	1	0	264.369	1.176	50	0		CDAARO
COc1ncc(C[N@H+](C)CCc2scnc2C)cn1	ZINC001506415380	975155864	/nfs/dbraw/zinc/15/58/64/975155864.db2.gz	NLUVCUKQTPTYSN-UHFFFAOYSA-N	1	0	278.381	1.925	50	0		CDAARO
C[C@@H](CC(N)=O)[N@H+](C)Cc1cc(=O)c2cccc(F)c2[nH]1	ZINC001506417892	975157073	/nfs/dbraw/zinc/15/70/73/975157073.db2.gz	CFXPTGRZVKRJGZ-VIFPVBQESA-N	1	0	291.326	1.775	50	0		CDAARO
CCC[N@@H+]1CC[C@H](Nc2nc(N)nc(C)c2Cl)C1	ZINC001506428412	975161927	/nfs/dbraw/zinc/16/19/27/975161927.db2.gz	PSVKWUXWVSJMFY-VIFPVBQESA-N	1	0	269.780	1.917	50	0		CDAARO
O=C(NC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCCO1	ZINC000004750441	230369035	/nfs/dbraw/zinc/36/90/35/230369035.db2.gz	TWMLEMYWGACHBZ-INIZCTEOSA-N	1	0	288.391	1.946	50	0		CDAARO
Cc1cc(C[NH+](CCO)CCO)cc(C(C)(C)C)c1O	ZINC000096027222	341983126	/nfs/dbraw/zinc/98/31/26/341983126.db2.gz	JPUGHNUHHMPVIA-UHFFFAOYSA-N	1	0	281.396	1.785	50	0		CDAARO
NC(=O)[C@H]1CCCC[C@H]1[NH2+]Cc1nc2c(s1)CCC2	ZINC000097375107	342002853	/nfs/dbraw/zinc/00/28/53/342002853.db2.gz	UCNUUPGJDPIZHZ-VHSXEESVSA-N	1	0	279.409	1.766	50	0		CDAARO
C[C@H]1CCCC[C@@H]1[NH2+]Cc1nc(CS(C)(=O)=O)no1	ZINC000095941192	185036505	/nfs/dbraw/zinc/03/65/05/185036505.db2.gz	PRVSBVVGGMHJEF-UWVGGRQHSA-N	1	0	287.385	1.283	50	0		CDAARO
c1ncn(Cc2cccc(C[NH2+][C@@H]3CCSC3)c2)n1	ZINC000095967273	185046510	/nfs/dbraw/zinc/04/65/10/185046510.db2.gz	WZRISROARAACNY-CQSZACIVSA-N	1	0	274.393	1.922	50	0		CDAARO
C[C@@H]1CCC[C@@H]2CCC[N@H+](CCN3CCNC3=O)[C@H]12	ZINC000242100104	361754652	/nfs/dbraw/zinc/75/46/52/361754652.db2.gz	WEIVKEJJXIIWAS-MGPQQGTHSA-N	1	0	265.401	1.912	50	0		CDAARO
COCCc1noc(C2CC[NH+](C(C)C)CC2)n1	ZINC000096130668	185103515	/nfs/dbraw/zinc/10/35/15/185103515.db2.gz	GCMICEHNQLUPMR-UHFFFAOYSA-N	1	0	253.346	1.846	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@@H](CN(C)c2nccc(N)n2)C1	ZINC000096141249	185106268	/nfs/dbraw/zinc/10/62/68/185106268.db2.gz	LUUFDGUMBHYSLK-LBPRGKRZSA-N	1	0	263.389	1.615	50	0		CDAARO
C[NH+]1CCC(C)(c2nc([C@H]3CCOC3)no2)CC1	ZINC000096142193	185106448	/nfs/dbraw/zinc/10/64/48/185106448.db2.gz	CMJKQLLVAXQBSZ-JTQLQIEISA-N	1	0	251.330	1.557	50	0		CDAARO
COc1ccc(OCCC[N@H+](C)[C@H]2COC[C@@H]2O)cc1	ZINC000244719127	361858348	/nfs/dbraw/zinc/85/83/48/361858348.db2.gz	LXLVRFYXTUVVSO-GJZGRUSLSA-N	1	0	281.352	1.156	50	0		CDAARO
COc1c[nH]c(CN2CC([N@@H+]3CCCC[C@@H]3C)C2)cc1=O	ZINC000244700917	361856714	/nfs/dbraw/zinc/85/67/14/361856714.db2.gz	JWENPQXHSDDDPN-LBPRGKRZSA-N	1	0	291.395	1.854	50	0		CDAARO
CCOCCCNc1cc([C@H]2C[C@@H]([NH3+])C2)nc(N)n1	ZINC000244899806	361869071	/nfs/dbraw/zinc/86/90/71/361869071.db2.gz	ZQLKHXZUWOLZOH-AOOOYVTPSA-N	1	0	265.361	1.102	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1ccc(C(C)=O)cc1	ZINC000097229361	342204838	/nfs/dbraw/zinc/20/48/38/342204838.db2.gz	ULLXXDRBMIGRGQ-LBPRGKRZSA-N	1	0	284.381	1.295	50	0		CDAARO
COc1nccnc1CN1CC[N@H+](C)C[C@H]1C(C)C	ZINC000253426368	361938765	/nfs/dbraw/zinc/93/87/65/361938765.db2.gz	ZOPQVQFNVRBLTD-ZDUSSCGKSA-N	1	0	264.373	1.257	50	0		CDAARO
NC(=O)NC(=O)CC[N@@H+]1CCC[C@H]1/C=C/c1ccccc1	ZINC000253425912	361938849	/nfs/dbraw/zinc/93/88/49/361938849.db2.gz	ULNHNVOVNWBCEQ-VFNNOXKTSA-N	1	0	287.363	1.749	50	0		CDAARO
CC[C@@H]1CN(C(=O)C(C)C)CC[C@@H]1[NH2+]Cc1nccn1C	ZINC000084736434	342268375	/nfs/dbraw/zinc/26/83/75/342268375.db2.gz	ZMDKRWSUUYPQTA-KGLIPLIRSA-N	1	0	292.427	1.793	50	0		CDAARO
O=C(Nc1ccccc1N1CCCC1)[C@@H]1CCC[NH2+]1	ZINC000037016645	539141769	/nfs/dbraw/zinc/14/17/69/539141769.db2.gz	KSXLJCJEUXFULV-ZDUSSCGKSA-N	1	0	259.353	1.977	50	0		CDAARO
CC(C)[C@H](C(=O)N1CC[C@H](O)C1)[NH+]1CCCCC1	ZINC000085379725	342381548	/nfs/dbraw/zinc/38/15/48/342381548.db2.gz	CFXCZBKRZHQYDN-QWHCGFSZSA-N	1	0	254.374	1.090	50	0		CDAARO
CCc1ccnc(CNC(=O)NC2(C[NH+](C)C)CCC2)c1	ZINC000252509304	342384355	/nfs/dbraw/zinc/38/43/55/342384355.db2.gz	YKHZEOAOFUXJSA-UHFFFAOYSA-N	1	0	290.411	1.928	50	0		CDAARO
CCCNc1ccccc1NC(=O)[C@H]1CN(C)CCO1	ZINC000190140864	362338335	/nfs/dbraw/zinc/33/83/35/362338335.db2.gz	ZKURXMRHXKSOAK-CQSZACIVSA-N	1	0	277.368	1.778	50	0		CDAARO
CC[NH+](CC)CCCC1CCN(S(N)(=O)=O)CC1	ZINC000097082340	185523968	/nfs/dbraw/zinc/52/39/68/185523968.db2.gz	DPQVDKGGHXXPIZ-UHFFFAOYSA-N	1	0	277.434	1.024	50	0		CDAARO
O=C(Nc1c[nH+]ccc1N1CCCCC1)[C@@H]1COCCO1	ZINC000095958975	136517900	/nfs/dbraw/zinc/51/79/00/136517900.db2.gz	LHKPYBZJLJMFSC-AWEZNQCLSA-N	1	0	291.351	1.426	50	0		CDAARO
CC[C@H]1COCCN1C(=O)N[C@@H](C)C(C)(C)C[NH+](C)C	ZINC000085425485	179059663	/nfs/dbraw/zinc/05/96/63/179059663.db2.gz	CUXBSKDVLHMOAG-STQMWFEESA-N	1	0	285.432	1.783	50	0		CDAARO
Cn1nc(C(=O)N[C@H]2C[C@H]3CCC[C@@H](C2)[NH2+]3)c2ccccc21	ZINC000100012439	185701421	/nfs/dbraw/zinc/70/14/21/185701421.db2.gz	VIGVTDRZHFWDBM-ITGUQSILSA-N	1	0	298.390	1.976	50	0	in-vitro	CDAARO
CCS(=O)(=O)N1CC(C[NH2+][C@@H]2CC(C)(C)C[C@H]2C)C1	ZINC000193149886	362847351	/nfs/dbraw/zinc/84/73/51/362847351.db2.gz	IWEPSYGBGODEHS-DGCLKSJQSA-N	1	0	288.457	1.682	50	0		CDAARO
Cc1cccc(S(=O)(=O)N2CCC[NH2+]CC2)c1F	ZINC000193232335	362901231	/nfs/dbraw/zinc/90/12/31/362901231.db2.gz	DMXCNWUBSDKPHU-UHFFFAOYSA-N	1	0	272.345	1.118	50	0		CDAARO
CC(C)(C)[C@@H](O)C[NH2+][C@@H]1CCN(CC(F)(F)F)C1	ZINC000088720946	179658184	/nfs/dbraw/zinc/65/81/84/179658184.db2.gz	LENAEGRRZFUAMQ-ZJUUUORDSA-N	1	0	268.323	1.620	50	0		CDAARO
Cc1c(C(=O)NCCC[N@@H+]2CCCC[C@H]2CO)ccn1C	ZINC000584896403	349357272	/nfs/dbraw/zinc/35/72/72/349357272.db2.gz	YESBDGAYDUTXEE-AWEZNQCLSA-N	1	0	293.411	1.300	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CCC1CCN(S(C)(=O)=O)CC1	ZINC000089929757	179884641	/nfs/dbraw/zinc/88/46/41/179884641.db2.gz	DCHXQPXFLNVPOG-ZDUSSCGKSA-N	1	0	288.457	1.923	50	0		CDAARO
CCn1nc(CO)c2c1CC[N@@H+](C1Cc3ccccc3C1)C2	ZINC000584887656	349346650	/nfs/dbraw/zinc/34/66/50/349346650.db2.gz	PGBKSTPODZCSCT-UHFFFAOYSA-N	1	0	297.402	1.921	50	0		CDAARO
CN(CC[NH+]1CCCC1)C(=O)[C@@H]1CCOC(C)(C)C1	ZINC000584889721	349348997	/nfs/dbraw/zinc/34/89/97/349348997.db2.gz	KEVRIKYKHQPOCH-CYBMUJFWSA-N	1	0	268.401	1.746	50	0		CDAARO
COc1ccc2ncn(C[C@@]3(C)CC[N@H+](C)C3)c(=O)c2c1	ZINC000584892322	349351799	/nfs/dbraw/zinc/35/17/99/349351799.db2.gz	NJGFUBMJKCZBNG-INIZCTEOSA-N	1	0	287.363	1.747	50	0		CDAARO
COc1cc(NC2(C[NH+]3CCCCC3)CC2)nc(OC)n1	ZINC000584897711	349358879	/nfs/dbraw/zinc/35/88/79/349358879.db2.gz	VTWBKWMMADSAQW-UHFFFAOYSA-N	1	0	292.383	1.924	50	0		CDAARO
COc1ccc([C@@H]2CCC[N@@H+]2CCNC(C)=O)cc1	ZINC000090608691	180012079	/nfs/dbraw/zinc/01/20/79/180012079.db2.gz	WTLDOEIFCDYYGS-HNNXBMFYSA-N	1	0	262.353	1.968	50	0		CDAARO
C[C@@H]([NH2+]C[C@H]1CN2CCN1CC2)c1ccc2c(c1)OCO2	ZINC000090649282	180018130	/nfs/dbraw/zinc/01/81/30/180018130.db2.gz	LIRPGXFIBQLNJG-OCCSQVGLSA-N	1	0	289.379	1.066	50	0		CDAARO
C[C@@H]([NH2+]C[C@@]1(O)CCOC1)c1ccc(F)cc1F	ZINC000090850238	180046343	/nfs/dbraw/zinc/04/63/43/180046343.db2.gz	QLEPXFNGJBUKCW-RNCFNFMXSA-N	1	0	257.280	1.767	50	0		CDAARO
O=C(C[C@@H]1C[NH2+]CCO1)NCc1ccc(Cl)s1	ZINC000091312551	180132734	/nfs/dbraw/zinc/13/27/34/180132734.db2.gz	SQMNFLXMZFZLTQ-MRVPVSSYSA-N	1	0	274.773	1.396	50	0		CDAARO
C[C@@H]1C[N@H+](CCC(=O)NC2CCCC2)C[C@@]1(O)C1CC1	ZINC000091445075	180156931	/nfs/dbraw/zinc/15/69/31/180156931.db2.gz	MGDIOPRZDMOMLQ-WBMJQRKESA-N	1	0	280.412	1.528	50	0		CDAARO
C[C@@H]1CN(C(=O)C[NH+]2CCCC2)CC[C@@]1(O)C1CCC1	ZINC000091493440	180171076	/nfs/dbraw/zinc/17/10/76/180171076.db2.gz	KZVXCFMCKVXQQF-CJNGLKHVSA-N	1	0	280.412	1.482	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2cccc(-n3cnnc3)c2)C[C@@H]1C1CC1	ZINC000091726247	180243284	/nfs/dbraw/zinc/24/32/84/180243284.db2.gz	KYMUVVSBMDNJPO-CABCVRRESA-N	1	0	297.362	1.077	50	0		CDAARO
CCC[C@H]1CN(C(=O)CN(C)c2ccccc2)C[C@@H]1[NH3+]	ZINC000091819346	180262938	/nfs/dbraw/zinc/26/29/38/180262938.db2.gz	JZEOQRPQTHVQLB-ZFWWWQNUSA-N	1	0	275.396	1.709	50	0		CDAARO
C[NH+](C)C[C@H]1C[C@H](CO)CN(Cc2ccccn2)C1	ZINC000091966349	180293610	/nfs/dbraw/zinc/29/36/10/180293610.db2.gz	YQPAMHDKSIMYEC-KGLIPLIRSA-N	1	0	263.385	1.074	50	0		CDAARO
C[C@@H](C(=O)NCC[N@@H+]1CCC[C@@H](C)C1)n1cccn1	ZINC000106563360	186127472	/nfs/dbraw/zinc/12/74/72/186127472.db2.gz	STCXRFWUHRZVNB-OLZOCXBDSA-N	1	0	264.373	1.292	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)N[C@@H](C)c1ccccc1)[C@H]1CCOC1	ZINC000108334419	186213324	/nfs/dbraw/zinc/21/33/24/186213324.db2.gz	LNRFGXWFHTXHJL-IPYPFGDCSA-N	1	0	276.380	1.878	50	0		CDAARO
COC[C@H]1CCC[N@@H+]1CCC(=O)Nc1cccnc1	ZINC000065382559	362966719	/nfs/dbraw/zinc/96/67/19/362966719.db2.gz	LPPQGDNKVBIHLI-CYBMUJFWSA-N	1	0	263.341	1.521	50	0		CDAARO
OC[C@@H]1C[C@@H](O)C[N@@H+]1CCc1cccc(C(F)(F)F)c1	ZINC000628237933	362975155	/nfs/dbraw/zinc/97/51/55/362975155.db2.gz	DTBQPXJZSJHQRD-QWHCGFSZSA-N	1	0	289.297	1.675	50	0		CDAARO
Cc1cc(NC(=O)N(C)C2CC[NH+](C)CC2)no1	ZINC000012944440	366121101	/nfs/dbraw/zinc/12/11/01/366121101.db2.gz	IDGOUKGVERNYCH-UHFFFAOYSA-N	1	0	252.318	1.541	50	0		CDAARO
Cc1n[nH]cc1C[NH2+][C@H]1CCCN(c2ncccn2)C1	ZINC000037090239	363367898	/nfs/dbraw/zinc/36/78/98/363367898.db2.gz	WVEWLGTVUFRYCB-ZDUSSCGKSA-N	1	0	272.356	1.267	50	0		CDAARO
[NH3+][C@H]1CCCN(S(=O)(=O)c2ccc(F)c(F)c2)C1	ZINC000037116474	363396453	/nfs/dbraw/zinc/39/64/53/363396453.db2.gz	CQKFTQSNXMEVBH-QMMMGPOBSA-N	1	0	276.308	1.077	50	0		CDAARO
CC[C@H](O)[C@@H]1CCCC[N@@H+]1C[C@@H](O)CN1CCC(C)CC1	ZINC000195530867	363456924	/nfs/dbraw/zinc/45/69/24/363456924.db2.gz	VOJUROBBYILNPW-ULQDDVLXSA-N	1	0	298.471	1.705	50	0		CDAARO
C[C@H](CNC(=O)[C@H](C)Oc1ccccc1)C[NH+](C)C	ZINC000002881517	355986136	/nfs/dbraw/zinc/98/61/36/355986136.db2.gz	POVREMZLKFLXJK-OLZOCXBDSA-N	1	0	264.369	1.768	50	0		CDAARO
CCC[C@H](CN=c1nc(N(C)C)[nH]s1)[NH+](C)C	ZINC000584901421	355956310	/nfs/dbraw/zinc/95/63/10/355956310.db2.gz	KDJFWVWGZKRZFJ-SECBINFHSA-N	1	0	257.407	1.168	50	0		CDAARO
O=C(c1ccc(C(F)(F)F)cc1)N1CC[NH2+]CC1	ZINC000005001287	356048428	/nfs/dbraw/zinc/04/84/28/356048428.db2.gz	QBTRUOBOJNFCSN-UHFFFAOYSA-N	1	0	258.243	1.751	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1	ZINC000097373432	356094630	/nfs/dbraw/zinc/09/46/30/356094630.db2.gz	NTLNYBMBBNLTFL-YBTHPKLGSA-N	1	0	296.436	1.847	50	0		CDAARO
COCCN(Cc1ccc(C)c(Cl)c1)[C@@H](C)C(N)=O	ZINC000193889007	358500625	/nfs/dbraw/zinc/50/06/25/358500625.db2.gz	YAOXMBFWRQCRID-NSHDSACASA-N	1	0	284.787	1.971	50	0		CDAARO
O[C@H](CN1CCOCC1)C[N@@H+]1CCC[C@@H]1c1ccccc1	ZINC000032889932	356412833	/nfs/dbraw/zinc/41/28/33/356412833.db2.gz	JYIQSMZPACXSFW-IAGOWNOFSA-N	1	0	290.407	1.517	50	0		CDAARO
C[NH+](C)C[C@H](O)COc1ccc(CN2CCCCO2)cc1	ZINC000015061539	356405304	/nfs/dbraw/zinc/40/53/04/356405304.db2.gz	WXVMKBNIENTOSL-HNNXBMFYSA-N	1	0	294.395	1.515	50	0		CDAARO
Cc1ccccc1O[C@H](C)C(=O)NC1CC[NH+](C)CC1	ZINC000016603066	356443029	/nfs/dbraw/zinc/44/30/29/356443029.db2.gz	FBYVVYLPMJTPFG-CYBMUJFWSA-N	1	0	276.380	1.973	50	0		CDAARO
CCOc1ccc(NC(=O)CC[NH+]2CCN(C)CC2)cc1	ZINC000019364117	356482516	/nfs/dbraw/zinc/48/25/16/356482516.db2.gz	WTEBPUFDVZMAST-UHFFFAOYSA-N	1	0	291.395	1.661	50	0		CDAARO
COc1ccc(CCC(=O)N2CCC[NH2+]CC2)cc1	ZINC000019390525	356483728	/nfs/dbraw/zinc/48/37/28/356483728.db2.gz	LWZMXXWBUPTQIN-UHFFFAOYSA-N	1	0	262.353	1.450	50	0		CDAARO
COc1cc(CN2CC[N@H+](C)[C@@H](CCO)C2)cc(OC)c1	ZINC000019743100	356499517	/nfs/dbraw/zinc/49/95/17/356499517.db2.gz	VXAODQAXKYIEAD-AWEZNQCLSA-N	1	0	294.395	1.202	50	0		CDAARO
Fc1ccccc1N1CCN(C2CC[NH2+]CC2)CC1	ZINC000019779170	356502017	/nfs/dbraw/zinc/50/20/17/356502017.db2.gz	BOLQWIBJKPSDGA-UHFFFAOYSA-N	1	0	263.360	1.700	50	0		CDAARO
CN1CCC[N@H+](C[C@@H](O)COCc2cccs2)CC1	ZINC000022876919	356623330	/nfs/dbraw/zinc/62/33/30/356623330.db2.gz	IKHZLHKOPZJERA-CYBMUJFWSA-N	1	0	284.425	1.263	50	0		CDAARO
C[C@H]1CN(C(=O)C(C)(C)n2cc(Cl)cn2)C[C@H]1[NH+](C)C	ZINC000078896462	538477252	/nfs/dbraw/zinc/47/72/52/538477252.db2.gz	VNYOOFCPBOGLOF-CMPLNLGQSA-N	1	0	298.818	1.680	50	0		CDAARO
O=C(CN1CCC2(CC1)OCCO2)NCc1cccs1	ZINC000026933579	356701136	/nfs/dbraw/zinc/70/11/36/356701136.db2.gz	STNRWNUAHGSRBG-UHFFFAOYSA-N	1	0	296.392	1.203	50	0		CDAARO
C[NH+](C)CCNC(=O)c1cnc2cc(Cl)ccc2c1O	ZINC000028475898	356721429	/nfs/dbraw/zinc/72/14/29/356721429.db2.gz	LYSRTMFIGKTUQF-UHFFFAOYSA-N	1	0	293.754	1.473	50	0		CDAARO
Cc1ccc(C[N@H+](CCC(=O)NC(N)=O)C2CC2)cc1	ZINC000027595085	356711253	/nfs/dbraw/zinc/71/12/53/356711253.db2.gz	QTNZZECXSNUTNV-UHFFFAOYSA-N	1	0	275.352	1.544	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@H](CNC(=O)c2cccs2)C1	ZINC000028013706	356716764	/nfs/dbraw/zinc/71/67/64/356716764.db2.gz	MLAQLMWEKPAXDD-GFCCVEGCSA-N	1	0	282.409	1.835	50	0		CDAARO
CCOCCN1CC[N@H+](C[C@H]2CCCCO2)C[C@@H]1CC	ZINC000247206980	356744315	/nfs/dbraw/zinc/74/43/15/356744315.db2.gz	PKUOPQFCZNLPOI-JKSUJKDBSA-N	1	0	284.444	1.988	50	0		CDAARO
COc1ccc(C[C@H](C)[NH+]2CCN(C=O)CC2)cc1	ZINC000023283129	356816674	/nfs/dbraw/zinc/81/66/74/356816674.db2.gz	WMUFINUBDHLEBE-ZDUSSCGKSA-N	1	0	262.353	1.400	50	0		CDAARO
CCC(CC)C[NH+]1CCC(NS(C)(=O)=O)CC1	ZINC000032565492	356783103	/nfs/dbraw/zinc/78/31/03/356783103.db2.gz	BVKLRCVEUOKJHC-UHFFFAOYSA-N	1	0	262.419	1.436	50	0		CDAARO
C[NH2+][C@@H]1CCS(=O)(=O)c2ccc(Br)cc21	ZINC000035763225	356848707	/nfs/dbraw/zinc/84/87/07/356848707.db2.gz	AUSXOOHJDFBOTN-SECBINFHSA-N	1	0	290.182	1.887	50	0		CDAARO
Cc1ccc(C)c(C[N@H+]2CCN(C)[C@H](CCO)C2)c1	ZINC000039430137	356973309	/nfs/dbraw/zinc/97/33/09/356973309.db2.gz	KCQXCZWYBYENKU-MRXNPFEDSA-N	1	0	262.397	1.802	50	0		CDAARO
CCN(C(=O)c1[nH]nc2c1C[NH2+]CC2)C1CCCCC1	ZINC000042783810	357080292	/nfs/dbraw/zinc/08/02/92/357080292.db2.gz	MLTNDDWHQWJVFA-UHFFFAOYSA-N	1	0	276.384	1.850	50	0		CDAARO
O=S(=O)(N[C@@H]1CC[N@@H+]2CCCC[C@H]12)c1ccccc1	ZINC000046036412	357133933	/nfs/dbraw/zinc/13/39/33/357133933.db2.gz	CCJULNHRHTZKFT-ZIAGYGMSSA-N	1	0	280.393	1.592	50	0		CDAARO
C[C@@H](C(=O)NCCc1nccn1C)[NH+]1CCCCCC1	ZINC000095404150	357198227	/nfs/dbraw/zinc/19/82/27/357198227.db2.gz	SLBCHUXDQHZGBN-ZDUSSCGKSA-N	1	0	278.400	1.343	50	0		CDAARO
CCS(=O)(=O)NCCC[NH2+][C@H]1CCc2ccc(C)cc21	ZINC000095421396	357340422	/nfs/dbraw/zinc/34/04/22/357340422.db2.gz	NMSVRMTYKRLIKF-HNNXBMFYSA-N	1	0	296.436	1.901	50	0		CDAARO
C[C@@H]1CC(C)(C)C[C@](CO)([NH2+]CCN2C(=O)CCC2=O)C1	ZINC000095432079	357514277	/nfs/dbraw/zinc/51/42/77/357514277.db2.gz	JVZHJPZAYTUROP-MLGOLLRUSA-N	1	0	296.411	1.302	50	0		CDAARO
Cc1nnc([C@@H](C)NC(=O)CC[NH+]2CCCCCCC2)[nH]1	ZINC000063872502	357519005	/nfs/dbraw/zinc/51/90/05/357519005.db2.gz	DORBKKFWLDCEHP-GFCCVEGCSA-N	1	0	293.415	1.947	50	0		CDAARO
C[C@H](COc1ccccc1)[NH2+]CCc1nnc(N)s1	ZINC000065382311	357534800	/nfs/dbraw/zinc/53/48/00/357534800.db2.gz	CLTZDKYXJAVXTN-SNVBAGLBSA-N	1	0	278.381	1.720	50	0		CDAARO
O=c1c2c(ncn1Cc1ccco1)sc1c2CC[NH2+]C1	ZINC000065399128	357537526	/nfs/dbraw/zinc/53/75/26/357537526.db2.gz	BQEHBGARZRBXPJ-UHFFFAOYSA-N	1	0	287.344	1.745	50	0		CDAARO
CCNc1ccnc(N2CC[C@@H]([NH+](CC)CC)C2)n1	ZINC000065403502	357537554	/nfs/dbraw/zinc/53/75/54/357537554.db2.gz	KDCRVEPTIIOOGZ-GFCCVEGCSA-N	1	0	263.389	1.829	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]CCCn2cc(C)cn2)CC1	ZINC000065431438	357541317	/nfs/dbraw/zinc/54/13/17/357541317.db2.gz	BRCIPPCKCYBOOQ-UHFFFAOYSA-N	1	0	294.399	1.792	50	0		CDAARO
C[NH+]1CCC(C)(C(=O)NCCC[C@@H]2CCOC2)CC1	ZINC000067679158	357618095	/nfs/dbraw/zinc/61/80/95/357618095.db2.gz	ORUUWQSYUINWSE-CYBMUJFWSA-N	1	0	268.401	1.651	50	0		CDAARO
CC[NH+](CC)CCN1c2ccc(C)cc2C(=O)C1=O	ZINC000002480516	357692176	/nfs/dbraw/zinc/69/21/76/357692176.db2.gz	BVLLOGWXVBAMCB-UHFFFAOYSA-N	1	0	260.337	1.866	50	0		CDAARO
CN(C)c1cc(C(=O)NCc2ncc[nH]2)c2ccccc2n1	ZINC000097080099	357943915	/nfs/dbraw/zinc/94/39/15/357943915.db2.gz	XOXWFXGLGMLLND-UHFFFAOYSA-N	1	0	295.346	1.954	50	0		CDAARO
Cc1nn(C)c2ncc(CN3CC[NH2+]C[C@@H]3C)cc12	ZINC000097095591	357952932	/nfs/dbraw/zinc/95/29/32/357952932.db2.gz	XBYLFUFJDPGVMP-JTQLQIEISA-N	1	0	259.357	1.070	50	0		CDAARO
C[C@H](NCc1nncn1C)[C@H]1CCC[N@@H+](C2CCC2)C1	ZINC000097110953	357986746	/nfs/dbraw/zinc/98/67/46/357986746.db2.gz	VUZZMUCDIAPGBP-STQMWFEESA-N	1	0	277.416	1.558	50	0		CDAARO
CSc1cncc(NC[C@@H](O)C[NH+]2CCCCC2)n1	ZINC000097162930	358004862	/nfs/dbraw/zinc/00/48/62/358004862.db2.gz	VHEBTUYSTOBJKB-LLVKDONJSA-N	1	0	282.413	1.457	50	0		CDAARO
CCOC(=O)[C@]1(C(C)C)CC[N@H+](Cc2cnn(C)c2)C1	ZINC000194857073	358542937	/nfs/dbraw/zinc/54/29/37/358542937.db2.gz	NYHPTNGKROYZQK-OAHLLOKOSA-N	1	0	279.384	1.831	50	0		CDAARO
COCC[NH2+]CCNC(=O)c1ccc2sccc2c1	ZINC000195547815	358560535	/nfs/dbraw/zinc/56/05/35/358560535.db2.gz	LWYYWLUWRISNLH-UHFFFAOYSA-N	1	0	278.377	1.867	50	0		CDAARO
Cc1cc(C(N)=O)ccc1NC(=O)N(C)[C@@H]1CC[N@H+](C)C1	ZINC000096165013	358712289	/nfs/dbraw/zinc/71/22/89/358712289.db2.gz	JOQZLLRTFZBAJS-GFCCVEGCSA-N	1	0	290.367	1.262	50	0		CDAARO
Cc1nc2ncccn2c1C(=O)NCc1ccc(C[NH3+])cc1	ZINC000097394138	358773021	/nfs/dbraw/zinc/77/30/21/358773021.db2.gz	BGXPJOMWKARYPQ-UHFFFAOYSA-N	1	0	295.346	1.426	50	0		CDAARO
COc1cc(CN2C[C@H]3CC[C@@H](C2)[NH2+]C3)cc2c1OCO2	ZINC000097784970	358798864	/nfs/dbraw/zinc/79/88/64/358798864.db2.gz	NMTHOPNJGMQKHX-AAEUAGOBSA-N	1	0	290.363	1.608	50	0		CDAARO
Cc1ncc(C[NH+]2CCC(Cn3cccn3)CC2)[nH]1	ZINC000215196841	358878869	/nfs/dbraw/zinc/87/88/69/358878869.db2.gz	SPGIRVGYOUPSOY-UHFFFAOYSA-N	1	0	259.357	1.827	50	0		CDAARO
COC[C@H]1CC[N@H+](Cc2ccc3c(c2)OCCO3)C1	ZINC000215473031	358889872	/nfs/dbraw/zinc/88/98/72/358889872.db2.gz	CKTUCHUTVOVUDT-ZDUSSCGKSA-N	1	0	263.337	1.926	50	0		CDAARO
COc1cccc2ccc(CN3CCOC[C@@H]3CO)nc21	ZINC000215482410	358891061	/nfs/dbraw/zinc/89/10/61/358891061.db2.gz	LTIZOWIBBHPLMJ-AWEZNQCLSA-N	1	0	288.347	1.437	50	0		CDAARO
Cc1nc2cc(C(=O)NCC[NH+]3CCCC3)ccc2[nH]1	ZINC000215509135	358892332	/nfs/dbraw/zinc/89/23/32/358892332.db2.gz	RCNKBITXERLCKG-UHFFFAOYSA-N	1	0	272.352	1.697	50	0		CDAARO
Cc1cnn(C)c1C[N@H+](C)C[C@H](O)c1ccccc1	ZINC000216045726	358920174	/nfs/dbraw/zinc/92/01/74/358920174.db2.gz	WKNRQMSNVJGXAU-HNNXBMFYSA-N	1	0	259.353	1.894	50	0		CDAARO
COCCN(Cc1ccsc1)C(=O)C[C@H]1CC[NH2+]C1	ZINC000216493867	358947400	/nfs/dbraw/zinc/94/74/00/358947400.db2.gz	XYLBXHSLAFCDKM-GFCCVEGCSA-N	1	0	282.409	1.723	50	0		CDAARO
[NH3+]CC(=O)N1CCc2[nH]nc(-c3cccc(F)c3)c2C1	ZINC000067559302	283419941	/nfs/dbraw/zinc/41/99/41/283419941.db2.gz	BHABJWYZOKCEDS-UHFFFAOYSA-N	1	0	274.299	1.059	50	0		CDAARO
CCCC[N@H+](C)CC1CCN(C(=O)[C@H](C)[NH3+])CC1	ZINC000037825972	359234602	/nfs/dbraw/zinc/23/46/02/359234602.db2.gz	GZCHVOOUEOHLEA-LBPRGKRZSA-N	1	0	255.406	1.304	50	0		CDAARO
C[C@H](CC(=O)N(C)CCc1ccncc1)[NH+]1CCOCC1	ZINC000221402610	359245053	/nfs/dbraw/zinc/24/50/53/359245053.db2.gz	MGLMSNWLCZCNPC-CQSZACIVSA-N	1	0	291.395	1.193	50	0		CDAARO
COCC[N@H+](C)Cc1cc2c(cc1OC)OCCCO2	ZINC000222372141	359337191	/nfs/dbraw/zinc/33/71/91/359337191.db2.gz	ZTRIKLWFRAMDIP-UHFFFAOYSA-N	1	0	281.352	1.935	50	0		CDAARO
COCC1CCN(c2cc(C3CC([NH3+])C3)nc(N)n2)CC1	ZINC000222418398	359341005	/nfs/dbraw/zinc/34/10/05/359341005.db2.gz	NBSUXDFNBKIFFQ-UHFFFAOYSA-N	1	0	291.399	1.126	50	0		CDAARO
Cc1ccc([C@@H](C)NC(=O)CC[NH+]2CCN(C)CC2)nc1	ZINC000222953068	359386872	/nfs/dbraw/zinc/38/68/72/359386872.db2.gz	WASAYLIYKNJAOA-CQSZACIVSA-N	1	0	290.411	1.205	50	0		CDAARO
Cc1ccc([C@H](C)NC(=O)CC[NH+]2CCN(C)CC2)nc1	ZINC000222953122	359387098	/nfs/dbraw/zinc/38/70/98/359387098.db2.gz	WASAYLIYKNJAOA-AWEZNQCLSA-N	1	0	290.411	1.205	50	0		CDAARO
C[C@H](C(=O)NC1CCCCC1)[NH+]1CCC2(CC1)OCCO2	ZINC000028077643	359523350	/nfs/dbraw/zinc/52/33/50/359523350.db2.gz	OUDUPRDSECRDNY-CYBMUJFWSA-N	1	0	296.411	1.663	50	0		CDAARO
C[C@@H]1C[N@H+](C)C[C@H]1NS(=O)(=O)/C=C/c1ccccc1	ZINC000257366228	359948354	/nfs/dbraw/zinc/94/83/54/359948354.db2.gz	OOFOEAJQOARGRV-UWCZFHCBSA-N	1	0	280.393	1.527	50	0		CDAARO
CC(C)Cc1cc(CSc2nnc(CC[NH3+])n2C)no1	ZINC000426434119	360529937	/nfs/dbraw/zinc/52/99/37/360529937.db2.gz	OHEXRUBTNTWEQQ-UHFFFAOYSA-N	1	0	295.412	1.795	50	0		CDAARO
CN(C)c1nc2sc(C(=O)N3CC[C@@H]([NH3+])C3)cc2s1	ZINC000178350355	189109590	/nfs/dbraw/zinc/10/95/90/189109590.db2.gz	JHDLSXOYDNTNHS-SSDOTTSWSA-N	1	0	296.421	1.597	50	0		CDAARO
C[C@@H](O)CSc1nnc(CC[NH3+])n1-c1ccccc1F	ZINC000426369125	360659832	/nfs/dbraw/zinc/65/98/32/360659832.db2.gz	FXPPDJYGKVRVJV-SECBINFHSA-N	1	0	296.371	1.381	50	0		CDAARO
Cc1nc(C(F)(F)F)ncc1CN1CCC[C@@H]([NH3+])C1	ZINC000426478813	360671912	/nfs/dbraw/zinc/67/19/12/360671912.db2.gz	NVUWVGSFYWLQOL-SNVBAGLBSA-N	1	0	274.290	1.727	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cc(F)cc3nc[nH]c32)C1	ZINC000178961689	189157612	/nfs/dbraw/zinc/15/76/12/189157612.db2.gz	MLASRKWAKPVZGM-SECBINFHSA-N	1	0	276.315	1.384	50	0		CDAARO
O=c1c2ccccc2ncn1CCC[NH+]1CCC(O)CC1	ZINC000032516131	360970233	/nfs/dbraw/zinc/97/02/33/360970233.db2.gz	YRRXTMNLYDQTBS-UHFFFAOYSA-N	1	0	287.363	1.243	50	0		CDAARO
COc1ccc(-c2ccc3c(c2)C[C@@H](C[NH3+])O3)nn1	ZINC000299773991	200867318	/nfs/dbraw/zinc/86/73/18/200867318.db2.gz	DGMJDGLYAWEILU-NSHDSACASA-N	1	0	257.293	1.414	50	0		CDAARO
Fc1ccc(CN2CCN([C@H]3CC[NH2+]C3)CC2)cc1Cl	ZINC000097773036	361081491	/nfs/dbraw/zinc/08/14/91/361081491.db2.gz	HBNGERYMWVNDKA-ZDUSSCGKSA-N	1	0	297.805	1.959	50	0		CDAARO
O=C(N1CC[NH2+]CC1)C1(c2ccc(F)cc2F)CCC1	ZINC000181321657	189293835	/nfs/dbraw/zinc/29/38/35/189293835.db2.gz	WJBCFBOSJLLNNA-UHFFFAOYSA-N	1	0	280.318	1.818	50	0		CDAARO
Cc1ccccc1CNC(=O)C[NH2+][C@H](C)[C@@H]1CCCO1	ZINC000183086582	189346049	/nfs/dbraw/zinc/34/60/49/189346049.db2.gz	AOVOGUFCVXVSDS-HIFRSBDPSA-N	1	0	276.380	1.768	50	0		CDAARO
COc1ccccc1CCNC(=O)[C@H]1CC12CC[NH2+]CC2	ZINC000231327080	361599317	/nfs/dbraw/zinc/59/93/17/361599317.db2.gz	PXDHWNKSQQVQLS-CQSZACIVSA-N	1	0	288.391	1.744	50	0		CDAARO
CCOc1ccccc1CCC(=O)N1CCC[C@H]([NH3+])C1	ZINC000195113601	189672481	/nfs/dbraw/zinc/67/24/81/189672481.db2.gz	FFDZLMUBTWZDGZ-AWEZNQCLSA-N	1	0	276.380	1.968	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CCC[C@@H]2C[NH3+])cc1F	ZINC000606442027	366881441	/nfs/dbraw/zinc/88/14/41/366881441.db2.gz	ZAIMLMJJHWROPJ-SMYYYNMVSA-N	1	0	278.327	1.797	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)c2ccccc2Br)C1	ZINC000050228606	365500397	/nfs/dbraw/zinc/50/03/97/365500397.db2.gz	WAYUWUBPCHLGFK-QMMMGPOBSA-N	1	0	269.142	1.622	50	0		CDAARO
COc1ccc(CN(C)C(=O)C[C@H]2CC[NH2+]C2)cc1F	ZINC000089743386	366925241	/nfs/dbraw/zinc/92/52/41/366925241.db2.gz	HGYDKGPHVLMDPV-LLVKDONJSA-N	1	0	280.343	1.792	50	0		CDAARO
C[C@@H](C(=O)NCc1ccccc1F)N1CC[N@H+](C)C[C@H]1C	ZINC000089938889	366972062	/nfs/dbraw/zinc/97/20/62/366972062.db2.gz	HZQYFSLSFFMKDW-OLZOCXBDSA-N	1	0	293.386	1.466	50	0		CDAARO
CC[C@H](C(=O)N[C@@H]1CCCCC[C@H]1CO)[NH+](C)C	ZINC000252477455	367546018	/nfs/dbraw/zinc/54/60/18/367546018.db2.gz	OFDYGMKALQZFSO-YNEHKIRRSA-N	1	0	256.390	1.384	50	0		CDAARO
COCC(=O)N[C@H](C[NH+](C)C)c1ccc(Cl)cc1	ZINC000252507550	367651798	/nfs/dbraw/zinc/65/17/98/367651798.db2.gz	WOIGVGVYUTXLQO-GFCCVEGCSA-N	1	0	270.760	1.705	50	0		CDAARO
O=C([C@@H]1CC=CCC1)N1CC[NH+]([C@H]2CCC[C@H]2O)CC1	ZINC000252506456	367653409	/nfs/dbraw/zinc/65/34/09/367653409.db2.gz	SZMNVPYDQGFHHK-QLFBSQMISA-N	1	0	278.396	1.400	50	0		CDAARO
[NH3+]C[C@H]1CCCC[C@@H]1NS(=O)(=O)CCc1ccccc1	ZINC000089108079	368997502	/nfs/dbraw/zinc/99/75/02/368997502.db2.gz	KSGFQRYBDVEAHW-CABCVRRESA-N	1	0	296.436	1.666	50	0		CDAARO
COC(=O)c1sccc1NC(=S)N1CCN(C)CC1	ZINC000003906948	371138369	/nfs/dbraw/zinc/13/83/69/371138369.db2.gz	KVTMOIARQDEZSL-UHFFFAOYSA-N	1	0	299.421	1.479	50	0		CDAARO
COC(=O)c1ccc(C(=O)N2CCC([NH3+])CC2)cc1	ZINC000067801055	372358539	/nfs/dbraw/zinc/35/85/39/372358539.db2.gz	HZFPVOKMKXDCGU-UHFFFAOYSA-N	1	0	262.309	1.037	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](CNC(=O)c2ccncc2C)C1	ZINC000299756219	372744944	/nfs/dbraw/zinc/74/49/44/372744944.db2.gz	DVCBKEFSZYBOBB-AWEZNQCLSA-N	1	0	291.395	1.478	50	0		CDAARO
CC(C)(CC(=O)NC[C@]1(O)CC[NH2+]C1)c1ccccc1	ZINC000299766153	372748912	/nfs/dbraw/zinc/74/89/12/372748912.db2.gz	BTESXVCAQSRNPR-INIZCTEOSA-N	1	0	276.380	1.195	50	0		CDAARO
O=C1CC[C@@H]2C[NH2+]CC[C@@H]2N1CCc1cccc(F)c1	ZINC000299777355	372754207	/nfs/dbraw/zinc/75/42/07/372754207.db2.gz	PUWZPDSYKNITMZ-HIFRSBDPSA-N	1	0	276.355	1.969	50	0		CDAARO
CSc1ccccc1NC(=O)NC[C@@]1(O)CC[NH2+]C1	ZINC000299777886	372755234	/nfs/dbraw/zinc/75/52/34/372755234.db2.gz	LJARHWYZHBZBHV-CYBMUJFWSA-N	1	0	281.381	1.254	50	0		CDAARO
O=C(NC[C@]1(O)CC[NH2+]C1)Nc1cccc(Cl)c1	ZINC000299782745	372759984	/nfs/dbraw/zinc/75/99/84/372759984.db2.gz	UGPHRIVEVLHEKL-LBPRGKRZSA-N	1	0	269.732	1.186	50	0		CDAARO
CO[C@]12CC[N@H+](CCCn3ccnc3C)[C@H]1C[C@H](O)CC2	ZINC000299788250	372762847	/nfs/dbraw/zinc/76/28/47/372762847.db2.gz	XWSZKWWUUXPANI-OWCLPIDISA-N	1	0	293.411	1.586	50	0		CDAARO
CCc1ccc(CN2CC[C@H]3[C@H](C2)OCc2cnnn23)nc1	ZINC000299800446	372771242	/nfs/dbraw/zinc/77/12/42/372771242.db2.gz	WSDXUIZDIVLKIM-HOTGVXAUSA-N	1	0	299.378	1.581	50	0		CDAARO
Cc1noc(C)c1CN(C)C(=O)C1([NH3+])CCCCC1	ZINC000037819140	373426589	/nfs/dbraw/zinc/42/65/89/373426589.db2.gz	UFSIKOOJFOACFP-UHFFFAOYSA-N	1	0	265.357	1.911	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)Cc2ccc(F)c(F)c2)C1	ZINC000095045478	373692149	/nfs/dbraw/zinc/69/21/49/373692149.db2.gz	JRDCQEUGNIRSEV-SNVBAGLBSA-N	1	0	254.280	1.315	50	0		CDAARO
C[C@H](NC(=O)NCCc1ccccn1)C1=CC[N@H+](C)CC1	ZINC000253424925	373732615	/nfs/dbraw/zinc/73/26/15/373732615.db2.gz	UXTZWBMHLDTKAS-ZDUSSCGKSA-N	1	0	288.395	1.574	50	0		CDAARO
C[N@H+](CCC(=O)NC(N)=O)CCc1ccc(Cl)cc1	ZINC000113265849	374246982	/nfs/dbraw/zinc/24/69/82/374246982.db2.gz	LSLSCLFZTNTENQ-UHFFFAOYSA-N	1	0	283.759	1.399	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@H]1NC(=O)Cc1cccc(F)c1F	ZINC000094712186	374643227	/nfs/dbraw/zinc/64/32/27/374643227.db2.gz	HGNDBGXPLWRIFQ-JOYOIKCWSA-N	1	0	268.307	1.764	50	0		CDAARO
COc1cc(CNC[C@H]2CCC[N@H+](C)C2)cc2c1OCO2	ZINC000108428674	412828876	/nfs/dbraw/zinc/82/88/76/412828876.db2.gz	XRNRBXVSVMCXSL-GFCCVEGCSA-N	1	0	292.379	1.855	50	0		CDAARO
CCCn1nc(C)c(C[NH2+][C@H]2CCN(C(=O)OC)C2)c1C	ZINC000095414142	374915818	/nfs/dbraw/zinc/91/58/18/374915818.db2.gz	ISDKNFMNHBWZKM-ZDUSSCGKSA-N	1	0	294.399	1.840	50	0		CDAARO
CN(CC(F)(F)F)C1CC[NH+](C[C@H]2CCOC2)CC1	ZINC000095431995	374932569	/nfs/dbraw/zinc/93/25/69/374932569.db2.gz	KNGNWOAVIJGSGB-LLVKDONJSA-N	1	0	280.334	1.981	50	0		CDAARO
O=C(OC[C@H]1CC(=O)N(C2CC2)C1)c1ccn2c[nH+]cc2c1	ZINC000095455096	374953603	/nfs/dbraw/zinc/95/36/03/374953603.db2.gz	IHYJALFJRYZATN-NSHDSACASA-N	1	0	299.330	1.502	50	0		CDAARO
Cc1nc(C)c(C[NH2+]C[C@H]2COC3(CCOCC3)O2)s1	ZINC000097037646	375138875	/nfs/dbraw/zinc/13/88/75/375138875.db2.gz	FACJOPZXWXVVIT-LBPRGKRZSA-N	1	0	298.408	1.772	50	0		CDAARO
Cc1cc(NC(=O)[C@H](C)[NH+](C)C)c2ccccc2n1	ZINC000097081711	375144863	/nfs/dbraw/zinc/14/48/63/375144863.db2.gz	REUDZIFUFOYADL-NSHDSACASA-N	1	0	257.337	1.854	50	0		CDAARO
C[C@@H](CCc1cccc(F)c1)[NH+]1CCN(CCO)CC1	ZINC000097084192	375145282	/nfs/dbraw/zinc/14/52/82/375145282.db2.gz	JFWQMXYONCLBCT-AWEZNQCLSA-N	1	0	280.387	1.757	50	0		CDAARO
Clc1cc2c(c(CN3CC[NH2+]CC3)c1)OCC2	ZINC000097085162	375146274	/nfs/dbraw/zinc/14/62/74/375146274.db2.gz	MUPIOFNORSHORS-UHFFFAOYSA-N	1	0	252.745	1.680	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNC(=O)N1CCO[C@@H](C)C1	ZINC000227158505	375454335	/nfs/dbraw/zinc/45/43/35/375454335.db2.gz	MJCIFVPKLJUACW-QWHCGFSZSA-N	1	0	269.389	1.291	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)/C(C)=C\c1ccc(F)cc1	ZINC000606443598	375824302	/nfs/dbraw/zinc/82/43/02/375824302.db2.gz	MWTUNUVBFBPMCW-TUXSLMJFSA-N	1	0	278.327	1.332	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)/C(C)=C\c1ccc(F)cc1	ZINC000606443588	375824965	/nfs/dbraw/zinc/82/49/65/375824965.db2.gz	MWTUNUVBFBPMCW-LLFZRSNRSA-N	1	0	278.327	1.332	50	0		CDAARO
CN(C)c1ccc(Nc2nc(N)nc3nc[nH]c32)cc1	ZINC000031812079	375834119	/nfs/dbraw/zinc/83/41/19/375834119.db2.gz	VJDMFBOWNKTNFQ-UHFFFAOYSA-N	1	0	269.312	1.745	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@H](c2ccccc2)[C@H](C)[C@]12NC(=O)NC2=O	ZINC000004011732	375841289	/nfs/dbraw/zinc/84/12/89/375841289.db2.gz	MMSXRWNFSXWXPU-KTSGXFQWSA-N	1	0	287.363	1.524	50	0		CDAARO
CC(C)(C)OC(=O)N1CCO[C@@H]2CCC[NH2+]C[C@H]21	ZINC000261507317	190040375	/nfs/dbraw/zinc/04/03/75/190040375.db2.gz	HJRPVTPZNLXFRN-GHMZBOCLSA-N	1	0	256.346	1.374	50	0		CDAARO
C[C@@H](O)[C@H]1C[C@H](C)CC[N@@H+]1CC(=O)NCC1CCC1	ZINC000239882259	376016426	/nfs/dbraw/zinc/01/64/26/376016426.db2.gz	DASODIWMXPICSN-YRGRVCCFSA-N	1	0	268.401	1.384	50	0		CDAARO
CN1CCC[C@@H]([NH2+][C@H]2CCN(CC(F)(F)F)C2)C1	ZINC000240744092	376017636	/nfs/dbraw/zinc/01/76/36/376017636.db2.gz	HULNCOUMAWUBCT-MNOVXSKESA-N	1	0	265.323	1.307	50	0		CDAARO
O=S(=O)(c1cccs1)N1CCN2CCCC[C@H]2C1	ZINC000241173119	376019843	/nfs/dbraw/zinc/01/98/43/376019843.db2.gz	KGFADPWEHJJIIF-NSHDSACASA-N	1	0	286.422	1.607	50	0		CDAARO
C[C@H]1CC[C@H](C(=O)N2CCO[C@]3(C2)C[NH2+]CCOC3)CC1	ZINC000244794635	376023349	/nfs/dbraw/zinc/02/33/49/376023349.db2.gz	QQTVXKYWUUDKIW-DZKIICNBSA-N	1	0	296.411	1.030	50	0		CDAARO
Cc1noc(-c2cccnc2N2CC[C@H]([NH+]3CC=CC3)C2)n1	ZINC000101341828	376025278	/nfs/dbraw/zinc/02/52/78/376025278.db2.gz	FUQNIPXXFOJJEA-ZDUSSCGKSA-N	1	0	297.362	1.891	50	0		CDAARO
COCc1ccc(CNC(=O)CC[C@H]2CC[NH2+]C2)cc1	ZINC000261884657	190045993	/nfs/dbraw/zinc/04/59/93/190045993.db2.gz	UVYQEFBKQITOOV-AWEZNQCLSA-N	1	0	276.380	1.839	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCCN(CCCc2ccccc2)C1=O	ZINC000012715734	377013097	/nfs/dbraw/zinc/01/30/97/377013097.db2.gz	UDECBOZZCIOMAN-KRWDZBQOSA-N	1	0	290.407	1.534	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1c(C)noc1C	ZINC000069674663	378518119	/nfs/dbraw/zinc/51/81/19/378518119.db2.gz	YRKCXEOYLVUTOM-NSHDSACASA-N	1	0	251.330	1.506	50	0		CDAARO
CSc1ccc(OCC[NH+]2CCC(C(N)=O)CC2)cc1	ZINC000096441369	532985556	/nfs/dbraw/zinc/98/55/56/532985556.db2.gz	OXHAOPPWSIBVEA-UHFFFAOYSA-N	1	0	294.420	1.985	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@@H]1NC(=O)c1ccc(F)c(F)c1F	ZINC000094184057	184760175	/nfs/dbraw/zinc/76/01/75/184760175.db2.gz	HSIKYTHLJKUCGT-XVKPBYJWSA-N	1	0	272.270	1.974	50	0		CDAARO
COC(=O)c1ccc2ccn(C[C@H]3CC[NH2+]C3)c(=O)c2c1	ZINC000095373114	184957235	/nfs/dbraw/zinc/95/72/35/184957235.db2.gz	LKXPHADBBCRJKK-NSHDSACASA-N	1	0	286.331	1.398	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCCN(CCc2ccccc2)C1=O	ZINC000015080662	390215225	/nfs/dbraw/zinc/21/52/25/390215225.db2.gz	OCAFCNQTJJNZIJ-INIZCTEOSA-N	1	0	276.380	1.144	50	0		CDAARO
O=C(NCCN1CC[NH2+]CC1)C1(Cc2ccccc2)CC1	ZINC000095427866	184979615	/nfs/dbraw/zinc/97/96/15/184979615.db2.gz	KCQITYBTFOQNPY-UHFFFAOYSA-N	1	0	287.407	1.031	50	0		CDAARO
C[C@@H]1C[C@H](C)C[N@@H+](CC(=O)NC(=O)NCc2ccco2)C1	ZINC000014086420	390461953	/nfs/dbraw/zinc/46/19/53/390461953.db2.gz	ZWSQIZUDLPKUPB-TXEJJXNPSA-N	1	0	293.367	1.583	50	0		CDAARO
O=C1CC[C@@H]([NH2+]Cc2ccc3c[nH]nc3c2)C2(CCC2)N1	ZINC000282970288	195758333	/nfs/dbraw/zinc/75/83/33/195758333.db2.gz	YZSMEJRZVGIEQT-CQSZACIVSA-N	1	0	284.363	1.854	50	0		CDAARO
COCCC(=O)N[C@H]1CC[N@H+](CC2CCCC2)C1	ZINC000096431850	390520456	/nfs/dbraw/zinc/52/04/56/390520456.db2.gz	KNLYSNSTEJJBBP-ZDUSSCGKSA-N	1	0	254.374	1.404	50	0		CDAARO
CC[C@@H]1CN(Cc2cnc(N(C)C)nc2)CC[N@@H+]1C(C)C	ZINC000072149013	390625538	/nfs/dbraw/zinc/62/55/38/390625538.db2.gz	VCJZOHALLVKWKA-OAHLLOKOSA-N	1	0	291.443	1.847	50	0		CDAARO
[NH3+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O	ZINC000070495343	390607840	/nfs/dbraw/zinc/60/78/40/390607840.db2.gz	NQNUYIFAYFLLID-JTQLQIEISA-N	1	0	256.252	1.742	50	0		CDAARO
CC(C)N(CC[N@H+](C)Cc1ccccc1)CC(N)=O	ZINC000278769755	390946741	/nfs/dbraw/zinc/94/67/41/390946741.db2.gz	YQLAFKXTQFZMPH-UHFFFAOYSA-N	1	0	263.385	1.314	50	0		CDAARO
Cc1cnc(N2CCCO[C@H](C[NH+]3CCCCC3)C2)nc1	ZINC000095356212	390910941	/nfs/dbraw/zinc/91/09/41/390910941.db2.gz	LUGPLDCXJIYLRZ-OAHLLOKOSA-N	1	0	290.411	1.866	50	0		CDAARO
C/C(=C\c1ccccc1)C[NH2+]CCS(C)(=O)=O	ZINC000096297206	390957114	/nfs/dbraw/zinc/95/71/14/390957114.db2.gz	KMDFVTSMPZVIBI-ZRDIBKRKSA-N	1	0	253.367	1.724	50	0		CDAARO
Cc1csc(NC(=O)[C@@H](C)[N@H+](C)C2CCOCC2)n1	ZINC000244678570	391343860	/nfs/dbraw/zinc/34/38/60/391343860.db2.gz	IFZIWLKZDBPIBK-SNVBAGLBSA-N	1	0	283.397	1.889	50	0		CDAARO
[NH2+]=C1S[C@H]2CS(=O)(=O)C[C@H]2N1CCc1ccccc1	ZINC000035982298	391859277	/nfs/dbraw/zinc/85/92/77/391859277.db2.gz	SGQUNMIYQVOSKO-NEPJUHHUSA-N	1	0	296.417	1.378	50	0		CDAARO
Cc1cc2c(c(-c3ncccc3C(N)=O)c1)O[C@@H](C[NH3+])C2	ZINC000067688500	292000625	/nfs/dbraw/zinc/00/06/25/292000625.db2.gz	XSOIRTZRTPLJKA-LLVKDONJSA-N	1	0	283.331	1.418	50	0		CDAARO
COCCOC1CC[NH+](CC[C@H]2CCOC2)CC1	ZINC000438119382	392532230	/nfs/dbraw/zinc/53/22/30/392532230.db2.gz	SJYMYICBWKBZSP-ZDUSSCGKSA-N	1	0	257.374	1.540	50	0		CDAARO
O=C1CNC(=O)N1CC[NH2+][C@H]1CCCNc2ccccc21	ZINC000193286501	393295541	/nfs/dbraw/zinc/29/55/41/393295541.db2.gz	QRDTUFYAVDAYMV-ZDUSSCGKSA-N	1	0	288.351	1.075	50	0		CDAARO
[NH3+]C1(C(=O)N2CCN(c3ccccc3Cl)CC2)CC1	ZINC000088129715	135052296	/nfs/dbraw/zinc/05/22/96/135052296.db2.gz	FICYLHDEFIUIIQ-UHFFFAOYSA-N	1	0	279.771	1.480	50	0		CDAARO
COc1ccccc1[C@H]1C[NH2+]CCN1Cc1c[nH]nc1C	ZINC000261604991	140362339	/nfs/dbraw/zinc/36/23/39/140362339.db2.gz	AYIJFHBAYABIMW-OAHLLOKOSA-N	1	0	286.379	1.873	50	0		CDAARO
O=C(NC[C@@H]1[NH2+]CCc2ccccc21)c1cc[nH]c(=O)c1	ZINC000261625581	140366148	/nfs/dbraw/zinc/36/61/48/140366148.db2.gz	HBHANKMHIDDPIQ-AWEZNQCLSA-N	1	0	283.331	1.404	50	0		CDAARO
CSCC[C@@H](C)[N@H+](C)CC(=O)N1C[C@@H](C)O[C@@H](C)C1	ZINC000195531744	397727475	/nfs/dbraw/zinc/72/74/75/397727475.db2.gz	AIGZIGFVSBFLBY-UPJWGTAASA-N	1	0	288.457	1.696	50	0		CDAARO
Cc1c(CC(=O)N2CCC[C@@H]2C[NH3+])nnn1-c1ccccc1	ZINC000269186864	397824492	/nfs/dbraw/zinc/82/44/92/397824492.db2.gz	BLISWKKCBXIBGW-CQSZACIVSA-N	1	0	299.378	1.068	50	0		CDAARO
Cc1ccccc1C[NH2+]CCSc1nnnn1C	ZINC000004998035	170052289	/nfs/dbraw/zinc/05/22/89/170052289.db2.gz	LFVSLUDGRPCVKH-UHFFFAOYSA-N	1	0	263.370	1.400	50	0		CDAARO
COc1ccc2cc(C(=O)NCCC[NH+](C)C)[nH]c2c1	ZINC000005206459	170076110	/nfs/dbraw/zinc/07/61/10/170076110.db2.gz	KYOSGAJSZKBZLF-UHFFFAOYSA-N	1	0	275.352	1.858	50	0		CDAARO
CC[NH+](CC)CCN1c2ccc(OC)cc2C(=O)C1=O	ZINC000006759709	170241564	/nfs/dbraw/zinc/24/15/64/170241564.db2.gz	BGNKGUIZMBKFLY-UHFFFAOYSA-N	1	0	276.336	1.566	50	0		CDAARO
CCOc1c(C[NH2+][C@H](CC)CO)cccc1OC	ZINC000008337120	170331848	/nfs/dbraw/zinc/33/18/48/170331848.db2.gz	SHVQUJPLFJVUIO-GFCCVEGCSA-N	1	0	253.342	1.954	50	0		CDAARO
Cc1c(C)n(CCC[NH+](C)C)c(N)c1S(C)(=O)=O	ZINC000008873626	170357646	/nfs/dbraw/zinc/35/76/46/170357646.db2.gz	BJXVGXDZGIHFBE-UHFFFAOYSA-N	1	0	273.402	1.042	50	0		CDAARO
CCC(CC)[C@H](CNc1ccc2nnnn2n1)[NH+](C)C	ZINC000012734867	170506069	/nfs/dbraw/zinc/50/60/69/170506069.db2.gz	NZDUCCPPILIBAE-NSHDSACASA-N	1	0	277.376	1.298	50	0		CDAARO
CNC(=O)c1cc(Oc2cccc(C[NH3+])c2)ccn1	ZINC000043558689	175064985	/nfs/dbraw/zinc/06/49/85/175064985.db2.gz	TZZZRPYJZUJQLQ-UHFFFAOYSA-N	1	0	257.293	1.692	50	0		CDAARO
O=C(NCc1cccc(C(F)(F)F)c1)[C@H]1C[NH2+]CCO1	ZINC000043707524	175100326	/nfs/dbraw/zinc/10/03/26/175100326.db2.gz	KWHVORXERIMBAH-LLVKDONJSA-N	1	0	288.269	1.310	50	0		CDAARO
COc1ccc(CC[NH2+]Cc2cnc(N)nc2)cc1	ZINC000046085423	175392105	/nfs/dbraw/zinc/39/21/05/175392105.db2.gz	PSPNJVLBRZQHRF-UHFFFAOYSA-N	1	0	258.325	1.400	50	0		CDAARO
CC[C@@H](O)Cn1cc(C2=CC[N@H+](CCOC)CC2)cn1	ZINC000065406336	175731410	/nfs/dbraw/zinc/73/14/10/175731410.db2.gz	ZMMSZINEALESAN-OAHLLOKOSA-N	1	0	279.384	1.390	50	0		CDAARO
CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)[C@@H]1C[NH2+]CCO1	ZINC000071419295	176160525	/nfs/dbraw/zinc/16/05/25/176160525.db2.gz	XTIFASPNOJUFJG-AWEZNQCLSA-N	1	0	291.326	1.254	50	0		CDAARO
O=C(C[NH+]1CCCC1)N1CCCC[C@@H]1CCn1ccnc1	ZINC000077456198	177270940	/nfs/dbraw/zinc/27/09/40/177270940.db2.gz	GTWQSTIVQCENSY-OAHLLOKOSA-N	1	0	290.411	1.750	50	0		CDAARO
CCc1ccccc1OCC[N@@H+]1CCOC[C@H](O)C1	ZINC000077471518	177272275	/nfs/dbraw/zinc/27/22/75/177272275.db2.gz	BEAMBRVUCNUGEV-CQSZACIVSA-N	1	0	265.353	1.321	50	0		CDAARO
Cc1ccccc1CSCC(=O)N[C@@H]1CC[NH2+]C[C@H]1O	ZINC000077505017	177275900	/nfs/dbraw/zinc/27/59/00/177275900.db2.gz	WMHQDPMNOAHPGS-ZIAGYGMSSA-N	1	0	294.420	1.067	50	0		CDAARO
C[NH2+]CC(=O)NCCC(=O)Nc1cccc2ccccc21	ZINC000071752886	260273433	/nfs/dbraw/zinc/27/34/33/260273433.db2.gz	OUZQWCRFWSULKR-UHFFFAOYSA-N	1	0	285.347	1.504	50	0		CDAARO
CCc1cc(N2CCC[NH2+]CC2)n2nc(C)c(C)c2n1	ZINC000072424271	273767817	/nfs/dbraw/zinc/76/78/17/273767817.db2.gz	FYKJZUGMCPGVJL-UHFFFAOYSA-N	1	0	273.384	1.708	50	0		CDAARO
COc1cc(C)nc(N2CCC[C@@H]([NH+](C)C)CC2)n1	ZINC000253433659	274092615	/nfs/dbraw/zinc/09/26/15/274092615.db2.gz	ZUIFWMYIXDVMJR-GFCCVEGCSA-N	1	0	264.373	1.714	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+]C[C@]2(O)CCSC2)C12CCC2	ZINC000097034617	276345927	/nfs/dbraw/zinc/34/59/27/276345927.db2.gz	XGWKVQPNGBKMKH-JHJVBQTASA-N	1	0	271.426	1.792	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1	ZINC000049882561	277188601	/nfs/dbraw/zinc/18/86/01/277188601.db2.gz	HPEUFZJDMPYRGN-CHWSQXEVSA-N	1	0	284.400	1.843	50	0		CDAARO
CC(C)(C)c1oc(C(N)=O)cc1CN1CCCC[C@@H]([NH3+])C1	ZINC000082096788	277281721	/nfs/dbraw/zinc/28/17/21/277281721.db2.gz	APHGDUNSPYTGPG-GFCCVEGCSA-N	1	0	293.411	1.989	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)c1ccnc(-n2ccnc2)c1	ZINC000269199269	278317232	/nfs/dbraw/zinc/31/72/32/278317232.db2.gz	XYMUUHUFWDSZNZ-TZMCWYRMSA-N	1	0	299.378	1.609	50	0		CDAARO
CC(C)(C)OC(=O)N[C@H]1COC2(C1)CC[NH2+]CC2	ZINC000072362062	278444180	/nfs/dbraw/zinc/44/41/80/278444180.db2.gz	ACUKKOFVWISMOI-SNVBAGLBSA-N	1	0	256.346	1.422	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](N2CC[C@@H](N(C)C(C)=O)C2)C1	ZINC000032529868	279292982	/nfs/dbraw/zinc/29/29/82/279292982.db2.gz	DJBJOHJIEJVGFU-ZIAGYGMSSA-N	1	0	253.390	1.023	50	0		CDAARO
Cn1c2ccccc2nc1-c1cn(C2CC[NH2+]CC2)nn1	ZINC000091678378	279320884	/nfs/dbraw/zinc/32/08/84/279320884.db2.gz	NNPJUKCBMJAVIU-UHFFFAOYSA-N	1	0	282.351	1.756	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1ccc2c(c1)OCCCO2	ZINC000178498273	279907813	/nfs/dbraw/zinc/90/78/13/279907813.db2.gz	XQICARFPYOMTHM-NSHDSACASA-N	1	0	276.336	1.282	50	0		CDAARO
CCC(=O)N1CC[C@H]([NH2+][C@H]2CC(C)(C)OC2(C)C)C1	ZINC000095969369	289063508	/nfs/dbraw/zinc/06/35/08/289063508.db2.gz	JYZPMUUASFCKPX-RYUDHWBXSA-N	1	0	268.401	1.933	50	0		CDAARO
Cn1c(=O)sc(C=O)c1-[n+]1ccc2ccccc2c1	ZINC000000547010	294146043	/nfs/dbraw/zinc/14/60/43/294146043.db2.gz	JPCKFNWMVQQCHS-UHFFFAOYSA-N	1	0	271.321	1.689	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])s1	ZINC000534590710	328317978	/nfs/dbraw/zinc/31/79/78/328317978.db2.gz	UCARXSLBJULAEW-PEGIJTEDSA-N	1	0	286.422	1.414	50	0		CDAARO
CC[N@H+](C)C1(CNC(=O)c2csc(N)n2)CCCC1	ZINC000534643431	328329507	/nfs/dbraw/zinc/32/95/07/328329507.db2.gz	BFYFKTVIQJNYDW-UHFFFAOYSA-N	1	0	282.413	1.550	50	0		CDAARO
O=C([C@@H]1C=CC[NH2+]1)N1CCCN(Cc2cccs2)CC1	ZINC000534641510	328336203	/nfs/dbraw/zinc/33/62/03/328336203.db2.gz	GLAJLHBTXSWEOO-AWEZNQCLSA-N	1	0	291.420	1.310	50	0		CDAARO
O=C(NC[C@]1(O)CCC[NH2+]C1)c1sccc1Cl	ZINC000534657473	328340929	/nfs/dbraw/zinc/34/09/29/328340929.db2.gz	MXTIWCIKGKDWOA-NSHDSACASA-N	1	0	274.773	1.246	50	0		CDAARO
CC[C@H](C(=O)N1C[C@H]2CC[C@@H](C1)[C@H]2[NH3+])n1cccn1	ZINC000534672396	328347993	/nfs/dbraw/zinc/34/79/93/328347993.db2.gz	JZPQIMFJEGUUQG-XQHKEYJVSA-N	1	0	262.357	1.030	50	0		CDAARO
[NH3+]C[C@H]1CN(CCCCOCc2ccccc2)CCO1	ZINC000534673009	328348479	/nfs/dbraw/zinc/34/84/79/328348479.db2.gz	IPVLXRMPHYABLL-INIZCTEOSA-N	1	0	278.396	1.643	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)[C@H]2CC[C@@H](O)CC2)CC1	ZINC000534663962	328351432	/nfs/dbraw/zinc/35/14/32/328351432.db2.gz	DYOQFPMKPPOZOA-BETUJISGSA-N	1	0	268.401	1.528	50	0		CDAARO
C[C@@H](CCn1cccn1)[NH2+]Cc1nnc2ccccn21	ZINC000097376794	323208163	/nfs/dbraw/zinc/20/81/63/323208163.db2.gz	GQKJLTMDMTYQJY-LBPRGKRZSA-N	1	0	270.340	1.494	50	0		CDAARO
[NH3+]C[C@H]1CCN(CC(=O)NCCc2cccc(Cl)c2)C1	ZINC000050248795	328392708	/nfs/dbraw/zinc/39/27/08/328392708.db2.gz	PRWSTNFPEQODDP-CYBMUJFWSA-N	1	0	295.814	1.279	50	0		CDAARO
[NH3+][C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccco1	ZINC000000329110	326791502	/nfs/dbraw/zinc/79/15/02/326791502.db2.gz	FQLXKOCHDBPFLL-AWEZNQCLSA-N	1	0	283.331	1.947	50	0	biogenic	CDAARO
COc1ccc(F)cc1C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179119426	329205481	/nfs/dbraw/zinc/20/54/81/329205481.db2.gz	NRQZEUWWNOVVSB-SNVBAGLBSA-N	1	0	252.289	1.268	50	0		CDAARO
CCO[C@H]1C[C@@H]([N@H+](C)CCN2CCOC2=O)C1(C)C	ZINC000084800733	482507277	/nfs/dbraw/zinc/50/72/77/482507277.db2.gz	IVJLVIQVWXINQG-NEPJUHHUSA-N	1	0	270.373	1.574	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@H]1NC(=O)c1ccc(F)cc1F	ZINC000091496672	482567993	/nfs/dbraw/zinc/56/79/93/482567993.db2.gz	LMXCRDTVFHGTKO-PRHODGIISA-N	1	0	254.280	1.835	50	0		CDAARO
CS(=O)(=O)N1CCCSC[C@@H]1C[NH+]1CCCCC1	ZINC000085473286	482592326	/nfs/dbraw/zinc/59/23/26/482592326.db2.gz	RFACFQAVLAOCTE-LBPRGKRZSA-N	1	0	292.470	1.239	50	0		CDAARO
COCc1nc(C)cc(N2C[C@@H]3CC[N@H+](C)C[C@@H]3C2)n1	ZINC000585092394	482828555	/nfs/dbraw/zinc/82/85/55/482828555.db2.gz	URNZPVUVRXUPOS-QWHCGFSZSA-N	1	0	276.384	1.319	50	0		CDAARO
Cc1nc(CN(C)CCCc2c(C)n[nH]c2C)no1	ZINC000670436510	482973646	/nfs/dbraw/zinc/97/36/46/482973646.db2.gz	BHBAAPDRNKJXPL-UHFFFAOYSA-N	1	0	263.345	1.783	50	0		CDAARO
Cc1cc(CN(C)C(=O)CC[N@@H+]2C[C@@H]3CC[C@H]2C3)no1	ZINC000670457646	483037542	/nfs/dbraw/zinc/03/75/42/483037542.db2.gz	KGLXEBJHVYRXOX-OCCSQVGLSA-N	1	0	277.368	1.816	50	0		CDAARO
OCC[C@@H]1CN(c2ncc(Cl)cn2)CC[N@@H+]1CC1CC1	ZINC000670461925	483049060	/nfs/dbraw/zinc/04/90/60/483049060.db2.gz	DAEHXDRPRFXPFP-CYBMUJFWSA-N	1	0	296.802	1.413	50	0		CDAARO
COc1cc2c(cc1CN[C@H](C)CC[NH+](C)C)OCCO2	ZINC000670468126	483059386	/nfs/dbraw/zinc/05/93/86/483059386.db2.gz	CUUNBYKESIZGEX-GFCCVEGCSA-N	1	0	294.395	1.896	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@H](CNc2cncc(Cl)n2)C1	ZINC000096453232	528020243	/nfs/dbraw/zinc/02/02/43/528020243.db2.gz	BYDNEKJVMINAHK-LLVKDONJSA-N	1	0	284.791	1.899	50	0		CDAARO
CCC[N@H+](CCO)Cc1cnc(-c2ccccn2)nc1	ZINC000222587103	528098791	/nfs/dbraw/zinc/09/87/91/528098791.db2.gz	YSSWMBIMOOPHBL-UHFFFAOYSA-N	1	0	272.352	1.743	50	0		CDAARO
CCNC(=O)NC[C@@H](c1ccco1)[NH+](CC)CC	ZINC000194846170	528180488	/nfs/dbraw/zinc/18/04/88/528180488.db2.gz	KLEDTKZJBQDFIL-NSHDSACASA-N	1	0	253.346	1.982	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNc1nc2ccccc2c(=O)[nH]1	ZINC000097994932	529083212	/nfs/dbraw/zinc/08/32/12/529083212.db2.gz	VTCBYSNYPAAOCV-LLVKDONJSA-N	1	0	272.352	1.819	50	0		CDAARO
CC(C)[N@@H+]1C[C@@H](C)[C@@H](N[C@@H](C)c2cnn(C)c2)C1	ZINC000096478366	529090925	/nfs/dbraw/zinc/09/09/25/529090925.db2.gz	YEXXIVAENYCGHI-DYEKYZERSA-N	1	0	250.390	1.799	50	0		CDAARO
Cc1cc(C#N)ccc1S(=O)(=O)N1CC[C@@H]([NH3+])C[C@H]1C	ZINC000299741241	538417578	/nfs/dbraw/zinc/41/75/78/538417578.db2.gz	FAZFPQGOZSKRCP-DGCLKSJQSA-N	1	0	293.392	1.367	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@H](C(=O)N(C)CC2(CO)CCC2)C1	ZINC000952972814	614346820	/nfs/dbraw/zinc/34/68/20/614346820.db2.gz	AFICKSZYQCQTDA-AWEZNQCLSA-N	1	0	282.428	1.728	50	0		CDAARO
C=CC(=O)N1C[C@@H]2C[N@@H+](C)[C@H](c3ccccc3)[C@H]2C1	ZINC000888102170	617767716	/nfs/dbraw/zinc/76/77/16/617767716.db2.gz	KZDDFIXKIUXDSX-OFQRWUPVSA-N	1	0	256.349	1.934	50	0		CDAARO
C[NH+](C)[C@@H]1[C@H]2CN(CCC(=O)Nc3cccc(F)c3)C[C@H]21	ZINC000585133467	1164216408	/nfs/dbraw/zinc/21/64/08/1164216408.db2.gz	IVXVKLSULBVUOD-FOLVSLTJSA-N	1	0	291.370	1.646	50	0		CDAARO
COc1ccccc1C(=O)N1CCO[C@H](CC[NH+](C)C)C1	ZINC000012439780	726012778	/nfs/dbraw/zinc/01/27/78/726012778.db2.gz	HXMIIMXZXMCCCB-CYBMUJFWSA-N	1	0	292.379	1.488	50	0		CDAARO
CCc1nnc(CN(C)CC[N@H+](C)C2CCCC2)[nH]1	ZINC000244874537	726914390	/nfs/dbraw/zinc/91/43/90/726914390.db2.gz	XCYUWRDFGKCEEM-UHFFFAOYSA-N	1	0	265.405	1.673	50	0		CDAARO
Cc1cc[nH]c(=O)c1C(=O)N1CC[N@@H+]2CCC[C@@H]2C1	ZINC000181048057	727247435	/nfs/dbraw/zinc/24/74/35/727247435.db2.gz	AITXWUFGSWTUGB-LLVKDONJSA-N	1	0	261.325	1.016	50	0		CDAARO
Cn1nccc1C(=O)NC[C@H]1CCCN(c2cc[nH+]cc2)C1	ZINC000952981099	727423958	/nfs/dbraw/zinc/42/39/58/727423958.db2.gz	CAFRRWDGEXLQQQ-CYBMUJFWSA-N	1	0	299.378	1.462	50	0		CDAARO
[NH3+][C@@H](C1CCCC1)C1(O)CCC2(CC1)OCCO2	ZINC000958528765	727486461	/nfs/dbraw/zinc/48/64/61/727486461.db2.gz	UNZCJNOIBVYWSB-LBPRGKRZSA-N	1	0	255.358	1.552	50	0		CDAARO
COc1ccc(C[NH2+]CCN2CCC[C@H](CO)C2)cc1O	ZINC000952962938	728123229	/nfs/dbraw/zinc/12/32/29/728123229.db2.gz	GQPBOAIAZUTZHL-AWEZNQCLSA-N	1	0	294.395	1.195	50	0		CDAARO
Cc1nnc(CN[C@H](C)C[NH+]2CCCCCC2)[nH]1	ZINC000952869131	910420936	/nfs/dbraw/zinc/42/09/36/910420936.db2.gz	XOWGHKPDGWPHSQ-LLVKDONJSA-N	1	0	251.378	1.467	50	0		CDAARO
C[C@@H]1CN(C[C@@H](O)Cn2cccn2)CC[N@@H+]1C1CCCC1	ZINC000952884274	910458718	/nfs/dbraw/zinc/45/87/18/910458718.db2.gz	WVZKDIBFAUUOIR-GDBMZVCRSA-N	1	0	292.427	1.193	50	0		CDAARO
CCS(=O)(=O)NC[C@@H](C)[NH+]1CCC(CCOC)CC1	ZINC000824384122	925028860	/nfs/dbraw/zinc/02/88/60/925028860.db2.gz	MGAUNRLJNJNWCO-GFCCVEGCSA-N	1	0	292.445	1.063	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](NC(=O)Cc2sc(N)nc2C)C1	ZINC000822922772	925656780	/nfs/dbraw/zinc/65/67/80/925656780.db2.gz	UBZWZEPSMLZGAQ-LLVKDONJSA-N	1	0	296.440	1.567	50	0		CDAARO
CCCc1cnc(C)nc1NC[C@@H]1CCC[N@H+](CCO)C1	ZINC000823012074	925660823	/nfs/dbraw/zinc/66/08/23/925660823.db2.gz	STQLQSWRQLSXRP-AWEZNQCLSA-N	1	0	292.427	1.854	50	0		CDAARO
CCc1cc(N[C@H]2CC(=O)N(C)C2)nc(N2CCCC2)[nH+]1	ZINC000823503697	925698487	/nfs/dbraw/zinc/69/84/87/925698487.db2.gz	ANJIIFATWQBAKN-LBPRGKRZSA-N	1	0	289.383	1.282	50	0		CDAARO
Cc1[nH]nc2c1CN(Cc1[nH]cc(C)c(=O)c1C)CC2	ZINC000825116747	925851728	/nfs/dbraw/zinc/85/17/28/925851728.db2.gz	XZMJOXFDRNNTMI-UHFFFAOYSA-N	1	0	272.352	1.582	50	0		CDAARO
O=C(C1CC1)N1CC([N@@H+](Cc2ccncc2)CC2CC2)C1	ZINC000581776040	927194697	/nfs/dbraw/zinc/19/46/97/927194697.db2.gz	HDEPSBSCNVTYIR-UHFFFAOYSA-N	1	0	285.391	1.914	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1CCNC(=O)c1cn(C)cn1	ZINC000581813076	927203321	/nfs/dbraw/zinc/20/33/21/927203321.db2.gz	VJOYXOLKHGQZRI-UHFFFAOYSA-N	1	0	273.340	1.232	50	0		CDAARO
COCCC1([NH+](C)C)CCN(C(=O)c2ccncc2)CC1	ZINC000581804598	927204006	/nfs/dbraw/zinc/20/40/06/927204006.db2.gz	CZORVZHZXSUJPX-UHFFFAOYSA-N	1	0	291.395	1.655	50	0		CDAARO
Cc1cc(C(=O)N[C@@H](C[NH+](C)C)C(C)C)ns1	ZINC000585079520	930852225	/nfs/dbraw/zinc/85/22/25/930852225.db2.gz	GBUIROKQVMGEOG-NSHDSACASA-N	1	0	255.387	1.768	50	0		CDAARO
C[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)N(CC(N)=O)[C@H]1C	ZINC000585116128	930967801	/nfs/dbraw/zinc/96/78/01/930967801.db2.gz	ICRCBPNGRCYHQT-GRYCIOLGSA-N	1	0	299.415	1.485	50	0		CDAARO
Cc1cc(C[NH2+][C@@H]2C(=O)NCC2(C)C)ccc1F	ZINC000585116806	930969750	/nfs/dbraw/zinc/96/97/50/930969750.db2.gz	JFUFTICQVVDSJG-GFCCVEGCSA-N	1	0	250.317	1.748	50	0		CDAARO
C[C@@H](C[NH+](C)C)[C@@H]1CCCCN1Cc1cnn(C)c1	ZINC000585117014	930971993	/nfs/dbraw/zinc/97/19/93/930971993.db2.gz	OXKWCWHYPNZXAG-ZFWWWQNUSA-N	1	0	264.417	1.972	50	0		CDAARO
Cc1nc([C@H]([NH3+])C2(O)CC(CF)(CF)C2)cn1C	ZINC000958527536	935020068	/nfs/dbraw/zinc/02/00/68/935020068.db2.gz	BZWOJBTZFIGKTM-JTQLQIEISA-N	1	0	259.300	1.179	50	0		CDAARO
C[C@@H]1CCc2nn3ccnc(N4CC[NH2+]CC4)c3c2C1	ZINC000409421897	941341223	/nfs/dbraw/zinc/34/12/23/941341223.db2.gz	HYMDRACEWNLJCL-LLVKDONJSA-N	1	0	271.368	1.264	50	0		CDAARO
C[C@@H](c1ccccc1)n1nccc1NC(=O)CC[NH3+]	ZINC001529091888	968978459	/nfs/dbraw/zinc/97/84/59/968978459.db2.gz	RXYXDLBGOKDEIM-NSHDSACASA-N	1	0	258.325	1.780	50	0		CDAARO
CC(C)SCC[N@H+](C)C[C@H]1CCCN(CCO)C1	ZINC001529102166	968981646	/nfs/dbraw/zinc/98/16/46/968981646.db2.gz	YWXJMWQXCFEVJS-CQSZACIVSA-N	1	0	274.474	1.764	50	0		CDAARO
Cc1nc[nH]c1C[N@@H+]1C[C@H](O)[C@H](Cc2ccncc2)C1	ZINC001529118271	968985181	/nfs/dbraw/zinc/98/51/81/968985181.db2.gz	IFKYNSIZEHRBGQ-HIFRSBDPSA-N	1	0	272.352	1.149	50	0		CDAARO
CCc1c(C)noc1NC(=O)[C@@]1(C)CC[N@H+](C)C1	ZINC001529119354	968986114	/nfs/dbraw/zinc/98/61/14/968986114.db2.gz	FNRRWOOVVOKJHB-ZDUSSCGKSA-N	1	0	251.330	1.826	50	0		CDAARO
CCn1ncc(C)c1NC(=O)[C@@H]([NH3+])CCSC	ZINC001529146123	968986719	/nfs/dbraw/zinc/98/67/19/968986719.db2.gz	IWMUZGLNXVXLGD-VIFPVBQESA-N	1	0	256.375	1.230	50	0		CDAARO
CCC[C@]1(CO)CN(Cc2cccnc2OC)CC[C@H]1O	ZINC001529189896	969008323	/nfs/dbraw/zinc/00/83/23/969008323.db2.gz	BLRPLNMZINSJKF-GDBMZVCRSA-N	1	0	294.395	1.436	50	0		CDAARO
CCc1nc(N(C)CC[C@H](C)[NH+]2CCCC2)no1	ZINC001506398581	975149279	/nfs/dbraw/zinc/14/92/79/975149279.db2.gz	SFSLIRGDROOWAA-NSHDSACASA-N	1	0	252.362	1.943	50	0		CDAARO
Cc1ccnn1CC[NH+]1CCC(N2CCCC2=O)CC1	ZINC001506407070	975152092	/nfs/dbraw/zinc/15/20/92/975152092.db2.gz	LXVNVINRVYTXPY-UHFFFAOYSA-N	1	0	276.384	1.278	50	0		CDAARO
CC(C)n1cc(NC(=O)CN2C[C@@H]3CC[C@H]2C3)cn1	ZINC001506421082	975158133	/nfs/dbraw/zinc/15/81/33/975158133.db2.gz	UODCLBOZNLUKTC-YPMHNXCESA-N	1	0	262.357	1.887	50	0		CDAARO
COc1nccnc1NC[C@@H]1CCC[N@@H+]1C(C)C	ZINC001506423140	975159727	/nfs/dbraw/zinc/15/97/27/975159727.db2.gz	UDAPIBCXZMTXIL-NSHDSACASA-N	1	0	250.346	1.770	50	0		CDAARO
COc1cccc(OC)c1OCCN1CCCC[C@H]([NH3+])C1	ZINC000082125640	177922574	/nfs/dbraw/zinc/92/25/74/177922574.db2.gz	DCJDZPKSHDPWJU-ZDUSSCGKSA-N	1	0	294.395	1.896	50	0		CDAARO
Cc1cc(=O)[nH]c(CCNC(=O)C[N@@H+](C)C2CCCC2)n1	ZINC000584902381	341986892	/nfs/dbraw/zinc/98/68/92/341986892.db2.gz	LKQLEKDLSGKUIT-UHFFFAOYSA-N	1	0	292.383	1.024	50	0		CDAARO
CSCCC(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1C	ZINC000106661403	349446044	/nfs/dbraw/zinc/44/60/44/349446044.db2.gz	JCIWEEJIJKTWNZ-VXGBXAGGSA-N	1	0	256.415	1.825	50	0		CDAARO
OCCN1CC[NH+](C[C@@H]2CCOc3ccccc3C2)CC1	ZINC000095529734	185005240	/nfs/dbraw/zinc/00/52/40/185005240.db2.gz	SUHHDRQTPXLAGF-OAHLLOKOSA-N	1	0	290.407	1.238	50	0		CDAARO
COc1ccc(OC)c([C@H](O)CN2CC[N@H+](C)C[C@@H]2C)c1	ZINC000107580807	398156141	/nfs/dbraw/zinc/15/61/41/398156141.db2.gz	GSJMUGFGZXJONF-SWLSCSKDSA-N	1	0	294.395	1.373	50	0		CDAARO
[NH3+][C@]1(CO)CCc2cc(Br)ccc2C1	ZINC000082496702	178062844	/nfs/dbraw/zinc/06/28/44/178062844.db2.gz	MSTRFUJCHQGTND-LLVKDONJSA-N	1	0	256.143	1.628	50	0		CDAARO
COc1ccc(C[NH2+][C@@H](CCO)C2CCOCC2)cn1	ZINC000095943047	185037190	/nfs/dbraw/zinc/03/71/90/185037190.db2.gz	XNAPIFXNJFYSTK-AWEZNQCLSA-N	1	0	280.368	1.357	50	0		CDAARO
CC(=O)N[C@@H]1CCC[N@H+](CCC(=O)NC2CCCCC2)C1	ZINC000095952522	185040631	/nfs/dbraw/zinc/04/06/31/185040631.db2.gz	IJBMVGLVPGDPKB-OAHLLOKOSA-N	1	0	295.427	1.426	50	0		CDAARO
O=C1C[C@@H]([NH2+]C[C@@H]2CCCO2)C(=O)N1c1ccccc1	ZINC000095952490	185040737	/nfs/dbraw/zinc/04/07/37/185040737.db2.gz	OMZNHAYDKPVXQO-QWHCGFSZSA-N	1	0	274.320	1.087	50	0		CDAARO
CC(C)C(=O)c1ccc(S(=O)(=O)N2CC[C@H]([NH3+])C2)cc1	ZINC000095972599	185049275	/nfs/dbraw/zinc/04/92/75/185049275.db2.gz	OHBPXURHQMXNGM-LBPRGKRZSA-N	1	0	296.392	1.247	50	0		CDAARO
C[C@@H](Cn1ncc2ccccc2c1=O)[NH2+][C@@H]1CCOC1	ZINC000095983742	185054004	/nfs/dbraw/zinc/05/40/04/185054004.db2.gz	CDLTVFMCRBLJSI-WCQYABFASA-N	1	0	273.336	1.164	50	0		CDAARO
CC[C@@H](O)C[NH+]1CCC(NC(=O)NCC(F)(F)F)CC1	ZINC000095986856	185056598	/nfs/dbraw/zinc/05/65/98/185056598.db2.gz	XTDKFNGEIUVQTE-SNVBAGLBSA-N	1	0	297.321	1.083	50	0		CDAARO
CC[N@@H+]1CC[C@@H]2[C@@H](C1)OCCN2C(=O)[C@@H](C)CSC	ZINC000241316717	361751619	/nfs/dbraw/zinc/75/16/19/361751619.db2.gz	LUHUULSRFSAWEP-YNEHKIRRSA-N	1	0	286.441	1.307	50	0		CDAARO
CN1C(=O)N[C@](C)([C@H]2CCC[N@H+](CC3CCCC3)C2)C1=O	ZINC000089914245	539087680	/nfs/dbraw/zinc/08/76/80/539087680.db2.gz	YSPBOWPVBMNVAE-XJKSGUPXSA-N	1	0	293.411	1.829	50	0		CDAARO
COCC[N@H+](C)C[C@H]1CCCN1c1cccc(C)n1	ZINC000195575670	342628868	/nfs/dbraw/zinc/62/88/68/342628868.db2.gz	ZNRIQPVJLYKRCT-CQSZACIVSA-N	1	0	263.385	1.937	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1C(=O)N1CCOC2(CCCC2)C1	ZINC000095422742	539087982	/nfs/dbraw/zinc/08/79/82/539087982.db2.gz	NEUUJCDKPULZNO-CYBMUJFWSA-N	1	0	266.385	1.642	50	0		CDAARO
Cc1ccc(OC2CN(C(=O)[C@H]([NH3+])C(C)C)C2)cc1	ZINC000244718951	361858221	/nfs/dbraw/zinc/85/82/21/361858221.db2.gz	LUBJVDCFPVWLRJ-CQSZACIVSA-N	1	0	262.353	1.568	50	0		CDAARO
C[N@H+](CCC[C@@H]1CCCO1)CCn1cc[nH]c1=O	ZINC000244716032	361858372	/nfs/dbraw/zinc/85/83/72/361858372.db2.gz	LHBGIGBYORLEGA-GFCCVEGCSA-N	1	0	253.346	1.067	50	0		CDAARO
C[N@H+]([C@H]1CCC[C@@H]1S(C)(=O)=O)[C@@H]1C=CCCC1	ZINC000227336606	539088293	/nfs/dbraw/zinc/08/82/93/539088293.db2.gz	ITBGSKFSEXMHMF-AGIUHOORSA-N	1	0	257.399	1.993	50	0		CDAARO
C[C@@H]1[C@H](C)SCC[N@@H+]1CCn1nc2ccccn2c1=O	ZINC000097002212	185150602	/nfs/dbraw/zinc/15/06/02/185150602.db2.gz	VLVVEDQLEMGFBA-NEPJUHHUSA-N	1	0	292.408	1.322	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)C1	ZINC000097019430	185152778	/nfs/dbraw/zinc/15/27/78/185152778.db2.gz	FLMGASITEJAASQ-CQSZACIVSA-N	1	0	283.331	1.419	50	0		CDAARO
Cc1cn2c(n1)CC[C@@H](NC(=O)c1ccnc(N(C)C)c1)C2	ZINC000097198632	342216997	/nfs/dbraw/zinc/21/69/97/342216997.db2.gz	YGMBRCIATAYUTL-CYBMUJFWSA-N	1	0	299.378	1.397	50	0		CDAARO
CCOC(=O)Cc1csc(NCC[NH+](C)C)n1	ZINC000105849274	342268488	/nfs/dbraw/zinc/26/84/88/342268488.db2.gz	VUHKIEIIWSLFNU-UHFFFAOYSA-N	1	0	257.359	1.222	50	0		CDAARO
C[NH+](C)[C@@H]1CCC[C@H]1Nc1ccc2nccnc2n1	ZINC000585117936	362046223	/nfs/dbraw/zinc/04/62/23/362046223.db2.gz	DQLMHLKZRKQFDL-ZYHUDNBSSA-N	1	0	257.341	1.293	50	0		CDAARO
c1nnc(C[NH2+]CCC[C@@H]2CCO2)n1-c1ccccc1	ZINC000585117786	362046422	/nfs/dbraw/zinc/04/64/22/362046422.db2.gz	XCGCFRFGIKRBBC-CQSZACIVSA-N	1	0	272.352	1.926	50	0		CDAARO
C[C@H](C(=O)N1CCO[C@](C)(c2ccccc2)C1)[NH+](C)C	ZINC000585131675	362056637	/nfs/dbraw/zinc/05/66/37/362056637.db2.gz	COCWGOAPPSRHFE-CJNGLKHVSA-N	1	0	276.380	1.711	50	0		CDAARO
C[NH+](C)CC(=O)N1CC2(CCCC2)OC(C)(C)C1	ZINC000189382707	362057821	/nfs/dbraw/zinc/05/78/21/362057821.db2.gz	WIMCTNCFBVDYJP-UHFFFAOYSA-N	1	0	254.374	1.498	50	0		CDAARO
Cc1nc(C)n(-c2ccc(C(=O)N3CC[NH2+]C[C@@H]3C)cc2)n1	ZINC000126401502	187237745	/nfs/dbraw/zinc/23/77/45/187237745.db2.gz	ZSOXVSSVNPVSIQ-NSHDSACASA-N	1	0	299.378	1.318	50	0		CDAARO
C[C@@H](C[NH+]1CCCCCC1)NC(=O)N(C)CC1(CO)CC1	ZINC000252494827	342382564	/nfs/dbraw/zinc/38/25/64/342382564.db2.gz	OGAVLWFMNNWKOL-AWEZNQCLSA-N	1	0	297.443	1.665	50	0		CDAARO
C[N@H+](Cc1cnc[nH]1)CC(C)(C)CN1CCOCC1	ZINC000093769621	342426311	/nfs/dbraw/zinc/42/63/11/342426311.db2.gz	CZXZPQQPQRUKCB-UHFFFAOYSA-N	1	0	266.389	1.200	50	0		CDAARO
Cc1ccc(C)c(CC(=O)N2CCO[C@H]([C@H](C)[NH3+])C2)c1	ZINC000127868447	187338627	/nfs/dbraw/zinc/33/86/27/187338627.db2.gz	MCRWVYRTFWGVLE-ZFWWWQNUSA-N	1	0	276.380	1.421	50	0		CDAARO
CNC(=O)[C@@H]1CC[N@H+](Cc2cccc(SC)c2)C1	ZINC000097743184	529906757	/nfs/dbraw/zinc/90/67/57/529906757.db2.gz	PZJOUTFOPDZMDO-GFCCVEGCSA-N	1	0	264.394	1.976	50	0		CDAARO
Cc1[nH]ccc1C(=O)NCCCC[NH+]1C[C@H](C)O[C@@H](C)C1	ZINC000084028693	362259381	/nfs/dbraw/zinc/25/93/81/362259381.db2.gz	BVSYZHMKGKYRGH-STQMWFEESA-N	1	0	293.411	1.942	50	0		CDAARO
Cc1c[nH]c(CN2CCC[C@H]([NH+](C)C)C2)c(C)c1=O	ZINC000253537147	362434967	/nfs/dbraw/zinc/43/49/67/362434967.db2.gz	ZPDZNKOJASZQJH-ZDUSSCGKSA-N	1	0	263.385	1.930	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCCN(c2cc(C3CC3)ncn2)C1	ZINC000095384442	136516575	/nfs/dbraw/zinc/51/65/75/136516575.db2.gz	LVDZUBMRTCDGPG-HNNXBMFYSA-N	1	0	276.384	1.247	50	0		CDAARO
CCc1nnc2n1C[C@H](C[NH2+]Cc1cc(C)on1)CC2	ZINC000089296393	346755215	/nfs/dbraw/zinc/75/52/15/346755215.db2.gz	WRUDAYWVEZKJTG-NSHDSACASA-N	1	0	275.356	1.489	50	0		CDAARO
O=C(NCC1([NH+]2CCCC2)CCCC1)c1cncnc1	ZINC000584885013	349342965	/nfs/dbraw/zinc/34/29/65/349342965.db2.gz	KZMQLKSQJORXGK-UHFFFAOYSA-N	1	0	274.368	1.615	50	0		CDAARO
CCC[NH+]1CCC(NC(=O)c2cnc(N)s2)CC1	ZINC000584885783	349344072	/nfs/dbraw/zinc/34/40/72/349344072.db2.gz	SUKAQVMHJCGJES-UHFFFAOYSA-N	1	0	268.386	1.160	50	0		CDAARO
NC(=O)C1(NC(=O)CC2CC[NH2+]CC2)CCCCCC1	ZINC000584895201	349355945	/nfs/dbraw/zinc/35/59/45/349355945.db2.gz	CXNANYUOUCKNNJ-UHFFFAOYSA-N	1	0	281.400	1.071	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1CCn1cnc2cccnc2c1=O	ZINC000584900149	349362407	/nfs/dbraw/zinc/36/24/07/349362407.db2.gz	USWKLKAWXBJFLV-LLVKDONJSA-N	1	0	258.325	1.276	50	0		CDAARO
Cc1nc(NCCc2noc(C3CCC3)n2)cc(N)[nH+]1	ZINC000091452468	180159438	/nfs/dbraw/zinc/15/94/38/180159438.db2.gz	MNDSFULHOBAWAU-UHFFFAOYSA-N	1	0	274.328	1.672	50	0		CDAARO
Cc1ccc2[nH]c(C[NH2+]C[C@H]3CCOC3)cc(=O)c2c1	ZINC000091535161	180182074	/nfs/dbraw/zinc/18/20/74/180182074.db2.gz	JUDMMXBRNRSVGZ-GFCCVEGCSA-N	1	0	272.348	1.963	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)CCc2ccccn2)C[C@@H]1c1ccccc1	ZINC000091535249	180182445	/nfs/dbraw/zinc/18/24/45/180182445.db2.gz	UWVDDYUGHLOPGB-SJORKVTESA-N	1	0	295.386	1.968	50	0		CDAARO
Cc1cc(F)ccc1C(=O)N1C[C@H]([NH3+])[C@@H](C2CC2)C1	ZINC000091793166	180257142	/nfs/dbraw/zinc/25/71/42/180257142.db2.gz	PISDQJPASHZRBF-KGLIPLIRSA-N	1	0	262.328	1.943	50	0		CDAARO
CCn1cc(C[N@@H+]2CC[C@@](O)(C3CC3)[C@H](C)C2)cn1	ZINC000091793223	180257190	/nfs/dbraw/zinc/25/71/90/180257190.db2.gz	BPHYHRYUEDBJSM-DOMZBBRYSA-N	1	0	263.385	1.886	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNc1cc(COC)ncn1	ZINC000092107247	180326890	/nfs/dbraw/zinc/32/68/90/180326890.db2.gz	LAUUUSWGLOZODC-GFCCVEGCSA-N	1	0	250.346	1.519	50	0		CDAARO
CS(=O)(=O)NCCC[NH2+]C1CC(c2ccccc2)C1	ZINC000122821327	187053501	/nfs/dbraw/zinc/05/35/01/187053501.db2.gz	OXFJSRWFZFERHL-UHFFFAOYSA-N	1	0	282.409	1.462	50	0		CDAARO
[NH3+][C@H]1CCN(S(=O)(=O)c2cc(F)ccc2Cl)C1	ZINC000123895733	187113237	/nfs/dbraw/zinc/11/32/37/187113237.db2.gz	NXANLUCJXNIPOX-QMMMGPOBSA-N	1	0	278.736	1.201	50	0		CDAARO
C[C@H](CN1CCOCC1)[N@H+](C)Cc1cccc(O)c1	ZINC000271607481	191239089	/nfs/dbraw/zinc/23/90/89/191239089.db2.gz	JUARGXDLDZIXMZ-CYBMUJFWSA-N	1	0	264.369	1.545	50	0		CDAARO
CS(=O)(=O)CC[NH2+]Cc1c[nH]nc1-c1ccc(F)cc1	ZINC000062423124	363225089	/nfs/dbraw/zinc/22/50/89/363225089.db2.gz	FZYJVQFEZXNSGS-UHFFFAOYSA-N	1	0	297.355	1.350	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](NC(=O)c2cc(NC)ccc2OC)C1	ZINC000000347685	355906076	/nfs/dbraw/zinc/90/60/76/355906076.db2.gz	XWHNDBGCEUFEKS-CYBMUJFWSA-N	1	0	291.395	1.951	50	0		CDAARO
O=C(COc1ccc(F)cc1)NCC[NH+]1CCCC1	ZINC000000383104	355907605	/nfs/dbraw/zinc/90/76/05/355907605.db2.gz	KSFJOZCBDWYCNP-UHFFFAOYSA-N	1	0	266.316	1.417	50	0		CDAARO
Cc1ccc(OCCOCC[N@H+](C)CCO)c(Cl)c1	ZINC000002980665	355989808	/nfs/dbraw/zinc/98/98/08/355989808.db2.gz	IDQDOPFLCJZPPD-UHFFFAOYSA-N	1	0	287.787	1.968	50	0		CDAARO
CC[NH+](CC)CCOC(=O)c1ccc(O)c(OC)c1	ZINC000002294628	355966327	/nfs/dbraw/zinc/96/63/27/355966327.db2.gz	AEHAGXHAPATGJS-UHFFFAOYSA-N	1	0	267.325	1.899	50	0	biogenic	CDAARO
Cn1c(CSC(N)=[NH2+])c(Cl)c(=O)n1-c1ccccc1	ZINC000004666878	356039969	/nfs/dbraw/zinc/03/99/69/356039969.db2.gz	SFPQXZGJLAURMC-UHFFFAOYSA-N	1	0	296.783	1.956	50	0		CDAARO
C[C@@H]1C[C@@H]([NH3+])CCN1C(=O)c1ccc2c(c1)CCO2	ZINC000124675512	356058256	/nfs/dbraw/zinc/05/82/56/356058256.db2.gz	UBXKCAHAEQIVCG-MFKMUULPSA-N	1	0	260.337	1.573	50	0		CDAARO
COCCNC(=O)c1ccc(C[NH+]2CCCC2)cc1	ZINC000010363546	356257524	/nfs/dbraw/zinc/25/75/24/356257524.db2.gz	PZQWEVUOOUKREW-UHFFFAOYSA-N	1	0	262.353	1.659	50	0		CDAARO
COc1ccc(CN2CCC([NH3+])CC2)cc1OC	ZINC000011729473	356278191	/nfs/dbraw/zinc/27/81/91/356278191.db2.gz	SFGKHXRAIWBGPR-UHFFFAOYSA-N	1	0	250.342	1.627	50	0		CDAARO
Cc1cc(NCCc2nncn2C)nc(N2CCCC2)[nH+]1	ZINC000032577531	356294994	/nfs/dbraw/zinc/29/49/94/356294994.db2.gz	OIZMJGFZATXQGK-UHFFFAOYSA-N	1	0	287.371	1.168	50	0		CDAARO
COc1cc(C[NH2+]Cc2ccco2)ccc1OCCO	ZINC000013730907	356354968	/nfs/dbraw/zinc/35/49/68/356354968.db2.gz	MLUBTQNEFHSIQW-UHFFFAOYSA-N	1	0	277.320	1.949	50	0		CDAARO
CC[NH+]1CCN(CCC(=O)Nc2ccc(F)cc2)CC1	ZINC000019528182	356490852	/nfs/dbraw/zinc/49/08/52/356490852.db2.gz	QTCGJEARGNQBLM-UHFFFAOYSA-N	1	0	279.359	1.792	50	0		CDAARO
Nc1ccc(N2CC[NH+](Cc3ccccc3)CC2)cn1	ZINC000019868613	356512058	/nfs/dbraw/zinc/51/20/58/356512058.db2.gz	PINJXNRJRQRMKC-UHFFFAOYSA-N	1	0	268.364	1.986	50	0		CDAARO
Cc1ccc(Cl)c(OCCOCCNCC[NH3+])c1	ZINC000019772371	356500918	/nfs/dbraw/zinc/50/09/18/356500918.db2.gz	UFCOQHUJXFIYFT-UHFFFAOYSA-N	1	0	272.776	1.592	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000019790722	356504454	/nfs/dbraw/zinc/50/44/54/356504454.db2.gz	KPJRIDHMLWHCQZ-AWEZNQCLSA-N	1	0	298.814	1.717	50	0		CDAARO
CCc1cc(C(=O)N2CCN(c3cc[nH+]cc3)CC2)on1	ZINC000020993777	356560290	/nfs/dbraw/zinc/56/02/90/356560290.db2.gz	MYDJOUAVNSLKNI-UHFFFAOYSA-N	1	0	286.335	1.594	50	0		CDAARO
CCC[NH+]1CCN(C[C@@H](O)COCc2cccs2)CC1	ZINC000022030345	356597956	/nfs/dbraw/zinc/59/79/56/356597956.db2.gz	OJEPTLNLMYXFLB-CQSZACIVSA-N	1	0	298.452	1.653	50	0		CDAARO
C[NH+](C)CC(C)(C)Cn1c(=O)[nH]c2ccccc2c1=O	ZINC000025464121	356674905	/nfs/dbraw/zinc/67/49/05/356674905.db2.gz	UIPLNSXMODRNJZ-UHFFFAOYSA-N	1	0	275.352	1.278	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[NH+]1CCC(c2ccccc2)CC1	ZINC000024991311	356665499	/nfs/dbraw/zinc/66/54/99/356665499.db2.gz	KZKHYOBNDCYURV-LBPRGKRZSA-N	1	0	289.379	1.710	50	0		CDAARO
CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)N2CCC(O)CC2)c1C	ZINC000026859499	356700417	/nfs/dbraw/zinc/70/04/17/356700417.db2.gz	JXZAVXNUQKMOBL-NSHDSACASA-N	1	0	292.379	1.862	50	0		CDAARO
COc1cccc(/C(C)=C\C(=O)N2CC[C@@H](C[NH3+])C2)c1	ZINC000255496321	356702400	/nfs/dbraw/zinc/70/24/00/356702400.db2.gz	HQMCXAKDXGOQTC-FSBNRTBOSA-N	1	0	274.364	1.906	50	0		CDAARO
Cc1cc(S(=O)(=O)N2CC[N@@H+]3CCC[C@H]3C2)ccc1F	ZINC000247215838	356750505	/nfs/dbraw/zinc/75/05/05/356750505.db2.gz	BDTONLSFKOIYDL-LBPRGKRZSA-N	1	0	298.383	1.603	50	0		CDAARO
c1n[nH]cc1CCC[N@@H+]1CCCC[C@@H]1CN1CCOCC1	ZINC000032498399	356780708	/nfs/dbraw/zinc/78/07/08/356780708.db2.gz	RXJPXKFSYLTAKJ-MRXNPFEDSA-N	1	0	292.427	1.529	50	0		CDAARO
COc1cccc(/C(C)=C\C(=O)N2CC[NH2+][C@H](C)C2)c1	ZINC000255627017	356805730	/nfs/dbraw/zinc/80/57/30/356805730.db2.gz	ONPBGYAGLNTYHJ-KIWPFMIBSA-N	1	0	274.364	1.919	50	0		CDAARO
CC(=O)N1CCC([NH+]2CCN(c3ccccc3)CC2)CC1	ZINC000000212512	356812551	/nfs/dbraw/zinc/81/25/51/356812551.db2.gz	KTPKJZAOQLKDOG-UHFFFAOYSA-N	1	0	287.407	1.820	50	0		CDAARO
COc1cc(C)ccc1OCCOCC[NH+](C)C	ZINC000002823569	356813588	/nfs/dbraw/zinc/81/35/88/356813588.db2.gz	JPUMHGWDWWPPHW-UHFFFAOYSA-N	1	0	253.342	1.961	50	0		CDAARO
CC(=O)N1CC[NH+]([C@@H]2CCc3ccccc3C2)CC1	ZINC000023282565	356816877	/nfs/dbraw/zinc/81/68/77/356816877.db2.gz	MLNALDQTTAADNX-MRXNPFEDSA-N	1	0	258.365	1.708	50	0		CDAARO
O=C1CCCN1C[C@H]1CCCN(c2cc[nH+]c(CO)c2)C1	ZINC000032517994	356781818	/nfs/dbraw/zinc/78/18/18/356781818.db2.gz	PGMHILJKKWFNLR-ZDUSSCGKSA-N	1	0	289.379	1.413	50	0		CDAARO
Cc1noc(C)c1S(=O)(=O)NC[C@H]([NH3+])c1ccccc1	ZINC000036297696	356869614	/nfs/dbraw/zinc/86/96/14/356869614.db2.gz	AJHREXXPHYIMHG-LBPRGKRZSA-N	1	0	295.364	1.270	50	0		CDAARO
COc1cc(COC[C@@H]2CC[NH2+]C2)cc(OC)c1	ZINC000042774052	357079374	/nfs/dbraw/zinc/07/93/74/357079374.db2.gz	OTOZBNAEAYZJFO-LLVKDONJSA-N	1	0	251.326	1.830	50	0		CDAARO
CC(C)C[N@@H+]1CCN(Cc2ccoc2)[C@H](CCO)C1	ZINC000042917335	357083824	/nfs/dbraw/zinc/08/38/24/357083824.db2.gz	TYQLEBGYFUCJNH-OAHLLOKOSA-N	1	0	266.385	1.804	50	0		CDAARO
CCCC[NH+]1CCN(c2ncnc3oc(C)nc32)CC1	ZINC000055282317	357331062	/nfs/dbraw/zinc/33/10/62/357331062.db2.gz	JTZBLCUNXBCELK-UHFFFAOYSA-N	1	0	275.356	1.848	50	0		CDAARO
Cc1ccc(CNC(=O)CN2CCC(O)CC2)cc1	ZINC000015306888	357415673	/nfs/dbraw/zinc/41/56/73/357415673.db2.gz	DCGZMRCEAVLZIG-UHFFFAOYSA-N	1	0	262.353	1.068	50	0		CDAARO
CNC(=O)C[N@H+](C[C@H]1CCCO1)C1CCC(C)CC1	ZINC000096441481	357473397	/nfs/dbraw/zinc/47/33/97/357473397.db2.gz	JDZMCMFCUGVCEO-JXQTWKCFSA-N	1	0	268.401	1.792	50	0		CDAARO
Cc1cccnc1NCC[NH2+][C@@H](C)C(=O)NC1CCCC1	ZINC000065385652	357534197	/nfs/dbraw/zinc/53/41/97/357534197.db2.gz	IAGCYRXSWHBCEL-ZDUSSCGKSA-N	1	0	290.411	1.839	50	0		CDAARO
CCc1cc(NC[C@H]2COCCO2)nc(N2CCCC2)[nH+]1	ZINC000065501403	357546024	/nfs/dbraw/zinc/54/60/24/357546024.db2.gz	ZJPLHRAZJFMAIT-ZDUSSCGKSA-N	1	0	292.383	1.467	50	0		CDAARO
[NH3+]C[C@H]1CN(Cc2ccccc2Cn2cccn2)CCO1	ZINC000067739549	357622698	/nfs/dbraw/zinc/62/26/98/357622698.db2.gz	YBHIYDLAPHGYET-INIZCTEOSA-N	1	0	286.379	1.091	50	0		CDAARO
Cc1ccc2cc(C3(O)CCN(C(=O)C[NH3+])CC3)ccc2n1	ZINC000067789652	357627691	/nfs/dbraw/zinc/62/76/91/357627691.db2.gz	BUYLPLJUBVMKPF-UHFFFAOYSA-N	1	0	299.374	1.312	50	0		CDAARO
O=C(NC1CC[NH+](Cc2ccccn2)CC1)[C@H]1CCOC1	ZINC000066918605	357588480	/nfs/dbraw/zinc/58/84/80/357588480.db2.gz	HMNRPFVEJRVHQY-ZDUSSCGKSA-N	1	0	289.379	1.199	50	0		CDAARO
CCCN1C[C@@H]([NH2+]C2CSCCSC2)CC1=O	ZINC000067866784	357633524	/nfs/dbraw/zinc/63/35/24/357633524.db2.gz	DVCPCDCEULHHJP-JTQLQIEISA-N	1	0	274.455	1.436	50	0		CDAARO
Cc1cccc(O[C@H](C)C(=O)NC2CC[NH+](C)CC2)c1	ZINC000071754591	357778664	/nfs/dbraw/zinc/77/86/64/357778664.db2.gz	DNPZROHPRPUEDV-CYBMUJFWSA-N	1	0	276.380	1.973	50	0		CDAARO
Nc1ncccc1CN1CCC([NH+]2CCC(O)CC2)CC1	ZINC000072429335	357834944	/nfs/dbraw/zinc/83/49/44/357834944.db2.gz	YQDHDIWQFVDANM-UHFFFAOYSA-N	1	0	290.411	1.085	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2ccco2)CCOCC1	ZINC000073132702	357868274	/nfs/dbraw/zinc/86/82/74/357868274.db2.gz	NCZWRMAGOBIHLL-UHFFFAOYSA-N	1	0	252.314	1.120	50	0		CDAARO
Cc1cccc(N2CC[C@@H](S(=O)(=O)NC(C)C)C2)n1	ZINC000097096489	357953485	/nfs/dbraw/zinc/95/34/85/357953485.db2.gz	LNBKOCYBOBJIRV-GFCCVEGCSA-N	1	0	283.397	1.297	50	0		CDAARO
COC(=O)C1(C[NH2+]Cc2c(C)noc2C)CCOCC1	ZINC000097108633	357983733	/nfs/dbraw/zinc/98/37/33/357983733.db2.gz	VNXDSKSNTFYNSK-UHFFFAOYSA-N	1	0	282.340	1.351	50	0		CDAARO
CCC[C@@H]1CN(C(=O)c2cnn(C)c2)C[C@H]1[NH+](C)C	ZINC000082138744	358148772	/nfs/dbraw/zinc/14/87/72/358148772.db2.gz	QOHQKWFPZGCQSE-DGCLKSJQSA-N	1	0	264.373	1.222	50	0		CDAARO
[NH3+][C@@H]1CCCCN(C(=O)CCc2[nH]nc3c2CCCC3)C1	ZINC000082133451	358148808	/nfs/dbraw/zinc/14/88/08/358148808.db2.gz	CZOYWJZDJOHKOA-GFCCVEGCSA-N	1	0	290.411	1.561	50	0		CDAARO
C[C@H]([NH2+]CC(C)(C)C(N)=O)c1ccc(S(C)(=O)=O)cc1	ZINC000195558781	299276288	/nfs/dbraw/zinc/27/62/88/299276288.db2.gz	PMUUVJMARYXNTD-JTQLQIEISA-N	1	0	298.408	1.252	50	0		CDAARO
COc1cc(CC(=O)N(C)CC[N@H+](C)C2CC2)ccc1O	ZINC000294880608	199228950	/nfs/dbraw/zinc/22/89/50/199228950.db2.gz	BXHDGLUBLWGBMW-UHFFFAOYSA-N	1	0	292.379	1.496	50	0		CDAARO
CC[n+]1cc(N)nc(-c2ccc(Br)cc2)n1	ZINC000000506409	366442539	/nfs/dbraw/zinc/44/25/39/366442539.db2.gz	OXPZGOSNNKFDRZ-UHFFFAOYSA-N	1	0	280.149	1.796	50	0		CDAARO
CCCC(=O)NC[C@@H](c1ccc2c(c1)OCO2)[NH+](C)C	ZINC000012196000	358552302	/nfs/dbraw/zinc/55/23/02/358552302.db2.gz	NPPZIRFIWYLREF-LBPRGKRZSA-N	1	0	278.352	1.934	50	0		CDAARO
CC(C)Oc1ccc(S(=O)(=O)N(C)[C@H](C)C[NH3+])cc1	ZINC000195555277	358557779	/nfs/dbraw/zinc/55/77/79/358557779.db2.gz	PWILFHFWYFCKMB-LLVKDONJSA-N	1	0	286.397	1.442	50	0		CDAARO
COc1ccc(Cl)cc1CNCC[NH2+]C[C@H](C)O	ZINC000095098700	358678224	/nfs/dbraw/zinc/67/82/24/358678224.db2.gz	HRXVASVBRNYBHQ-JTQLQIEISA-N	1	0	272.776	1.409	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)N[C@@H](C)c2cnn(C)c2)CC1	ZINC000095361444	358685898	/nfs/dbraw/zinc/68/58/98/358685898.db2.gz	DGCRNYVOHIRNDT-LBPRGKRZSA-N	1	0	278.400	1.718	50	0		CDAARO
O=C(CSCC[NH+]1CCCC1)N1CCc2[nH]cnc2C1	ZINC000095367815	358686954	/nfs/dbraw/zinc/68/69/54/358686954.db2.gz	GWZOFZCFOCOQTI-UHFFFAOYSA-N	1	0	294.424	1.123	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1NC[C@@H](CC)N1CCOCC1	ZINC000095379371	358689840	/nfs/dbraw/zinc/68/98/40/358689840.db2.gz	QBAQMNDGLZBFRU-GFCCVEGCSA-N	1	0	293.415	1.452	50	0		CDAARO
CC[NH+]1CCC(Cc2nc(CCOC)no2)CC1	ZINC000096138309	358709153	/nfs/dbraw/zinc/70/91/53/358709153.db2.gz	ZPUBQPMYMBSVTE-UHFFFAOYSA-N	1	0	253.346	1.533	50	0		CDAARO
[NH3+][C@@H]1CCN(c2ccc(-c3ccccc3F)nn2)C1	ZINC000098211193	358816858	/nfs/dbraw/zinc/81/68/58/358816858.db2.gz	IADPMZVVJXBWJO-SNVBAGLBSA-N	1	0	258.300	1.820	50	0		CDAARO
CC1=[NH+]CCN1CCNC(=O)Nc1ccc(F)cc1	ZINC000100228455	358823372	/nfs/dbraw/zinc/82/33/72/358823372.db2.gz	WCUVDYOYTOLHPU-UHFFFAOYSA-N	1	0	264.304	1.681	50	0		CDAARO
CN(C)c1nc(N)cc(-c2ccc(C[NH+](C)C)cc2)n1	ZINC000097514295	358781588	/nfs/dbraw/zinc/78/15/88/358781588.db2.gz	UNHKLYSAQHIYMY-UHFFFAOYSA-N	1	0	271.368	1.853	50	0		CDAARO
O=C(CCc1cn2ccccc2n1)N1CCSCC1	ZINC000097568914	358785256	/nfs/dbraw/zinc/78/52/56/358785256.db2.gz	WDBQHKKIOIMTBM-UHFFFAOYSA-N	1	0	275.377	1.842	50	0		CDAARO
O=c1[nH]ccnc1N1CC[NH+](CCc2ccccc2)CC1	ZINC000097785472	358798479	/nfs/dbraw/zinc/79/84/79/358798479.db2.gz	VAXUODATDBSFGS-UHFFFAOYSA-N	1	0	284.363	1.135	50	0		CDAARO
C[NH+](C)CC(C)(C)CNC(=O)c1cnc(C2CC2)nc1	ZINC000097797413	358799821	/nfs/dbraw/zinc/79/98/21/358799821.db2.gz	NIZXJDRFTRXYSD-UHFFFAOYSA-N	1	0	276.384	1.672	50	0		CDAARO
CCc1nccc(CN(C)C[C@@H]2CC[N@H+](CCOC)C2)n1	ZINC000215775151	358903454	/nfs/dbraw/zinc/90/34/54/358903454.db2.gz	RVMSPCPBOFJBNQ-AWEZNQCLSA-N	1	0	292.427	1.439	50	0		CDAARO
CC(C)(C)OC(=O)N1C[C@H]2CCC[N@@H+]2C[C@@H]1CO	ZINC000072233500	359060173	/nfs/dbraw/zinc/06/01/73/359060173.db2.gz	NDMVHLYKYURZNP-GHMZBOCLSA-N	1	0	256.346	1.062	50	0		CDAARO
C[C@@H]1C[NH+](CCCNC(=O)c2ccco2)C[C@@H](C)O1	ZINC000032826824	359252812	/nfs/dbraw/zinc/25/28/12/359252812.db2.gz	FSTCAMPIUUYFSY-VXGBXAGGSA-N	1	0	266.341	1.509	50	0		CDAARO
C[NH+]1CCC(OCCCNC(=O)c2ccncc2)CC1	ZINC000222482246	359346954	/nfs/dbraw/zinc/34/69/54/359346954.db2.gz	ZFYKCSHGPCPQGJ-UHFFFAOYSA-N	1	0	277.368	1.312	50	0		CDAARO
OC[C@@H]1CCC[N@@H+]1Cc1cnc(N2CCCCC2)nc1	ZINC000223505854	359430656	/nfs/dbraw/zinc/43/06/56/359430656.db2.gz	AGDQIXWMVVJHTR-AWEZNQCLSA-N	1	0	276.384	1.424	50	0		CDAARO
CN1C(=O)[C@H]2C[N@H+](Cc3ccc4[nH]ccc4c3)C[C@H]2C1=O	ZINC000257181707	359398341	/nfs/dbraw/zinc/39/83/41/359398341.db2.gz	NSWADJPNFOHFLU-BETUJISGSA-N	1	0	283.331	1.215	50	0		CDAARO
CC[NH+](CC)[C@@H](CNc1ncncn1)c1ccco1	ZINC000223195810	359406677	/nfs/dbraw/zinc/40/66/77/359406677.db2.gz	QJUOWBTXSSZHFK-NSHDSACASA-N	1	0	261.329	1.960	50	0		CDAARO
O=C(Cc1coc2cc(F)ccc12)NCC1C[NH2+]C1	ZINC000262037533	359604674	/nfs/dbraw/zinc/60/46/74/359604674.db2.gz	QWKRHKVHNIITAF-UHFFFAOYSA-N	1	0	262.284	1.450	50	0		CDAARO
C[C@@H]1CCCC[C@@H]1OCC[NH2+]C[C@H]1CN(C)CCO1	ZINC000257365349	359944822	/nfs/dbraw/zinc/94/48/22/359944822.db2.gz	NZNOSVYHHYTYOL-ILXRZTDVSA-N	1	0	270.417	1.502	50	0		CDAARO
Cc1ccc(NC(=O)[C@@H](C)[NH2+]CC(C)(C)CO)cc1	ZINC000065370278	360094241	/nfs/dbraw/zinc/09/42/41/360094241.db2.gz	NDXNWRNYNUPONA-GFCCVEGCSA-N	1	0	264.369	1.930	50	0		CDAARO
O=C(N[C@@H]1CCCC[C@@H]1CO)[C@@H]1CC12CC[NH2+]CC2	ZINC000231316194	360054873	/nfs/dbraw/zinc/05/48/73/360054873.db2.gz	KZFLCDFUBJTKOW-FRRDWIJNSA-N	1	0	266.385	1.043	50	0		CDAARO
CC(=O)N1CCC[C@@H]1[C@H]1CCC[N@H+]1[C@H](C)C(=O)NC1CC1	ZINC000247933724	360252264	/nfs/dbraw/zinc/25/22/64/360252264.db2.gz	KPSFOGHTYCJJJL-KCPJHIHWSA-N	1	0	293.411	1.129	50	0		CDAARO
CCN(CC)c1ccc(Nc2cnnc(=O)[nH]2)cc1	ZINC000011903615	360417275	/nfs/dbraw/zinc/41/72/75/360417275.db2.gz	QMCBBNOZODILDD-UHFFFAOYSA-N	1	0	259.313	1.755	50	0		CDAARO
O=C(Cn1nccc1[C@H]1CCC[NH2+]C1)NCc1cccnc1	ZINC000426477544	360568803	/nfs/dbraw/zinc/56/88/03/360568803.db2.gz	JYGACLKKVHJAMS-AWEZNQCLSA-N	1	0	299.378	1.062	50	0		CDAARO
Cc1c[nH]c(CNC(=O)N2CC([N@H+]3CCCC[C@H]3C)C2)n1	ZINC000426661365	360694156	/nfs/dbraw/zinc/69/41/56/360694156.db2.gz	RAXPSKWSWUNTQG-GFCCVEGCSA-N	1	0	291.399	1.486	50	0		CDAARO
COCCN(Cc1ccc(F)cc1)C(=O)[C@H](C)[NH+](C)C	ZINC000426396399	360663392	/nfs/dbraw/zinc/66/33/92/360663392.db2.gz	JWWFHCCSQKSMNU-LBPRGKRZSA-N	1	0	282.359	1.751	50	0		CDAARO
Cc1nc([C@@H]2CCOC2)cc(N(C)C2CC[NH+](C)CC2)n1	ZINC000426419960	360668041	/nfs/dbraw/zinc/66/80/41/360668041.db2.gz	IGBJXGHNVMLNFB-CYBMUJFWSA-N	1	0	290.411	1.819	50	0		CDAARO
Cc1c(C)n(C[C@H](O)C[NH2+]CCO)c2c1cccc2Cl	ZINC000012421911	360698703	/nfs/dbraw/zinc/69/87/03/360698703.db2.gz	BTVOKTFWWOILBL-GFCCVEGCSA-N	1	0	296.798	1.854	50	0		CDAARO
CCCNC(=O)NC(=O)C[N@H+](C)[C@H]1CCc2ccccc21	ZINC000012821113	361416358	/nfs/dbraw/zinc/41/63/58/361416358.db2.gz	JNUDRGLLGAQGRP-AWEZNQCLSA-N	1	0	289.379	1.842	50	0		CDAARO
COc1ccc(C[NH2+]C2CCN(C(C)=O)CC2)cc1OC	ZINC000017316992	364027411	/nfs/dbraw/zinc/02/74/11/364027411.db2.gz	RZNLITQPHHLDCQ-UHFFFAOYSA-N	1	0	292.379	1.804	50	0		CDAARO
COc1coc(C[N@H+](C)C[C@@H]2CCOC2)cc1=O	ZINC000268490586	364054976	/nfs/dbraw/zinc/05/49/76/364054976.db2.gz	RHRPYDDLFJZHCQ-JTQLQIEISA-N	1	0	253.298	1.117	50	0		CDAARO
CC(=O)c1ccc(C(=O)N2CCC[C@@H]([NH+](C)C)C2)cc1O	ZINC000240551533	364439971	/nfs/dbraw/zinc/43/99/71/364439971.db2.gz	GUKPQRWJATURJR-CYBMUJFWSA-N	1	0	290.363	1.761	50	0		CDAARO
C[C@@H](C(=O)N1C[C@H](C)C[C@H](C)C1)[NH+]1CCC(O)CC1	ZINC000249305489	364505808	/nfs/dbraw/zinc/50/58/08/364505808.db2.gz	JERNGNIEVLLHNX-XQQFMLRXSA-N	1	0	268.401	1.336	50	0		CDAARO
CC(C)(C[NH2+]CCN1CCOCC1)c1ccccc1	ZINC000037935095	364515551	/nfs/dbraw/zinc/51/55/51/364515551.db2.gz	UQHXUQUPSQCSFL-UHFFFAOYSA-N	1	0	262.397	1.886	50	0		CDAARO
CC[C@H](NC(=O)CCC[NH+]1CCCC1)c1cnn(C)c1	ZINC000219448602	189720022	/nfs/dbraw/zinc/72/00/22/189720022.db2.gz	JYWQFSSPRRJVFN-AWEZNQCLSA-N	1	0	278.400	1.863	50	0		CDAARO
CC[C@@H]1CN(C(=O)C2CC2)CC[C@H]1[NH2+]Cc1ncc[nH]1	ZINC000089948777	366975517	/nfs/dbraw/zinc/97/55/17/366975517.db2.gz	JIXUYFVYDWFVOF-DGCLKSJQSA-N	1	0	276.384	1.536	50	0		CDAARO
CC[C@@H](O)C[NH+]1CCN(Cc2noc(CC(C)C)n2)CC1	ZINC000089943372	366976340	/nfs/dbraw/zinc/97/63/40/366976340.db2.gz	DZQRVGIADOOMEL-CYBMUJFWSA-N	1	0	296.415	1.157	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1cccc(C(=O)NC)n1	ZINC000089977246	366993547	/nfs/dbraw/zinc/99/35/47/366993547.db2.gz	CALWYSNKPVLHNG-LBPRGKRZSA-N	1	0	276.384	1.728	50	0		CDAARO
CC1(C)C[C@H]([NH2+][C@@H]2CC(=O)N(C3CC3)C2)C(C)(C)O1	ZINC000090181385	367024468	/nfs/dbraw/zinc/02/44/68/367024468.db2.gz	KASGNWRGEGBPHC-PWSUYJOCSA-N	1	0	266.385	1.685	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CC[NH2+]C[C@H]2C)c(C)c1	ZINC000094345691	367482503	/nfs/dbraw/zinc/48/25/03/367482503.db2.gz	PMQJYNPUTRBAEG-CHWSQXEVSA-N	1	0	282.409	1.580	50	0		CDAARO
Cn1ncc2c1ncnc2NCc1cn2ccccc2n1	ZINC000012547357	368832488	/nfs/dbraw/zinc/83/24/88/368832488.db2.gz	RVDMTOFVLTUENK-UHFFFAOYSA-N	1	0	279.307	1.623	50	0		CDAARO
COC(=O)[C@H](C)N1C[C@@H]2C[N@H+](C)[C@H](c3ccccc3)[C@H]2C1	ZINC000252673680	371693025	/nfs/dbraw/zinc/69/30/25/371693025.db2.gz	RJVMIGKQMVHTQG-QCEMKRCNSA-N	1	0	288.391	1.783	50	0		CDAARO
CC(C)[N@H+](C)CC(=O)Nc1c2c(nn1C)CCC2	ZINC000299497827	372619135	/nfs/dbraw/zinc/61/91/35/372619135.db2.gz	JZJHCNNHKOIYHF-UHFFFAOYSA-N	1	0	250.346	1.188	50	0		CDAARO
Cc1nc(CN(C)C[C@@H]2CCCC[N@@H+]2C)[nH]c1C	ZINC000299781887	372760423	/nfs/dbraw/zinc/76/04/23/372760423.db2.gz	LXAHWUZOCXJEIZ-ZDUSSCGKSA-N	1	0	250.390	1.943	50	0		CDAARO
Cc1nonc1CNC(=O)C1CC[NH+](C2CCCC2)CC1	ZINC000299796172	372768864	/nfs/dbraw/zinc/76/88/64/372768864.db2.gz	PTRZLXDVZYFNKH-UHFFFAOYSA-N	1	0	292.383	1.649	50	0		CDAARO
O=C(Cc1ccccc1F)N1CC[C@@H]2[NH2+]CCC[C@@H]2C1	ZINC000299803043	372773484	/nfs/dbraw/zinc/77/34/84/372773484.db2.gz	VEMFBRQWGDSILB-HIFRSBDPSA-N	1	0	276.355	1.969	50	0		CDAARO
NC(=O)c1ccc(C[NH+]2CCC3(CCO3)CC2)cc1	ZINC000240936825	189903471	/nfs/dbraw/zinc/90/34/71/189903471.db2.gz	SEJUAQPHINYPTD-UHFFFAOYSA-N	1	0	260.337	1.540	50	0		CDAARO
COC(=O)[C@H]1CN(CCC[NH+]2CCCCC2)C[C@@H](C)O1	ZINC000097100754	541886979	/nfs/dbraw/zinc/88/69/79/541886979.db2.gz	ZSENEEDQGKTVBR-ZIAGYGMSSA-N	1	0	284.400	1.125	50	0		CDAARO
O=C(N[C@@H]1C[N@H+](C2CCC2)C[C@H]1CO)c1ccccc1	ZINC000253412483	373720553	/nfs/dbraw/zinc/72/05/53/373720553.db2.gz	RDNQMUAXUHAQLE-DZGCQCFKSA-N	1	0	274.364	1.262	50	0		CDAARO
CCS(=O)(=O)NCC1CCN(c2cc[nH+]c(C)c2)CC1	ZINC000253399719	373688422	/nfs/dbraw/zinc/68/84/22/373688422.db2.gz	JVICDSIOFROCAK-UHFFFAOYSA-N	1	0	297.424	1.546	50	0		CDAARO
Cc1nc2ccc(N[C@H]3CCC[C@H]([NH+](C)C)C3)nn2n1	ZINC000253415436	373726412	/nfs/dbraw/zinc/72/64/12/373726412.db2.gz	CPSQSWZENXNGCP-RYUDHWBXSA-N	1	0	274.372	1.717	50	0		CDAARO
COC(=O)[C@]1(C)C[C@@H](CO)[C@@H](c2ccccc2F)N1C	ZINC000012336739	374492478	/nfs/dbraw/zinc/49/24/78/374492478.db2.gz	ZMRSHGSKTLXEPR-XEGUGMAKSA-N	1	0	281.327	1.743	50	0		CDAARO
CC1=CC[N@H+](CCNC(=O)NCc2cccnc2)CC1	ZINC000390833849	374850652	/nfs/dbraw/zinc/85/06/52/374850652.db2.gz	NXFLPYPTPUVNGM-UHFFFAOYSA-N	1	0	274.368	1.533	50	0		CDAARO
CSCC1(C[N@@H+]2CC[C@@H](NS(C)(=O)=O)C2)CCC1	ZINC000095435332	374935619	/nfs/dbraw/zinc/93/56/19/374935619.db2.gz	IXKCWTVGTHQDFJ-LLVKDONJSA-N	1	0	292.470	1.143	50	0		CDAARO
CC(C)(C)c1n[nH]cc1CNC[C@@H](O)C[NH+]1CCCCC1	ZINC000097160067	375150642	/nfs/dbraw/zinc/15/06/42/375150642.db2.gz	HFZPMEJSTYTXST-CQSZACIVSA-N	1	0	294.443	1.644	50	0		CDAARO
CC(=O)N1CC[C@H]([N@@H+]2CCC[C@H](O)C2)c2ccccc2C1	ZINC000097165320	375152866	/nfs/dbraw/zinc/15/28/66/375152866.db2.gz	VZDSAFWZUINVFB-RDJZCZTQSA-N	1	0	288.391	1.937	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CC(=O)NC(=O)NCc1ccccc1	ZINC000003583355	375756208	/nfs/dbraw/zinc/75/62/08/375756208.db2.gz	OUULZDBZOMTEJV-ZDUSSCGKSA-N	1	0	289.379	1.887	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)/C=C\c2ccc(OC)c(F)c2)C1	ZINC000606441872	375823370	/nfs/dbraw/zinc/82/33/70/375823370.db2.gz	PQZMACIGUCGCAS-RYWCDNDXSA-N	1	0	292.354	1.915	50	0		CDAARO
OCCCCC[NH+]1CCC(N2CCSCC2)CC1	ZINC000032500552	375959985	/nfs/dbraw/zinc/95/99/85/375959985.db2.gz	VEYJEMVRMAYVRG-UHFFFAOYSA-N	1	0	272.458	1.662	50	0		CDAARO
CCc1cc(N2CC[N@@H+]3CCCC[C@H]3C2)nc(N(C)C)n1	ZINC000244787737	376023694	/nfs/dbraw/zinc/02/36/94/376023694.db2.gz	QCSJFNOYXQECHL-AWEZNQCLSA-N	1	0	289.427	1.780	50	0		CDAARO
CC(=O)c1cc(CC(=O)N[C@H]2CC[C@@H]([NH3+])CC2)cs1	ZINC000244633357	376033151	/nfs/dbraw/zinc/03/31/51/376033151.db2.gz	GBMYSUMYSOUMBN-TXEJJXNPSA-N	1	0	280.393	1.879	50	0		CDAARO
CCN(C(=O)C[C@H]1COCC[NH2+]1)c1ccc(OC)cc1	ZINC000262031591	190046932	/nfs/dbraw/zinc/04/69/32/190046932.db2.gz	FCJMIFJMCJILHP-LBPRGKRZSA-N	1	0	278.352	1.427	50	0		CDAARO
CN1C(=O)[C@H]2[C@H]3CCC[N@@H+]3[C@H](c3ccc(F)cc3)[C@H]2C1=O	ZINC000248050611	377195524	/nfs/dbraw/zinc/19/55/24/377195524.db2.gz	QZZNCEYZNMCPSB-ZOBORPQBSA-N	1	0	288.322	1.576	50	0		CDAARO
C[C@@H]1CN(C(=O)Nc2ccc(F)cn2)C[C@H](C)[N@H+]1C	ZINC000294299084	377389598	/nfs/dbraw/zinc/38/95/98/377389598.db2.gz	UEYSJOVCDBGIFX-AOOOYVTPSA-N	1	0	266.320	1.777	50	0		CDAARO
COc1cccc2c1CC[C@H]([NH2+]C1(C(N)=O)CC1)C2	ZINC000190522656	377725635	/nfs/dbraw/zinc/72/56/35/377725635.db2.gz	ZUXOQFWDTMZVDJ-NSHDSACASA-N	1	0	260.337	1.160	50	0		CDAARO
CC[C@@H](C(=O)N1CCC[C@@H](C(C)(C)C(=O)OC)C1)[NH+](C)C	ZINC000089367534	377837404	/nfs/dbraw/zinc/83/74/04/377837404.db2.gz	PXXBVYUGBWZVCS-OLZOCXBDSA-N	1	0	298.427	1.764	50	0		CDAARO
C[C@@H](CO)NC(=O)N[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C	ZINC000245338946	378071756	/nfs/dbraw/zinc/07/17/56/378071756.db2.gz	PMYTZFJRKYSLSV-VNHYZAJKSA-N	1	0	291.395	1.187	50	0		CDAARO
C[C@]1(O)CC[N@@H+]([C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000245343850	378073288	/nfs/dbraw/zinc/07/32/88/378073288.db2.gz	WADUQEFWEPFWRH-RDJZCZTQSA-N	1	0	288.391	1.634	50	0		CDAARO
C[C@@H](C(N)=O)N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000193877317	378308332	/nfs/dbraw/zinc/30/83/32/378308332.db2.gz	SNXXPOGSXNNCCK-VIFPVBQESA-N	1	0	284.306	1.682	50	0		CDAARO
Cn1cncc1C(=O)NCc1ccc(C[NH+]2CCCC2)cc1	ZINC000278515140	194021965	/nfs/dbraw/zinc/02/19/65/194021965.db2.gz	BUSOVRHWMPEYAG-UHFFFAOYSA-N	1	0	298.390	1.946	50	0		CDAARO
CC[N@@H+]1CCC[C@H](N2C(=O)OC(C)(C)[C@@]2(C)O)C1	ZINC000000086219	285264439	/nfs/dbraw/zinc/26/44/39/285264439.db2.gz	YNKAKTJZJSXZAA-GXFFZTMASA-N	1	0	256.346	1.410	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1ccc(=O)n(-c2ccccc2)c1	ZINC000096192131	256793607	/nfs/dbraw/zinc/79/36/07/256793607.db2.gz	XQQLQFMDJUVABZ-UHFFFAOYSA-N	1	0	299.374	1.519	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)N2CCc3n[nH]cc3C2)CC1	ZINC000095357800	184952638	/nfs/dbraw/zinc/95/26/38/184952638.db2.gz	ANVSKHYMWMEGBO-UHFFFAOYSA-N	1	0	276.384	1.415	50	0		CDAARO
O=C(N[C@@H]1CCSc2ccc(F)cc21)[C@H]1C[C@H](O)C[NH2+]1	ZINC000037018188	390204095	/nfs/dbraw/zinc/20/40/95/390204095.db2.gz	ZBODSPGPEBUNET-MVWJERBFSA-N	1	0	296.367	1.202	50	0		CDAARO
Cc1cnc(N2CC[NH2+]CC2)c(Br)c1	ZINC000038537814	390418510	/nfs/dbraw/zinc/41/85/10/390418510.db2.gz	KSLBPFNANUOETD-UHFFFAOYSA-N	1	0	256.147	1.562	50	0		CDAARO
Cc1cc(F)ccc1NC(=O)C[NH2+][C@@H](C)Cn1cncn1	ZINC000067741560	390575704	/nfs/dbraw/zinc/57/57/04/390575704.db2.gz	FYAFUUOCRBXGDA-NSHDSACASA-N	1	0	291.330	1.342	50	0		CDAARO
Cn1ncnc1CC[NH2+]Cc1cc(Cl)ccc1F	ZINC000095435703	390632001	/nfs/dbraw/zinc/63/20/01/390632001.db2.gz	KQIPKRCSLOSMSO-UHFFFAOYSA-N	1	0	268.723	1.940	50	0		CDAARO
COc1ccc(CCC[N@@H+]2CC[C@@H](C(N)=O)C2)cc1F	ZINC000097103873	390791788	/nfs/dbraw/zinc/79/17/88/390791788.db2.gz	WQTLKYHACONQGC-GFCCVEGCSA-N	1	0	280.343	1.574	50	0		CDAARO
Cc1ccc2[nH]c([C@H]3CCC[N@@H+]([C@@H]4CCNC4=O)C3)nc2c1	ZINC000097032966	390827001	/nfs/dbraw/zinc/82/70/01/390827001.db2.gz	BGRAIOFQXOHUIS-SWLSCSKDSA-N	1	0	298.390	1.939	50	0		CDAARO
Cc1ccc(CC2SC(NC(N)=[NH2+])=NC2=O)cc1	ZINC000084460071	390854156	/nfs/dbraw/zinc/85/41/56/390854156.db2.gz	NNOYQGOHZDCZFF-VIFPVBQESA-N	1	0	262.338	1.019	50	0		CDAARO
CCC[N@@H+]1CC[C@@H](CNC(=O)Cc2cc(C)no2)C1	ZINC000220214681	391078636	/nfs/dbraw/zinc/07/86/36/391078636.db2.gz	BKFVBIHLVPPCKN-LBPRGKRZSA-N	1	0	265.357	1.374	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](Nc2nc(C)ns2)C1	ZINC000096456186	533343988	/nfs/dbraw/zinc/34/39/88/533343988.db2.gz	MFAIDQNIBWDZFO-SNVBAGLBSA-N	1	0	256.375	1.369	50	0		CDAARO
C[C@@H](C1CCN(C(=O)c2cnco2)CC1)[NH+](C)C	ZINC000220608973	533389370	/nfs/dbraw/zinc/38/93/70/533389370.db2.gz	JNRJUIZPEXZFNK-JTQLQIEISA-N	1	0	251.330	1.477	50	0		CDAARO
CC(C)SCC[N@@H+]1CC[C@H]2[C@H](C1)OCc1cnnn12	ZINC000299778405	391721515	/nfs/dbraw/zinc/72/15/15/391721515.db2.gz	GHJVBUHZAJRIBQ-STQMWFEESA-N	1	0	282.413	1.565	50	0		CDAARO
CNC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc2ccccc2[nH]c1=O	ZINC000171916955	391964625	/nfs/dbraw/zinc/96/46/25/391964625.db2.gz	WPUUTFGOEUHWMM-HNNXBMFYSA-N	1	0	299.374	1.629	50	0		CDAARO
CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@@](C)(O)c1cccs1	ZINC000195533960	393273309	/nfs/dbraw/zinc/27/33/09/393273309.db2.gz	JGBWQIIYDUQEED-SWLSCSKDSA-N	1	0	296.436	1.946	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)CCc2cc(F)ccc2F)C1	ZINC000237980714	140260789	/nfs/dbraw/zinc/26/07/89/140260789.db2.gz	RUQCZELYGRXEDC-LLVKDONJSA-N	1	0	254.280	1.457	50	0		CDAARO
O=c1c2c3c(sc2ncn1C1CCOCC1)C[NH2+]CC3	ZINC000077539954	296528699	/nfs/dbraw/zinc/52/86/99/296528699.db2.gz	TZJUTQMECNDUQB-UHFFFAOYSA-N	1	0	291.376	1.455	50	0		CDAARO
CO[C@H]1C[C@@H](C[NH+]2CCCC2)N(C(=O)[C@@H]2CCCOC2)C1	ZINC000408516388	286093787	/nfs/dbraw/zinc/09/37/87/286093787.db2.gz	VEAXDBATVHSXFS-ILXRZTDVSA-N	1	0	296.411	1.125	50	0		CDAARO
C[C@H](O)C[NH2+]CCOCCOc1ccc2c(c1)CCC2	ZINC000002879921	169840415	/nfs/dbraw/zinc/84/04/15/169840415.db2.gz	RIKBNNLIWJTPSS-ZDUSSCGKSA-N	1	0	279.380	1.541	50	0		CDAARO
CC(=O)c1ccc(S(=O)(=O)NCCC[NH+](C)C)cc1	ZINC000006671029	170224608	/nfs/dbraw/zinc/22/46/08/170224608.db2.gz	MZQIJPSRNXMUMZ-UHFFFAOYSA-N	1	0	284.381	1.119	50	0		CDAARO
CCc1noc(C)c1C(=O)N1CCC[N@H+](C)CC1	ZINC000006727027	170233689	/nfs/dbraw/zinc/23/36/89/170233689.db2.gz	CKDYLWCGAXEGRS-UHFFFAOYSA-N	1	0	251.330	1.323	50	0		CDAARO
COC[C@@H](C)[NH2+]CC(=O)N1CCc2ccccc2C1	ZINC000007141223	170268416	/nfs/dbraw/zinc/26/84/16/170268416.db2.gz	QAXKMFKUBRLHNZ-GFCCVEGCSA-N	1	0	262.353	1.196	50	0		CDAARO
CNC(=O)c1ccc(NC(=O)C[NH+]2CCCCCC2)cc1	ZINC000007339607	170277791	/nfs/dbraw/zinc/27/77/91/170277791.db2.gz	BLMWJMNVBHECHE-UHFFFAOYSA-N	1	0	289.379	1.861	50	0		CDAARO
NC(=O)C1CC[NH+](CCOc2ccc(Cl)cc2)CC1	ZINC000008317237	170330691	/nfs/dbraw/zinc/33/06/91/170330691.db2.gz	GULALIVUTQSXIA-UHFFFAOYSA-N	1	0	282.771	1.916	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1[nH]c(C)c(C(C)=O)c1C	ZINC000008981349	170360192	/nfs/dbraw/zinc/36/01/92/170360192.db2.gz	SVEVOCRDQCVREN-UHFFFAOYSA-N	1	0	279.384	1.906	50	0		CDAARO
Cc1cc(C)c(C(=O)N2CCO[C@@H](CC[NH+](C)C)C2)o1	ZINC000012050974	170467868	/nfs/dbraw/zinc/46/78/68/170467868.db2.gz	DVZBQBMEEAWLEM-ZDUSSCGKSA-N	1	0	280.368	1.689	50	0		CDAARO
CC(C)[NH2+]C[C@]1(O)CCCN(CCc2ccccc2)C1=O	ZINC000012440091	170488358	/nfs/dbraw/zinc/48/83/58/170488358.db2.gz	CAHNEAHMOQQDCD-QGZVFWFLSA-N	1	0	290.407	1.581	50	0		CDAARO
COCCN1C(=O)N(C)C(=O)C12CC[NH+](CC(C)C)CC2	ZINC000014748955	170644180	/nfs/dbraw/zinc/64/41/80/170644180.db2.gz	RMJIIGPTPKBFBZ-UHFFFAOYSA-N	1	0	297.399	1.017	50	0		CDAARO
CN1CCN(NC2CC[NH+](Cc3ccccc3)CC2)CC1	ZINC000019170242	170754524	/nfs/dbraw/zinc/75/45/24/170754524.db2.gz	AWBNJQGQVIHPIC-UHFFFAOYSA-N	1	0	288.439	1.403	50	0		CDAARO
C[NH+]1CCN(CCNC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000020153938	171038182	/nfs/dbraw/zinc/03/81/82/171038182.db2.gz	JXXNUZHEJSGKMM-UHFFFAOYSA-N	1	0	296.802	1.709	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N1CCC(C[NH3+])CC1	ZINC000020182565	171046208	/nfs/dbraw/zinc/04/62/08/171046208.db2.gz	ZLBCIDZIJFPXJA-UHFFFAOYSA-N	1	0	286.372	1.494	50	0		CDAARO
CC[NH+]1CCN(CC(=O)NC2CCCCCC2)CC1	ZINC000020608801	171267685	/nfs/dbraw/zinc/26/76/85/171267685.db2.gz	MUAUFKKCQCMQCX-UHFFFAOYSA-N	1	0	267.417	1.463	50	0		CDAARO
c1cc(OCCOCCN2CCOCC2)cc2c1CCC2	ZINC000020652916	171269094	/nfs/dbraw/zinc/26/90/94/171269094.db2.gz	ABCVNGCLBADERZ-UHFFFAOYSA-N	1	0	291.391	1.903	50	0		CDAARO
C[C@@H]1CN(CCOc2cccc(C=O)c2)C[C@@H](C)O1	ZINC000020653362	171269162	/nfs/dbraw/zinc/26/91/62/171269162.db2.gz	QFOPVDKLMMOVFU-CHWSQXEVSA-N	1	0	263.337	1.987	50	0		CDAARO
c1cc(CCN2CC[NH+](CCc3ccncc3)CC2)ccn1	ZINC000022042715	171350039	/nfs/dbraw/zinc/35/00/39/171350039.db2.gz	BHPREEJKJGFUPY-UHFFFAOYSA-N	1	0	296.418	1.879	50	0		CDAARO
Cc1ccc([C@H](C)CC[NH+]2CCN(CCO)CC2)o1	ZINC000022077685	171352525	/nfs/dbraw/zinc/35/25/25/171352525.db2.gz	YLCXWHVBAKFNAY-CYBMUJFWSA-N	1	0	266.385	1.692	50	0		CDAARO
Cc1cc(C)c(C)c(OC[C@@H](O)CN2CC[NH+](C)CC2)c1	ZINC000022467429	171388896	/nfs/dbraw/zinc/38/88/96/171388896.db2.gz	KLRGGXJUFGEYOD-INIZCTEOSA-N	1	0	292.423	1.599	50	0		CDAARO
Fc1ccc(-c2noc(CN3CC[NH2+]CC3)n2)cc1	ZINC000037389312	173172722	/nfs/dbraw/zinc/17/27/22/173172722.db2.gz	RQCZCAFWHDMFIA-UHFFFAOYSA-N	1	0	262.288	1.281	50	0		CDAARO
C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1cc(=O)n(C)c(=O)n1C	ZINC000040497571	174295511	/nfs/dbraw/zinc/29/55/11/174295511.db2.gz	SQEYXRNWVGQQNC-YPMHNXCESA-N	1	0	279.384	1.095	50	0		CDAARO
C[N@@H+]1CCC[C@@H](c2n[nH]c(=O)n2CCc2ccccc2)C1	ZINC000065461788	175740165	/nfs/dbraw/zinc/74/01/65/175740165.db2.gz	XJYLUROHRDARMD-CQSZACIVSA-N	1	0	286.379	1.623	50	0		CDAARO
OCCOCC[N@@H+]1CCC[C@@H]1c1ccc(F)cc1	ZINC000072153021	176328118	/nfs/dbraw/zinc/32/81/18/176328118.db2.gz	GBJTWVSUODMEFK-CQSZACIVSA-N	1	0	253.317	1.972	50	0		CDAARO
NC(=O)COc1ccc(-c2cccc3c2CC[NH2+]C3)cc1	ZINC000072166391	176331690	/nfs/dbraw/zinc/33/16/90/176331690.db2.gz	ADOZKSHKTQLQHV-UHFFFAOYSA-N	1	0	282.343	1.863	50	0		CDAARO
C[C@@H]1CCCC[C@@H]1NC(=O)CN1CCCC[C@@H]1C(N)=O	ZINC000009727189	260037336	/nfs/dbraw/zinc/03/73/36/260037336.db2.gz	WYMKZSHLTVPKQF-FRRDWIJNSA-N	1	0	281.400	1.021	50	0		CDAARO
COCCN1CC2(CC[NH2+]CC2)Nc2ccccc2C1=O	ZINC000097673623	277513599	/nfs/dbraw/zinc/51/35/99/277513599.db2.gz	AOVNVOCHSDYTCV-UHFFFAOYSA-N	1	0	289.379	1.323	50	0		CDAARO
C[C@H](C(=O)NC(=O)NC(C)(C)C)[N@@H+]1CCC[C@@H](C)C1	ZINC000105706808	279215671	/nfs/dbraw/zinc/21/56/71/279215671.db2.gz	SAJPJOGBTXJTKG-GHMZBOCLSA-N	1	0	269.389	1.731	50	0		CDAARO
[NH3+][C@H]1[C@H]2CCO[C@H]2[C@@H]1NC(=O)c1ccc(Cl)s1	ZINC000223644571	279692122	/nfs/dbraw/zinc/69/21/22/279692122.db2.gz	ZNWFLAOFEBHULF-KNPZVZKISA-N	1	0	272.757	1.246	50	0		CDAARO
Cc1c2ccccc2[nH]c(=O)c1C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179063978	280270085	/nfs/dbraw/zinc/27/00/85/280270085.db2.gz	ORNJPTDKCWNOLK-NSHDSACASA-N	1	0	285.347	1.683	50	0		CDAARO
Cc1ccc(C(=O)N2CCN(C)C[C@@H]2C[NH3+])cc1Cl	ZINC000095411887	280766935	/nfs/dbraw/zinc/76/69/35/280766935.db2.gz	IVONJGKURCRQST-LBPRGKRZSA-N	1	0	281.787	1.363	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(CCO[C@@H]2CCCC[C@@H]2C)C[C@H]1C	ZINC000252474546	290113403	/nfs/dbraw/zinc/11/34/03/290113403.db2.gz	HJKMFYUHPTUJKZ-VVLHAWIVSA-N	1	0	298.471	1.969	50	0		CDAARO
C[C@H]1C[C@H](C)CN(C(=O)C2([NH3+])Cc3ccccc3C2)C1	ZINC000299739822	300477945	/nfs/dbraw/zinc/47/79/45/300477945.db2.gz	RPBAFNCNHKYSSK-STQMWFEESA-N	1	0	272.392	1.987	50	0		CDAARO
O=C(CCC(F)(F)F)N1C[C@@H]2CC[C@H]1C[NH2+]C2	ZINC000534578926	328311098	/nfs/dbraw/zinc/31/10/98/328311098.db2.gz	SIMRBYOBNTWWSG-BDAKNGLRSA-N	1	0	250.264	1.539	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)C[C@@H]2CCCOC2)CC1	ZINC000534581210	328311824	/nfs/dbraw/zinc/31/18/24/328311824.db2.gz	GWAGMFUYQHECBB-ZDUSSCGKSA-N	1	0	268.401	1.794	50	0		CDAARO
CN(CC(=O)N1CCC2(CCCC2)C1)C1CC[NH2+]CC1	ZINC000534631852	328331624	/nfs/dbraw/zinc/33/16/24/328331624.db2.gz	SKGDINFCKUGRRO-UHFFFAOYSA-N	1	0	279.428	1.463	50	0		CDAARO
CC(C)[C@@H](CNc1cccc(C(N)=O)n1)[NH+](C)C	ZINC000534660318	328342423	/nfs/dbraw/zinc/34/24/23/328342423.db2.gz	LKHKDGCYKPFVJN-LLVKDONJSA-N	1	0	250.346	1.179	50	0		CDAARO
Cc1[nH]nc(C2CC2)c1C(=O)NCCc1ncc[nH]1	ZINC000534667848	328346016	/nfs/dbraw/zinc/34/60/16/328346016.db2.gz	YOEAGDNUAISDDY-UHFFFAOYSA-N	1	0	259.313	1.291	50	0		CDAARO
O=C(C[N@@H+]1C[C@@H]2CC[C@H]1C2)NCCCOC1CCCC1	ZINC000534663297	328350885	/nfs/dbraw/zinc/35/08/85/328350885.db2.gz	XUJUQZLSDHDBEP-KGLIPLIRSA-N	1	0	280.412	1.936	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+]C[C@]2(O)CCSC2)C1(C)C	ZINC000097231015	323207552	/nfs/dbraw/zinc/20/75/52/323207552.db2.gz	SBTKSQKGXAZLJR-NQBHXWOUSA-N	1	0	259.415	1.648	50	0		CDAARO
CO[C@H]1CCN(C(=O)CCc2cccs2)[C@H](C[NH3+])C1	ZINC000195557551	323571516	/nfs/dbraw/zinc/57/15/16/323571516.db2.gz	XYEWXMJHTUYLIE-RYUDHWBXSA-N	1	0	282.409	1.645	50	0		CDAARO
O=C1NC2(CC[NH2+]CC2)C(=O)N1CCCc1ccccc1	ZINC000041598968	327227850	/nfs/dbraw/zinc/22/78/50/327227850.db2.gz	KRYHHDXXZDJEIF-UHFFFAOYSA-N	1	0	287.363	1.293	50	0		CDAARO
Cc1nc(N2C[C@H]3C[NH2+]C[C@]3(CO)C2)ccc1Cl	ZINC001772703867	1159438812	/nfs/dbraw/zinc/43/88/12/1159438812.db2.gz	KAMZGNHCTSXCMH-ZWNOBZJWSA-N	1	0	267.760	1.062	50	0		CDAARO
CNCc1nnc(NCC2CC[NH+](C3CCCC3)CC2)o1	ZINC001772709969	1159444005	/nfs/dbraw/zinc/44/40/05/1159444005.db2.gz	NHLRUYJZTIXGLD-UHFFFAOYSA-N	1	0	293.415	1.856	50	0		CDAARO
CC(=O)c1cnc(N2CCC[C@@H]([NH+](C)C)CC2)nc1C	ZINC001772711295	1159446272	/nfs/dbraw/zinc/44/62/72/1159446272.db2.gz	XIXYYSLUFPETES-CYBMUJFWSA-N	1	0	276.384	1.908	50	0		CDAARO
C[C@]1(CO)CCC[N@H+](C[C@H](O)c2ccccc2F)C1	ZINC000095973214	482491664	/nfs/dbraw/zinc/49/16/64/482491664.db2.gz	FVZGOQRBGOLCDC-GJZGRUSLSA-N	1	0	267.344	1.954	50	0		CDAARO
[NH3+][C@@H]1CCC[C@H]1C(=O)N1CCN(c2ccccc2F)CC1	ZINC000085365304	482577831	/nfs/dbraw/zinc/57/78/31/482577831.db2.gz	DCBSSNIMRUJCSZ-TZMCWYRMSA-N	1	0	291.370	1.602	50	0		CDAARO
O=C(C1CCC1)N1CCC[N@H+](C[C@@H]2CCCOC2)CC1	ZINC000670437757	482978054	/nfs/dbraw/zinc/97/80/54/482978054.db2.gz	WEUQJSKNXDRTFH-AWEZNQCLSA-N	1	0	280.412	1.747	50	0		CDAARO
CCc1nccn1CCC(=O)NC[C@]1(C)CC[N@H+](C)C1	ZINC000670443008	482989283	/nfs/dbraw/zinc/98/92/83/482989283.db2.gz	JGGAAAIOURIQGK-HNNXBMFYSA-N	1	0	278.400	1.294	50	0		CDAARO
O=C(c1ccoc1)N1CCC[N@@H+]([C@H]2CCSC2)CC1	ZINC000670460753	483046010	/nfs/dbraw/zinc/04/60/10/483046010.db2.gz	GMEAWQYAJVFYAA-ZDUSSCGKSA-N	1	0	280.393	1.933	50	0		CDAARO
CNC(=O)[C@H]1CC[N@H+](CC(=O)NC2CCCCCCC2)C1	ZINC000670469606	483064616	/nfs/dbraw/zinc/06/46/16/483064616.db2.gz	UVNKOTZKPSNRSF-ZDUSSCGKSA-N	1	0	295.427	1.283	50	0		CDAARO
CC(C)CC(=O)N1CC[NH+](CC[C@H]2CCOC2)CC1	ZINC000670469493	483064630	/nfs/dbraw/zinc/06/46/30/483064630.db2.gz	QAQKPWHFMGFKIU-AWEZNQCLSA-N	1	0	268.401	1.603	50	0		CDAARO
COc1cc2c(cc1C[N@H+](C)C[C@H]1CCOC1)OCCO2	ZINC000670470899	483073790	/nfs/dbraw/zinc/07/37/90/483073790.db2.gz	UCZHAIRYTSLUOP-GFCCVEGCSA-N	1	0	293.363	1.935	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CCc2nc(C3CC3)no2)n1	ZINC000670472807	483081662	/nfs/dbraw/zinc/08/16/62/483081662.db2.gz	UWZLCKSXLKQIAM-LLVKDONJSA-N	1	0	289.383	1.981	50	0		CDAARO
CS[C@H]1CCCC[N@@H+]([C@@H](C)C(=O)NC2CC2)C1	ZINC000083966477	483229580	/nfs/dbraw/zinc/22/95/80/483229580.db2.gz	FIYBELUNFNBLBI-JQWIXIFHSA-N	1	0	256.415	1.871	50	0		CDAARO
Cc1cnn(C[C@@H]2CCCN2C(=O)C[NH2+]C(C)(C)C)c1	ZINC000084265158	483269264	/nfs/dbraw/zinc/26/92/64/483269264.db2.gz	QTQRAUMHSJUIJS-ZDUSSCGKSA-N	1	0	278.400	1.571	50	0		CDAARO
COc1cc(CNC(=O)[C@@H]2CCCC[NH2+]2)ccc1C	ZINC000096481210	533860601	/nfs/dbraw/zinc/86/06/01/533860601.db2.gz	RGJRZJPRTIEAMD-ZDUSSCGKSA-N	1	0	262.353	1.762	50	0		CDAARO
Cn1c(CC[NH3+])nnc1SC[C@H](O)c1ccccc1	ZINC000426711485	534684044	/nfs/dbraw/zinc/68/40/44/534684044.db2.gz	PQGOLIQTLVOBGF-NSHDSACASA-N	1	0	278.381	1.142	50	0		CDAARO
CC(C)(C[NH2+][C@@H]1CCN(c2ccccn2)C1)S(C)(=O)=O	ZINC000096494398	527178972	/nfs/dbraw/zinc/17/89/72/527178972.db2.gz	VHMOUFWTWYQGCB-GFCCVEGCSA-N	1	0	297.424	1.073	50	0		CDAARO
CC(=O)c1cc(C(=O)N[C@H](C)C2=CC[N@H+](C)CC2)n(C)c1	ZINC000272998602	527201596	/nfs/dbraw/zinc/20/15/96/527201596.db2.gz	RSNBVVRMGNZXSD-LLVKDONJSA-N	1	0	289.379	1.608	50	0		CDAARO
C(c1noc(C2CC2)n1)N1CC[NH+](CC2CCC2)CC1	ZINC000096441435	527497642	/nfs/dbraw/zinc/49/76/42/527497642.db2.gz	WZIRTQUUZXEDJK-UHFFFAOYSA-N	1	0	276.384	1.865	50	0		CDAARO
CC1CC(NC(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)C1	ZINC000098016313	528160210	/nfs/dbraw/zinc/16/02/10/528160210.db2.gz	XTBWCZQLDPKTPB-TUUUFIMRSA-N	1	0	251.374	1.663	50	0		CDAARO
CC[C@@H]([NH2+]C[C@H]1CCOC1)c1cccc(S(N)(=O)=O)c1	ZINC000096501607	529179703	/nfs/dbraw/zinc/17/97/03/529179703.db2.gz	LWKUHQOBWQGQBP-BXUZGUMPSA-N	1	0	298.408	1.411	50	0		CDAARO
Cc1nc(NC(=O)N2CCN(C)C[C@H]2C)sc1C	ZINC000089562636	545567579	/nfs/dbraw/zinc/56/75/79/545567579.db2.gz	ODGDAOQRFQGNLZ-MRVPVSSYSA-N	1	0	268.386	1.928	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]1NC(=O)C1=Cc2ccccc2OC=C1	ZINC000072135219	567902552	/nfs/dbraw/zinc/90/25/52/567902552.db2.gz	BBPIXNQQGBUANV-OLZOCXBDSA-N	1	0	256.305	1.582	50	0		CDAARO
CC[C@@H](C(=O)NCc1nnc(C2CCC2)n1C)[NH+](C)C	ZINC000097141934	567904819	/nfs/dbraw/zinc/90/48/19/567904819.db2.gz	GBTAMJPLQUYAMR-NSHDSACASA-N	1	0	279.388	1.039	50	0		CDAARO
C[C@@H]1N[C@H]([C@@H]2CC[C@H](C(F)(F)F)NC2)CC[C@H]1[NH3+]	ZINC000757211906	574906692	/nfs/dbraw/zinc/90/66/92/574906692.db2.gz	KQKXTGCKNQULAL-UNQZSWDGSA-N	1	0	265.323	1.385	50	0		CDAARO
C[N@H+](Cc1cc(C2CC2)on1)[C@H]1C[C@H]2CNC(=O)C[C@H]2C1	ZINC001704325227	1177687465	/nfs/dbraw/zinc/68/74/65/1177687465.db2.gz	JWLSFNRJYCLQCJ-MBNYWOFBSA-N	1	0	289.379	1.899	50	0		CDAARO
[NH3+][C@H](c1ccsc1)C1(O)CCC2(CC1)OCCO2	ZINC000958528794	728860734	/nfs/dbraw/zinc/86/07/34/728860734.db2.gz	VJSAHLCVQPJVOW-LLVKDONJSA-N	1	0	269.366	1.796	50	0		CDAARO
O=C(N1CC(n2cccn2)C1)C1([NH+]2CCCC2)CCCC1	ZINC000065531179	729157217	/nfs/dbraw/zinc/15/72/17/729157217.db2.gz	ZRFGOTBJPAXNGQ-UHFFFAOYSA-N	1	0	288.395	1.675	50	0		CDAARO
CCc1nnc(CN(C)C[C@H]2CC[N@H+](C)C2(C)C)[nH]1	ZINC000252500043	729841857	/nfs/dbraw/zinc/84/18/57/729841857.db2.gz	SMJIOGAVWGMBFO-LLVKDONJSA-N	1	0	265.405	1.529	50	0		CDAARO
C[C@@H]1CC[NH2+][C@@H](C)[C@@H]1NC(=O)Cc1cccc(O)c1	ZINC000387947184	730037988	/nfs/dbraw/zinc/03/79/88/730037988.db2.gz	ALZIEVRDPMWTDR-JRPNMDOOSA-N	1	0	262.353	1.437	50	0		CDAARO
COc1cccc2c1OC[C@H]([NH2+]CCc1cnccn1)C2	ZINC000012090145	730043232	/nfs/dbraw/zinc/04/32/32/730043232.db2.gz	LMBQNYNSEACCEJ-CQSZACIVSA-N	1	0	285.347	1.621	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)c1cn(C2CCCCC2)nn1	ZINC000012093887	921348823	/nfs/dbraw/zinc/34/88/23/921348823.db2.gz	SVDHMYWMZKFXDX-UHFFFAOYSA-N	1	0	291.399	1.609	50	0		CDAARO
CN(CC[NH+](C)C)C[C@H]1CC[C@@H](Cc2nccs2)O1	ZINC000952854443	910408693	/nfs/dbraw/zinc/40/86/93/910408693.db2.gz	PTTYQLGAIGBKPN-QWHCGFSZSA-N	1	0	283.441	1.727	50	0		CDAARO
C/C=C/C[N@@H+]1CCC[C@H](CNC(=O)c2cc(C)n(C)n2)C1	ZINC000952960031	910469362	/nfs/dbraw/zinc/46/93/62/910469362.db2.gz	XDLACMYRCQYPRI-ISZGNANSSA-N	1	0	290.411	1.746	50	0		CDAARO
CCn1nc(CC(N)=O)nc1-c1cccc(C[NH+](C)C)c1	ZINC000823600508	925708605	/nfs/dbraw/zinc/70/86/05/925708605.db2.gz	QYWJPUKOTMLTRM-UHFFFAOYSA-N	1	0	287.367	1.054	50	0		CDAARO
FC(F)(F)c1noc(CN2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)n1	ZINC000825720645	925882007	/nfs/dbraw/zinc/88/20/07/925882007.db2.gz	QYSBIYCWLOUHKB-SPJNRGJMSA-N	1	0	288.273	1.271	50	0		CDAARO
CS(=O)(=O)CC[N@@H+]1CC[C@@H](Cc2cccc(CO)c2)C1	ZINC000219577321	930883245	/nfs/dbraw/zinc/88/32/45/930883245.db2.gz	IOSQFZMOYQPWIO-AWEZNQCLSA-N	1	0	297.420	1.088	50	0		CDAARO
COc1ccc(/C=C/C(=O)N2CC[NH2+]C[C@@H]2C)cc1F	ZINC000126343996	931976502	/nfs/dbraw/zinc/97/65/02/931976502.db2.gz	RHWUQWYODQKAFK-MALLOTDXSA-N	1	0	278.327	1.668	50	0		CDAARO
C[C@](O)(CN1CC[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1	ZINC000252689428	935056764	/nfs/dbraw/zinc/05/67/64/935056764.db2.gz	RDTJMZQABUUBAB-PMPSAXMXSA-N	1	0	260.381	1.720	50	0		CDAARO
Cc1nn(C)cc1NC(=O)C[C@H]1CCCC[N@@H+]1C	ZINC001529100111	968980825	/nfs/dbraw/zinc/98/08/25/968980825.db2.gz	NPTKTGGHHFGJJS-LLVKDONJSA-N	1	0	250.346	1.541	50	0		CDAARO
CNC(=O)c1cccnc1NC[C@H]1CCCC[N@@H+]1C	ZINC001529142436	968992193	/nfs/dbraw/zinc/99/21/93/968992193.db2.gz	OFRWZXZVVAFHHS-LLVKDONJSA-N	1	0	262.357	1.337	50	0		CDAARO
CC(=O)c1ccc(NCC[N@@H+]2CCCC[C@@H]2CO)nc1	ZINC001506397438	975147798	/nfs/dbraw/zinc/14/77/98/975147798.db2.gz	NCTOURPIPOVPJY-CQSZACIVSA-N	1	0	277.368	1.543	50	0		CDAARO
O[C@H]1CCC[N@@H+](C2CC[NH+](CCCn3ccnc3)CC2)C1	ZINC001506400617	975148963	/nfs/dbraw/zinc/14/89/63/975148963.db2.gz	FHVOBUZMMVUBJB-INIZCTEOSA-N	1	0	292.427	1.194	50	0		CDAARO
CC[C@H]1CN(CCn2cnnc2C)CC[N@@H+]1C(C)C	ZINC001506398894	975149389	/nfs/dbraw/zinc/14/93/89/975149389.db2.gz	ZJTXINQWRKRCCW-AWEZNQCLSA-N	1	0	265.405	1.391	50	0		CDAARO
C[N@@H+]1CCC[C@@H](Nc2ncc(F)c(N3CCCC3)n2)C1	ZINC001506406732	975152207	/nfs/dbraw/zinc/15/22/07/975152207.db2.gz	NBSJPPAPXUGYAP-LLVKDONJSA-N	1	0	279.363	1.722	50	0		CDAARO
Cc1nc(N2CC[NH+](CCC(N)=O)CC2)ccc1Cl	ZINC001506416123	975156282	/nfs/dbraw/zinc/15/62/82/975156282.db2.gz	UQKJJZFXNSJIOZ-UHFFFAOYSA-N	1	0	282.775	1.041	50	0		CDAARO
OCC[N@H+](CC[C@@H]1CCOC1)Cc1cccs1	ZINC001506419146	975157448	/nfs/dbraw/zinc/15/74/48/975157448.db2.gz	YMZKHSJCONWIGI-GFCCVEGCSA-N	1	0	255.383	1.969	50	0		CDAARO
COC[C@H](c1ccccn1)N(C)Cc1cncn1C	ZINC001506421456	975157974	/nfs/dbraw/zinc/15/79/74/975157974.db2.gz	PVBLINUKSPKPCS-CQSZACIVSA-N	1	0	260.341	1.635	50	0		CDAARO
CN1CCO[C@H](C[NH2+]Cc2ccc(OCC3CC3)cc2)C1	ZINC000190960367	342456474	/nfs/dbraw/zinc/45/64/74/342456474.db2.gz	XQKJTXKPCVWEHI-QGZVFWFLSA-N	1	0	290.407	1.896	50	0		CDAARO
O=C(NCCc1ccccn1)N1CC[N@@H+]2CCCC[C@H]2C1	ZINC000098009484	230389550	/nfs/dbraw/zinc/38/95/50/230389550.db2.gz	TTWSDWHTALIYGT-HNNXBMFYSA-N	1	0	288.395	1.504	50	0		CDAARO
O=C(NCCc1ccccn1)N1CC[N@@H+]2CCCC[C@@H]2C1	ZINC000098009483	230389591	/nfs/dbraw/zinc/38/95/91/230389591.db2.gz	TTWSDWHTALIYGT-OAHLLOKOSA-N	1	0	288.395	1.504	50	0		CDAARO
CN1CCC[C@H]1C[N@H+](C)C1CSCCSC1	ZINC000584903002	341986586	/nfs/dbraw/zinc/98/65/86/341986586.db2.gz	HPOHFJYHWUNHET-NSHDSACASA-N	1	0	260.472	1.861	50	0		CDAARO
c1ccc([C@@H](C[NH2+]C2CCOCC2)N2CCOCC2)nc1	ZINC000584902476	341987036	/nfs/dbraw/zinc/98/70/36/341987036.db2.gz	WFIQHEVLQFBEDU-MRXNPFEDSA-N	1	0	291.395	1.224	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]1)N1CCC(OCc2ccccc2)CC1	ZINC000177950174	342495162	/nfs/dbraw/zinc/49/51/62/342495162.db2.gz	ZNKCTICMDUNXGM-INIZCTEOSA-N	1	0	288.391	1.946	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@H]2CC(=O)N(C(C)C)C2)C[C@H]1[NH+](C)C	ZINC000107504247	398149578	/nfs/dbraw/zinc/14/95/78/398149578.db2.gz	HGQKWBCUMCHDEJ-HZSPNIEDSA-N	1	0	295.427	1.042	50	0		CDAARO
COc1cc(CO[C@@H]2CCC[NH2+]C2)cc(OC)c1	ZINC000035781817	260153300	/nfs/dbraw/zinc/15/33/00/260153300.db2.gz	WJSFQIKHCILIIB-GFCCVEGCSA-N	1	0	251.326	1.972	50	0		CDAARO
COC1(CNC(=O)NC[C@H]2CC[N@@H+](C3CC3)C2)CCC1	ZINC000096002184	185061424	/nfs/dbraw/zinc/06/14/24/185061424.db2.gz	GOPVHVPKCZGVQT-GFCCVEGCSA-N	1	0	281.400	1.339	50	0		CDAARO
CN1C(=O)N[C@@](C)([C@H]2CCC[N@H+](CC3CCC3)C2)C1=O	ZINC000089914240	539087686	/nfs/dbraw/zinc/08/76/86/539087686.db2.gz	HBFDGHIIUWZJHV-WFASDCNBSA-N	1	0	279.384	1.439	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)C[C@@H](C)c1ccc(F)cc1F	ZINC000195554029	342625774	/nfs/dbraw/zinc/62/57/74/342625774.db2.gz	VIWZOWWZOAMBLT-FZQKWOKYSA-N	1	0	298.333	1.561	50	0		CDAARO
Cc1cc2c(cc1C[N@@H+]1CC[C@](C)(O)[C@@H](O)C1)OCCO2	ZINC000096141848	185107018	/nfs/dbraw/zinc/10/70/18/185107018.db2.gz	BVVRCIVZBDAOHK-HOTGVXAUSA-N	1	0	293.363	1.084	50	0		CDAARO
Cc1ncsc1CC[N@@H+](C)C[C@H](C)N1CCOCC1	ZINC000243893235	361828896	/nfs/dbraw/zinc/82/88/96/361828896.db2.gz	APQJEIBXFXBQQS-LBPRGKRZSA-N	1	0	283.441	1.647	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1cnc(-c2ccccc2)nc1	ZINC000125890337	342148170	/nfs/dbraw/zinc/14/81/70/342148170.db2.gz	GGNVAYXOXGTIDX-LBPRGKRZSA-N	1	0	282.347	1.578	50	0		CDAARO
CC1(C)CCC[NH2+][C@H]1CNS(=O)(=O)CC1CCCC1	ZINC000252479336	361841873	/nfs/dbraw/zinc/84/18/73/361841873.db2.gz	BDEFGTXKYJATTH-ZDUSSCGKSA-N	1	0	288.457	1.874	50	0		CDAARO
[NH3+][C@H]1C[C@@H](c2cc(NCCc3cscn3)ncn2)C1	ZINC000244748797	361861674	/nfs/dbraw/zinc/86/16/74/361861674.db2.gz	OONMBJUETDXMKK-AOOOYVTPSA-N	1	0	275.381	1.792	50	0		CDAARO
Cc1csc([C@@H]2CN(c3cc(C)[nH+]c(N)n3)CCO2)n1	ZINC000065473922	361906361	/nfs/dbraw/zinc/90/63/61/361906361.db2.gz	XPCWZPUZPYSGHG-JTQLQIEISA-N	1	0	291.380	1.710	50	0		CDAARO
Cc1cc(C)n(Cc2cccc(C(=O)N3CC[C@H]([NH3+])C3)c2)n1	ZINC000097019993	185152466	/nfs/dbraw/zinc/15/24/66/185152466.db2.gz	VQGNCOGTJNIMRQ-INIZCTEOSA-N	1	0	298.390	1.721	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+]CC2(OC)CCOCC2)C1(C)C	ZINC000097034772	185157271	/nfs/dbraw/zinc/15/72/71/185157271.db2.gz	WCGAEYDDDLHWHX-QWHCGFSZSA-N	1	0	271.401	1.975	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@H]1NC(=O)c1cccc(CO)c1	ZINC000585136451	342216065	/nfs/dbraw/zinc/21/60/65/342216065.db2.gz	GZXMHUZKWHCYIN-GYSYKLTISA-N	1	0	262.353	1.295	50	0		CDAARO
OC[C@H]1C[NH2+]CCN1Cc1nc2ccccc2s1	ZINC000685943314	539046027	/nfs/dbraw/zinc/04/60/27/539046027.db2.gz	LGLQREDSFGGEQH-SNVBAGLBSA-N	1	0	263.366	1.062	50	0		CDAARO
C[C@H](NCc1ncnn1C)[C@H](c1ccccc1)[NH+](C)C	ZINC000585117757	362046863	/nfs/dbraw/zinc/04/68/63/362046863.db2.gz	VVLIFFBBSFKVTK-SWLSCSKDSA-N	1	0	273.384	1.596	50	0		CDAARO
COCCOc1cccc(CNC(=O)[C@H](C)[NH+](C)C)c1	ZINC000078689844	343597697	/nfs/dbraw/zinc/59/76/97/343597697.db2.gz	RPJYARJZDWLXLH-LBPRGKRZSA-N	1	0	280.368	1.278	50	0		CDAARO
CC[C@@H](C(=O)NCC1([NH+](C)C)CCOCC1)n1cccn1	ZINC000252500832	362389027	/nfs/dbraw/zinc/38/90/27/362389027.db2.gz	TWECCLUHNDXJJQ-ZDUSSCGKSA-N	1	0	294.399	1.061	50	0		CDAARO
CCOC(=O)[C@@H]1C[N@H+](C)C[C@@H]1C(=O)c1ccccc1	ZINC000052530351	362539620	/nfs/dbraw/zinc/53/96/20/362539620.db2.gz	WQKWIFSBDCEQNX-QWHCGFSZSA-N	1	0	261.321	1.610	50	0		CDAARO
COC(=O)[C@@H](O)C1CC[NH+](C/C=C/c2ccccc2)CC1	ZINC000095432424	362545216	/nfs/dbraw/zinc/54/52/16/362545216.db2.gz	BLQPTSGEBIMHAQ-WHWKNOJMSA-N	1	0	289.375	1.946	50	0		CDAARO
COC(=O)C1CCC([NH2+][C@H]2CCC[C@@H](C(N)=O)C2)CC1	ZINC000192443084	362628253	/nfs/dbraw/zinc/62/82/53/362628253.db2.gz	HCKPNJHIVPOGLZ-KPFVRQRISA-N	1	0	282.384	1.352	50	0		CDAARO
O=C1NCCN1C1CC[NH+](C[C@H](O)c2ccccc2)CC1	ZINC000051449849	346318977	/nfs/dbraw/zinc/31/89/77/346318977.db2.gz	OXYPYJJUFOHWTD-HNNXBMFYSA-N	1	0	289.379	1.210	50	0		CDAARO
CC(C)CN(CC[NH+](C)C)C(=O)Nc1cnn(C)c1	ZINC000085552018	179093415	/nfs/dbraw/zinc/09/34/15/179093415.db2.gz	ULWSRRAHTJGGPR-UHFFFAOYSA-N	1	0	267.377	1.472	50	0		CDAARO
COc1cccc(CN2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)c1F	ZINC000192981105	362749082	/nfs/dbraw/zinc/74/90/82/362749082.db2.gz	ZAMCDJGMFIPRLY-BETUJISGSA-N	1	0	264.344	1.828	50	0		CDAARO
CCn1cc(C[NH2+]C[C@H]2CCO[C@H]2c2cnn(C)c2)cn1	ZINC000089306039	346755909	/nfs/dbraw/zinc/75/59/09/346755909.db2.gz	AYWCLUAOFFXEQM-UKRRQHHQSA-N	1	0	289.383	1.504	50	0		CDAARO
COCCN(Cc1ccccn1)C(=O)C[C@H]1CC[NH2+]C1	ZINC000089745426	179858678	/nfs/dbraw/zinc/85/86/78/179858678.db2.gz	HBGRJCKTXPEVHE-CYBMUJFWSA-N	1	0	277.368	1.056	50	0		CDAARO
O=C(N1CCCC1)N1CCC([NH2+][C@H]2CCCOC2)CC1	ZINC000584896179	349357225	/nfs/dbraw/zinc/35/72/25/349357225.db2.gz	YQGSVOFBCYYMTR-AWEZNQCLSA-N	1	0	281.400	1.435	50	0		CDAARO
Cc1n[nH]cc1CN(C)C(=O)C[NH+]1CCCCCCC1	ZINC000584896896	349358258	/nfs/dbraw/zinc/35/82/58/349358258.db2.gz	DUSGIXCFAGSXLU-UHFFFAOYSA-N	1	0	278.400	1.943	50	0		CDAARO
CCOCCC(=O)N(C)C[C@@H]1CC[N@H+](C)C1(C)C	ZINC000584887490	349344798	/nfs/dbraw/zinc/34/47/98/349344798.db2.gz	GJEUOABMLMQDAV-LBPRGKRZSA-N	1	0	256.390	1.602	50	0		CDAARO
Cc1cccc2c1ncn(C[C@H]1COCC[N@@H+](C)C1)c2=O	ZINC000584889060	349348012	/nfs/dbraw/zinc/34/80/12/349348012.db2.gz	AKTKRCFNINPOTO-ZDUSSCGKSA-N	1	0	287.363	1.283	50	0		CDAARO
CC(C)[C@H]1CN(C(=O)CCCn2cncn2)C[C@@H]1[NH+](C)C	ZINC000091616775	180208756	/nfs/dbraw/zinc/20/87/56/180208756.db2.gz	HNBRWFPBCBJDEM-KGLIPLIRSA-N	1	0	293.415	1.103	50	0		CDAARO
Cc1ccc([C@H]2CN(C(=O)c3cnc(C)cn3)C[C@@H]2[NH3+])o1	ZINC000091604138	180203014	/nfs/dbraw/zinc/20/30/14/180203014.db2.gz	JGVNJBOAAWNJKV-RYUDHWBXSA-N	1	0	286.335	1.253	50	0		CDAARO
NC(=O)CN1C[C@H]2CC[C@@H]1C[N@@H+](C1Cc3ccccc3C1)C2	ZINC000091644526	180214508	/nfs/dbraw/zinc/21/45/08/180214508.db2.gz	GPLSDWSSYKCZIJ-XJKSGUPXSA-N	1	0	299.418	1.035	50	0		CDAARO
Cc1cccc(C(=O)N2C[C@H]3CC[C@@H]2C[N@H+](C)C3)n1	ZINC000091645082	180214608	/nfs/dbraw/zinc/21/46/08/180214608.db2.gz	LXAUTBYNWWEAEE-QWHCGFSZSA-N	1	0	259.353	1.556	50	0		CDAARO
CCCCc1c(C)[nH+]c(N)nc1N1CC[C@H](C(=O)NC)C1	ZINC000091857994	180274656	/nfs/dbraw/zinc/27/46/56/180274656.db2.gz	OUSMGYAZQBJGEK-NSHDSACASA-N	1	0	291.399	1.282	50	0		CDAARO
CCC[C@H]1CN(C(=O)CCn2cc(C)cn2)C[C@@H]1[NH3+]	ZINC000091997265	180302776	/nfs/dbraw/zinc/30/27/76/180302776.db2.gz	JBUQEQJPPMHCAC-STQMWFEESA-N	1	0	264.373	1.167	50	0		CDAARO
CC[C@H]1CN(Cc2noc(C3CC3)n2)CC[N@@H+]1C[C@H](C)O	ZINC000106906906	186149330	/nfs/dbraw/zinc/14/93/30/186149330.db2.gz	BHMXSIJYMGAYRN-AAEUAGOBSA-N	1	0	294.399	1.224	50	0		CDAARO
O[C@H]([C@@H]1CCC[N@@H+]1CCn1cccn1)C(F)(F)F	ZINC000106850556	186141334	/nfs/dbraw/zinc/14/13/34/186141334.db2.gz	ZFEQEOJGYRVZFT-VHSXEESVSA-N	1	0	263.263	1.271	50	0		CDAARO
C[C@@H](Cn1cccn1)[NH2+][C@@H]1CCN(CC(F)(F)F)C1=O	ZINC000111229650	186371654	/nfs/dbraw/zinc/37/16/54/186371654.db2.gz	CLAOWZILUPQXHT-VHSXEESVSA-N	1	0	290.289	1.024	50	0		CDAARO
Cc1cccc(CN2CC(n3cc([C@@H](C)O)nn3)C2)c1	ZINC000096000055	351469138	/nfs/dbraw/zinc/46/91/38/351469138.db2.gz	GXTDMJXWYJWILB-GFCCVEGCSA-N	1	0	272.352	1.697	50	0		CDAARO
C[C@H](NC(=O)[C@@H]1C[C@H](O)C[NH2+]1)c1ccc2c(c1)CCCC2	ZINC000037030933	363315797	/nfs/dbraw/zinc/31/57/97/363315797.db2.gz	HYMTVKIFCYHIPP-UVBJJODRSA-N	1	0	288.391	1.465	50	0		CDAARO
CC[NH+]1CCN(c2nc3ccccc3n3c(C)nnc23)CC1	ZINC000000310698	355903345	/nfs/dbraw/zinc/90/33/45/355903345.db2.gz	YZACUYIQRBPZPP-UHFFFAOYSA-N	1	0	296.378	1.728	50	0		CDAARO
COC(=O)CCc1ccc(OC[C@@H](O)C[NH2+]C(C)C)cc1	ZINC000000896523	355923467	/nfs/dbraw/zinc/92/34/67/355923467.db2.gz	AQNDDEOPVVGCPG-AWEZNQCLSA-N	1	0	295.379	1.530	50	0	fda	CDAARO
CCC[C@@H](CN=c1nc(N(C)C)[nH]s1)[NH+](C)C	ZINC000584901422	355956155	/nfs/dbraw/zinc/95/61/55/355956155.db2.gz	KDJFWVWGZKRZFJ-VIFPVBQESA-N	1	0	257.407	1.168	50	0		CDAARO
NC(=O)N1CCC[N@H+](C/C=C\c2ccc(F)cc2)CC1	ZINC000255268080	356029418	/nfs/dbraw/zinc/02/94/18/356029418.db2.gz	JELVUSLEXDAQRK-IWQZZHSRSA-N	1	0	277.343	1.925	50	0		CDAARO
CC[NH+](CC)C[C@H](C)NC(=O)c1ccnn1C(F)F	ZINC000002782317	356105663	/nfs/dbraw/zinc/10/56/63/356105663.db2.gz	SBEAHXFAJASRDE-VIFPVBQESA-N	1	0	274.315	1.738	50	0		CDAARO
CN1CCC([N@@H+]2CCC[C@@H](NC(=O)C3=CCCC3)C2)CC1	ZINC000011879569	356281837	/nfs/dbraw/zinc/28/18/37/356281837.db2.gz	KYFBWJBHQPPZPO-OAHLLOKOSA-N	1	0	291.439	1.772	50	0		CDAARO
COCc1cc(C(=O)N2CC[C@H](C[NH3+])C2)ccc1F	ZINC000299740396	356286566	/nfs/dbraw/zinc/28/65/66/356286566.db2.gz	ZGKHAPRGMDBCAK-SNVBAGLBSA-N	1	0	266.316	1.393	50	0		CDAARO
C[C@@H](Oc1ccc(F)cc1)C(=O)NCC[NH+](C)C	ZINC000013667930	356352725	/nfs/dbraw/zinc/35/27/25/356352725.db2.gz	ZKLJNXDDEYLCCM-SNVBAGLBSA-N	1	0	254.305	1.271	50	0		CDAARO
Cc1ccccc1C[N@H+](C)CCn1nc2ccccn2c1=O	ZINC000032777997	356363577	/nfs/dbraw/zinc/36/35/77/356363577.db2.gz	PTHYIIWIYUTDFQ-UHFFFAOYSA-N	1	0	296.374	1.936	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC[C@@H]2CCC[NH2+]C2)cc1	ZINC000019393592	356483957	/nfs/dbraw/zinc/48/39/57/356483957.db2.gz	GBCVMVUEBVZOSD-GFCCVEGCSA-N	1	0	268.382	1.273	50	0		CDAARO
CCN1CC[NH+](CCCCOc2ccccc2CO)CC1	ZINC000023076586	356626982	/nfs/dbraw/zinc/62/69/82/356626982.db2.gz	KPEAXCZNFXTJSU-UHFFFAOYSA-N	1	0	292.423	1.975	50	0		CDAARO
COc1ccc(NC(=O)NC2CC[NH+](C)CC2)cc1	ZINC000023234444	356636416	/nfs/dbraw/zinc/63/64/16/356636416.db2.gz	IUIQWGLLFRONRF-UHFFFAOYSA-N	1	0	263.341	1.911	50	0		CDAARO
C[C@@H]1C[NH+](CCCNc2cc(Cl)nc(N)n2)C[C@@H](C)O1	ZINC000024056939	356651717	/nfs/dbraw/zinc/65/17/17/356651717.db2.gz	IIFXDPAFQWUMLV-NXEZZACHSA-N	1	0	299.806	1.623	50	0		CDAARO
CCN(CC(F)(F)F)C(=O)[C@H]1CC12CC[NH2+]CC2	ZINC000070255778	356742104	/nfs/dbraw/zinc/74/21/04/356742104.db2.gz	OFDNAXLYPLWQQN-SECBINFHSA-N	1	0	264.291	1.787	50	0		CDAARO
O=C1N(Cc2ccccc2)CCN1C1CC[NH2+]CC1	ZINC000033048055	356794162	/nfs/dbraw/zinc/79/41/62/356794162.db2.gz	BJRBCTOJFSIBEA-UHFFFAOYSA-N	1	0	259.353	1.676	50	0		CDAARO
C[NH2+]Cc1c(C)nn(-c2ccccc2)c1-n1cncn1	ZINC000034825226	356821256	/nfs/dbraw/zinc/82/12/56/356821256.db2.gz	BGEMXHSOMSEDLA-UHFFFAOYSA-N	1	0	268.324	1.481	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]1)N1CCC[C@@H]1Cc1ccccc1	ZINC000037804091	356933112	/nfs/dbraw/zinc/93/31/12/356933112.db2.gz	XEWUIEICOPIFNT-CABCVRRESA-N	1	0	258.365	1.972	50	0		CDAARO
Cc1ccccc1N1CCN(C(=O)[C@@H]2CCC[NH2+]2)CC1	ZINC000040430499	357000111	/nfs/dbraw/zinc/00/01/11/357000111.db2.gz	LASBUAWLVBHKIZ-AWEZNQCLSA-N	1	0	273.380	1.396	50	0		CDAARO
Cc1cc(C)cc(OCC(=O)NC[C@H](C)C[NH+](C)C)c1	ZINC000004598836	357103748	/nfs/dbraw/zinc/10/37/48/357103748.db2.gz	NGGZDFBSOMJAHY-AWEZNQCLSA-N	1	0	278.396	1.996	50	0		CDAARO
Ic1ccccc1OC1C[NH2+]C1	ZINC000042770066	357079817	/nfs/dbraw/zinc/07/98/17/357079817.db2.gz	JWODLTMIBDYGOU-UHFFFAOYSA-N	1	0	275.089	1.642	50	0		CDAARO
Cc1noc(-c2cccnc2N2CC[NH+](C3CC3)CC2)n1	ZINC000096427342	357471378	/nfs/dbraw/zinc/47/13/78/357471378.db2.gz	RVXYBCQWRNYIPB-UHFFFAOYSA-N	1	0	285.351	1.724	50	0		CDAARO
CC(C)[N@H+](CCC(N)=O)Cc1cccc2c1OCO2	ZINC000065405072	357537976	/nfs/dbraw/zinc/53/79/76/357537976.db2.gz	LVUBHQXLMRVJMP-UHFFFAOYSA-N	1	0	264.325	1.501	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](NC(=O)CCC(=O)Nc2cccc(O)c2)C1	ZINC000067817697	357629015	/nfs/dbraw/zinc/62/90/15/357629015.db2.gz	HVKKKBWSCYYQPE-ZYHUDNBSSA-N	1	0	291.351	1.107	50	0		CDAARO
[NH3+]CC(=O)NCc1cccnc1Oc1ccc(F)cc1F	ZINC000067803366	357629186	/nfs/dbraw/zinc/62/91/86/357629186.db2.gz	UOYYQPOAGCDDPX-UHFFFAOYSA-N	1	0	293.273	1.727	50	0		CDAARO
Cn1ncc2c1CCC[C@@H]2NC(=O)C[C@H]1CSCC[NH2+]1	ZINC000091135235	357709320	/nfs/dbraw/zinc/70/93/20/357709320.db2.gz	ZCEBYVVGTFDTTN-JQWIXIFHSA-N	1	0	294.424	1.009	50	0		CDAARO
FC(F)(F)CCc1ccnc(N2C[C@H]3CC[C@@H](C2)[NH2+]3)n1	ZINC000071754315	357778805	/nfs/dbraw/zinc/77/88/05/357778805.db2.gz	DYACWFGPRNKOKS-PHIMTYICSA-N	1	0	286.301	1.912	50	0		CDAARO
OCC1(O)CC[NH+](C[C@@H]2CCCN3CCCC[C@H]23)CC1	ZINC000072121037	357826074	/nfs/dbraw/zinc/82/60/74/357826074.db2.gz	DRMDHOVKVJYFES-LSDHHAIUSA-N	1	0	282.428	1.070	50	0		CDAARO
O=C(NC[C@H]1CCC[NH2+]1)[C@@H]1CSc2ccccc21	ZINC000092239281	357943980	/nfs/dbraw/zinc/94/39/80/357943980.db2.gz	YNHMBSBXVYSPSK-ZYHUDNBSSA-N	1	0	262.378	1.744	50	0		CDAARO
COC(=O)[C@@]12CCC[C@@H]1C[N@H+](Cc1ccncc1)C2	ZINC000097082971	357945350	/nfs/dbraw/zinc/94/53/50/357945350.db2.gz	ZHMOWTRATIEDCY-UKRRQHHQSA-N	1	0	260.337	1.857	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)N1CCNC1=O)c1ccc(Cl)s1	ZINC000097111502	357986968	/nfs/dbraw/zinc/98/69/68/357986968.db2.gz	YGRNQRITAPQMBO-SSDOTTSWSA-N	1	0	287.772	1.604	50	0		CDAARO
CC(C)[N@H+](C)CCNS(=O)(=O)c1cccs1	ZINC000097165969	358005797	/nfs/dbraw/zinc/00/57/97/358005797.db2.gz	KMBKWPQFOLDWJE-UHFFFAOYSA-N	1	0	262.400	1.367	50	0		CDAARO
COCCNC(=O)CC[NH2+]C1C[C@H](C)C[C@@H](C)C1	ZINC000097229302	358043167	/nfs/dbraw/zinc/04/31/67/358043167.db2.gz	LMTILIARBQGAJC-VXGBXAGGSA-N	1	0	256.390	1.553	50	0		CDAARO
C[C@H](CN1CCOCC1)[NH2+][C@H](CO)c1ccccc1	ZINC000097238530	358051261	/nfs/dbraw/zinc/05/12/61/358051261.db2.gz	AIIHAGBTUAGAFG-UKRRQHHQSA-N	1	0	264.369	1.030	50	0		CDAARO
Cn1cc(C[NH2+]Cc2ccc3c(c2)OCCO3)cn1	ZINC000020120841	358329224	/nfs/dbraw/zinc/32/92/24/358329224.db2.gz	WRDZKMAYXPUMJS-UHFFFAOYSA-N	1	0	259.309	1.481	50	0		CDAARO
CC(C)OC[C@@H](O)C[N@H+](C)CCOc1ccccc1	ZINC000098066281	358354834	/nfs/dbraw/zinc/35/48/34/358354834.db2.gz	OMQWRDOGTSACFD-AWEZNQCLSA-N	1	0	267.369	1.783	50	0		CDAARO
CN(Cc1ccon1)C(=O)CC[C@H]1CCCC[N@@H+]1C	ZINC000095368601	358687537	/nfs/dbraw/zinc/68/75/37/358687537.db2.gz	YAZQKQIWRVKAMW-CYBMUJFWSA-N	1	0	265.357	1.898	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@@H](CO)N(C(=O)Nc2cccc(F)c2F)C1	ZINC000095497070	358695298	/nfs/dbraw/zinc/69/52/98/358695298.db2.gz	DKLLYXPNGMQSGD-ZJUUUORDSA-N	1	0	299.321	1.494	50	0		CDAARO
Cc1nc(C)n(CCNC(=O)[C@H]2CCC[N@@H+](C(C)C)C2)n1	ZINC000095497419	358695386	/nfs/dbraw/zinc/69/53/86/358695386.db2.gz	BRQKOECRQNKGGH-AWEZNQCLSA-N	1	0	293.415	1.132	50	0		CDAARO
COCc1cc(CN(C)C(=O)[C@@H]2CCCCC[N@@H+]2C)[nH]n1	ZINC000097393928	358771784	/nfs/dbraw/zinc/77/17/84/358771784.db2.gz	JYCXFHJOZPYPLB-AWEZNQCLSA-N	1	0	294.399	1.389	50	0		CDAARO
CCc1nc(C)cc(N2CC[C@]3(CNC(=O)C3)C2)n1	ZINC000287545962	358771524	/nfs/dbraw/zinc/77/15/24/358771524.db2.gz	BVTMQLRUGCDRLT-AWEZNQCLSA-N	1	0	260.341	1.064	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)Nc1ccc2c(c1)COC2	ZINC000097495485	358780801	/nfs/dbraw/zinc/78/08/01/358780801.db2.gz	ICTMVHVLINASKZ-SNVBAGLBSA-N	1	0	261.325	1.542	50	0		CDAARO
Cc1cc(C)n(CCC[N@@H+](C)C[C@H]2CCOC2)n1	ZINC000216001080	358916243	/nfs/dbraw/zinc/91/62/43/358916243.db2.gz	PXCYVNWVLWLFJF-CQSZACIVSA-N	1	0	251.374	1.858	50	0		CDAARO
CC[N@@H+](Cc1cn(C)nc1C)C[C@H](O)c1cccc(O)c1	ZINC000215231335	358879565	/nfs/dbraw/zinc/87/95/65/358879565.db2.gz	HOANCXVLIZMWNQ-INIZCTEOSA-N	1	0	289.379	1.990	50	0		CDAARO
Cn1ccnc1CCC[N@H+](C)Cc1cccnc1N	ZINC000215429990	358889174	/nfs/dbraw/zinc/88/91/74/358889174.db2.gz	GTOHCXSEYSWRPZ-UHFFFAOYSA-N	1	0	259.357	1.462	50	0		CDAARO
CC[N@H+](C1CN(C(=O)C2CCC2)C1)C1CCOCC1	ZINC000257176012	359065875	/nfs/dbraw/zinc/06/58/75/359065875.db2.gz	BWNQJWVZEIHEMA-UHFFFAOYSA-N	1	0	266.385	1.498	50	0		CDAARO
COCC[NH2+]Cc1cn(CCC(N)=O)c2ccccc12	ZINC000055310370	359081767	/nfs/dbraw/zinc/08/17/67/359081767.db2.gz	KRSUJEGHKAHDMD-UHFFFAOYSA-N	1	0	275.352	1.253	50	0		CDAARO
CCO[C@H]1CN(Cc2noc(-c3ccccc3)n2)C[C@@H]1O	ZINC000220076659	359148780	/nfs/dbraw/zinc/14/87/80/359148780.db2.gz	JMUVWFAOGJGTPZ-STQMWFEESA-N	1	0	289.335	1.318	50	0		CDAARO
C[NH2+][C@@H](C)C(=O)N(C)Cc1cc(-c2ccccc2)n[nH]1	ZINC000220288092	359161824	/nfs/dbraw/zinc/16/18/24/359161824.db2.gz	RTFKNTMBDIEQAW-NSHDSACASA-N	1	0	272.352	1.643	50	0		CDAARO
CC[NH+](CC)CCCNS(=O)(=O)c1c(C)noc1C	ZINC000028224760	359240917	/nfs/dbraw/zinc/24/09/17/359240917.db2.gz	FTCHXQUCCAWJTD-UHFFFAOYSA-N	1	0	289.401	1.302	50	0		CDAARO
CCOC(=O)[C@@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000000248228	359399321	/nfs/dbraw/zinc/39/93/21/359399321.db2.gz	DHNVWVJYVSKEOI-GFCCVEGCSA-N	1	0	254.374	1.356	50	0		CDAARO
C[C@@H](C(=O)NCC1(O)CC[NH+](C)CC1)c1ccc(O)cc1	ZINC000223620493	359440358	/nfs/dbraw/zinc/44/03/58/359440358.db2.gz	DEDIRSYPRHSEOF-GFCCVEGCSA-N	1	0	292.379	1.069	50	0		CDAARO
CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1C[C@H]1CNC(=O)C1	ZINC000585094335	482828918	/nfs/dbraw/zinc/82/89/18/482828918.db2.gz	LAQZRBYQEKJSNF-BDAKNGLRSA-N	1	0	264.291	1.785	50	0		CDAARO
C[C@@H]1C[N@@H+]2CCC[C@H]2CN1S(=O)(=O)c1cncc(F)c1	ZINC000257365451	359944878	/nfs/dbraw/zinc/94/48/78/359944878.db2.gz	WIQUMFIORPANAY-PWSUYJOCSA-N	1	0	299.371	1.078	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1[C@H]1CCN(C(=O)c2nccn2C)C1	ZINC000409421066	360230722	/nfs/dbraw/zinc/23/07/22/360230722.db2.gz	CBRMQKCLQQQLDG-ZDUSSCGKSA-N	1	0	299.378	1.890	50	0		CDAARO
CN(Cc1ccoc1)C(=O)NCC[N@@H+]1CCC[C@@H](CO)C1	ZINC000426498476	360677991	/nfs/dbraw/zinc/67/79/91/360677991.db2.gz	IYBRFDKGZWLALW-CYBMUJFWSA-N	1	0	295.383	1.125	50	0		CDAARO
Cc1nnc([C@H]2CCCN2C(=O)C2(C)CC[NH+](C)CC2)[nH]1	ZINC000426563112	360684714	/nfs/dbraw/zinc/68/47/14/360684714.db2.gz	JOPXLAKVVYLTCK-GFCCVEGCSA-N	1	0	291.399	1.509	50	0		CDAARO
COCCSc1nnc(CC[NH3+])n1-c1ccc(F)cc1	ZINC000426368208	360660256	/nfs/dbraw/zinc/66/02/56/360660256.db2.gz	GEDMPLZCZXLFKA-UHFFFAOYSA-N	1	0	296.371	1.646	50	0		CDAARO
Cc1cc(=O)[nH]c(CCNC(=O)C(C)(C)[NH+]2CCCC2)n1	ZINC000426493976	360676280	/nfs/dbraw/zinc/67/62/80/360676280.db2.gz	HSSUGEKTMAVGLU-UHFFFAOYSA-N	1	0	292.383	1.024	50	0		CDAARO
Cc1cccc(OCCC(=O)N2CC[C@H](C[NH3+])C2)c1C	ZINC000178587520	189128708	/nfs/dbraw/zinc/12/87/08/189128708.db2.gz	XSNYYYDFVITBFE-CQSZACIVSA-N	1	0	276.380	1.880	50	0		CDAARO
CCCCc1nc(CN2CCN([C@@H]3CC[NH2+]C3)CC2)c[nH]1	ZINC000426720052	360698562	/nfs/dbraw/zinc/69/85/62/360698562.db2.gz	ZNDYKPSLQBIUAZ-OAHLLOKOSA-N	1	0	291.443	1.232	50	0		CDAARO
CCOc1cccc(C(=O)N2CC[C@@H](C[NH2+]C)C2)c1	ZINC000179006430	189161040	/nfs/dbraw/zinc/16/10/40/189161040.db2.gz	IEQLMXIBXQHKSY-LBPRGKRZSA-N	1	0	262.353	1.767	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2ccccc2OCCOC)C1	ZINC000179020543	189162034	/nfs/dbraw/zinc/16/20/34/189162034.db2.gz	IZXUSFPUUBEGFC-CYBMUJFWSA-N	1	0	292.379	1.393	50	0		CDAARO
CCc1c(C(=O)N(C)[C@H]2CC[NH2+]C2)cnn1-c1ccccn1	ZINC000179111144	189170668	/nfs/dbraw/zinc/17/06/68/189170668.db2.gz	RDJDPJLLZFNGKA-LBPRGKRZSA-N	1	0	299.378	1.264	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N[C@@H]2CCCCNC2=O)c1C	ZINC000032529750	360997558	/nfs/dbraw/zinc/99/75/58/360997558.db2.gz	UYBNJUPGUYXOCY-LLVKDONJSA-N	1	0	277.372	1.240	50	0		CDAARO
C[C@@H](C1CCN(C(=O)Cn2nccn2)CC1)[NH+]1CCCC1	ZINC000299765859	200863172	/nfs/dbraw/zinc/86/31/72/200863172.db2.gz	CKOLKHRXKVPSSW-ZDUSSCGKSA-N	1	0	291.399	1.001	50	0		CDAARO
COC(=O)[C@@H](NCC[NH+]1CCCCC1)C(C)(C)C	ZINC000089621440	291264668	/nfs/dbraw/zinc/26/46/68/291264668.db2.gz	LERKRWAILAHPOF-GFCCVEGCSA-N	1	0	256.390	1.650	50	0		CDAARO
O=C(Nc1cnns1)N1CC[C@@H](C[NH+]2CCCCC2)C1	ZINC000192355264	361656848	/nfs/dbraw/zinc/65/68/48/361656848.db2.gz	YUVZGVUMNWCWIX-NSHDSACASA-N	1	0	295.412	1.878	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1Cn1cc(C(F)(F)F)ccc1=O	ZINC000521394949	363943477	/nfs/dbraw/zinc/94/34/77/363943477.db2.gz	DPJFNOAXXKLVEK-SNVBAGLBSA-N	1	0	260.259	1.961	50	0		CDAARO
Cn1ccc(C[NH+]2CCN(c3ccccc3)CC2)cc1=O	ZINC000042112292	364514696	/nfs/dbraw/zinc/51/46/96/364514696.db2.gz	MTBXBYKSHURMRM-UHFFFAOYSA-N	1	0	283.375	1.708	50	0		CDAARO
COc1ccc(C(=O)O[C@@H]2CCC[N@H+](C)C2)cc1OC	ZINC000000487026	365049203	/nfs/dbraw/zinc/04/92/03/365049203.db2.gz	SXZSTOYRBQKQOM-GFCCVEGCSA-N	1	0	279.336	1.955	50	0	biogenic	CDAARO
COc1cc(C(=O)OCC[NH+](C)C)cc(OC)c1OC	ZINC000000489517	365336167	/nfs/dbraw/zinc/33/61/67/365336167.db2.gz	GUSZNZWHOZBJKH-UHFFFAOYSA-N	1	0	283.324	1.431	50	0	biogenic	CDAARO
CC(C)(C[NH2+]C1CCN(C2CC2)CC1)S(C)(=O)=O	ZINC000089761794	366929635	/nfs/dbraw/zinc/92/96/35/366929635.db2.gz	FQGPDSPFHMPETQ-UHFFFAOYSA-N	1	0	274.430	1.026	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CC[NH2+]C[C@@H]2C)c(C)c1	ZINC000094345689	367469783	/nfs/dbraw/zinc/46/97/83/367469783.db2.gz	PMQJYNPUTRBAEG-QWHCGFSZSA-N	1	0	282.409	1.580	50	0		CDAARO
COC(=O)CC(C)(C)C(=O)N[C@@H]1C[C@H](C)[N@@H+](C2CC2)C1	ZINC000252508583	367657273	/nfs/dbraw/zinc/65/72/73/367657273.db2.gz	XPIYNGPWQAOGKE-WDEREUQCSA-N	1	0	282.384	1.317	50	0		CDAARO
COc1ccc(/C=C/C(=O)NCC[NH+](C)C)cc1OC	ZINC000003209163	368533574	/nfs/dbraw/zinc/53/35/74/368533574.db2.gz	KHOHOXHCAKOINY-SOFGYWHQSA-N	1	0	278.352	1.395	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+]1C[C@@H]1C(C)=CCC[C@@H]1C	ZINC000195578151	284178764	/nfs/dbraw/zinc/17/87/64/284178764.db2.gz	GVMYSEUEEJARIT-FQUUOJAGSA-N	1	0	267.369	1.587	50	0		CDAARO
C[C@H](C1CCN(C(=O)c2cn[nH]n2)CC1)[NH+]1CCCC1	ZINC000299757429	372745127	/nfs/dbraw/zinc/74/51/27/372745127.db2.gz	JMQANEZCMXDKPU-LLVKDONJSA-N	1	0	277.372	1.141	50	0		CDAARO
CCN1C(=O)N(CCC(C)C)C2(CC[NH2+]CC2)C1=O	ZINC000299767816	372750896	/nfs/dbraw/zinc/75/08/96/372750896.db2.gz	VJGCYLYWZYIRIO-UHFFFAOYSA-N	1	0	267.373	1.439	50	0		CDAARO
C[C@@H](C[N@@H+]1CCc2ccccc2C1)NC(=O)c1cn(C)cn1	ZINC000299782961	372760391	/nfs/dbraw/zinc/76/03/91/372760391.db2.gz	GSQQIAVOBYGZIQ-ZDUSSCGKSA-N	1	0	298.390	1.597	50	0		CDAARO
CC(C)(C)c1ccc2c(c1)CCN2C(=O)[C@H]1C[NH2+]CCO1	ZINC000187614891	372801641	/nfs/dbraw/zinc/80/16/41/372801641.db2.gz	BXGLPNPSEBHLPO-OAHLLOKOSA-N	1	0	288.391	1.862	50	0		CDAARO
CCN(Cc1ccccc1Cl)C(=O)[C@@H]1C[C@@H](O)C[NH2+]1	ZINC000037808799	373376323	/nfs/dbraw/zinc/37/63/23/373376323.db2.gz	AHFSARJUDKKQTB-YPMHNXCESA-N	1	0	282.771	1.411	50	0		CDAARO
CC(=O)N[C@@H]1CCCN(C(=O)C[C@H]([NH3+])c2ccccc2)C1	ZINC000037815244	373412701	/nfs/dbraw/zinc/41/27/01/373412701.db2.gz	HKIZICYTMVPCSN-CABCVRRESA-N	1	0	289.379	1.204	50	0		CDAARO
Cc1cc(C[N@@H+]2C[C@@H](CO)[C@H](c3ccccn3)C2)n(C)n1	ZINC000253403888	373693177	/nfs/dbraw/zinc/69/31/77/373693177.db2.gz	HNPBBUSWTOYZIO-DZGCQCFKSA-N	1	0	286.379	1.331	50	0		CDAARO
CN(C[C@H]1CCC[N@@H+]([C@H]2C=CCCC2)C1)S(C)(=O)=O	ZINC000253417342	373726128	/nfs/dbraw/zinc/72/61/28/373726128.db2.gz	XDRNTGIBIUYOCI-KGLIPLIRSA-N	1	0	286.441	1.699	50	0		CDAARO
OC1(C[NH2+]Cc2cccc3c2OCO3)CCOCC1	ZINC000112717283	374227814	/nfs/dbraw/zinc/22/78/14/374227814.db2.gz	ZIWKWGCPGPBURO-UHFFFAOYSA-N	1	0	265.309	1.046	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1C(=O)COc1cccc(F)c1	ZINC000299740115	375199016	/nfs/dbraw/zinc/19/90/16/375199016.db2.gz	VYQCFNPFLNQQIW-GFCCVEGCSA-N	1	0	266.316	1.544	50	0		CDAARO
COc1ccccc1/C(C)=C\C(=O)N1CCC[NH2+]CC1	ZINC000606441087	375821851	/nfs/dbraw/zinc/82/18/51/375821851.db2.gz	CUKJEAACUHMLHF-SEYXRHQNSA-N	1	0	274.364	1.920	50	0		CDAARO
COc1ccc(S(=O)(=O)N2CC[N@@H+]3CCC[C@H]3C2)cc1	ZINC000239248032	376015524	/nfs/dbraw/zinc/01/55/24/376015524.db2.gz	XXCRXJCKFLTCQG-LBPRGKRZSA-N	1	0	296.392	1.164	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000261753419	190043690	/nfs/dbraw/zinc/04/36/90/190043690.db2.gz	QJIYAIKCOWJNRW-OWCLPIDISA-N	1	0	288.391	1.853	50	0		CDAARO
Cc1noc(C)c1[C@@H](C)C(=O)N1CC[NH2+]C[C@@H]1C	ZINC000125459433	376307469	/nfs/dbraw/zinc/30/74/69/376307469.db2.gz	TXVNCXVXXBTTBC-DTWKUNHWSA-N	1	0	251.330	1.215	50	0		CDAARO
COCCC[NH+]1CCC(Nc2cnccn2)CC1	ZINC000263819641	190080093	/nfs/dbraw/zinc/08/00/93/190080093.db2.gz	XEBZIDZHULYGEJ-UHFFFAOYSA-N	1	0	250.346	1.389	50	0		CDAARO
Cn1cc(CNC(=O)N2CC[C@H]([NH+]3CCCCC3)C2)cn1	ZINC000264607592	190122199	/nfs/dbraw/zinc/12/21/99/190122199.db2.gz	OTYWTVNVCMRHKQ-AWEZNQCLSA-N	1	0	291.399	1.190	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)Nc2ncnc3c2CC[NH2+]C3)n1	ZINC000067804291	377241017	/nfs/dbraw/zinc/24/10/17/377241017.db2.gz	XMVWBYRSJRTATP-NSHDSACASA-N	1	0	286.383	1.436	50	0		CDAARO
COCC[C@H]1CCCC[N@H+](CCN2CCO[C@H](C)C2)C1	ZINC000253397124	285176050	/nfs/dbraw/zinc/17/60/50/285176050.db2.gz	IHHVZVKZMZKQBQ-HZPDHXFCSA-N	1	0	284.444	1.846	50	0		CDAARO
O=c1[nH]c(COc2ccc(Cl)cc2)nc2c1CC[NH2+]C2	ZINC000077338561	285195872	/nfs/dbraw/zinc/19/58/72/285195872.db2.gz	ZAEPJBQUPQSXME-UHFFFAOYSA-N	1	0	291.738	1.648	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@@H]1NC(=O)Cc1cccc(F)c1F	ZINC000094712188	184845502	/nfs/dbraw/zinc/84/55/02/184845502.db2.gz	HGNDBGXPLWRIFQ-CABZTGNLSA-N	1	0	268.307	1.764	50	0		CDAARO
CCOCC[N@@H+]1CCN(CCOCC(F)(F)F)C[C@H]1C	ZINC000247070190	390242011	/nfs/dbraw/zinc/24/20/11/390242011.db2.gz	GNDUSBAKHWBMGX-GFCCVEGCSA-N	1	0	298.349	1.608	50	0		CDAARO
COCCNC(=O)N1CC[NH+](C2CCC(C)CC2)CC1	ZINC000096407026	390507446	/nfs/dbraw/zinc/50/74/46/390507446.db2.gz	MJVZUUQAFKVQEG-UHFFFAOYSA-N	1	0	283.416	1.539	50	0		CDAARO
C[C@@H]1COC2(CC[NH+](CCC(=O)NC(C)(C)C)CC2)O1	ZINC000096414909	390512205	/nfs/dbraw/zinc/51/22/05/390512205.db2.gz	VMBZJOQTVWESPD-GFCCVEGCSA-N	1	0	284.400	1.519	50	0		CDAARO
COCC(=O)NCC1CC[NH+](Cc2ccsc2)CC1	ZINC000043971449	390911328	/nfs/dbraw/zinc/91/13/28/390911328.db2.gz	GBRUPLDPDFJJKE-UHFFFAOYSA-N	1	0	282.409	1.723	50	0		CDAARO
CN1CCN(C(=O)[C@@H]2CCOC2)[C@@H](c2ccccc2)C1	ZINC000071832965	391889588	/nfs/dbraw/zinc/88/95/88/391889588.db2.gz	NXUQKZXOXDCOQK-HUUCEWRRSA-N	1	0	274.364	1.538	50	0		CDAARO
O=C(C1CC[NH2+]CC1)N1CCN(c2ccccc2)CC1	ZINC000004247615	134647911	/nfs/dbraw/zinc/64/79/11/134647911.db2.gz	BXOFULNKGRWZLW-UHFFFAOYSA-N	1	0	273.380	1.335	50	0		CDAARO
[NH3+]C[C@H]1CN(c2nccc(C3CCCC3)n2)CCO1	ZINC000071750437	134976412	/nfs/dbraw/zinc/97/64/12/134976412.db2.gz	NVQDPHNJBDLEJS-LBPRGKRZSA-N	1	0	262.357	1.298	50	0		CDAARO
[NH3+]CC[C@@H]1CN(c2ccnc(C(F)(F)F)n2)CCO1	ZINC000091663403	135072926	/nfs/dbraw/zinc/07/29/26/135072926.db2.gz	ZJSBGGIXWYWBMF-MRVPVSSYSA-N	1	0	276.262	1.049	50	0		CDAARO
C[N@H+](CCO)C[C@H]1COCCN1C(=O)CCC1CCCC1	ZINC000085469773	397611115	/nfs/dbraw/zinc/61/11/15/397611115.db2.gz	XIKSCQQOMJRGDM-HNNXBMFYSA-N	1	0	298.427	1.108	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCCN1C(=O)c1ccc2nccn2c1	ZINC000262758816	397750375	/nfs/dbraw/zinc/75/03/75/397750375.db2.gz	PVXXYQHDFPBGBJ-WCQYABFASA-N	1	0	272.352	1.676	50	0		CDAARO
C[C@@H](NC(=O)N1CC[C@@H](C[NH+](C)C)C1)c1ccco1	ZINC000097101598	397967055	/nfs/dbraw/zinc/96/70/55/397967055.db2.gz	CBYLHNZOQCEATP-NEPJUHHUSA-N	1	0	265.357	1.934	50	0		CDAARO
O=C1NC(=O)C(=CNc2cc[nH+]cc2)c2ccccc21	ZINC000104934005	397980108	/nfs/dbraw/zinc/98/01/08/397980108.db2.gz	NQSGUWGRJODSET-LCYFTJDESA-N	1	0	265.272	1.805	50	0		CDAARO
CCO[C@H]1CCCN(C(=O)C2([NH3+])Cc3ccccc3C2)C1	ZINC000299738738	286448489	/nfs/dbraw/zinc/44/84/89/286448489.db2.gz	FSSJYSHLUUZCOY-HNNXBMFYSA-N	1	0	288.391	1.510	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)c1ccc(N(C)C)nc1	ZINC000121966033	286923231	/nfs/dbraw/zinc/92/32/31/286923231.db2.gz	AKHLLJDLOSYWSL-DGCLKSJQSA-N	1	0	276.384	1.490	50	0		CDAARO
CC(C)(C)[C@@H](O)C[C@H](CO)[NH2+]Cc1ccsc1	ZINC000284204349	196002431	/nfs/dbraw/zinc/00/24/31/196002431.db2.gz	ZDKFDPMVXWPBPU-NEPJUHHUSA-N	1	0	257.399	1.996	50	0		CDAARO
OCC[NH2+]CCOc1ccc(Br)cc1	ZINC000005024272	170057232	/nfs/dbraw/zinc/05/72/32/170057232.db2.gz	OVBNAISWYLPNDK-UHFFFAOYSA-N	1	0	260.131	1.410	50	0		CDAARO
COc1ccc(OC[C@H](O)C[NH2+]C2CCCC2)cc1	ZINC000005050855	170061530	/nfs/dbraw/zinc/06/15/30/170061530.db2.gz	AVAOEPBPSCNXFA-CYBMUJFWSA-N	1	0	265.353	1.967	50	0		CDAARO
Cc1c(C)n(CCC[NH+](C)C)c2ncnc(NCCO)c12	ZINC000005348259	170088559	/nfs/dbraw/zinc/08/85/59/170088559.db2.gz	HVIWOXMEZXQHDV-UHFFFAOYSA-N	1	0	291.399	1.404	50	0		CDAARO
COc1cccc(C[N@@H+]2CCC[C@@H]2CO)c1OC	ZINC000005527519	170108914	/nfs/dbraw/zinc/10/89/14/170108914.db2.gz	FYEZUCBZHCOSIX-GFCCVEGCSA-N	1	0	251.326	1.661	50	0		CDAARO
[NH3+]CCCCC[C@]1(c2ccc(Cl)cc2)NC(=O)NC1=O	ZINC000006658167	170223312	/nfs/dbraw/zinc/22/33/12/170223312.db2.gz	SSGGLJNBVJJIDW-CQSZACIVSA-N	1	0	295.770	1.894	50	0		CDAARO
C[NH+](C)CCNC(=O)Nc1sc2c(c1C(N)=O)CCC2	ZINC000006669987	170224524	/nfs/dbraw/zinc/22/45/24/170224524.db2.gz	OROKVLAFIUZZSS-UHFFFAOYSA-N	1	0	296.396	1.019	50	0		CDAARO
O=C(c1ccco1)N1CCC2(CC1)[NH2+]CCc1nc[nH]c12	ZINC000008914734	170359018	/nfs/dbraw/zinc/35/90/18/170359018.db2.gz	YCGDDBZNYANBRJ-UHFFFAOYSA-N	1	0	286.335	1.280	50	0		CDAARO
O=C(C[N@@H+]1CCC[C@@H]1c1ccccc1)NC(=O)NC1CC1	ZINC000010088871	170397260	/nfs/dbraw/zinc/39/72/60/170397260.db2.gz	IPNJACLNBCQBQQ-CQSZACIVSA-N	1	0	287.363	1.812	50	0		CDAARO
O=C1C[C@H]([NH2+]CCc2ccccn2)C(=O)N1c1ccccc1	ZINC000019892136	170909941	/nfs/dbraw/zinc/90/99/41/170909941.db2.gz	MYQZIFFKLZYGNB-HNNXBMFYSA-N	1	0	295.342	1.546	50	0		CDAARO
C[NH+]1CCN(CCCCOc2cccc(C=O)c2)CC1	ZINC000020326752	171150975	/nfs/dbraw/zinc/15/09/75/171150975.db2.gz	SGXHQDULCQTIMQ-UHFFFAOYSA-N	1	0	276.380	1.906	50	0		CDAARO
Cc1ccc2c(CN3CC[NH+](C)CC3)cc(=O)oc2c1	ZINC000020503728	171227886	/nfs/dbraw/zinc/22/78/86/171227886.db2.gz	KUGFLXRUXNGYPP-UHFFFAOYSA-N	1	0	272.348	1.849	50	0		CDAARO
Cc1cc([C@H](C)NC(=O)[C@@H]2C[C@H](O)C[NH2+]2)c(C)s1	ZINC000037002201	172861316	/nfs/dbraw/zinc/86/13/16/172861316.db2.gz	VGBCQAUXLJSYGB-PEXQALLHSA-N	1	0	268.382	1.265	50	0		CDAARO
[NH3+][C@H]1CCN(Cc2ccccc2Br)C1	ZINC000038538691	174145239	/nfs/dbraw/zinc/14/52/39/174145239.db2.gz	OSIMPZQGBAVRSX-JTQLQIEISA-N	1	0	255.159	1.982	50	0		CDAARO
COc1ccc(CN2CC[N@H+](C)[C@H](C)C2)c(OC)c1OC	ZINC000043154259	174981868	/nfs/dbraw/zinc/98/18/68/174981868.db2.gz	JRMAVMWXWVBGDH-GFCCVEGCSA-N	1	0	294.395	1.848	50	0		CDAARO
O=C(Nc1ccc(F)cc1Cl)[C@H]1C[NH2+]CCO1	ZINC000043707910	175100694	/nfs/dbraw/zinc/10/06/94/175100694.db2.gz	JZGWFMJSHFOHCU-SNVBAGLBSA-N	1	0	258.680	1.406	50	0		CDAARO
Cc1ccoc1C(=O)N1CCC[C@@](O)(C[NH+](C)C)CC1	ZINC000072159017	176329114	/nfs/dbraw/zinc/32/91/14/176329114.db2.gz	YOPRVHDYOWWENW-HNNXBMFYSA-N	1	0	280.368	1.507	50	0		CDAARO
C[C@H]1CN(Cc2cccc(Cl)c2)[C@@H](CO)C[NH2+]1	ZINC000072233497	176344798	/nfs/dbraw/zinc/34/47/98/176344798.db2.gz	HWLQHMHFYPQFJO-GXFFZTMASA-N	1	0	254.761	1.495	50	0		CDAARO
C[NH+]1CCC(Cn2cnnc2)(c2ccccc2)CC1	ZINC000065508053	277026810	/nfs/dbraw/zinc/02/68/10/277026810.db2.gz	KJAUPAWERIUGJU-UHFFFAOYSA-N	1	0	256.353	1.942	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@]2(C[C@H](C[NH3+])CO2)C1	ZINC000091303590	277187395	/nfs/dbraw/zinc/18/73/95/277187395.db2.gz	CYIJGWKOFZHWLD-RISCZKNCSA-N	1	0	270.373	1.751	50	0		CDAARO
C[C@@H]1Cc2ccccc2N(C(=O)[C@H]2C[NH2+]CCO2)C1	ZINC000105569031	278039954	/nfs/dbraw/zinc/03/99/54/278039954.db2.gz	NLCPQTGQHASCJJ-BXUZGUMPSA-N	1	0	260.337	1.200	50	0		CDAARO
CC(=O)NC1(C(=O)N2C[C@@H](C)[C@H]([NH+](C)C)C2)CCCCC1	ZINC000089937150	278081514	/nfs/dbraw/zinc/08/15/14/278081514.db2.gz	WCOWEQKCLIFFPR-TZMCWYRMSA-N	1	0	295.427	1.234	50	0		CDAARO
Cc1ccc(C[NH2+]C[C@H](O)CN2CCCC2=O)cc1	ZINC000001391347	278806664	/nfs/dbraw/zinc/80/66/64/278806664.db2.gz	MKIRWDZDSJKHBB-AWEZNQCLSA-N	1	0	262.353	1.068	50	0		CDAARO
Cc1ccccc1C[NH2+]C1CCN(S(C)(=O)=O)CC1	ZINC000030656278	279138207	/nfs/dbraw/zinc/13/82/07/279138207.db2.gz	KDJVUAKPWZCYKL-UHFFFAOYSA-N	1	0	282.409	1.509	50	0		CDAARO
CC[C@@H]1CCCCN1C(=O)[C@@H](C)[N@@H+]1C[C@@H](C)[C@H](C(N)=O)C1	ZINC000408048179	280243626	/nfs/dbraw/zinc/24/36/26/280243626.db2.gz	LQVIFGSXPVRSBB-AAVRWANBSA-N	1	0	295.427	1.219	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@@H]1[NH2+][C@@H](C)C(=O)NCC(C)C	ZINC000089948641	280396328	/nfs/dbraw/zinc/39/63/28/280396328.db2.gz	VMLJGRRQELUCBT-CFVMTHIKSA-N	1	0	297.443	1.384	50	0		CDAARO
CC[C@@]1(C(=O)N[C@H](C)c2cn(C)nc2C)CCC[NH2+]1	ZINC000184102934	280634740	/nfs/dbraw/zinc/63/47/40/280634740.db2.gz	UBPBFPJBDAWGKB-YGRLFVJLSA-N	1	0	264.373	1.438	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)/C=C\c2cncc(F)c2)C1	ZINC000255089197	289355967	/nfs/dbraw/zinc/35/59/67/289355967.db2.gz	FHGZPJYYNHICLM-ZFDPJTLLSA-N	1	0	263.316	1.444	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)/C=C\c2ccccc2OC)C1	ZINC000255225023	289361721	/nfs/dbraw/zinc/36/17/21/289361721.db2.gz	RPJFUCIPGLHLHT-CMUBDUJZSA-N	1	0	274.364	1.919	50	0		CDAARO
C[NH2+]C1CCN(C(=O)/C=C\c2c(C)nn(C)c2Cl)CC1	ZINC000255327788	289366629	/nfs/dbraw/zinc/36/66/29/289366629.db2.gz	PQKCBSSALFKQLC-PLNGDYQASA-N	1	0	296.802	1.606	50	0		CDAARO
C[C@H]([NH2+]CC(=O)N1CCOCC1)C(C)(C)c1ccccc1	ZINC000097033216	289941970	/nfs/dbraw/zinc/94/19/70/289941970.db2.gz	XQKGVQHZWCLWCJ-AWEZNQCLSA-N	1	0	290.407	1.801	50	0		CDAARO
C[C@H](O)C(=O)NC[C@@H](c1ccccc1)[NH+]1CCC(C)CC1	ZINC000095979915	290067527	/nfs/dbraw/zinc/06/75/27/290067527.db2.gz	SPSOQIWAMGXYOV-HOCLYGCPSA-N	1	0	290.407	1.957	50	0		CDAARO
Clc1ccc(-c2noc(N3CC[NH2+]CC3)n2)cc1	ZINC000021365110	294102850	/nfs/dbraw/zinc/10/28/50/294102850.db2.gz	JSUGHTIRFNMJLZ-UHFFFAOYSA-N	1	0	264.716	1.800	50	0		CDAARO
[NH3+]Cc1ccc(C(=O)N2CCOC[C@H]2C2CC2)cc1	ZINC000186481836	295278018	/nfs/dbraw/zinc/27/80/18/295278018.db2.gz	NQOXZUWNBFLQMN-AWEZNQCLSA-N	1	0	260.337	1.396	50	0		CDAARO
CC(C)c1cc(C[NH2+][C@H]2CCNC(=O)CC2)no1	ZINC000534580410	328311638	/nfs/dbraw/zinc/31/16/38/328311638.db2.gz	HZFZUTFRLOGEIU-SNVBAGLBSA-N	1	0	251.330	1.556	50	0		CDAARO
Cc1nnc(N[C@H]2COC[C@@H]2[NH+]2CCCC2)c2ccccc12	ZINC000534586778	328315828	/nfs/dbraw/zinc/31/58/28/328315828.db2.gz	IMTZDKFYUMSAKK-HOTGVXAUSA-N	1	0	298.390	1.635	50	0		CDAARO
CCC[C@@H](NC(C)=O)C(=O)NCC1(C[NH+]2CCCC2)CC1	ZINC000534588844	328316857	/nfs/dbraw/zinc/31/68/57/328316857.db2.gz	VBSDHSBJNLARGY-CQSZACIVSA-N	1	0	295.427	1.283	50	0		CDAARO
CCCc1ncncc1C(=O)N[C@@H](C)C1CC[NH+](C)CC1	ZINC000534588986	328317002	/nfs/dbraw/zinc/31/70/02/328317002.db2.gz	JVIBCMZYVYHAAZ-LBPRGKRZSA-N	1	0	290.411	1.889	50	0		CDAARO
COCC1(CNC(=O)C[C@H](C)n2ccnc2C)CC1	ZINC000534590174	328317763	/nfs/dbraw/zinc/31/77/63/328317763.db2.gz	LDAUEWQSZQMHGJ-NSHDSACASA-N	1	0	265.357	1.685	50	0		CDAARO
COC(C)(C)C(=O)NC[C@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534660548	328339623	/nfs/dbraw/zinc/33/96/23/328339623.db2.gz	SEUVSOTYNXGFEG-GFCCVEGCSA-N	1	0	268.401	1.792	50	0		CDAARO
CN(Cc1cc(-c2cccs2)n[nH]1)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000534670173	328346958	/nfs/dbraw/zinc/34/69/58/328346958.db2.gz	MSAOOMGUUFUREI-NSHDSACASA-N	1	0	288.376	1.625	50	0		CDAARO
NC(=O)c1cncc(NC[C@@H]2CC[N@@H+](C3CCCC3)C2)n1	ZINC000534662693	328350618	/nfs/dbraw/zinc/35/06/18/328350618.db2.gz	ATZAZCMAUXHGQT-NSHDSACASA-N	1	0	289.383	1.252	50	0		CDAARO
Cc1ncc(Cl)c(NC[C@H](O)C[NH+]2CCCC2)n1	ZINC001772705078	1159440641	/nfs/dbraw/zinc/44/06/41/1159440641.db2.gz	VOMXNZCVVBTJQS-JTQLQIEISA-N	1	0	270.764	1.307	50	0		CDAARO
CC(=O)NC(C)(C)C[C@H](C)[NH2+]Cc1csc(N)n1	ZINC000670448978	483005439	/nfs/dbraw/zinc/00/54/39/483005439.db2.gz	WYLGHDAYUCNQKX-QMMMGPOBSA-N	1	0	270.402	1.508	50	0		CDAARO
COCCN(C)CC(=O)N[C@@H](C)c1csc(C)n1	ZINC000670452232	483020745	/nfs/dbraw/zinc/02/07/45/483020745.db2.gz	KVMWDGUDHXIEHK-VIFPVBQESA-N	1	0	271.386	1.207	50	0		CDAARO
Cc1cccc(CC[N@@H+]2CCC[C@H](c3nnc[nH]3)C2)n1	ZINC000670454638	483027951	/nfs/dbraw/zinc/02/79/51/483027951.db2.gz	XUMHULKTMZBMBH-ZDUSSCGKSA-N	1	0	271.368	1.930	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CN(C)c2nnc(C)s2)C1	ZINC000670459508	483042080	/nfs/dbraw/zinc/04/20/80/483042080.db2.gz	YLJZEHXAEMGFDT-LLVKDONJSA-N	1	0	270.402	1.251	50	0		CDAARO
COc1ccc2ncn([C@@H]3CC[C@@H]([NH3+])C3)c(=O)c2c1	ZINC000670474366	483085255	/nfs/dbraw/zinc/08/52/55/483085255.db2.gz	JMHAKBIYKKBFGE-NXEZZACHSA-N	1	0	259.309	1.457	50	0		CDAARO
CCn1cc([C@@H]2OCC[C@@H]2C[NH2+]Cc2c[nH]nc2C)cn1	ZINC000083843479	483203947	/nfs/dbraw/zinc/20/39/47/483203947.db2.gz	OSTFOBNLGHQMBE-IUODEOHRSA-N	1	0	289.383	1.802	50	0		CDAARO
O=C(COC1CCCCC1)NC[C@@H]1C[N@@H+]2CCC[C@@H]2CO1	ZINC000084543984	483286433	/nfs/dbraw/zinc/28/64/33/483286433.db2.gz	VAJGPFWVKOSYDU-UKRRQHHQSA-N	1	0	296.411	1.315	50	0		CDAARO
CCC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@@H+]1CCn1cccn1	ZINC000084718645	483317753	/nfs/dbraw/zinc/31/77/53/483317753.db2.gz	UIGPWOPFHNWAJL-LSDHHAIUSA-N	1	0	290.411	1.749	50	0		CDAARO
CN(C(=O)c1cc(Cl)cn1C)C1CC[NH2+]CC1	ZINC000036283268	523918486	/nfs/dbraw/zinc/91/84/86/523918486.db2.gz	KDSQGEITWFNTKQ-UHFFFAOYSA-N	1	0	255.749	1.503	50	0		CDAARO
Cc1cc(C(=O)N(C)[C@@H]2CC[NH2+]C2)c(C)n1C1CC1	ZINC000179088778	526226462	/nfs/dbraw/zinc/22/64/62/526226462.db2.gz	YCANDBXYDPWERB-CYBMUJFWSA-N	1	0	261.369	1.874	50	0		CDAARO
CC(=O)Oc1c(C)[n+](C)cc2c1CO[C@H](C)OC2	ZINC000000187146	538221011	/nfs/dbraw/zinc/22/10/11/538221011.db2.gz	GZXPBHDZTLFAAP-SNVBAGLBSA-N	1	0	252.290	1.138	50	0		CDAARO
C[NH+](C)CCNc1ncnc2c1cnn2-c1ccccc1	ZINC000000487759	545531714	/nfs/dbraw/zinc/53/17/14/545531714.db2.gz	HUDXUPBLGSAGNG-UHFFFAOYSA-N	1	0	282.351	1.789	50	0	biogenic	CDAARO
CCN(C)c1ccccc1NC(=O)NCC[NH+](C)C	ZINC000097052114	567903681	/nfs/dbraw/zinc/90/36/81/567903681.db2.gz	QIBMORRVCQBJGL-UHFFFAOYSA-N	1	0	264.373	1.826	50	0		CDAARO
COCc1noc([C@H](C)N2CCC([NH2+]C(C)C)CC2)n1	ZINC000097086113	567904148	/nfs/dbraw/zinc/90/41/48/567904148.db2.gz	OLJKGUKQHDRLAR-NSHDSACASA-N	1	0	282.388	1.739	50	0		CDAARO
CCc1nc(C)c(C[N@H+](CC)CCn2cccn2)[nH]1	ZINC000952991374	615736571	/nfs/dbraw/zinc/73/65/71/615736571.db2.gz	QTTIOMXCTSRQOW-UHFFFAOYSA-N	1	0	261.373	1.999	50	0		CDAARO
CN(CC1(C)COC1)C(=O)[C@H]1CCCCC[N@@H+]1C	ZINC000952966221	616056490	/nfs/dbraw/zinc/05/64/90/616056490.db2.gz	GGEWQLORLIQXPN-GFCCVEGCSA-N	1	0	254.374	1.356	50	0		CDAARO
COCC(C)(C)C(=O)N1CC[C@]2(CCC[N@@H+]2C)C1	ZINC000952994949	616707310	/nfs/dbraw/zinc/70/73/10/616707310.db2.gz	XKUIHSQXAFQECP-CQSZACIVSA-N	1	0	254.374	1.356	50	0		CDAARO
CC[C@@](C)([NH2+]Cc1cccc2c1OC(F)(F)O2)C(N)=O	ZINC000888093980	617752844	/nfs/dbraw/zinc/75/28/44/617752844.db2.gz	RDKRXESXMALQAN-GFCCVEGCSA-N	1	0	286.278	1.752	50	0		CDAARO
O=C([O-])CC[C@]12C[NH2+]C[C@@H]1CN(Cc1ccsc1)C2	ZINC001772700512	1159436801	/nfs/dbraw/zinc/43/68/01/1159436801.db2.gz	FXJQHCWEJKENTJ-TZMCWYRMSA-N	1	0	280.393	1.634	50	0		CDAARO
c1cc(C[C@@H]2COC[C@H]2Nc2cc[nH+]cc2)ccn1	ZINC001704299819	1177680131	/nfs/dbraw/zinc/68/01/31/1177680131.db2.gz	KQSCVMQMTGCTIE-UKRRQHHQSA-N	1	0	255.321	1.568	50	0		CDAARO
Cn1c(=O)[nH]cc(CC[N@H+](C)CCc2ccccc2)c1=O	ZINC001704347962	1177697465	/nfs/dbraw/zinc/69/74/65/1177697465.db2.gz	JBLIGXOVRXHMES-UHFFFAOYSA-N	1	0	287.363	1.203	50	0		CDAARO
CCOCC[NH2+][C@H](C)c1cccc(-n2cnnc2)c1	ZINC000863983317	730682367	/nfs/dbraw/zinc/68/23/67/730682367.db2.gz	FTMSPZBBSRTFCS-GFCCVEGCSA-N	1	0	260.341	1.954	50	0		CDAARO
CC(=O)N1CCN(c2cc[nH+]c3ccccc32)C[C@@H](O)C1	ZINC000091793509	730760076	/nfs/dbraw/zinc/76/00/76/730760076.db2.gz	UIBPPTATQGTCRP-ZDUSSCGKSA-N	1	0	285.347	1.264	50	0		CDAARO
O=C1CC[C@H]([NH2+]CCn2cccn2)CCN1CC1CC1	ZINC000952977199	731001126	/nfs/dbraw/zinc/00/11/26/731001126.db2.gz	XHMXPQORKXIHBI-AWEZNQCLSA-N	1	0	276.384	1.264	50	0		CDAARO
Cc1nnc2n1CC[N@@H+](Cc1ccc3c(c1)CCO3)CC2	ZINC000012245457	731180160	/nfs/dbraw/zinc/18/01/60/731180160.db2.gz	XEHJYGLXWSMHNZ-UHFFFAOYSA-N	1	0	284.363	1.580	50	0		CDAARO
Cc1cc(C)cc(N2CCN(C3CC[NH2+]CC3)CC2=O)c1	ZINC000067956018	731369138	/nfs/dbraw/zinc/36/91/38/731369138.db2.gz	NCDNKGPBWVFCOD-UHFFFAOYSA-N	1	0	287.407	1.704	50	0		CDAARO
Cc1cnccc1CNC(=O)[C@@H](C)[NH+]1CCCCC1	ZINC000426487565	732941324	/nfs/dbraw/zinc/94/13/24/732941324.db2.gz	SJJSDTDCOPHZJK-CYBMUJFWSA-N	1	0	261.369	1.881	50	0		CDAARO
COC1(OC)CC[C@@H]1[NH2+]CCNC(=O)c1cccc(C)c1	ZINC000864097344	733155819	/nfs/dbraw/zinc/15/58/19/733155819.db2.gz	TZVQJYKJINQYTE-AWEZNQCLSA-N	1	0	292.379	1.466	50	0		CDAARO
CC(C)C[N@@H+]1CCCN(C(=O)[C@H]2CC(C(C)C)=NO2)CC1	ZINC000952863273	910416210	/nfs/dbraw/zinc/41/62/10/910416210.db2.gz	DDWPWPJPPWKRDO-OAHLLOKOSA-N	1	0	295.427	1.978	50	0		CDAARO
O=C(NCC1CC[NH+](CCCO)CC1)c1ccoc1	ZINC000952965212	910479990	/nfs/dbraw/zinc/47/99/90/910479990.db2.gz	CDIUYNZRNXALHV-UHFFFAOYSA-N	1	0	266.341	1.104	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)C2(Cn3ccnc3)CC2)CC1	ZINC000823076025	925666892	/nfs/dbraw/zinc/66/68/92/925666892.db2.gz	KYNGGRAMHGQLMH-UHFFFAOYSA-N	1	0	290.411	1.654	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2cncc(C)c2)CC1	ZINC000824412421	925820930	/nfs/dbraw/zinc/82/09/30/925820930.db2.gz	PEIBYQXHDLKWGW-UHFFFAOYSA-N	1	0	291.395	1.478	50	0		CDAARO
Cc1cnn(CCC[N@@H+]2CCC[C@H](c3nnc[nH]3)C2)c1	ZINC000825253227	925857987	/nfs/dbraw/zinc/85/79/87/925857987.db2.gz	BSPULJMLGRBQGU-ZDUSSCGKSA-N	1	0	274.372	1.579	50	0		CDAARO
CN(CC1(CO)CCCC1)C(=O)[C@]1(C)CCC[NH2+]C1	ZINC000828686787	926164933	/nfs/dbraw/zinc/16/49/33/926164933.db2.gz	VWEQMSORCFGVOA-CQSZACIVSA-N	1	0	268.401	1.387	50	0		CDAARO
COc1ccccc1/C=C/C[NH2+]CCc1cn(C)nn1	ZINC000585089152	930913166	/nfs/dbraw/zinc/91/31/66/930913166.db2.gz	MRTGGYWUCTXCCF-FNORWQNLSA-N	1	0	272.352	1.669	50	0		CDAARO
O=C(Nc1cc(F)cc(F)c1)N1CC[N@@H+]2CC[C@H]1C2	ZINC000864094335	934606235	/nfs/dbraw/zinc/60/62/35/934606235.db2.gz	REGUXGTUJJAYEI-LBPRGKRZSA-N	1	0	267.279	1.887	50	0		CDAARO
C[NH+](C)CCc1nnc(NC(=O)Cc2cccnc2)s1	ZINC001506406987	975151436	/nfs/dbraw/zinc/15/14/36/975151436.db2.gz	SUTFNQBNRIILRO-UHFFFAOYSA-N	1	0	291.380	1.218	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]Cc1cn2c(n1)SCC2	ZINC001506404908	975152108	/nfs/dbraw/zinc/15/21/08/975152108.db2.gz	VYOWZGCUCFLLOJ-LLVKDONJSA-N	1	0	291.424	1.926	50	0		CDAARO
Cc1nnc(N2CC[N@@H+](C)[C@H](CCO)C2)c2ccccc12	ZINC001506415596	975155714	/nfs/dbraw/zinc/15/57/14/975155714.db2.gz	ZBVMWMUQJYRKQY-CYBMUJFWSA-N	1	0	286.379	1.441	50	0		CDAARO
CC[C@@H]1CN(c2ncc(F)c(NC)n2)CC[N@@H+]1C	ZINC001506430913	975161581	/nfs/dbraw/zinc/16/15/81/975161581.db2.gz	ZENDUFITVJJWJR-SECBINFHSA-N	1	0	253.325	1.188	50	0		CDAARO
C[C@H]1C[C@H](NCc2ccnc(N(C)C)n2)C[N@@H+]1C1CC1	ZINC000096493537	230383327	/nfs/dbraw/zinc/38/33/27/230383327.db2.gz	MWEFLYOLNIMECG-AAEUAGOBSA-N	1	0	275.400	1.257	50	0		CDAARO
CCOc1ncccc1C[NH2+][C@@H](C)CCn1cncn1	ZINC000097016517	230386226	/nfs/dbraw/zinc/38/62/26/230386226.db2.gz	OFJPYAHLODGOPV-LBPRGKRZSA-N	1	0	275.356	1.640	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)CCCOC	ZINC000106662023	349446088	/nfs/dbraw/zinc/44/60/88/349446088.db2.gz	ZJLBNLQXAAYJBP-ZIAGYGMSSA-N	1	0	268.401	1.888	50	0		CDAARO
Cc1cc(C)cc(CNC(=O)NC[C@@]2(O)CCC[NH2+]C2)c1	ZINC000426435018	230418477	/nfs/dbraw/zinc/41/84/77/230418477.db2.gz	URFVNJSVGXUCPW-MRXNPFEDSA-N	1	0	291.395	1.217	50	0		CDAARO
O=C(NCCCC[NH+]1CCCCCC1)c1ccnnc1	ZINC000221452150	230397710	/nfs/dbraw/zinc/39/77/10/230397710.db2.gz	VEZGGQXXIVHIAW-UHFFFAOYSA-N	1	0	276.384	1.863	50	0		CDAARO
CC(C)CCO[C@@H]1CC[N@@H+]([C@H](C)C(=O)N(C)C)C1	ZINC000107359824	398140867	/nfs/dbraw/zinc/14/08/67/398140867.db2.gz	UTRSMERQSHLDPN-CHWSQXEVSA-N	1	0	256.390	1.600	50	0		CDAARO
NC(=O)[C@@H]1CCCC[C@@H]1[NH2+]Cc1nc2c(s1)CCC2	ZINC000097375103	342002785	/nfs/dbraw/zinc/00/27/85/342002785.db2.gz	UCNUUPGJDPIZHZ-ZJUUUORDSA-N	1	0	279.409	1.766	50	0		CDAARO
O=C(Nc1nc(-c2ccsc2)ns1)[C@@H]1CCC[NH2+]1	ZINC000095959414	185044037	/nfs/dbraw/zinc/04/40/37/185044037.db2.gz	PKYAYLHRCSHJPN-QMMMGPOBSA-N	1	0	280.378	1.957	50	0		CDAARO
COC(=O)CN1CCC[N@H+](C[C@H]2CC=CCC2)CC1	ZINC000095982753	185053844	/nfs/dbraw/zinc/05/38/44/185053844.db2.gz	JXKJETIWCVPFEA-AWEZNQCLSA-N	1	0	266.385	1.523	50	0		CDAARO
CS(=O)(=O)CCC[NH2+]C1(c2cccc(F)c2)CC1	ZINC000095985323	185055232	/nfs/dbraw/zinc/05/52/32/185055232.db2.gz	JRXKZHWKJONLAC-UHFFFAOYSA-N	1	0	271.357	1.839	50	0		CDAARO
CCNC(=O)N1CCC([NH2+][C@@H](C)CN(CC)CC)CC1	ZINC000095986445	185056196	/nfs/dbraw/zinc/05/61/96/185056196.db2.gz	GPQGYKCBTFHDHK-ZDUSSCGKSA-N	1	0	284.448	1.500	50	0		CDAARO
CCC1(CC)[C@H](NC(=O)[C@H]2C[C@H](OC)C[NH2+]2)[C@@H](C)[C@H]1OC	ZINC000240423833	361748364	/nfs/dbraw/zinc/74/83/64/361748364.db2.gz	FRHDUIZGECCWHC-XVIXHAIJSA-N	1	0	298.427	1.319	50	0		CDAARO
CO[C@@H](C(=O)N1CC[C@H](C[NH+]2CCCCC2)C1)C1CC1	ZINC000241644488	361753021	/nfs/dbraw/zinc/75/30/21/361753021.db2.gz	PRDTZXWALOFUGJ-UKRRQHHQSA-N	1	0	280.412	1.746	50	0		CDAARO
CCOCC(C)(C)NC(=O)[C@H]1CC12CC[NH2+]CC2	ZINC000386201075	342089932	/nfs/dbraw/zinc/08/99/32/342089932.db2.gz	UYKKYLUBZMPDIO-LLVKDONJSA-N	1	0	254.374	1.307	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1	ZINC000125199317	187174335	/nfs/dbraw/zinc/17/43/35/187174335.db2.gz	IAYLPRPKBUVVHJ-ADEWGFFLSA-N	1	0	280.318	1.889	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1cc(-c2ccccn2)n[nH]1	ZINC000096118416	185102190	/nfs/dbraw/zinc/10/21/90/185102190.db2.gz	HAFIZKJYINHHGJ-LBPRGKRZSA-N	1	0	299.378	1.686	50	0		CDAARO
CC[N@@H+]1CCCN(CC(=O)N2CCCCCCC2)CC1	ZINC000089977259	539087703	/nfs/dbraw/zinc/08/77/03/539087703.db2.gz	STVHSWUDKJTMDJ-UHFFFAOYSA-N	1	0	281.444	1.807	50	0		CDAARO
Cc1nn(C)c2nc(NC[C@@H](O)C[NH+]3CCCC3)sc12	ZINC000096130677	185104083	/nfs/dbraw/zinc/10/40/83/185104083.db2.gz	BILKRSRYWIMZHI-SNVBAGLBSA-N	1	0	295.412	1.207	50	0		CDAARO
Cc1ncsc1CC[N@H+](C)CCCn1cnnn1	ZINC000243893533	361829446	/nfs/dbraw/zinc/82/94/46/361829446.db2.gz	ARRFZPHZNWUZSS-UHFFFAOYSA-N	1	0	266.374	1.003	50	0		CDAARO
CC[N@H+](CCn1ccc(C)n1)C[C@@H](O)c1cccc(O)c1	ZINC000244741954	361859854	/nfs/dbraw/zinc/85/98/54/361859854.db2.gz	NZOOSHJZYTVAAM-MRXNPFEDSA-N	1	0	289.379	1.953	50	0		CDAARO
Cc1nnc([C@@H]2CCC[N@H+](CCC(=O)NC(C)(C)C)C2)[nH]1	ZINC000244724117	361860492	/nfs/dbraw/zinc/86/04/92/361860492.db2.gz	MNWZZBBSNCABNV-GFCCVEGCSA-N	1	0	293.415	1.597	50	0		CDAARO
Cc1ccnn1CC[N@@H+](C)CC1(CO)CCCC1	ZINC000244774082	361861482	/nfs/dbraw/zinc/86/14/82/361861482.db2.gz	PNMPMCVFIDIKTO-UHFFFAOYSA-N	1	0	251.374	1.676	50	0		CDAARO
C[NH+](C)CCCNC(=O)/C=C/c1nc2ccccc2o1	ZINC000253417184	361935367	/nfs/dbraw/zinc/93/53/67/361935367.db2.gz	SMGYCQVMGCLUKY-CMDGGOBGSA-N	1	0	273.336	1.909	50	0		CDAARO
CN(C(=O)c1conc1C1CC1)[C@H]1CCC[N@H+](C)C1	ZINC000253417695	361937565	/nfs/dbraw/zinc/93/75/65/361937565.db2.gz	DSKYJDAEURIVJS-NSHDSACASA-N	1	0	263.341	1.718	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)OCc2ccccc2)CC1(F)F	ZINC000221010984	342286332	/nfs/dbraw/zinc/28/63/32/342286332.db2.gz	MATYFHSYNPENMM-LLVKDONJSA-N	1	0	270.279	1.992	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)CCc1cc(F)ccc1F	ZINC000125899003	187204093	/nfs/dbraw/zinc/20/40/93/187204093.db2.gz	JZFOSLJLNVMZPU-JTQLQIEISA-N	1	0	268.307	1.718	50	0		CDAARO
Cc1cc(C(=O)N2CC[NH2+]C[C@@H]2C)nn1C(C)(C)C	ZINC000126308034	187231703	/nfs/dbraw/zinc/23/17/03/187231703.db2.gz	XHMMRBPYDPCFTK-NSHDSACASA-N	1	0	264.373	1.380	50	0		CDAARO
Cc1cc(CNC(=O)[C@@H]2CC[N@@H+]2C2CCCC2)no1	ZINC000585121303	362040447	/nfs/dbraw/zinc/04/04/47/362040447.db2.gz	LKMFGADFMWMRAT-ZDUSSCGKSA-N	1	0	263.341	1.616	50	0		CDAARO
CS(=O)(=O)N1CCC[C@H]([NH2+]C[C@H]2CC=CCC2)C1	ZINC000095433927	342431697	/nfs/dbraw/zinc/43/16/97/342431697.db2.gz	OHUFSIHPLHFGNN-STQMWFEESA-N	1	0	272.414	1.356	50	0		CDAARO
O=C1C[C@@H]([NH2+]C2CCOCC2)CN1CC1CCCCC1	ZINC000015066191	362253690	/nfs/dbraw/zinc/25/36/90/362253690.db2.gz	YUZGGZSYSMCLHV-OAHLLOKOSA-N	1	0	280.412	1.936	50	0		CDAARO
Cc1ccc(CNc2cc([C@H]3C[C@@H](O)C3)[nH+]c(N)n2)o1	ZINC000253378486	362425896	/nfs/dbraw/zinc/42/58/96/362425896.db2.gz	GKIBKNPGEQETKZ-AOOOYVTPSA-N	1	0	274.324	1.811	50	0		CDAARO
Cc1nc[nH]c1CN1CCCO[C@@H](C[NH+]2CCCC2)C1	ZINC000097480393	185614219	/nfs/dbraw/zinc/61/42/19/185614219.db2.gz	XAAFQBKDNDOPEW-AWEZNQCLSA-N	1	0	278.400	1.405	50	0		CDAARO
CCc1ccc([C@@H](C)[NH2+]CC(C)(C)NS(C)(=O)=O)o1	ZINC000089581844	179824165	/nfs/dbraw/zinc/82/41/65/179824165.db2.gz	DXJFQFUEFXOREU-SNVBAGLBSA-N	1	0	288.413	1.820	50	0		CDAARO
O=C(N1CCCC1)N1CCC([NH2+][C@@H]2CCCOC2)CC1	ZINC000584896180	349357570	/nfs/dbraw/zinc/35/75/70/349357570.db2.gz	YQGSVOFBCYYMTR-CQSZACIVSA-N	1	0	281.400	1.435	50	0		CDAARO
C[NH+](C)C1(CNC(=O)CCc2cn[nH]c2)CCCCC1	ZINC000584884251	349342490	/nfs/dbraw/zinc/34/24/90/349342490.db2.gz	DISDPRIDOCGDMI-UHFFFAOYSA-N	1	0	278.400	1.723	50	0		CDAARO
Cc1cncc(C(=O)NCCC[N@@H+]2CCCC[C@@H]2CO)c1	ZINC000584888633	349347362	/nfs/dbraw/zinc/34/73/62/349347362.db2.gz	HEVRNJHQVQDCSX-OAHLLOKOSA-N	1	0	291.395	1.357	50	0		CDAARO
Nc1ccnc(NC2CC[NH+](C3CCCC3)CC2)n1	ZINC000584890330	349349626	/nfs/dbraw/zinc/34/96/26/349349626.db2.gz	UKRJFCKORTYWKM-UHFFFAOYSA-N	1	0	261.373	1.708	50	0		CDAARO
CCOCCC(=O)NCC1([NH+]2CCCC2)CCCC1	ZINC000584891732	349351332	/nfs/dbraw/zinc/35/13/32/349351332.db2.gz	LAPYZHPCEUWEHI-UHFFFAOYSA-N	1	0	268.401	1.938	50	0		CDAARO
Cc1nc(C)c(C)c(N(C)CCCC[NH+]2CCOCC2)n1	ZINC000091270520	180117647	/nfs/dbraw/zinc/11/76/47/180117647.db2.gz	KCVZOZIFVYBNAY-UHFFFAOYSA-N	1	0	292.427	1.950	50	0		CDAARO
COCc1nsc(N2CCC[C@@H]([NH+]3CCCC3)C2)n1	ZINC000091453428	180159835	/nfs/dbraw/zinc/15/98/35/180159835.db2.gz	DPLZPPHULZGYMK-LLVKDONJSA-N	1	0	282.413	1.749	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)c2ccncc2Cl)C1	ZINC000091456864	180160025	/nfs/dbraw/zinc/16/00/25/180160025.db2.gz	UIVBOMKKEFURBH-SECBINFHSA-N	1	0	253.733	1.559	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CNc2nccc(C(C)C)n2)C1	ZINC000091411233	180148610	/nfs/dbraw/zinc/14/86/10/180148610.db2.gz	JRBPZRRGDXXZBI-CYBMUJFWSA-N	1	0	278.400	1.980	50	0		CDAARO
O=C(C1C[NH2+]C1)N(Cc1ccc(F)cc1F)C1CC1	ZINC000091410860	180149171	/nfs/dbraw/zinc/14/91/71/180149171.db2.gz	KJNRBGJKGYMTOA-UHFFFAOYSA-N	1	0	266.291	1.675	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1NCc1cnn(CC)c1	ZINC000091426487	180152086	/nfs/dbraw/zinc/15/20/86/180152086.db2.gz	IZVIATCANFOUAD-UHFFFAOYSA-N	1	0	260.345	1.758	50	0		CDAARO
CNC(=O)c1cccnc1N1C[C@H]([NH+](C)C)[C@@H](C2CC2)C1	ZINC000091595925	180202188	/nfs/dbraw/zinc/20/21/88/180202188.db2.gz	RPOSDSVXSXZHGA-KGLIPLIRSA-N	1	0	288.395	1.218	50	0		CDAARO
COc1cccc(CC(=O)N2C[C@H]3CC[C@H](C[N@H+]3C)C2)c1	ZINC000091643703	180214238	/nfs/dbraw/zinc/21/42/38/180214238.db2.gz	BTGPKGPUIPWDFG-HUUCEWRRSA-N	1	0	288.391	1.790	50	0		CDAARO
CC(C)[C@H]1C[N@H+](Cc2ccco2)C[C@@H]1NS(C)(=O)=O	ZINC000091677862	180225448	/nfs/dbraw/zinc/22/54/48/180225448.db2.gz	HZXWUADFFQQBRT-OLZOCXBDSA-N	1	0	286.397	1.285	50	0		CDAARO
CC(C)(C)C[N@@H+]1CCN(Cc2cccnc2)C[C@H]1CCO	ZINC000105607990	186065555	/nfs/dbraw/zinc/06/55/55/186065555.db2.gz	FPHIEWMFPYDVJV-MRXNPFEDSA-N	1	0	291.439	1.996	50	0		CDAARO
CC(C)n1cc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)cn1	ZINC000091997547	180302791	/nfs/dbraw/zinc/30/27/91/180302791.db2.gz	WZCRSTTWTOHZNP-OLZOCXBDSA-N	1	0	262.357	1.273	50	0		CDAARO
CCc1cc(N2CCC[C@](C)(CO)C2)nc(N(C)C)[nH+]1	ZINC000065381731	362957162	/nfs/dbraw/zinc/95/71/62/362957162.db2.gz	UOGOAJHHCNMUIL-HNNXBMFYSA-N	1	0	278.400	1.704	50	0		CDAARO
COc1ccccc1[C@@H](C)NC(=O)C[N@@H+]1CCC[C@H]1CO	ZINC000106772535	186135889	/nfs/dbraw/zinc/13/58/89/186135889.db2.gz	VQZJMRYFBFPXJP-OLZOCXBDSA-N	1	0	292.379	1.329	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(CCc2ccncc2)C[C@@H]1C	ZINC000106844365	186140821	/nfs/dbraw/zinc/14/08/21/186140821.db2.gz	ZUOLXEWZYVBZKH-KBPBESRZSA-N	1	0	263.385	1.011	50	0		CDAARO
COCCn1ccc(NC(=O)[C@@H](C)[N@H+]2[C@H](C)CC[C@@H]2C)n1	ZINC000108468858	186218530	/nfs/dbraw/zinc/21/85/30/186218530.db2.gz	NCFDLOMEDMOKKI-FRRDWIJNSA-N	1	0	294.399	1.729	50	0		CDAARO
CN(CC[N@H+](C)C1CCOCC1)C(=O)OC(C)(C)C	ZINC000097099187	351600149	/nfs/dbraw/zinc/60/01/49/351600149.db2.gz	WOINIKBPPCTPAK-UHFFFAOYSA-N	1	0	272.389	1.964	50	0		CDAARO
O[C@@H](COc1ccccc1-n1cccn1)C[NH+]1CCCC1	ZINC000065405635	363090526	/nfs/dbraw/zinc/09/05/26/363090526.db2.gz	ALTHMEAMQVOEJM-CQSZACIVSA-N	1	0	287.363	1.708	50	0		CDAARO
CC[C@H](C)[C@H]([NH3+])C(=O)NCCCc1nc(C)cs1	ZINC000155693421	188222602	/nfs/dbraw/zinc/22/26/02/188222602.db2.gz	IDWAGWVMYUCOKA-CABZTGNLSA-N	1	0	269.414	1.874	50	0		CDAARO
CN1CC[C@@H]2CC[N@H+](C[C@@H](O)COC(C)(C)C)[C@@H]2C1	ZINC000253417075	283075444	/nfs/dbraw/zinc/07/54/44/283075444.db2.gz	LENXEFFBRGIKCU-MGPQQGTHSA-N	1	0	270.417	1.188	50	0		CDAARO
Cc1cccc(N2C[C@@H](C(=O)NCC[NH+](C)C)CC2=O)c1	ZINC000034916255	356001690	/nfs/dbraw/zinc/00/16/90/356001690.db2.gz	FCMZQSWIEFKIKR-ZDUSSCGKSA-N	1	0	289.379	1.026	50	0		CDAARO
CCOC(=O)CC[NH2+][C@@H](C)[C@H]1COc2ccccc2O1	ZINC000002183402	355963359	/nfs/dbraw/zinc/96/33/59/355963359.db2.gz	VPEJVSUDRBRPKB-SMDDNHRTSA-N	1	0	279.336	1.758	50	0		CDAARO
COc1ccc(C[NH2+]CCCN2CCOCC2)c(OC)c1	ZINC000002510431	355972031	/nfs/dbraw/zinc/97/20/31/355972031.db2.gz	QZMCJUMHUCXMBJ-UHFFFAOYSA-N	1	0	294.395	1.516	50	0		CDAARO
[NH2+]=C1Nc2nc3ccccc3n2[C@@H](c2ccncc2)N1	ZINC000008969704	356181804	/nfs/dbraw/zinc/18/18/04/356181804.db2.gz	ZJBYTXKKYSOWRW-LBPRGKRZSA-N	1	0	264.292	1.528	50	0		CDAARO
CN(C[C@@H](O)c1ccccc1)c1cc[nH+]c(CO)c1	ZINC000032573423	356280870	/nfs/dbraw/zinc/28/08/70/356280870.db2.gz	YLIMHYUJSUSXEA-OAHLLOKOSA-N	1	0	258.321	1.744	50	0		CDAARO
CC(C)(O)[C@@H]1CCC[N@H+](CCCCn2cncn2)C1	ZINC000032598106	356308071	/nfs/dbraw/zinc/30/80/71/356308071.db2.gz	DLAMLGGZQNDALU-CYBMUJFWSA-N	1	0	266.389	1.541	50	0		CDAARO
CC(C)[NH2+][C@H]1CC(=O)N(CCc2ccc(F)cc2)C1	ZINC000012588168	356310481	/nfs/dbraw/zinc/31/04/81/356310481.db2.gz	RNVGPEFQEJUNLU-AWEZNQCLSA-N	1	0	264.344	1.967	50	0		CDAARO
CC(C)C[N@H+](CC(=O)NC(=O)NC(C)C)C1CC1	ZINC000032777923	356363660	/nfs/dbraw/zinc/36/36/60/356363660.db2.gz	DNBPRRHCCDFSQU-UHFFFAOYSA-N	1	0	255.362	1.341	50	0		CDAARO
C[C@@H]1CN(C[C@H](O)COc2ccccc2)C[C@H](C)O1	ZINC000014359602	356385786	/nfs/dbraw/zinc/38/57/86/356385786.db2.gz	SMXAAYNAUFATPY-MJBXVCDLSA-N	1	0	265.353	1.536	50	0		CDAARO
CN1CCC([N@@H+]2CCC[C@@H](C(=O)N3CCCC3)C2)CC1	ZINC000014951814	356402179	/nfs/dbraw/zinc/40/21/79/356402179.db2.gz	SZCUNGREJZRXQL-CQSZACIVSA-N	1	0	279.428	1.415	50	0		CDAARO
C[NH+](C)CC(=O)N[C@@H]1CCCN(Cc2ccccc2F)C1	ZINC000014964288	356402239	/nfs/dbraw/zinc/40/22/39/356402239.db2.gz	QDNOZEQSKRXOAZ-CQSZACIVSA-N	1	0	293.386	1.468	50	0		CDAARO
O=C(C1CCOCC1)N1CCC[C@@H]1C[NH+]1CCCC1	ZINC000066945389	356450519	/nfs/dbraw/zinc/45/05/19/356450519.db2.gz	DKCINXMNVVUQLA-CQSZACIVSA-N	1	0	266.385	1.500	50	0		CDAARO
CC(C)[C@@H]([NH3+])C(=O)N1CCN(Cc2ccccc2)CC1	ZINC000019489192	356487979	/nfs/dbraw/zinc/48/79/79/356487979.db2.gz	FTNMATHIBXHACZ-OAHLLOKOSA-N	1	0	275.396	1.314	50	0		CDAARO
[NH3+]CCNCCOCCOc1cccc(Cl)c1Cl	ZINC000019772316	356500658	/nfs/dbraw/zinc/50/06/58/356500658.db2.gz	XRAXGLLSVNQGHR-UHFFFAOYSA-N	1	0	293.194	1.937	50	0		CDAARO
Cc1ccc(CN2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cn1	ZINC000019794887	356504930	/nfs/dbraw/zinc/50/49/30/356504930.db2.gz	GZBYUYSDKLSTCQ-IRXDYDNUSA-N	1	0	289.423	1.811	50	0		CDAARO
Cc1nc(-c2cccc(NC(=O)[C@@H]3CCCC[NH2+]3)c2)n[nH]1	ZINC000037769039	356531214	/nfs/dbraw/zinc/53/12/14/356531214.db2.gz	ZRJRJRCIBNZSJR-ZDUSSCGKSA-N	1	0	285.351	1.861	50	0		CDAARO
CCCC(=O)NCC1([NH+]2CCN(C)CC2)CCCCC1	ZINC000019902168	356514965	/nfs/dbraw/zinc/51/49/65/356514965.db2.gz	XOOIFRZMMITCKD-UHFFFAOYSA-N	1	0	281.444	1.853	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COCc2ccccc2F)CC1	ZINC000022030460	356597922	/nfs/dbraw/zinc/59/79/22/356597922.db2.gz	VPPVPPKNHCQVJB-HNNXBMFYSA-N	1	0	296.386	1.341	50	0		CDAARO
OCCOCCN1CC[NH+](CC2CCCCC2)CC1	ZINC000022027647	356598030	/nfs/dbraw/zinc/59/80/30/356598030.db2.gz	SOWQBSYZVRRADT-UHFFFAOYSA-N	1	0	270.417	1.193	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@H](CO)C2)c(OC)c1	ZINC000023114819	356628704	/nfs/dbraw/zinc/62/87/04/356628704.db2.gz	MRJUCIYRLPENPS-LBPRGKRZSA-N	1	0	265.353	1.908	50	0		CDAARO
C/C(=C\c1ccccc1)CN1CC[NH+](CCO)CC1	ZINC000023281864	356638445	/nfs/dbraw/zinc/63/84/45/356638445.db2.gz	UVHJVPGRVSFECF-FYWRMAATSA-N	1	0	260.381	1.700	50	0		CDAARO
CC(=O)c1cccc(OC[C@H](O)C[N@@H+]2CCC[C@@H](O)C2)c1	ZINC000023387163	356641701	/nfs/dbraw/zinc/64/17/01/356641701.db2.gz	FPNOPAJNRCQVRK-HUUCEWRRSA-N	1	0	293.363	1.086	50	0		CDAARO
Cc1ccccc1CS(=O)(=O)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000247219211	356751044	/nfs/dbraw/zinc/75/10/44/356751044.db2.gz	BRDWRQKWLMOMRL-HNNXBMFYSA-N	1	0	294.420	1.605	50	0		CDAARO
CCOC(=O)COc1ccc([C@H](C)[NH3+])cc1OC	ZINC000032627546	356784107	/nfs/dbraw/zinc/78/41/07/356784107.db2.gz	NWMQAQZETMHQDC-VIFPVBQESA-N	1	0	253.298	1.657	50	0		CDAARO
C[NH+]1CCN(c2cc(-c3ccccc3)nc(N)n2)CC1	ZINC000036139575	356862173	/nfs/dbraw/zinc/86/21/73/356862173.db2.gz	NIJGWJIOMPHDBP-UHFFFAOYSA-N	1	0	269.352	1.478	50	0	in-vitro	CDAARO
[NH3+]C1CCC(C(=O)Nc2ccc3c(c2)C(=O)NC3=O)CC1	ZINC000037623358	356914419	/nfs/dbraw/zinc/91/44/19/356914419.db2.gz	LJCIVKSIDBTSDY-UHFFFAOYSA-N	1	0	287.319	1.026	50	0		CDAARO
CCCN(CC(F)(F)F)C(=O)[C@H]1CCC[NH2+]C1	ZINC000037812075	356934847	/nfs/dbraw/zinc/93/48/47/356934847.db2.gz	UYQPLYOAIDJVSC-VIFPVBQESA-N	1	0	252.280	1.787	50	0		CDAARO
C[C@H](CO)N1CC[NH+](CCSc2ccccc2)CC1	ZINC000095407688	357214916	/nfs/dbraw/zinc/21/49/16/357214916.db2.gz	NTRNKHADASFRGZ-CQSZACIVSA-N	1	0	280.437	1.777	50	0		CDAARO
COc1c(C)cnc(CNc2cc(C)[nH+]c(N)n2)c1C	ZINC000050953384	357242289	/nfs/dbraw/zinc/24/22/89/357242289.db2.gz	CVBJLTZSVDCUDM-UHFFFAOYSA-N	1	0	273.340	2.000	50	0		CDAARO
CC(C)CN1CCO[C@@H](C[NH2+][C@H](C)C2CCOCC2)C1	ZINC000107524703	357332552	/nfs/dbraw/zinc/33/25/52/357332552.db2.gz	WVFMHTWNODRJPM-ZBFHGGJFSA-N	1	0	284.444	1.748	50	0		CDAARO
COC(=O)[C@@H](CC(C)C)NC(=O)[C@@H]([NH3+])Cc1ccccc1	ZINC000057466870	357358300	/nfs/dbraw/zinc/35/83/00/357358300.db2.gz	HGVNLOSOAISYIT-UONOGXRCSA-N	1	0	292.379	1.260	50	0		CDAARO
C[N@H+](CCNC(=O)NC[C@]1(C)CCCS1)C1CC1	ZINC000096467157	357478607	/nfs/dbraw/zinc/47/86/07/357478607.db2.gz	JBBPDPPMNCRDJE-ZDUSSCGKSA-N	1	0	271.430	1.666	50	0		CDAARO
Oc1cccc(C[NH+]2CCC(n3cnnc3)CC2)c1	ZINC000065373731	357533407	/nfs/dbraw/zinc/53/34/07/357533407.db2.gz	FYZXGGLAPAGHDY-UHFFFAOYSA-N	1	0	258.325	1.821	50	0		CDAARO
CC(=O)N1CCC([N@H+](C)Cc2snnc2C)CC1	ZINC000065406093	357539061	/nfs/dbraw/zinc/53/90/61/357539061.db2.gz	UJLYUGGLFBHJLK-UHFFFAOYSA-N	1	0	268.386	1.289	50	0		CDAARO
Cc1nc(C)n(CCNC(=O)CC[C@@H]2CCCC[N@H+]2C)n1	ZINC000065406349	357539312	/nfs/dbraw/zinc/53/93/12/357539312.db2.gz	BPKPDOHUTKQNPZ-AWEZNQCLSA-N	1	0	293.415	1.276	50	0		CDAARO
CCc1cc(N[C@@H](C)CN2CCOCC2)nc(N(C)C)[nH+]1	ZINC000065429090	357541045	/nfs/dbraw/zinc/54/10/45/357541045.db2.gz	LTRQZHGVORHGKJ-LBPRGKRZSA-N	1	0	293.415	1.238	50	0		CDAARO
CN(CCO)C(=O)[C@H]1CCC[N@@H+](C2CCCCC2)C1	ZINC000065531828	357547970	/nfs/dbraw/zinc/54/79/70/357547970.db2.gz	AELQOWYMFNMFSW-ZDUSSCGKSA-N	1	0	268.401	1.482	50	0		CDAARO
O=C(NC1CC1)c1ccc(OCC2CC[NH2+]CC2)cc1	ZINC000066323520	357562056	/nfs/dbraw/zinc/56/20/56/357562056.db2.gz	RFGAXPFCWLDEHX-UHFFFAOYSA-N	1	0	274.364	1.957	50	0		CDAARO
Cc1cnc(C(=O)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)cn1	ZINC000067490626	357610107	/nfs/dbraw/zinc/61/01/07/357610107.db2.gz	IHJOIUYVLGFVMP-AWEZNQCLSA-N	1	0	290.411	1.883	50	0		CDAARO
CCc1noc(C)c1C(=O)N(C)C[C@]1(C)CC[N@H+](C)C1	ZINC000067975006	357641645	/nfs/dbraw/zinc/64/16/45/357641645.db2.gz	ZXSQTHVLMWAYOO-OAHLLOKOSA-N	1	0	279.384	1.959	50	0		CDAARO
Cc1nccn1C1(C(=O)[O-])CCN(c2cc[nH+]cc2)CC1	ZINC000072477181	357838035	/nfs/dbraw/zinc/83/80/35/357838035.db2.gz	NMROTOBNGYYEFB-UHFFFAOYSA-N	1	0	286.335	1.667	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(Cc2ccc(C(=O)OC)[nH]2)C1	ZINC000097095599	357953073	/nfs/dbraw/zinc/95/30/73/357953073.db2.gz	PEVXQZZFTPZMHT-LLVKDONJSA-N	1	0	265.357	1.233	50	0		CDAARO
COc1cccc(CC(C)(C)NC(=O)C[NH+](C)C)c1	ZINC000097104313	357968273	/nfs/dbraw/zinc/96/82/73/357968273.db2.gz	AFPGCDDQENYAID-UHFFFAOYSA-N	1	0	264.369	1.694	50	0		CDAARO
Cc1ccc(S(=O)(=O)C[C@H](C)[NH2+][C@H]2CCCOC2)cc1	ZINC000097113284	357982944	/nfs/dbraw/zinc/98/29/44/357982944.db2.gz	STBBBSOVXPAXJB-KBPBESRZSA-N	1	0	297.420	1.926	50	0		CDAARO
Cc1ccccc1[C@H](C)[NH2+]CCNC(=O)c1ccn[nH]1	ZINC000097236305	358048572	/nfs/dbraw/zinc/04/85/72/358048572.db2.gz	KPEMUFPJPCWGID-LBPRGKRZSA-N	1	0	272.352	1.799	50	0		CDAARO
CC[N@@H+]1CCC[C@@]2(CCC(=O)N(CCc3c[nH]cn3)C2)C1	ZINC000082125924	358148106	/nfs/dbraw/zinc/14/81/06/358148106.db2.gz	KHNYCSZCONZUEX-MRXNPFEDSA-N	1	0	290.411	1.677	50	0		CDAARO
C[C@@H]1CCC[C@H](C)N1C(=O)CSc1nc(N)cc(N)[nH+]1	ZINC000013113132	366444073	/nfs/dbraw/zinc/44/40/73/366444073.db2.gz	MRDLDXJPPWMYJS-DTORHVGOSA-N	1	0	295.412	1.523	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCC[C@@H]2C[NH3+])c(F)c1	ZINC000195544557	358559870	/nfs/dbraw/zinc/55/98/70/358559870.db2.gz	CPTNCKMMCALMKZ-PWSUYJOCSA-N	1	0	286.372	1.540	50	0		CDAARO
O=C(c1ccc([C@H]2CCC[NH2+]C2)cc1)N1CCOCC1	ZINC000095353495	358682513	/nfs/dbraw/zinc/68/25/13/358682513.db2.gz	JZYYBNFHEBQXKX-HNNXBMFYSA-N	1	0	274.364	1.626	50	0		CDAARO
COC(=O)c1ccc2ccn(C[C@@H]3CC[NH2+]C3)c(=O)c2c1	ZINC000095373113	358688706	/nfs/dbraw/zinc/68/87/06/358688706.db2.gz	LKXPHADBBCRJKK-LLVKDONJSA-N	1	0	286.331	1.398	50	0		CDAARO
CCCc1nnc(N2CCC[C@@H]([NH+](C)C)CC2)o1	ZINC000095383596	358690442	/nfs/dbraw/zinc/69/04/42/358690442.db2.gz	FCUOJITZKYEBKB-LLVKDONJSA-N	1	0	252.362	1.943	50	0		CDAARO
Cc1ccnc(N2CCCO[C@@H](C[NH+]3CCCCC3)C2)n1	ZINC000095392014	358692925	/nfs/dbraw/zinc/69/29/25/358692925.db2.gz	PQMPMWAKCRWRBP-HNNXBMFYSA-N	1	0	290.411	1.866	50	0		CDAARO
CC(C)[C@@H]1CN(C(=O)C(=O)c2ccccc2)C[C@H]1[NH+](C)C	ZINC000095525690	358696175	/nfs/dbraw/zinc/69/61/75/358696175.db2.gz	VLLXOEDFXDBWEL-LSDHHAIUSA-N	1	0	288.391	1.914	50	0		CDAARO
O[C@@H]1C[NH2+]CCN(Cc2cc(C[NH+]3CCCC3)cs2)C1	ZINC000097568757	358785188	/nfs/dbraw/zinc/78/51/88/358785188.db2.gz	LECIHCOAKSZWCV-CQSZACIVSA-N	1	0	295.452	1.110	50	0		CDAARO
Cc1nccn1CC1(CNC(=O)C[C@@H]2CCC[N@H+]2C)CC1	ZINC000097602242	358787317	/nfs/dbraw/zinc/78/73/17/358787317.db2.gz	XFWONAZNZHZHTJ-AWEZNQCLSA-N	1	0	290.411	1.572	50	0		CDAARO
CCn1cnnc1CN(C)Cc1[nH+]c(C)n2ccccc12	ZINC000097797426	358799816	/nfs/dbraw/zinc/79/98/16/358799816.db2.gz	HQNPNHOMZCYEQL-UHFFFAOYSA-N	1	0	284.367	1.886	50	0		CDAARO
CSCC[NH+]1CCN(Cc2ccc(N(C)C)nc2)CC1	ZINC000215045777	358870538	/nfs/dbraw/zinc/87/05/38/358870538.db2.gz	OAJWJZWSKVFWBX-UHFFFAOYSA-N	1	0	294.468	1.628	50	0		CDAARO
Cc1nn(C)cc1CN(C)C[C@H]1CC[N@H+](C)C1(C)C	ZINC000215203187	358878592	/nfs/dbraw/zinc/87/85/92/358878592.db2.gz	MINBJBDRVOTXDK-CQSZACIVSA-N	1	0	264.417	1.891	50	0		CDAARO
CSc1ccccc1CN1CC[NH+](CCC(N)=O)CC1	ZINC000215224184	358879830	/nfs/dbraw/zinc/87/98/30/358879830.db2.gz	LTJDFAIDQAJMKB-UHFFFAOYSA-N	1	0	293.436	1.402	50	0		CDAARO
Cc1ccc(CN2CCN3CC[N@@H+](C)C[C@@H]3C2)c(F)c1F	ZINC000216264789	358934413	/nfs/dbraw/zinc/93/44/13/358934413.db2.gz	TWXDKUVFEPVCRL-CQSZACIVSA-N	1	0	295.377	1.705	50	0		CDAARO
CC[N@@H+]1CCCN(C(=O)C2CC2)CC12CCOCC2	ZINC000257181994	359438861	/nfs/dbraw/zinc/43/88/61/359438861.db2.gz	OIEVABGNBUAXCG-UHFFFAOYSA-N	1	0	266.385	1.500	50	0		CDAARO
Cc1noc(C)c1C[N@@H+]1C[C@@H](CO)[C@H](c2ccccn2)C1	ZINC000257190241	359538491	/nfs/dbraw/zinc/53/84/91/359538491.db2.gz	LPFMHSUILFIYOO-DZGCQCFKSA-N	1	0	287.363	1.894	50	0		CDAARO
CC(C)n1ccc(C(=O)NC[C@H]2CCC[N@@H+]2CCCO)n1	ZINC000408519817	359912882	/nfs/dbraw/zinc/91/28/82/359912882.db2.gz	DEPMVAFRBITNJH-CYBMUJFWSA-N	1	0	294.399	1.041	50	0		CDAARO
C[NH+]1CCC(NC(=S)NC2CCCCC2)CC1	ZINC000006549403	360193148	/nfs/dbraw/zinc/19/31/48/360193148.db2.gz	NTWYDBNWIDIMTQ-UHFFFAOYSA-N	1	0	255.431	1.877	50	0		CDAARO
CC[C@]1(O)CCOC2(CC[NH+](Cc3cnn(C)c3)CC2)C1	ZINC000409419919	360227007	/nfs/dbraw/zinc/22/70/07/360227007.db2.gz	RXQARLTUTUDDSS-HNNXBMFYSA-N	1	0	293.411	1.706	50	0		CDAARO
CN1C[C@@H]([NH2+][C@@H]2CC(C)(C)OC2(C)C)CCC1=O	ZINC000094424542	360315516	/nfs/dbraw/zinc/31/55/16/360315516.db2.gz	HEMMYKQKTAOQIR-WDEREUQCSA-N	1	0	254.374	1.543	50	0		CDAARO
[NH3+][C@@H](CCN1CCOCC1)c1ccc2c(c1)OCCO2	ZINC000020274122	283547607	/nfs/dbraw/zinc/54/76/07/283547607.db2.gz	QRSDCQDDHYLZGL-ZDUSSCGKSA-N	1	0	278.352	1.180	50	0		CDAARO
Cn1c(CC[NH3+])nnc1SCc1cc(C2CC2)on1	ZINC000426623209	360690940	/nfs/dbraw/zinc/69/09/40/360690940.db2.gz	LHRVCISUQKZKNX-UHFFFAOYSA-N	1	0	279.369	1.474	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)CCc1nc2ccccc2[nH]1	ZINC000178498764	189121387	/nfs/dbraw/zinc/12/13/87/189121387.db2.gz	HEWJLAVITHPMKE-NSHDSACASA-N	1	0	272.352	1.316	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C/C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178578586	189127950	/nfs/dbraw/zinc/12/79/50/189127950.db2.gz	MNITYQZAKWKYOX-HMDXOVGESA-N	1	0	282.775	1.202	50	0		CDAARO
CN(C(=O)CCc1cccc(F)c1F)[C@@H]1CC[NH2+]C1	ZINC000179050865	189165344	/nfs/dbraw/zinc/16/53/44/189165344.db2.gz	AGPCRFZFRLCRCE-LLVKDONJSA-N	1	0	268.307	1.718	50	0		CDAARO
Cc1noc([C@@H]2CCCN(C(=O)[C@H]3CCC[C@H]3[NH3+])C2)n1	ZINC000247335267	361061030	/nfs/dbraw/zinc/06/10/30/361061030.db2.gz	VWCDVGVPUIXXLM-GRYCIOLGSA-N	1	0	278.356	1.211	50	0		CDAARO
C[C@H](CCc1cccc(F)c1)[NH+]1CCN(CC(N)=O)CC1	ZINC000183007692	189342267	/nfs/dbraw/zinc/34/22/67/189342267.db2.gz	KGAPVVOAWXCZDU-CYBMUJFWSA-N	1	0	293.386	1.250	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC[C@H]([NH3+])C2)cc1F	ZINC000036297069	361462402	/nfs/dbraw/zinc/46/24/02/361462402.db2.gz	PWUUGGLIWKAHQQ-JTQLQIEISA-N	1	0	272.345	1.246	50	0		CDAARO
CC[NH+]1CCC(NCc2c(C)nn(C)c2C)CC1	ZINC000037977213	361528446	/nfs/dbraw/zinc/52/84/46/361528446.db2.gz	KZHUESPKTDSPPB-UHFFFAOYSA-N	1	0	250.390	1.611	50	0		CDAARO
CC(C)C[N@@H+]1CCN(Cc2ccc(O)cc2)C[C@H]1CCO	ZINC000104375001	361587170	/nfs/dbraw/zinc/58/71/70/361587170.db2.gz	DOZRUEVBXGCLAF-MRXNPFEDSA-N	1	0	292.423	1.917	50	0		CDAARO
CN(CCC(F)(F)F)C(=O)[C@H]([NH3+])Cc1ccccc1	ZINC000088420166	364842654	/nfs/dbraw/zinc/84/26/54/364842654.db2.gz	JRNYUIUQUKNRBD-LLVKDONJSA-N	1	0	274.286	1.967	50	0		CDAARO
CC(C)NS(=O)(=O)CC[NH2+][C@H]1CC(C)(C)C[C@@H]1C	ZINC000193131039	189636071	/nfs/dbraw/zinc/63/60/71/189636071.db2.gz	UJNUMLWWYNECJS-RYUDHWBXSA-N	1	0	276.446	1.729	50	0		CDAARO
C[C@H](O)C1CCN(C(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3[NH2+]2)CC1	ZINC000195542344	189677881	/nfs/dbraw/zinc/67/78/81/189677881.db2.gz	IGHSFRYLJWTOAE-MXAVVETBSA-N	1	0	280.412	1.527	50	0		CDAARO
CC(=O)NCC1CC[NH+](C2CCSCC2)CC1	ZINC000252498413	367648348	/nfs/dbraw/zinc/64/83/48/367648348.db2.gz	RBMKFDBUEOBBFP-UHFFFAOYSA-N	1	0	256.415	1.730	50	0		CDAARO
COCCN(C)c1ccc(C[N@@H+]2CC[C@H](O)[C@@H](C)C2)cn1	ZINC000252536922	367793566	/nfs/dbraw/zinc/79/35/66/367793566.db2.gz	JUNGOBWGANKIAL-ZFWWWQNUSA-N	1	0	293.411	1.367	50	0		CDAARO
Cn1cncc1C[NH2+][C@H]1CCc2ccccc2OC1	ZINC000377143868	367964384	/nfs/dbraw/zinc/96/43/84/367964384.db2.gz	XRIKHHLQFMTPNL-ZDUSSCGKSA-N	1	0	257.337	1.904	50	0		CDAARO
CC[NH+]1CCN(CC(=O)N[C@H]2CCc3ccccc32)CC1	ZINC000360184766	368165300	/nfs/dbraw/zinc/16/53/00/368165300.db2.gz	UWHQONJUSOHWJA-INIZCTEOSA-N	1	0	287.407	1.428	50	0		CDAARO
Cc1cc(F)ccc1NC(=O)NC[C@]1(O)CCC[NH2+]C1	ZINC000299781261	372757108	/nfs/dbraw/zinc/75/71/08/372757108.db2.gz	VQYGFYGWUKPUJV-AWEZNQCLSA-N	1	0	281.331	1.370	50	0		CDAARO
Cc1ccc2[nH]c(C[N@@H+]3CC[C@@H](O)C3)cc(=O)c2c1	ZINC000299796175	372769431	/nfs/dbraw/zinc/76/94/31/372769431.db2.gz	NHLPCCCQSFNVQF-GFCCVEGCSA-N	1	0	258.321	1.815	50	0		CDAARO
Cc1noc(C)c1CN(C)C(=O)[C@H]([NH3+])Cc1ccccc1	ZINC000037819151	373425664	/nfs/dbraw/zinc/42/56/64/373425664.db2.gz	JKQGHJRFGYOLLD-OAHLLOKOSA-N	1	0	287.363	1.820	50	0		CDAARO
OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCOC1	ZINC000253370148	373680216	/nfs/dbraw/zinc/68/02/16/373680216.db2.gz	MRGQRPMHIAQTRD-IRXDYDNUSA-N	1	0	290.407	1.522	50	0		CDAARO
Cc1cccc(OCCCN(C)C(=O)C[NH3+])c1C	ZINC000055253352	374379709	/nfs/dbraw/zinc/37/97/09/374379709.db2.gz	DTKKOALYACDKIO-UHFFFAOYSA-N	1	0	250.342	1.489	50	0		CDAARO
Nc1nccnc1C(=O)NCCC[NH+]1Cc2ccccc2C1	ZINC000095348747	374884352	/nfs/dbraw/zinc/88/43/52/374884352.db2.gz	YCRYWUFYZJTVDU-UHFFFAOYSA-N	1	0	297.362	1.195	50	0		CDAARO
CS(=O)(=O)NCC1CC[NH+](C2CCSCC2)CC1	ZINC000252571495	189981426	/nfs/dbraw/zinc/98/14/26/189981426.db2.gz	YBLIPJPKVPRPBX-UHFFFAOYSA-N	1	0	292.470	1.143	50	0		CDAARO
O=C([C@@H]1CCc2ccccc21)N1C[C@H]2C[NH2+]C[C@H]2C1	ZINC000097681843	284501421	/nfs/dbraw/zinc/50/14/21/284501421.db2.gz	JYONWFBSNUITFI-VNHYZAJKSA-N	1	0	256.349	1.394	50	0		CDAARO
CC[N@H+](CCNC(=O)N1CC[C@H]([C@@H](C)O)C1)C(C)C	ZINC000097107929	375149432	/nfs/dbraw/zinc/14/94/32/375149432.db2.gz	ZRGZCBUHMRVFJE-OLZOCXBDSA-N	1	0	271.405	1.129	50	0		CDAARO
CC(C)COC[C@H](O)C[NH2+]Cc1c[nH]nc1C(C)(C)C	ZINC000097160040	375151511	/nfs/dbraw/zinc/15/15/11/375151511.db2.gz	MGYPUCZFZFHJIH-CYBMUJFWSA-N	1	0	283.416	1.830	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2ccc(F)c(COC)c2)C1	ZINC000299738606	375198945	/nfs/dbraw/zinc/19/89/45/375198945.db2.gz	CTGSLUSGJROPKU-LLVKDONJSA-N	1	0	280.343	1.654	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2C[C@H]2c2cccc(F)c2)CC[NH2+]1	ZINC000299742098	375201128	/nfs/dbraw/zinc/20/11/28/375201128.db2.gz	GVJDAUJOQUUOPJ-SWHYSGLUSA-N	1	0	262.328	1.750	50	0		CDAARO
O=C(NCCc1csc2ccccc12)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000299750217	375207708	/nfs/dbraw/zinc/20/77/08/375207708.db2.gz	MXBMYVXKGHDIIU-AAEUAGOBSA-N	1	0	290.388	1.283	50	0		CDAARO
CC/C(C)=C/CC[N@@H+]1CCN(C(C)=O)C[C@@H](O)C1	ZINC000670440468	542011149	/nfs/dbraw/zinc/01/11/49/542011149.db2.gz	YQUBSGDAYUCTFH-CYIWUNGXSA-N	1	0	254.374	1.258	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CCC[C@H]([NH3+])C2)cc1F	ZINC000606441589	375823243	/nfs/dbraw/zinc/82/32/43/375823243.db2.gz	ZZJYIOJVRCDEPO-HWPRWLFBSA-N	1	0	278.327	1.797	50	0		CDAARO
CCn1nc(C[NH2+][C@@H]2CCNC(=O)CC2)c2ccccc21	ZINC000396749443	375829808	/nfs/dbraw/zinc/82/98/08/375829808.db2.gz	PCNFMZUADDYYFI-LBPRGKRZSA-N	1	0	286.379	1.815	50	0		CDAARO
C[N@@H+]1CC[C@H](CNC(=O)CCc2cccs2)C1	ZINC000066652270	376509395	/nfs/dbraw/zinc/50/93/95/376509395.db2.gz	XSHJYLFIEVKNJK-LLVKDONJSA-N	1	0	252.383	1.749	50	0		CDAARO
c1cc([C@@H]2[NH2+]CCc3nc[nH]c32)n(-c2cccnc2)c1	ZINC000067880415	377279330	/nfs/dbraw/zinc/27/93/30/377279330.db2.gz	ZWPSTEYHFQUESF-HNNXBMFYSA-N	1	0	265.320	1.831	50	0		CDAARO
C[N@@H+]1CCC[C@@H](NC(=O)NCCc2ccncc2)C1	ZINC000089375318	377848538	/nfs/dbraw/zinc/84/85/38/377848538.db2.gz	IILNQRVECTVGMC-CYBMUJFWSA-N	1	0	262.357	1.018	50	0		CDAARO
OC[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1	ZINC000245289580	378046215	/nfs/dbraw/zinc/04/62/15/378046215.db2.gz	CTUMWRFFXBTOBG-ULQDDVLXSA-N	1	0	274.408	1.979	50	0		CDAARO
CN(C)c1ncc(-c2cnn(C)c2)c([C@@H]2CC[NH2+]C2)n1	ZINC000242688159	256868044	/nfs/dbraw/zinc/86/80/44/256868044.db2.gz	VHNXABCBAGXMDM-SNVBAGLBSA-N	1	0	272.356	1.020	50	0		CDAARO
Cc1ccc(F)c(C(=O)N[C@@H]2CC[NH2+]C[C@H]2C)c1	ZINC000094345081	184785128	/nfs/dbraw/zinc/78/51/28/184785128.db2.gz	OMDOBBGSSMZZIT-ZWNOBZJWSA-N	1	0	250.317	1.862	50	0		CDAARO
COc1ccc2c(ccn(C[C@H]3CC[NH2+]C3)c2=O)c1OC	ZINC000095376595	184958308	/nfs/dbraw/zinc/95/83/08/184958308.db2.gz	BYMDBZALTOSWBE-NSHDSACASA-N	1	0	288.347	1.628	50	0		CDAARO
C[N@H+](Cc1ccccc1)C1CN(c2nccn3cnnc23)C1	ZINC000286221334	390193180	/nfs/dbraw/zinc/19/31/80/390193180.db2.gz	DATFPLAJKVXYMC-UHFFFAOYSA-N	1	0	294.362	1.445	50	0		CDAARO
CCO[C@H]1C[C@H]([NH2+]CC2(OC)CCOCC2)C1(C)C	ZINC000097034773	390827528	/nfs/dbraw/zinc/82/75/28/390827528.db2.gz	WCGAEYDDDLHWHX-STQMWFEESA-N	1	0	271.401	1.975	50	0		CDAARO
CC(C)c1cncnc1N1CC[C@@]2(O)CC[NH2+]C[C@H]2C1	ZINC000095387639	390910869	/nfs/dbraw/zinc/91/08/69/390910869.db2.gz	JWQZNAHTDGOBPU-WFASDCNBSA-N	1	0	276.384	1.151	50	0		CDAARO
C[NH2+]Cc1nc([C@H]2CCOC2)nn1-c1nc2ccccc2[nH]1	ZINC000097294942	390916795	/nfs/dbraw/zinc/91/67/95/390916795.db2.gz	LDMRVHQNPKRUPE-JTQLQIEISA-N	1	0	298.350	1.367	50	0		CDAARO
O=c1n2ccccc2nn1CC[N@@H+]1CCc2ccccc2C1	ZINC000026807558	391224343	/nfs/dbraw/zinc/22/43/43/391224343.db2.gz	JAUFCBLGLOFGFX-UHFFFAOYSA-N	1	0	294.358	1.554	50	0		CDAARO
Cc1ccc(OC[C@H](O)C[NH2+][C@H]2CCO[C@@H]2C)c(C)c1	ZINC000032523770	391461555	/nfs/dbraw/zinc/46/15/55/391461555.db2.gz	YEGOIUNTNBMTEZ-KFWWJZLASA-N	1	0	279.380	1.810	50	0		CDAARO
O=C(C[N@@H+]1CC[C@H]2CCCC[C@H]2C1)NC(=O)NC1CC1	ZINC000242191449	391681547	/nfs/dbraw/zinc/68/15/47/391681547.db2.gz	XFOVAHPTPXAMRY-NEPJUHHUSA-N	1	0	279.384	1.487	50	0		CDAARO
O=C(c1ccccc1)N1CC[NH+](CC[C@H]2CCOC2)CC1	ZINC000437575327	392462125	/nfs/dbraw/zinc/46/21/25/392462125.db2.gz	FJWICTQQJZKZTN-HNNXBMFYSA-N	1	0	288.391	1.871	50	0		CDAARO
O=C(c1ccccc1)N1CC[NH+](CC[C@@H]2CCOC2)CC1	ZINC000437575333	392462572	/nfs/dbraw/zinc/46/25/72/392462572.db2.gz	FJWICTQQJZKZTN-OAHLLOKOSA-N	1	0	288.391	1.871	50	0		CDAARO
CN(C[C@@H]1CCC[N@@H+]([C@@H]2C=CCCC2)C1)S(C)(=O)=O	ZINC000253417344	392718347	/nfs/dbraw/zinc/71/83/47/392718347.db2.gz	XDRNTGIBIUYOCI-UONOGXRCSA-N	1	0	286.441	1.699	50	0		CDAARO
Cc1c(CC(=O)N2CCC[C@H]2C[NH3+])nnn1-c1ccccc1	ZINC000269186862	132127259	/nfs/dbraw/zinc/12/72/59/132127259.db2.gz	BLISWKKCBXIBGW-AWEZNQCLSA-N	1	0	299.378	1.068	50	0		CDAARO
CCOC(=O)CCNC(=O)[C@@H]1CCCC[N@@H+]1C(C)C	ZINC000096421688	393184701	/nfs/dbraw/zinc/18/47/01/393184701.db2.gz	BVYIPSIEESWEFK-LBPRGKRZSA-N	1	0	270.373	1.319	50	0		CDAARO
COC[C@H](O)C[N@H+](C)[C@@H]1CCCN(c2ccccc2)C1	ZINC000083858972	135031408	/nfs/dbraw/zinc/03/14/08/135031408.db2.gz	KQMMHDJSKBQZED-HZPDHXFCSA-N	1	0	278.396	1.595	50	0		CDAARO
[NH3+]C1(c2noc(Cn3ncc4ccccc4c3=O)n2)CCC1	ZINC000261742944	140383803	/nfs/dbraw/zinc/38/38/03/140383803.db2.gz	LFPKAFNSAJUMCS-UHFFFAOYSA-N	1	0	297.318	1.166	50	0		CDAARO
Cc1n[nH]cc1CCCNC(=O)[C@H]1CCC[NH2+][C@H]1C	ZINC000384239295	397926561	/nfs/dbraw/zinc/92/65/61/397926561.db2.gz	IODIJLYYWVUYRL-AAEUAGOBSA-N	1	0	264.373	1.155	50	0		CDAARO
COc1cccc(CN2CC[NH2+][C@H](C)[C@@H]2C)c1OC	ZINC000097162669	397981390	/nfs/dbraw/zinc/98/13/90/397981390.db2.gz	CMDFEYASUYJHCK-NEPJUHHUSA-N	1	0	264.369	1.886	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)N1CCOCC1)C(C)(C)c1ccccc1	ZINC000097033217	287015281	/nfs/dbraw/zinc/01/52/81/287015281.db2.gz	XQKGVQHZWCLWCJ-CQSZACIVSA-N	1	0	290.407	1.801	50	0		CDAARO
COc1ccc2c3c1O[C@H]1[C@@H](O)C=C[C@@H]4[C@@H](C2)[N@@H+](C)CC[C@]314	ZINC000005599925	170118325	/nfs/dbraw/zinc/11/83/25/170118325.db2.gz	OROGSEYTTFOCAN-DTKOIPMJSA-N	1	0	299.370	1.501	50	0	in-vitro	CDAARO
CCOc1cc(C[NH2+]C)cc(Cl)c1OCC(N)=O	ZINC000005906112	170153197	/nfs/dbraw/zinc/15/31/97/170153197.db2.gz	YGFNROWDAODWRG-UHFFFAOYSA-N	1	0	272.732	1.322	50	0		CDAARO
Cn1c2ccc(C[NH2+]C[C@H]3CCCO3)cc2n(C)c1=O	ZINC000006678555	170225840	/nfs/dbraw/zinc/22/58/40/170225840.db2.gz	JKZACAYIDAUPLN-GFCCVEGCSA-N	1	0	275.352	1.146	50	0		CDAARO
CC[NH+](CC)CCN1C(=O)C(=O)c2c1c(OC)ccc2C	ZINC000006759567	170241355	/nfs/dbraw/zinc/24/13/55/170241355.db2.gz	DJKFYCIOYTZFOS-UHFFFAOYSA-N	1	0	290.363	1.875	50	0		CDAARO
CCNC(=O)NC(=O)C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1	ZINC000008266626	170327508	/nfs/dbraw/zinc/32/75/08/170327508.db2.gz	ZVNGGNLCNZEFBK-VXGBXAGGSA-N	1	0	267.373	1.344	50	0		CDAARO
CC(C)N1C(=O)N(C)C2(CC[NH+](C(C)C)CC2)C1=O	ZINC000014538198	170636447	/nfs/dbraw/zinc/63/64/47/170636447.db2.gz	NNGCNDKZUAQWDC-UHFFFAOYSA-N	1	0	267.373	1.532	50	0		CDAARO
[NH3+]CCc1ccc(NS(=O)(=O)c2ccccc2)cc1	ZINC000020224442	171087539	/nfs/dbraw/zinc/08/75/39/171087539.db2.gz	PRODIAPRPOSQSM-UHFFFAOYSA-N	1	0	276.361	1.989	50	0	in-vivo	CDAARO
[NH3+][C@@H]1CCCN(S(=O)(=O)c2ccccc2Cl)C1	ZINC000020473807	171218080	/nfs/dbraw/zinc/21/80/80/171218080.db2.gz	BJZWQBLHZGUIES-SECBINFHSA-N	1	0	274.773	1.452	50	0		CDAARO
COC(=O)c1ccc(CNC(=O)[C@H]2CCCC[N@@H+]2C)cc1	ZINC000020783914	171272888	/nfs/dbraw/zinc/27/28/88/171272888.db2.gz	LPDJVNFTBGTQCQ-CQSZACIVSA-N	1	0	290.363	1.574	50	0		CDAARO
C[NH+]1CCN(CCNC(=O)c2cccc(Cl)c2)CC1	ZINC000020818976	171273303	/nfs/dbraw/zinc/27/33/03/171273303.db2.gz	LRTRTLHBJWJKDV-UHFFFAOYSA-N	1	0	281.787	1.317	50	0		CDAARO
O=C(CC[NH+]1CCC(O)CC1)Nc1ccc(F)c(F)c1	ZINC000022199066	171372126	/nfs/dbraw/zinc/37/21/26/171372126.db2.gz	SCTIDKKXFBDKNH-UHFFFAOYSA-N	1	0	284.306	1.750	50	0		CDAARO
CC[NH+]1CCN(Cc2ccc(OC)c(O)c2)CC1	ZINC000022591243	171393450	/nfs/dbraw/zinc/39/34/50/171393450.db2.gz	SNCXFRIKXHTGBL-UHFFFAOYSA-N	1	0	250.342	1.538	50	0		CDAARO
CCCC(=O)NC[C@@H](c1ccsc1)N1CC[NH+](C)CC1	ZINC000022794476	171399399	/nfs/dbraw/zinc/39/93/99/171399399.db2.gz	MNEHBGXKHTZDLQ-AWEZNQCLSA-N	1	0	295.452	1.953	50	0		CDAARO
CCOc1ccccc1C(=O)N(CC)[C@@H]1CC[NH2+]C1	ZINC000037539933	173261629	/nfs/dbraw/zinc/26/16/29/173261629.db2.gz	STWIAEOHFDUIDC-GFCCVEGCSA-N	1	0	262.353	1.909	50	0		CDAARO
CCNc1nc(C)c(C(=O)N[C@@H]2CC[C@@H]([NH3+])C2)s1	ZINC000067833894	175795310	/nfs/dbraw/zinc/79/53/10/175795310.db2.gz	SPAVYJXUXIIIJO-RKDXNWHRSA-N	1	0	268.386	1.493	50	0		CDAARO
CN(C)c1ccc(CCNC(=O)[C@H]2CCC[NH2+]2)cc1	ZINC000070815445	176006825	/nfs/dbraw/zinc/00/68/25/176006825.db2.gz	HITAXSKGXCISRU-CQSZACIVSA-N	1	0	261.369	1.163	50	0		CDAARO
CO[C@H]1CN(C(=O)c2ccc(-c3ccccc3)[nH]2)CC[C@H]1[NH3+]	ZINC000071745480	176257936	/nfs/dbraw/zinc/25/79/36/176257936.db2.gz	KCKLLJKUORWCMI-CJNGLKHVSA-N	1	0	299.374	1.870	50	0		CDAARO
CO[C@H]1CN(C(=O)CCCCc2ccccc2)CC[C@H]1[NH3+]	ZINC000071759129	176260865	/nfs/dbraw/zinc/26/08/65/176260865.db2.gz	UKRDJYLUVDZKFU-CVEARBPZSA-N	1	0	290.407	1.974	50	0		CDAARO
CCCc1nc2c(cnn2C)c(N(C)CC[NH+](C)C)n1	ZINC000072146012	176325206	/nfs/dbraw/zinc/32/52/06/176325206.db2.gz	KBOUMOYGECAMLP-UHFFFAOYSA-N	1	0	276.388	1.314	50	0		CDAARO
CCCc1nc(C(=O)N2CC[C@](O)(C[NH+](C)C)C2)cs1	ZINC000072150287	176326976	/nfs/dbraw/zinc/32/69/76/176326976.db2.gz	OVZDPQFAUMJMRD-AWEZNQCLSA-N	1	0	297.424	1.234	50	0		CDAARO
c1ccc(-c2nc3c(c(N4CCCC4)n2)CC[NH2+]CC3)nc1	ZINC000072453780	176405056	/nfs/dbraw/zinc/40/50/56/176405056.db2.gz	YTKCZGIVZPVRLD-UHFFFAOYSA-N	1	0	295.390	1.827	50	0		CDAARO
Cc1ccccc1[C@@H](CN1CCOCC1)[NH2+][C@@H](C)CO	ZINC000183686994	292642147	/nfs/dbraw/zinc/64/21/47/292642147.db2.gz	XIRSHNFBPJCKQA-GOEBONIOSA-N	1	0	278.396	1.339	50	0		CDAARO
CC[N@@H+]1C[C@H](C)[C@H](NS(=O)(=O)/C=C\c2ccccc2)C1	ZINC000104200996	424555703	/nfs/dbraw/zinc/55/57/03/424555703.db2.gz	LMYWPOXQFKEENR-YEWGUGPNSA-N	1	0	294.420	1.917	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C[NH3+])C1	ZINC000091692696	275822758	/nfs/dbraw/zinc/82/27/58/275822758.db2.gz	BGZSTQMQTTUBPO-MRVPVSSYSA-N	1	0	250.289	1.837	50	0		CDAARO
CNC(=O)c1nn(C)c2c1C[C@@H]([NH+]1CCC(C)CC1)CC2	ZINC000014752641	277262255	/nfs/dbraw/zinc/26/22/55/277262255.db2.gz	ZNAYTMJHDWUHMJ-LBPRGKRZSA-N	1	0	290.411	1.369	50	0		CDAARO
CS(=O)(=O)N1C[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C1	ZINC000280630525	278112218	/nfs/dbraw/zinc/11/22/18/278112218.db2.gz	ZVSCAUDOIDGARS-OKILXGFUSA-N	1	0	280.393	1.010	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@H]1NC(=O)c1cccc(F)c1F	ZINC000094345238	278453866	/nfs/dbraw/zinc/45/38/66/278453866.db2.gz	RVIOFXNDFATHHU-GZMMTYOYSA-N	1	0	254.280	1.693	50	0		CDAARO
CC[NH+](CC)CCCN1CCOC2(CCOCC2)C1	ZINC000191554572	279094882	/nfs/dbraw/zinc/09/48/82/279094882.db2.gz	LERAWVWTUOZLNA-UHFFFAOYSA-N	1	0	270.417	1.600	50	0		CDAARO
CCN1C(=O)C[C@@H]([NH2+]C23CC4CC(CC(C4)C2)C3)C1=O	ZINC000004838149	279249069	/nfs/dbraw/zinc/24/90/69/279249069.db2.gz	JHZSBJBTIMMTEK-RRHJKOLHSA-N	1	0	276.380	1.692	50	0		CDAARO
CCS(=O)(=O)N1CCC([NH+]2C[C@@H](C)C[C@H](C)C2)CC1	ZINC000004745385	280010546	/nfs/dbraw/zinc/01/05/46/280010546.db2.gz	BAXBNFXLWWMJOV-STQMWFEESA-N	1	0	288.457	1.778	50	0		CDAARO
O=C([C@H]1CCCC[N@@H+]1C[C@H]1CCCCO1)N1CCOCC1	ZINC000245404685	280129931	/nfs/dbraw/zinc/12/99/31/280129931.db2.gz	QDNQTCYQJLORKQ-HUUCEWRRSA-N	1	0	296.411	1.269	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCN(C(=O)/C=C\c2cccnc2)C1	ZINC000255619933	289379829	/nfs/dbraw/zinc/37/98/29/289379829.db2.gz	ODENXLTXQIWLDF-DIQTYVNISA-N	1	0	259.353	1.681	50	0		CDAARO
[NH3+][C@H](CNC(=O)c1ccc(-c2cnco2)cc1)C1CC1	ZINC000261957889	289394886	/nfs/dbraw/zinc/39/48/86/289394886.db2.gz	RCXJQKXXGUVUCT-CYBMUJFWSA-N	1	0	271.320	1.809	50	0		CDAARO
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000246572159	297826411	/nfs/dbraw/zinc/82/64/11/297826411.db2.gz	BTSHEEACKOTCNJ-SUNKGSAMSA-N	1	0	260.337	1.371	50	0		CDAARO
COc1ccc(C)cc1NC(=O)N[C@H]1C[NH2+]C[C@@H]1OC	ZINC000534585460	328315078	/nfs/dbraw/zinc/31/50/78/328315078.db2.gz	UOGOERBIUWVIAX-AAEUAGOBSA-N	1	0	279.340	1.112	50	0		CDAARO
C[NH+](C)CC(C)(C)NC(=O)c1ccc(F)c(O)c1	ZINC000534634007	328332895	/nfs/dbraw/zinc/33/28/95/328332895.db2.gz	FZEPIICXNVJJOP-UHFFFAOYSA-N	1	0	254.305	1.601	50	0		CDAARO
CC(C)Cc1nc(CN2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)no1	ZINC000534670162	328346947	/nfs/dbraw/zinc/34/69/47/328346947.db2.gz	VCBBHVOFIKCORS-MPZDIEGVSA-N	1	0	276.384	1.450	50	0		CDAARO
O=C([C@@H]1C=CC[NH2+]1)N1CCC(OCc2ccccn2)CC1	ZINC000534663298	328350794	/nfs/dbraw/zinc/35/07/94/328350794.db2.gz	APDIHBRMAMTXAU-HNNXBMFYSA-N	1	0	287.363	1.117	50	0		CDAARO
Cc1ccccc1[C@H](CNC(=O)Cn1cccn1)[NH+](C)C	ZINC000534663982	328351519	/nfs/dbraw/zinc/35/15/19/328351519.db2.gz	KYRLURUGLCAMKH-HNNXBMFYSA-N	1	0	286.379	1.611	50	0		CDAARO
CN(C)[C@H](C[NH2+][C@H]1CC(C)(C)OC1(C)C)c1cnn(C)c1	ZINC000096477915	329526776	/nfs/dbraw/zinc/52/67/76/329526776.db2.gz	VCBNADBPQYUKLA-KGLIPLIRSA-N	1	0	294.443	1.959	50	0		CDAARO
Cc1ccccc1OCCN(C)C(=O)[C@@H]1CCC[C@@H]1[NH3+]	ZINC000085367445	482577927	/nfs/dbraw/zinc/57/79/27/482577927.db2.gz	OVZWLLRPFSXDRH-KGLIPLIRSA-N	1	0	276.380	1.960	50	0		CDAARO
COc1cccc(C[NH2+][C@]2(CO)CCOC2)c1F	ZINC000192709059	482834763	/nfs/dbraw/zinc/83/47/63/482834763.db2.gz	JPYAPLYDPIORPN-ZDUSSCGKSA-N	1	0	255.289	1.075	50	0		CDAARO
CCOc1ccnc(NCCC[N@@H+]2CCCC[C@@H]2CO)n1	ZINC000670434315	482969340	/nfs/dbraw/zinc/96/93/40/482969340.db2.gz	FXCNPDJLRSPRQE-CYBMUJFWSA-N	1	0	294.399	1.524	50	0		CDAARO
CCCc1cc(CNC(=O)[C@@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2[NH3+])on1	ZINC000670437431	482977472	/nfs/dbraw/zinc/97/74/72/482977472.db2.gz	STMAEOFFHUOCSW-QOBDMFJFSA-N	1	0	275.352	1.393	50	0		CDAARO
CC[N@@H+]1CC[C@H](CN(C)c2ncc(Cl)cn2)C1	ZINC000670444329	482993425	/nfs/dbraw/zinc/99/34/25/482993425.db2.gz	MMAKTXRWQCIKEB-SNVBAGLBSA-N	1	0	254.765	1.908	50	0		CDAARO
CCCS(=O)(=O)N1CCN(c2cc[nH+]cc2C)CC1	ZINC000670446955	483000265	/nfs/dbraw/zinc/00/02/65/483000265.db2.gz	RSRFIZLLHBLNRL-UHFFFAOYSA-N	1	0	283.397	1.252	50	0		CDAARO
C[N@H+](Cc1ccccc1OCCO)CC1(C)COC1	ZINC000670448900	483004217	/nfs/dbraw/zinc/00/42/17/483004217.db2.gz	MJNFXMURUJINRO-UHFFFAOYSA-N	1	0	265.353	1.526	50	0		CDAARO
C1CC1[C@H]1C[N@@H+](C2CSCCSC2)CCO1	ZINC000670451122	483017267	/nfs/dbraw/zinc/01/72/67/483017267.db2.gz	XWRHATNGOZRBOJ-GFCCVEGCSA-N	1	0	259.440	1.946	50	0		CDAARO
CCC[N@@H+]1CC[C@H](NC(=O)N(CC)CCn2cccn2)C1	ZINC000670471421	483074379	/nfs/dbraw/zinc/07/43/79/483074379.db2.gz	RULJBCOFEHEAOH-AWEZNQCLSA-N	1	0	293.415	1.399	50	0		CDAARO
COc1ccccc1C[C@H](C)[NH2+]C[C@@H](C)N1CCOCC1	ZINC000097016485	534117700	/nfs/dbraw/zinc/11/77/00/534117700.db2.gz	GYVMXFPDPHNRQI-LSDHHAIUSA-N	1	0	292.423	1.937	50	0		CDAARO
CC(=O)Nc1cccc(C[N@@H+](C)CC[C@H](C)O)c1	ZINC000096441472	527052221	/nfs/dbraw/zinc/05/22/21/527052221.db2.gz	ABFLDIXQWTZRGT-NSHDSACASA-N	1	0	250.342	1.848	50	0		CDAARO
CC(C)c1nccn1C[C@@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000096484730	528373110	/nfs/dbraw/zinc/37/31/10/528373110.db2.gz	OQPUCFZDIPNVQJ-MJBXVCDLSA-N	1	0	281.400	1.477	50	0		CDAARO
CCNC(=O)C[N@H+](C)CC1([C@@H]2CCCCO2)CCC1	ZINC000952994899	615465850	/nfs/dbraw/zinc/46/58/50/615465850.db2.gz	WGHLIBIWBXPAGJ-ZDUSSCGKSA-N	1	0	268.401	1.794	50	0		CDAARO
CC[C@H](CNC(=O)/C=C/c1cc(CO)cs1)[NH+](C)C	ZINC000952976397	615722472	/nfs/dbraw/zinc/72/24/72/615722472.db2.gz	WGYHVEKIVDHXFS-BTDICHCPSA-N	1	0	282.409	1.710	50	0		CDAARO
CC[NH+]1CCN(CCCNc2nc(C)ncc2Cl)CC1	ZINC001704325322	1177688084	/nfs/dbraw/zinc/68/80/84/1177688084.db2.gz	LTXGLVMJYHBYSA-UHFFFAOYSA-N	1	0	297.834	1.878	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CCNc1nccnc1N(C)C	ZINC000302187957	1186478067	/nfs/dbraw/zinc/47/80/67/1186478067.db2.gz	JIGFHHUJDMTWKR-LBPRGKRZSA-N	1	0	263.389	1.829	50	0		CDAARO
C[N@@H+](C/C=C/c1ccccc1)CCCNS(C)(=O)=O	ZINC000095434300	735434827	/nfs/dbraw/zinc/43/48/27/735434827.db2.gz	WHZXAYACRIAIAF-UXBLZVDNSA-N	1	0	282.409	1.571	50	0		CDAARO
COC(=O)c1cc(Br)c2c(c1)C[NH2+]CCO2	ZINC000950756054	735803045	/nfs/dbraw/zinc/80/30/45/735803045.db2.gz	GSFCMWQNWDFOOO-UHFFFAOYSA-N	1	0	286.125	1.718	50	0		CDAARO
CCc1ccccc1OCC[NH2+]C[C@@H]1CCS(=O)(=O)C1	ZINC000065405625	735847324	/nfs/dbraw/zinc/84/73/24/735847324.db2.gz	OXRJNKNLVGBCJZ-ZDUSSCGKSA-N	1	0	297.420	1.652	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)c1ccc(Cl)s1	ZINC000051172540	736053411	/nfs/dbraw/zinc/05/34/11/736053411.db2.gz	FGKZKIVTRNULQO-BQBZGAKWSA-N	1	0	260.746	1.118	50	0		CDAARO
Cc1ccccc1CCCN1CCNC(=O)CC12C[NH2+]C2	ZINC000864097171	733791539	/nfs/dbraw/zinc/79/15/39/733791539.db2.gz	PFEWVHVRNJZEMN-UHFFFAOYSA-N	1	0	287.407	1.092	50	0		CDAARO
Cc1ccc(C(=O)NC(C)C)cc1NC(=O)[C@@H]1CCC[NH2+]1	ZINC000952976018	733875505	/nfs/dbraw/zinc/87/55/05/733875505.db2.gz	UFHWEIANBTWYOB-ZDUSSCGKSA-N	1	0	289.379	1.824	50	0		CDAARO
Cc1nc(CCCNC(=O)[C@H](C)[NH+](C)C)sc1C	ZINC000426389273	734305115	/nfs/dbraw/zinc/30/51/15/734305115.db2.gz	PPCSDHFRJRDWJM-JTQLQIEISA-N	1	0	269.414	1.759	50	0		CDAARO
COC[C@H](NC(=O)C(C)(C)[NH+]1CCCC1)c1ccnn1C	ZINC000426465369	734306688	/nfs/dbraw/zinc/30/66/88/734306688.db2.gz	ZKFZEUHYZMHRBO-LBPRGKRZSA-N	1	0	294.399	1.098	50	0		CDAARO
C[N@H+](CCCc1cccnc1)C[C@@H]1COCCO1	ZINC000243957110	734990331	/nfs/dbraw/zinc/99/03/31/734990331.db2.gz	CFXCLHNXSCGLMO-CQSZACIVSA-N	1	0	250.342	1.361	50	0		CDAARO
CNc1ncccc1CN1CCC[C@@]2(CC[NH2+]C2)C1	ZINC000426622945	735167020	/nfs/dbraw/zinc/16/70/20/735167020.db2.gz	MOKQUWPAWWWQOB-HNNXBMFYSA-N	1	0	260.385	1.699	50	0		CDAARO
CCC1=NO[C@@H](C[N@H+](C)CCn2ccnc2C)C1	ZINC000252481436	735248071	/nfs/dbraw/zinc/24/80/71/735248071.db2.gz	CMFCFUOFMSHOME-CYBMUJFWSA-N	1	0	250.346	1.678	50	0		CDAARO
CCCCS(=O)(=O)N1CCc2[nH+]ccc(N)c2C1	ZINC000585138083	902294957	/nfs/dbraw/zinc/29/49/57/902294957.db2.gz	MWXBYOZCVOEITQ-UHFFFAOYSA-N	1	0	269.370	1.152	50	0		CDAARO
CCC1=NO[C@H](C(=O)N(CC)CC[NH+]2CCCC2)C1	ZINC000952862294	910416761	/nfs/dbraw/zinc/41/67/61/910416761.db2.gz	OHWFRHXKOZTPTC-ZDUSSCGKSA-N	1	0	267.373	1.486	50	0		CDAARO
O[C@H]1CCC[N@H+](CCCNCc2cnccc2Cl)C1	ZINC000952872595	910429702	/nfs/dbraw/zinc/42/97/02/910429702.db2.gz	PNXPQYYXTUJVNM-ZDUSSCGKSA-N	1	0	283.803	1.671	50	0		CDAARO
[NH3+][C@H]1CCc2ccccc2N(Cc2nncs2)C1	ZINC000952876649	910434504	/nfs/dbraw/zinc/43/45/04/910434504.db2.gz	DCSKWEMMDPXEHG-NSHDSACASA-N	1	0	260.366	1.818	50	0		CDAARO
Cc1csc(CN2C[C@@H](C)O[C@]3(CC[NH2+]C3)C2)n1	ZINC000952881819	910448595	/nfs/dbraw/zinc/44/85/95/910448595.db2.gz	MZRYPVMOLHSCBM-YPMHNXCESA-N	1	0	267.398	1.404	50	0		CDAARO
Cc1nc(CC[NH3+])cc(N2CC[C@](O)(c3ccccc3)C2)n1	ZINC000067785088	936620496	/nfs/dbraw/zinc/62/04/96/936620496.db2.gz	IOYQAKSFNVYHJE-QGZVFWFLSA-N	1	0	298.390	1.384	50	0		CDAARO
Cc1nncn1CCN1CCO[C@H](CC(C)C)C1	ZINC000821035083	925560606	/nfs/dbraw/zinc/56/06/06/925560606.db2.gz	HXMSPBZQTPVFFT-CYBMUJFWSA-N	1	0	252.362	1.333	50	0		CDAARO
CCc1nc(CN2CCC[C@H](C)C2)n(CC(C)(C)O)n1	ZINC000823560470	925709472	/nfs/dbraw/zinc/70/94/72/925709472.db2.gz	FPAGEBJAOZUVNA-LBPRGKRZSA-N	1	0	280.416	1.843	50	0		CDAARO
CN(C[C@@H]1CCCC[N@@H+]1C)S(=O)(=O)CC1CCCC1	ZINC000823777921	925726207	/nfs/dbraw/zinc/72/62/07/925726207.db2.gz	SQCQTTSXJQKXLR-AWEZNQCLSA-N	1	0	288.457	1.923	50	0		CDAARO
C[C@H](C[NH+]1CCCC1)C(=O)N(C)CCn1ccnc1	ZINC000827627206	925951705	/nfs/dbraw/zinc/95/17/05/925951705.db2.gz	QOQWQWVMIPUCMR-CYBMUJFWSA-N	1	0	264.373	1.073	50	0		CDAARO
Cc1c(O)cccc1C(=O)NCC[N@@H+]1CCC[C@H](CO)C1	ZINC000828711237	926169351	/nfs/dbraw/zinc/16/93/51/926169351.db2.gz	TWJNZXIYDFSVKS-ZDUSSCGKSA-N	1	0	292.379	1.135	50	0		CDAARO
C/C(=C\C(=O)N1CC[C@@H]([NH3+])C1)c1ccc(F)cc1F	ZINC000585086615	930888450	/nfs/dbraw/zinc/88/84/50/930888450.db2.gz	DASIZENFAPFZDO-OALRPVAKSA-N	1	0	266.291	1.928	50	0		CDAARO
CC[N@@H+]1CCC[C@@]2(CCC[NH+](CCC(=O)[O-])C2)C1	ZINC001529151345	968994964	/nfs/dbraw/zinc/99/49/64/968994964.db2.gz	BODNHLYSZBXAHW-CQSZACIVSA-N	1	0	254.374	1.659	50	0		CDAARO
CCOCCC(=O)Nc1nnc(CC[NH+](C)C)s1	ZINC001506396115	975147572	/nfs/dbraw/zinc/14/75/72/975147572.db2.gz	OAQRFWUZMVOGHE-UHFFFAOYSA-N	1	0	272.374	1.007	50	0		CDAARO
CC(=O)NC(C)(C)C[C@H](C)[NH2+]CCc1ncc[nH]1	ZINC001506400955	975150374	/nfs/dbraw/zinc/15/03/74/975150374.db2.gz	AZQGSFUNUFFBQJ-JTQLQIEISA-N	1	0	252.362	1.235	50	0		CDAARO
CC(C)C[C@@H](O)C(=O)N(C)CC[N@H+](C)C1CCCC1	ZINC001506411073	975154657	/nfs/dbraw/zinc/15/46/57/975154657.db2.gz	ZFICZDLBOUFZDT-CQSZACIVSA-N	1	0	270.417	1.726	50	0		CDAARO
COCCOC1CC[NH+](CCn2nccc2C)CC1	ZINC001506415789	975155518	/nfs/dbraw/zinc/15/55/18/975155518.db2.gz	CQNISZAOAONKDY-UHFFFAOYSA-N	1	0	267.373	1.319	50	0		CDAARO
Cc1cc(C(=O)Nc2ccnn2C2CC[NH+](C)CC2)no1	ZINC001506419225	975157316	/nfs/dbraw/zinc/15/73/16/975157316.db2.gz	XKWKDHNXULURBY-UHFFFAOYSA-N	1	0	289.339	1.699	50	0		CDAARO
Cc1cnc(C[N@H+](C)C[C@@H](O)c2ccccc2)cn1	ZINC001506418833	975157523	/nfs/dbraw/zinc/15/75/23/975157523.db2.gz	VTVYMXZFIZVKGH-OAHLLOKOSA-N	1	0	257.337	1.950	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)Cc1cnc(N(C)C)nc1	ZINC001506421270	975158457	/nfs/dbraw/zinc/15/84/57/975158457.db2.gz	IFQOSEPMERRXFD-UHFFFAOYSA-N	1	0	291.443	1.849	50	0		CDAARO
COCCCOc1cc(C)ccc1CNC1=[NH+]CCN1	ZINC000087000982	342451455	/nfs/dbraw/zinc/45/14/55/342451455.db2.gz	NEIGDYFFRLSWCX-UHFFFAOYSA-N	1	0	277.368	1.459	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CNC(=O)c2cc(F)ccc2O)C1	ZINC000096468335	230378892	/nfs/dbraw/zinc/37/88/92/230378892.db2.gz	WEHMPTJBMMZKKW-LLVKDONJSA-N	1	0	296.342	1.229	50	0		CDAARO
Cc1nc(C(F)(F)F)ncc1CN1CCC[C@H]([NH3+])C1	ZINC000426478810	230419620	/nfs/dbraw/zinc/41/96/20/230419620.db2.gz	NVUWVGSFYWLQOL-JTQLQIEISA-N	1	0	274.290	1.727	50	0		CDAARO
NC(=O)[C@H](C[NH2+][C@@H]1CCSC1)Cc1ccc(F)cc1	ZINC000097375217	342002811	/nfs/dbraw/zinc/00/28/11/342002811.db2.gz	MBIVMDAVBWVICO-WCQYABFASA-N	1	0	282.384	1.565	50	0		CDAARO
CC(C)[C@H]1C[N@H+](C)CCN1Cc1cnc2ncccn12	ZINC000097376901	342003094	/nfs/dbraw/zinc/00/30/94/342003094.db2.gz	FEPVCUHERZUJSU-CQSZACIVSA-N	1	0	273.384	1.501	50	0		CDAARO
COc1ccc(C)nc1NC(=O)NCC[NH+](C)C	ZINC000095943350	185037547	/nfs/dbraw/zinc/03/75/47/185037547.db2.gz	MIOXPRXUIUJQRD-UHFFFAOYSA-N	1	0	252.318	1.082	50	0		CDAARO
C[C@H](Cn1ncc2ccccc2c1=O)[NH2+][C@H]1CCOC1	ZINC000095983745	185054322	/nfs/dbraw/zinc/05/43/22/185054322.db2.gz	CDLTVFMCRBLJSI-YPMHNXCESA-N	1	0	273.336	1.164	50	0		CDAARO
COc1ccc([C@@H](C)[C@@H](C)[NH2+]CC(=O)N(C)C)cc1	ZINC000095992477	185058912	/nfs/dbraw/zinc/05/89/12/185058912.db2.gz	RBAYOGULEQENAE-NWDGAFQWSA-N	1	0	264.369	1.865	50	0		CDAARO
C[C@@H]([NH3+])C(=O)Nc1nc(-c2ccc(O)cc2)cs1	ZINC000095996151	185059964	/nfs/dbraw/zinc/05/99/64/185059964.db2.gz	CSHLYZGNXHLHSC-SSDOTTSWSA-N	1	0	263.322	1.801	50	0		CDAARO
COC(=O)CNC(=O)[C@H](C)[N@@H+]1CC[C@H](C)C[C@H](C)C1	ZINC000241684887	361753725	/nfs/dbraw/zinc/75/37/25/361753725.db2.gz	QGCGQDCTDKFIJT-SRVKXCTJSA-N	1	0	270.373	1.032	50	0		CDAARO
Cn1cc([C@@H]2CC[N@@H+]([C@H]3Cc4ccccc4[C@H]3O)C2)cn1	ZINC000242242310	361754830	/nfs/dbraw/zinc/75/48/30/361754830.db2.gz	XTSVZHDLTIFBIO-XOKHGSTOSA-N	1	0	283.375	1.868	50	0		CDAARO
COc1cc(CCNC(=O)[C@@H]2CCC[NH2+]2)ccc1F	ZINC000195555075	342626156	/nfs/dbraw/zinc/62/61/56/342626156.db2.gz	OTECRNNYXMDYHA-LBPRGKRZSA-N	1	0	266.316	1.245	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N1CCc2cc(C)ccc21	ZINC000195555058	342626190	/nfs/dbraw/zinc/62/61/90/342626190.db2.gz	UASFDVSXZWLNMS-LBPRGKRZSA-N	1	0	264.394	1.965	50	0		CDAARO
C[NH+]1CCC(C)(c2nc([C@@H]3CCOC3)no2)CC1	ZINC000096142192	185106725	/nfs/dbraw/zinc/10/67/25/185106725.db2.gz	CMJKQLLVAXQBSZ-SNVBAGLBSA-N	1	0	251.330	1.557	50	0		CDAARO
CCC(=O)N[C@@H]1CCC[N@H+](Cc2ccc(O)cc2)C1	ZINC000195575809	342628780	/nfs/dbraw/zinc/62/87/80/342628780.db2.gz	DXAVHNNXQXGZEH-CYBMUJFWSA-N	1	0	262.353	1.883	50	0		CDAARO
COCC[N@@H+]1CC[C@H](C(=O)N2CC(c3nccs3)C2)C1	ZINC000243902101	361830885	/nfs/dbraw/zinc/83/08/85/361830885.db2.gz	BFZZHWTYUZAZBN-NSHDSACASA-N	1	0	295.408	1.037	50	0		CDAARO
O[C@H]1CCCOC12CC[NH+](Cc1cncn1C1CC1)CC2	ZINC000244659754	361854939	/nfs/dbraw/zinc/85/49/39/361854939.db2.gz	HICLBSOGCZZZSO-HNNXBMFYSA-N	1	0	291.395	1.724	50	0		CDAARO
Cc1nc(CNC(=O)[C@H](C)[NH+]2CCCCCC2)cc(=O)[nH]1	ZINC000244758175	361861616	/nfs/dbraw/zinc/86/16/16/361861616.db2.gz	OTNKUWFUSACFOK-NSHDSACASA-N	1	0	292.383	1.371	50	0		CDAARO
Cc1nccn1CCCN1C[C@H](O)[C@@H]([NH+]2CCCCC2)C1	ZINC000244748676	361862054	/nfs/dbraw/zinc/86/20/54/361862054.db2.gz	OMFKUXYKUZTJEG-HOTGVXAUSA-N	1	0	292.427	1.113	50	0		CDAARO
CC(C)NC(=O)CC[N@@H+]1CC[C@@H](CNc2ccccn2)C1	ZINC000065541067	361913365	/nfs/dbraw/zinc/91/33/65/361913365.db2.gz	JBINIKVQVRJMCU-AWEZNQCLSA-N	1	0	290.411	1.730	50	0		CDAARO
O=C(NCCSCC1CC1)[C@H]1Cc2ccccc2C[NH2+]1	ZINC000097228763	342204888	/nfs/dbraw/zinc/20/48/88/342204888.db2.gz	QCCWSCVCOIQACM-OAHLLOKOSA-N	1	0	290.432	1.960	50	0		CDAARO
O[C@@H]1[C@H]2C[C@H]3C[N@H+](Cc4nc5cccnc5s4)[C@H]1[C@H]3C2	ZINC000440943595	361953005	/nfs/dbraw/zinc/95/30/05/361953005.db2.gz	ZBGSUDQASNLVLX-ZGAQPHEGSA-N	1	0	287.388	1.892	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@@H]1NC(=O)c1cccc(CO)c1	ZINC000585136452	342216028	/nfs/dbraw/zinc/21/60/28/342216028.db2.gz	GZXMHUZKWHCYIN-JTNHKYCSSA-N	1	0	262.353	1.295	50	0		CDAARO
Cc1ccnc(C[NH2+][C@@H]2CCC[C@@H](S(C)(=O)=O)C2)c1	ZINC000392826403	539061331	/nfs/dbraw/zinc/06/13/31/539061331.db2.gz	LSOWCJBLNDBORA-TZMCWYRMSA-N	1	0	282.409	1.835	50	0		CDAARO
O[C@@]1(Cn2ccnn2)CC[N@H+](Cc2cccc(F)c2)C1	ZINC000585081496	539103158	/nfs/dbraw/zinc/10/31/58/539103158.db2.gz	AFRXBIJLIHXGGP-AWEZNQCLSA-N	1	0	276.315	1.054	50	0		CDAARO
CCc1ccccc1OCC(=O)N1CC[NH2+]C[C@@H]1C	ZINC000125705855	187197388	/nfs/dbraw/zinc/19/73/88/187197388.db2.gz	RKKSOVHGCSBUDP-LBPRGKRZSA-N	1	0	262.353	1.448	50	0		CDAARO
CC(C)O[C@H](C[N@@H+]1CC[C@@H](C(N)=O)C1)c1ccccc1	ZINC000585085635	362012977	/nfs/dbraw/zinc/01/29/77/362012977.db2.gz	AYRKUGJELCTNCV-HUUCEWRRSA-N	1	0	276.380	1.960	50	0		CDAARO
NC(=O)[C@H]1CC[N@H+](Cc2ccccc2OCCCCO)C1	ZINC000585117788	362046536	/nfs/dbraw/zinc/04/65/36/362046536.db2.gz	XDBQOMBCCFWCJD-AWEZNQCLSA-N	1	0	292.379	1.145	50	0		CDAARO
CC[C@@H](Cn1c(=O)[nH]c2ccccc2c1=O)[NH+]1CCCC1	ZINC000036395980	362061290	/nfs/dbraw/zinc/06/12/90/362061290.db2.gz	GMUZXUZCSSKOMV-LBPRGKRZSA-N	1	0	287.363	1.564	50	0		CDAARO
C[C@@H]1CCN(C(=O)[C@@H]2CN(C)CCO2)[C@H]2CCCC[C@H]12	ZINC000081256586	342365890	/nfs/dbraw/zinc/36/58/90/342365890.db2.gz	JDFARXGDZGOPLD-KBXIAJHMSA-N	1	0	280.412	1.744	50	0		CDAARO
Cc1ccc(O[C@@H](C)C(=O)N2CC[C@H](C[NH3+])C2)cc1	ZINC000178556459	362246807	/nfs/dbraw/zinc/24/68/07/362246807.db2.gz	LPVSALNRXDSZAR-QWHCGFSZSA-N	1	0	262.353	1.570	50	0		CDAARO
O=C(NCCn1cccc1)N1CC[C@@H]([NH+]2CCCCC2)C1	ZINC000084457995	343628983	/nfs/dbraw/zinc/62/89/83/343628983.db2.gz	WKCWNUHEWFYCTG-OAHLLOKOSA-N	1	0	290.411	1.758	50	0		CDAARO
Cc1nccn1CC(=O)N[C@@H]1CC[N@@H+](C(C)(C)C)C1	ZINC000617340204	345170355	/nfs/dbraw/zinc/17/03/55/345170355.db2.gz	VXORDJDKQJWKTQ-GFCCVEGCSA-N	1	0	264.373	1.181	50	0		CDAARO
O=C(NC1CC[NH+](C2CCSCC2)CC1)c1ccon1	ZINC000097495282	185616242	/nfs/dbraw/zinc/61/62/42/185616242.db2.gz	YRTPSUNWKGIUJY-UHFFFAOYSA-N	1	0	295.408	1.764	50	0		CDAARO
c1c(-c2nc(-c3ccccc3)no2)nnn1[C@@H]1CC[NH2+]C1	ZINC000582468968	346223737	/nfs/dbraw/zinc/22/37/37/346223737.db2.gz	SPPGPJJVEWPNET-LLVKDONJSA-N	1	0	282.307	1.530	50	0		CDAARO
COc1ccc(OCCN(C)C(=O)[C@@H]2CCC[C@H]2[NH3+])cc1	ZINC000085366942	179037244	/nfs/dbraw/zinc/03/72/44/179037244.db2.gz	GKEYHTJOSLAXDM-HUUCEWRRSA-N	1	0	292.379	1.660	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)c2c(F)cc(F)cc2F)C1	ZINC000086997915	179377443	/nfs/dbraw/zinc/37/74/43/179377443.db2.gz	JTRNBKNYYOCRBE-VIFPVBQESA-N	1	0	272.270	1.928	50	0		CDAARO
OCC1CC[NH+](CCNc2ncccc2Cl)CC1	ZINC000088721902	348748385	/nfs/dbraw/zinc/74/83/85/348748385.db2.gz	AWFCBUFCVGOJJM-UHFFFAOYSA-N	1	0	269.776	1.851	50	0		CDAARO
Cn1nc(CO)c2c1CC[N@@H+](C1Cc3ccccc3C1)C2	ZINC000584885209	349343280	/nfs/dbraw/zinc/34/32/80/349343280.db2.gz	VCKQWAJKLBCMCA-UHFFFAOYSA-N	1	0	283.375	1.438	50	0		CDAARO
CC(=O)NC(C)(C)C[C@H](C)[NH2+]CC1(CO)CCOCC1	ZINC000584886747	349344755	/nfs/dbraw/zinc/34/47/55/349344755.db2.gz	LYQGEUWAWNVHJJ-LBPRGKRZSA-N	1	0	286.416	1.058	50	0		CDAARO
COCC1(CNC(=O)[C@H]2CC23CC[NH2+]CC3)CCCC1	ZINC000584888871	349347285	/nfs/dbraw/zinc/34/72/85/349347285.db2.gz	NWNRNVWWOFSDDC-CYBMUJFWSA-N	1	0	280.412	1.699	50	0		CDAARO
CCC[C@H](CNc1nccc(NCC)n1)[NH+](C)C	ZINC000584889561	349348694	/nfs/dbraw/zinc/34/86/94/349348694.db2.gz	POWBMITYEQALLK-LLVKDONJSA-N	1	0	251.378	1.473	50	0		CDAARO
C[C@H]([NH2+]C1CCOCC1)c1nc(-c2ccncc2)no1	ZINC000584892808	349352759	/nfs/dbraw/zinc/35/27/59/349352759.db2.gz	USGYZOHUXMOFDS-JTQLQIEISA-N	1	0	274.324	1.961	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](C(=O)NCCC2(O)CCCC2)C1	ZINC000584894735	349355057	/nfs/dbraw/zinc/35/50/57/349355057.db2.gz	AHWJLZYBAUJJBU-CQSZACIVSA-N	1	0	298.427	1.156	50	0		CDAARO
CCc1nn(C)c2c1ncn(CC[C@H]1CCC[N@@H+]1C)c2=O	ZINC000584895895	349356884	/nfs/dbraw/zinc/35/68/84/349356884.db2.gz	REILDIPNLXZEGL-LLVKDONJSA-N	1	0	289.383	1.177	50	0		CDAARO
Cc1n[nH]c(CCC(=O)N2CC[N@@H+](C)C(C)(C)C2)c1C	ZINC000584899143	349361283	/nfs/dbraw/zinc/36/12/83/349361283.db2.gz	PNBIYTZBUYCSQS-UHFFFAOYSA-N	1	0	278.400	1.512	50	0		CDAARO
CCC[C@@]1(CO)CCC[N@H+](CCn2ccnc2)C1	ZINC000091486107	180167244	/nfs/dbraw/zinc/16/72/44/180167244.db2.gz	DHXBJQYCBZNXTG-CQSZACIVSA-N	1	0	251.374	1.758	50	0		CDAARO
CCC[C@H]1CN(c2cc(COC)ncn2)C[C@@H]1[NH+](C)C	ZINC000091602452	180203067	/nfs/dbraw/zinc/20/30/67/180203067.db2.gz	LZFNOOGEISPOQC-JSGCOSHPSA-N	1	0	278.400	1.790	50	0		CDAARO
Cc1[nH+]c(N)nc(N[C@@H]2CCCN(C(=O)C3CC3)C2)c1C	ZINC000091621109	180208474	/nfs/dbraw/zinc/20/84/74/180208474.db2.gz	CPCCKVADZOHFIG-GFCCVEGCSA-N	1	0	289.383	1.489	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)Cc2cc(F)ccc2F)C[C@@H]1C1CC1	ZINC000091645149	180215007	/nfs/dbraw/zinc/21/50/07/180215007.db2.gz	MJLSPKPRGUHNIX-OCCSQVGLSA-N	1	0	280.318	1.703	50	0		CDAARO
CN([NH+]=C(N)N)c1cc(C(F)(F)F)cc(Cl)n1	ZINC000091695037	180228782	/nfs/dbraw/zinc/22/87/82/180228782.db2.gz	DIBIEUAWQXNCBL-UHFFFAOYSA-N	1	0	267.642	1.588	50	0		CDAARO
CCc1cc(C(=O)N2C[C@H]([NH3+])[C@@H](C(C)C)C2)ccn1	ZINC000091746276	180244921	/nfs/dbraw/zinc/24/49/21/180244921.db2.gz	YTALCZXATMOVPW-KGLIPLIRSA-N	1	0	261.369	1.699	50	0		CDAARO
[NH3+][C@H]1CN(S(=O)(=O)c2ccccc2)C[C@@H]1C1CC1	ZINC000091808072	180260921	/nfs/dbraw/zinc/26/09/21/180260921.db2.gz	JVIPEIQKZAUQLB-OLZOCXBDSA-N	1	0	266.366	1.044	50	0		CDAARO
C[C@@H](CN1CC2(CC[NH2+]CC2)CCC1=O)n1ccnc1	ZINC000091974272	180296972	/nfs/dbraw/zinc/29/69/72/180296972.db2.gz	LWTPJODKHSAFRC-ZDUSSCGKSA-N	1	0	276.384	1.436	50	0		CDAARO
CC(C)[N@H+](C)CCC(=O)N1CC[C@@](O)(C2CC2)[C@H](C)C1	ZINC000092078755	180318226	/nfs/dbraw/zinc/31/82/26/180318226.db2.gz	DRRWGCZQCYOYJL-CJNGLKHVSA-N	1	0	282.428	1.726	50	0		CDAARO
COCC[N@@H+]1CCC[C@H]1CNC(=O)C[C@@H]1C=CCC1	ZINC000106652708	186130055	/nfs/dbraw/zinc/13/00/55/186130055.db2.gz	YAYDUKWCZJSCJF-KGLIPLIRSA-N	1	0	266.385	1.570	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCN(S(=O)(=O)c2cccc(F)c2)C1	ZINC000109040350	186241359	/nfs/dbraw/zinc/24/13/59/186241359.db2.gz	HWSSQNNJGYUBKU-QWRGUYRKSA-N	1	0	286.372	1.574	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)N1C[C@@H](C)C[C@H](C)C1	ZINC000130051514	187467615	/nfs/dbraw/zinc/46/76/15/187467615.db2.gz	KPDXNTGDERSZJA-RYUDHWBXSA-N	1	0	291.461	1.316	50	0		CDAARO
O=C(N[C@H]1CCC[NH2+]C1)c1cnn(Cc2ccccc2)c1	ZINC000123916140	187114329	/nfs/dbraw/zinc/11/43/29/187114329.db2.gz	BLDMVAWREYPLTC-HNNXBMFYSA-N	1	0	284.363	1.413	50	0		CDAARO
C[C@H](CCn1cccn1)[NH2+]CCc1nccs1	ZINC000158780186	188393528	/nfs/dbraw/zinc/39/35/28/188393528.db2.gz	RGFMUMBMCUYGJQ-LLVKDONJSA-N	1	0	250.371	1.951	50	0		CDAARO
Fc1cnc(NC2CC[NH+]([C@H]3CCOC3)CC2)nc1	ZINC000089603374	283037145	/nfs/dbraw/zinc/03/71/45/283037145.db2.gz	WPDCIIHHTGWIBO-LBPRGKRZSA-N	1	0	266.320	1.281	50	0		CDAARO
COC[C@@H]1CC[N@H+](Cc2nnc(-c3ccco3)o2)C1	ZINC000265796390	363405668	/nfs/dbraw/zinc/40/56/68/363405668.db2.gz	NFYVIHORSHYQLA-SNVBAGLBSA-N	1	0	263.297	1.798	50	0		CDAARO
OCC[NH+](CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000000279720	355901314	/nfs/dbraw/zinc/90/13/14/355901314.db2.gz	YXYOXGSDQLJFDP-UHFFFAOYSA-N	1	0	264.152	1.780	50	0		CDAARO
Cc1ccc(OCCOCC[N@H+](C)CCO)cc1	ZINC000002981078	355989570	/nfs/dbraw/zinc/98/95/70/355989570.db2.gz	YICJNUBBLXTUEX-UHFFFAOYSA-N	1	0	253.342	1.315	50	0		CDAARO
CC(C)OCCC[NH2+]C[C@H](O)COc1ccccc1F	ZINC000002639009	356091788	/nfs/dbraw/zinc/09/17/88/356091788.db2.gz	JCCXOADOTPWIRW-ZDUSSCGKSA-N	1	0	285.359	1.970	50	0		CDAARO
[NH2+]=C1Nc2nc3ccccc3n2[C@H](c2cccnc2)N1	ZINC000008973822	356182479	/nfs/dbraw/zinc/18/24/79/356182479.db2.gz	DXKWYOCAUDEVNS-GFCCVEGCSA-N	1	0	264.292	1.528	50	0		CDAARO
O=C1C[C@H]([NH2+]Cc2cnc[nH]2)CN1C1CCCCCC1	ZINC000011818867	356279689	/nfs/dbraw/zinc/27/96/89/356279689.db2.gz	JMRMAEHRRSNDDH-LBPRGKRZSA-N	1	0	276.384	1.823	50	0		CDAARO
CCOc1ccccc1C[NH2+]CCNC(=O)c1ccncc1	ZINC000004498111	356369710	/nfs/dbraw/zinc/36/97/10/356369710.db2.gz	ICPDLTFIUCWMFV-UHFFFAOYSA-N	1	0	299.374	2.000	50	0		CDAARO
Fc1ccc(N2CCN([C@@H]3CCC[NH2+]C3)CC2)cc1	ZINC000037246729	356460964	/nfs/dbraw/zinc/46/09/64/356460964.db2.gz	QTUSPEVNIWRLGQ-OAHLLOKOSA-N	1	0	263.360	1.700	50	0		CDAARO
Brc1cnc(OC2CC[NH2+]CC2)nc1	ZINC000016678705	356444312	/nfs/dbraw/zinc/44/43/12/356444312.db2.gz	BHBAYAHFPQOLRL-UHFFFAOYSA-N	1	0	258.119	1.370	50	0		CDAARO
C[C@@H]1C(=O)OC[C@H]1C(=O)N1CCC[C@H](C[NH+]2CCCC2)C1	ZINC000043144591	356472582	/nfs/dbraw/zinc/47/25/82/356472582.db2.gz	RADYVFJDGDWEBN-BFHYXJOUSA-N	1	0	294.395	1.130	50	0		CDAARO
[NH3+]CCS[C@@H]1CC(=O)N(c2ccccc2)C1=O	ZINC000019765499	356500897	/nfs/dbraw/zinc/50/08/97/356500897.db2.gz	BPLRIIWVDGMZTA-SNVBAGLBSA-N	1	0	250.323	1.010	50	0		CDAARO
COc1cc(C)ccc1OCCCN1CC[NH2+]CC1	ZINC000022942766	356625468	/nfs/dbraw/zinc/62/54/68/356625468.db2.gz	QTNVQNIDRYQQFJ-UHFFFAOYSA-N	1	0	264.369	1.678	50	0		CDAARO
CN1C(=O)C(=O)N(CN(Cc2cccs2)C2CC2)C1=O	ZINC000026637508	356697566	/nfs/dbraw/zinc/69/75/66/356697566.db2.gz	VWDSELRVRJISCS-UHFFFAOYSA-N	1	0	293.348	1.091	50	0		CDAARO
NC(=O)[C@@H]([NH2+]C[C@@H]1Cc2ccccc2O1)c1ccccc1	ZINC000027032822	356703109	/nfs/dbraw/zinc/70/31/09/356703109.db2.gz	OGHGNCJYECCLBI-HOCLYGCPSA-N	1	0	282.343	1.806	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cc3ccccn3c2)C1	ZINC000269146064	356808886	/nfs/dbraw/zinc/80/88/86/356808886.db2.gz	FTDQVCVAEIJWCP-GFCCVEGCSA-N	1	0	257.337	1.621	50	0		CDAARO
Ic1ccc(COC2C[NH2+]C2)cc1	ZINC000042770105	357079487	/nfs/dbraw/zinc/07/94/87/357079487.db2.gz	JAMZAOYTNWPURE-UHFFFAOYSA-N	1	0	289.116	1.780	50	0		CDAARO
CCCS(=O)(=O)N1CC[NH+](C[C@H]2CC=CCC2)CC1	ZINC000049967589	357225920	/nfs/dbraw/zinc/22/59/20/357225920.db2.gz	QSUYKINLPPFIRE-AWEZNQCLSA-N	1	0	286.441	1.700	50	0		CDAARO
COC[C@@H](Cc1ccccc1)[NH2+]C[C@H]1CCS(=O)(=O)C1	ZINC000095419617	357334480	/nfs/dbraw/zinc/33/44/80/357334480.db2.gz	HBUPBNBOXGQNEM-HUUCEWRRSA-N	1	0	297.420	1.268	50	0		CDAARO
CCOC(=O)CCN1CCCC[C@H]1C(=O)OCC	ZINC000060474026	357442723	/nfs/dbraw/zinc/44/27/23/357442723.db2.gz	SNRCNAJPIJLHSH-NSHDSACASA-N	1	0	257.330	1.357	50	0		CDAARO
CCS(=O)(=O)N[C@H](C)C[N@H+]1C[C@H](C)C[C@H](C)C1	ZINC000096470380	357479327	/nfs/dbraw/zinc/47/93/27/357479327.db2.gz	TZRBOVVJLDBQPF-GRYCIOLGSA-N	1	0	262.419	1.292	50	0		CDAARO
C[N@@H+](Cc1ccccc1C(F)(F)F)C[C@H](O)CO	ZINC000065380944	357532800	/nfs/dbraw/zinc/53/28/00/357532800.db2.gz	QSUARHPRHZGSPS-JTQLQIEISA-N	1	0	263.259	1.490	50	0		CDAARO
Cc1cccc(Cn2c(=O)[nH]nc2[C@H]2CCC[N@@H+](C)C2)c1	ZINC000065397922	357536509	/nfs/dbraw/zinc/53/65/09/357536509.db2.gz	AAGKDWWBRNPFAD-AWEZNQCLSA-N	1	0	286.379	1.737	50	0		CDAARO
Cc1cccc(SC2CC[NH+](C(CO)CO)CC2)c1	ZINC000065395871	357537112	/nfs/dbraw/zinc/53/71/12/357537112.db2.gz	JNTWPFFNFNGJGY-UHFFFAOYSA-N	1	0	281.421	1.905	50	0		CDAARO
CC(C)CCCC(=O)N1CCN2CC[N@H+](C)C[C@@H]2C1	ZINC000065406053	357538996	/nfs/dbraw/zinc/53/89/96/357538996.db2.gz	ZPPOREOKYFFXEZ-CQSZACIVSA-N	1	0	267.417	1.271	50	0		CDAARO
C/C(=C\c1ccco1)CN1C[C@H]([NH+](C)C)C[C@H]1CO	ZINC000065405513	357539281	/nfs/dbraw/zinc/53/92/81/357539281.db2.gz	CBJQAGDEYMRXMF-NMEJBFKPSA-N	1	0	264.369	1.680	50	0		CDAARO
CCc1cc(N[C@H](C)CN2CCOCC2)nc(N(C)C)[nH+]1	ZINC000065429096	357541006	/nfs/dbraw/zinc/54/10/06/357541006.db2.gz	LTRQZHGVORHGKJ-GFCCVEGCSA-N	1	0	293.415	1.238	50	0		CDAARO
CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1Cc1ccc(OC)nn1	ZINC000283223914	357545812	/nfs/dbraw/zinc/54/58/12/357545812.db2.gz	SYDUPZFXXHTSPL-KGLIPLIRSA-N	1	0	276.384	1.544	50	0		CDAARO
C[C@H]([NH2+]CC(C)(C)CO)C(=O)Nc1nccs1	ZINC000065505112	357545857	/nfs/dbraw/zinc/54/58/57/357545857.db2.gz	MATKARQTHKQGKJ-QMMMGPOBSA-N	1	0	257.359	1.078	50	0		CDAARO
Cc1cnn([C@H](C)CNC(=O)C[NH+]2CCCCCC2)c1	ZINC000065527070	357546656	/nfs/dbraw/zinc/54/66/56/357546656.db2.gz	NOPXNWGCKMPUFG-CQSZACIVSA-N	1	0	278.400	1.745	50	0		CDAARO
COCc1cc(CNC2CC[NH+](CC(C)C)CC2)[nH]n1	ZINC000067726570	357621622	/nfs/dbraw/zinc/62/16/22/357621622.db2.gz	USYBBPOKCUEOHZ-UHFFFAOYSA-N	1	0	280.416	1.766	50	0		CDAARO
O=S1CCC([NH2+]CCN2CCc3ccccc32)CC1	ZINC000067786488	357627097	/nfs/dbraw/zinc/62/70/97/357627097.db2.gz	FATMDEGMHUHHDS-UHFFFAOYSA-N	1	0	278.421	1.550	50	0		CDAARO
CCC(=O)NCCNc1nc(N2CCCCC2)cc(C)[nH+]1	ZINC000067604013	357613910	/nfs/dbraw/zinc/61/39/10/357613910.db2.gz	BZIHEZVGGRVAHE-UHFFFAOYSA-N	1	0	291.399	1.713	50	0		CDAARO
C[N@@H+]1CCC[C@H](CNC(=O)Cn2ncc3ccccc32)C1	ZINC000067821735	357630485	/nfs/dbraw/zinc/63/04/85/357630485.db2.gz	NPHJDRSSFDZNCO-CYBMUJFWSA-N	1	0	286.379	1.494	50	0		CDAARO
CNC(=O)C[C@H](C)[N@H+](C)Cc1ccc(-n2ccnc2)cc1	ZINC000067921522	357637021	/nfs/dbraw/zinc/63/70/21/357637021.db2.gz	FKUSNXIHZLETHW-ZDUSSCGKSA-N	1	0	286.379	1.829	50	0		CDAARO
CCN1c2cc(F)ccc2C(=O)NC12CC[NH2+]CC2	ZINC000070451499	357724716	/nfs/dbraw/zinc/72/47/16/357724716.db2.gz	MAOVOGQWBLHEDN-UHFFFAOYSA-N	1	0	263.316	1.475	50	0		CDAARO
CC[C@@H](NCC(N)=O)c1nc(C(F)(F)F)cs1	ZINC000097111017	357986774	/nfs/dbraw/zinc/98/67/74/357986774.db2.gz	DGEBXORGYPZIKV-RXMQYKEDSA-N	1	0	267.276	1.688	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)c2sccc2Br)C1	ZINC000097212426	358036940	/nfs/dbraw/zinc/03/69/40/358036940.db2.gz	OKPOECCGGIAWQX-ZCFIWIBFSA-N	1	0	275.171	1.684	50	0		CDAARO
Cc1nonc1C(=O)N1CCCC[C@@H]1CC[NH+](C)C	ZINC000072458446	358052221	/nfs/dbraw/zinc/05/22/21/358052221.db2.gz	YFYBYUANKLRTIL-LLVKDONJSA-N	1	0	266.345	1.324	50	0		CDAARO
Cc1ccc(N2CCC([C@H](C)[NH+]3CCOCC3)CC2)nn1	ZINC000095354330	358683771	/nfs/dbraw/zinc/68/37/71/358683771.db2.gz	BBELKPBFZQCZPC-AWEZNQCLSA-N	1	0	290.411	1.722	50	0		CDAARO
CCc1nnc(CNC(=O)CC[C@@H]2CCCC[N@@H+]2C)s1	ZINC000095388516	358691923	/nfs/dbraw/zinc/69/19/23/358691923.db2.gz	ZALBTLGGCYVOCV-NSHDSACASA-N	1	0	296.440	1.981	50	0		CDAARO
COc1ccc(NC(=O)CN2C[C@@H](C)[C@@H](O)C2)cc1Cl	ZINC000095454169	358857620	/nfs/dbraw/zinc/85/76/20/358857620.db2.gz	BSCKULKQEQMMQL-SKDRFNHKSA-N	1	0	298.770	1.600	50	0		CDAARO
Cc1ccc(CN2CCN(C[C@H]3[C@@H]4C[NH2+]C[C@H]34)CC2=O)cc1	ZINC000102856131	358894284	/nfs/dbraw/zinc/89/42/84/358894284.db2.gz	NCIKTKQRSQFHNS-FVQHAEBGSA-N	1	0	299.418	1.105	50	0		CDAARO
CN(C)[C@H](C(=O)NC1CC[NH2+]CC1)c1cccc(F)c1	ZINC000218872758	359069129	/nfs/dbraw/zinc/06/91/29/359069129.db2.gz	GMKHTFWNKSHAFA-AWEZNQCLSA-N	1	0	279.359	1.297	50	0		CDAARO
Cc1occc1C(=O)N1CCC(O)(C[NH+]2CCCC2)CC1	ZINC000222497231	359349618	/nfs/dbraw/zinc/34/96/18/359349618.db2.gz	LVJUVBRBQOHLDS-UHFFFAOYSA-N	1	0	292.379	1.651	50	0		CDAARO
O=C(NCCC12CCC[NH+]1CCC2)c1ccc(=O)[nH]c1	ZINC000223683987	359446441	/nfs/dbraw/zinc/44/64/41/359446441.db2.gz	VAYSQVZGBCOJNW-UHFFFAOYSA-N	1	0	275.352	1.123	50	0		CDAARO
COc1ccc(CN2C[C@@H](CO)[C@H]([NH+](C)C)C2)c(OC)c1	ZINC000257190809	359536209	/nfs/dbraw/zinc/53/62/09/359536209.db2.gz	NVAKXFCEBPWZPC-DZGCQCFKSA-N	1	0	294.395	1.058	50	0		CDAARO
C[C@]1(O)CCOC2(CC[NH+](Cc3ccncc3)CC2)C1	ZINC000257187245	359529502	/nfs/dbraw/zinc/52/95/02/359529502.db2.gz	AHGGRUZCPCMUJA-HNNXBMFYSA-N	1	0	276.380	1.978	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](NC(=O)CSC(C)(C)C)C1	ZINC000408512854	359892841	/nfs/dbraw/zinc/89/28/41/359892841.db2.gz	MYWIJKZRWCAKCD-LBPRGKRZSA-N	1	0	288.457	1.745	50	0		CDAARO
CN1CCO[C@H](C(=O)N2CC[C@@H]3CCCC[C@@H]32)C1	ZINC000566279761	370667326	/nfs/dbraw/zinc/66/73/26/370667326.db2.gz	RCCCYVLEPOTXOO-AVGNSLFASA-N	1	0	252.358	1.108	50	0		CDAARO
Cc1c[nH+]c(C)n1C1CCN(C(=O)c2nccn2C)CC1	ZINC000409420977	360230547	/nfs/dbraw/zinc/23/05/47/360230547.db2.gz	QNIOSVYFTPZOSD-UHFFFAOYSA-N	1	0	287.367	1.711	50	0		CDAARO
O=C(NC1CC1)C1(F)CC[NH+](Cc2ccncc2)CC1	ZINC000409421622	360231399	/nfs/dbraw/zinc/23/13/99/360231399.db2.gz	KMPHDLHYKAKRAG-UHFFFAOYSA-N	1	0	277.343	1.664	50	0		CDAARO
COc1ccc(C)cc1NC(=O)N1C[C@@H]2[NH2+]CCO[C@H]2C1	ZINC000426434108	360528993	/nfs/dbraw/zinc/52/89/93/360528993.db2.gz	MPVXRPSTWLMVET-JSGCOSHPSA-N	1	0	291.351	1.208	50	0		CDAARO
CCOCCSc1nnc([C@@H]2CCC[NH2+]C2)n1C	ZINC000426556069	360683539	/nfs/dbraw/zinc/68/35/39/360683539.db2.gz	WVZNCOCHLHYEBW-SNVBAGLBSA-N	1	0	270.402	1.411	50	0		CDAARO
O=C(NCCCC[NH+]1CCCCCC1)c1cncc(=O)[nH]1	ZINC000426574867	360684469	/nfs/dbraw/zinc/68/44/69/360684469.db2.gz	WUNHRLCTUQNWCM-UHFFFAOYSA-N	1	0	292.383	1.156	50	0		CDAARO
O=C(Cc1nc2ccccc2[nH]1)N1CC([NH+]2CCCCC2)C1	ZINC000426618050	360689780	/nfs/dbraw/zinc/68/97/80/360689780.db2.gz	BRNOWISPZQJAMV-UHFFFAOYSA-N	1	0	298.390	1.802	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)c2c(Cl)nc3ccccn32)C1	ZINC000178550630	189126342	/nfs/dbraw/zinc/12/63/42/189126342.db2.gz	GIWNDXNAZFIEFC-SECBINFHSA-N	1	0	278.743	1.409	50	0		CDAARO
Cc1nc(CCNC(=O)NC[C@@H]2CCC[NH2+]2)sc1C	ZINC000426701760	360697642	/nfs/dbraw/zinc/69/76/42/360697642.db2.gz	XPRGKXAHEHUAPJ-NSHDSACASA-N	1	0	282.413	1.354	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)c2ccc(N3CCCC3=O)cc2)C1	ZINC000178536010	189124996	/nfs/dbraw/zinc/12/49/96/189124996.db2.gz	VBHJSRVSXRCKKJ-LBPRGKRZSA-N	1	0	287.363	1.234	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cc(OC)c(C)c(OC)c2)C1	ZINC000179024748	189162675	/nfs/dbraw/zinc/16/26/75/189162675.db2.gz	QRHJOZVRVYRSCO-LBPRGKRZSA-N	1	0	292.379	1.694	50	0		CDAARO
C[NH+](C)CC(C)(C)CNc1cc([C@H]2CCOC2)ncn1	ZINC000426511513	360934041	/nfs/dbraw/zinc/93/40/41/360934041.db2.gz	BJYOESSTTBDYQO-LBPRGKRZSA-N	1	0	278.400	1.402	50	0		CDAARO
CN(C)c1noc(C2CCN(Cc3cncs3)CC2)n1	ZINC000191907261	361385951	/nfs/dbraw/zinc/38/59/51/361385951.db2.gz	VLADMWFOGWDVAL-UHFFFAOYSA-N	1	0	293.396	1.972	50	0		CDAARO
Cn1cc(C[NH2+][C@@H]2CC(=O)N(C)C2)c(C2CCCCC2)n1	ZINC000273124510	239047035	/nfs/dbraw/zinc/04/70/35/239047035.db2.gz	RXTPMMWIYQPWIT-CQSZACIVSA-N	1	0	290.411	1.788	50	0		CDAARO
Cn1c2ccccc2nc1C(C)(C)NC(=O)C[NH+](C)C	ZINC000188881332	365454074	/nfs/dbraw/zinc/45/40/74/365454074.db2.gz	UIYQEDLNYVFTIL-UHFFFAOYSA-N	1	0	274.368	1.486	50	0		CDAARO
Cc1nc(CCNC(=O)N2CC[NH+](C(C)C)CC2)cs1	ZINC000089709098	366918766	/nfs/dbraw/zinc/91/87/66/366918766.db2.gz	VYKWIHZCXLDRHS-UHFFFAOYSA-N	1	0	296.440	1.730	50	0		CDAARO
O[C@H](CNCc1cnc(C2CCC2)s1)C[NH+]1CCCC1	ZINC000089764825	366931182	/nfs/dbraw/zinc/93/11/82/366931182.db2.gz	MKTBMKZZBPPHPT-CYBMUJFWSA-N	1	0	295.452	1.957	50	0		CDAARO
CC[C@@](C)([NH2+]CC(=O)N1CCCCCCC1)C(N)=O	ZINC000089941953	366974348	/nfs/dbraw/zinc/97/43/48/366974348.db2.gz	SEYSIEAXLRIQDQ-CQSZACIVSA-N	1	0	269.389	1.023	50	0		CDAARO
CCC[C@@H](C(=O)NCCc1nc(C)cs1)[NH+](C)C	ZINC000089949417	366979056	/nfs/dbraw/zinc/97/90/56/366979056.db2.gz	FEQYEBSCUVWNIE-NSHDSACASA-N	1	0	269.414	1.841	50	0		CDAARO
COc1ccc(CNC(=O)N2CCCC[C@@H]2C[NH3+])cc1F	ZINC000417087875	242308853	/nfs/dbraw/zinc/30/88/53/242308853.db2.gz	IJICRFSKMZLOCT-GFCCVEGCSA-N	1	0	295.358	1.857	50	0		CDAARO
COCCN(Cc1nnc(C)s1)C[C@H]1CCCO1	ZINC000299778855	372754344	/nfs/dbraw/zinc/75/43/44/372754344.db2.gz	IBDNGWGNVOITEQ-LLVKDONJSA-N	1	0	271.386	1.474	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@@H](CNC(=O)c2csnc2N)C1	ZINC000299783129	372759062	/nfs/dbraw/zinc/75/90/62/372759062.db2.gz	XUFWAAPOFVOGCV-JTQLQIEISA-N	1	0	282.413	1.433	50	0		CDAARO
O=C(NC[C@@]1(O)CC[NH2+]C1)Nc1cccc(Cl)c1	ZINC000299782727	372759559	/nfs/dbraw/zinc/75/95/59/372759559.db2.gz	UGPHRIVEVLHEKL-GFCCVEGCSA-N	1	0	269.732	1.186	50	0		CDAARO
CSc1ccc(NC(=O)N2C[C@H](O)[C@@H]([NH+](C)C)C2)cc1	ZINC000299797737	372769259	/nfs/dbraw/zinc/76/92/59/372769259.db2.gz	SMICCIBGUVLGCU-STQMWFEESA-N	1	0	295.408	1.547	50	0		CDAARO
OC1CC[NH+](Cc2cnn(-c3ccccc3)c2)CC1	ZINC000029696038	373069064	/nfs/dbraw/zinc/06/90/64/373069064.db2.gz	FXZMSQMJEALQJL-UHFFFAOYSA-N	1	0	257.337	1.829	50	0		CDAARO
Cc1c(F)cccc1S(=O)(=O)N[C@@H]1CCC[C@@H]1C[NH3+]	ZINC000095432105	291563024	/nfs/dbraw/zinc/56/30/24/291563024.db2.gz	DEDJRXGHXFHHGX-ZYHUDNBSSA-N	1	0	286.372	1.540	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1Cc1cnc(-c2ncccn2)s1	ZINC000097162630	541892410	/nfs/dbraw/zinc/89/24/10/541892410.db2.gz	VNYMUOPFPRNWSY-LLVKDONJSA-N	1	0	289.408	1.913	50	0		CDAARO
O=C(CC[NH+]1CCCCCCC1)NCCc1c[nH]cn1	ZINC000055211225	374299756	/nfs/dbraw/zinc/29/97/56/374299756.db2.gz	NBMXTHXFUAWAJP-UHFFFAOYSA-N	1	0	278.400	1.725	50	0		CDAARO
C[N@H+](CC[C@H]1C[NH2+]CC[C@H]1CC(=O)[O-])Cc1cccnc1	ZINC000067870502	374437304	/nfs/dbraw/zinc/43/73/04/374437304.db2.gz	RDGOPWFOJXFMDK-GJZGRUSLSA-N	1	0	291.395	1.604	50	0	biogenic,in-vitro	CDAARO
C[C@@H]([NH2+]CC(C)(C)N1CCOCC1)c1ccccn1	ZINC000020120635	374847536	/nfs/dbraw/zinc/84/75/36/374847536.db2.gz	JVOQWVTXDLMTGK-CYBMUJFWSA-N	1	0	263.385	1.843	50	0		CDAARO
CCc1ccc(C[NH2+][C@H]2CCCN(S(C)(=O)=O)C2)o1	ZINC000095415428	374917470	/nfs/dbraw/zinc/91/74/70/374917470.db2.gz	BUWCYDWXRBOYAF-NSHDSACASA-N	1	0	286.397	1.356	50	0		CDAARO
c1ccc(C[NH2+][C@@H]2CCN(c3ccccn3)C2)nc1	ZINC000095435724	374936188	/nfs/dbraw/zinc/93/61/88/374936188.db2.gz	VMLWSEVGSAGDJT-CQSZACIVSA-N	1	0	254.337	1.845	50	0		CDAARO
CO[C@@H]1CC[C@H]2OCC[N@H+](CCc3ccncc3)[C@@H]2C1	ZINC000095438011	374937618	/nfs/dbraw/zinc/93/76/18/374937618.db2.gz	BZQURKMTFLHUEX-BZUAXINKSA-N	1	0	276.380	1.892	50	0		CDAARO
CCc1nn(C)c(CC)c1C[NH2+]CC1(O)CCSCC1	ZINC000095440114	374940629	/nfs/dbraw/zinc/94/06/29/374940629.db2.gz	DUSSEGBYILZITH-UHFFFAOYSA-N	1	0	297.468	1.893	50	0		CDAARO
CC(C)S(=O)(=O)NC[C@H]1CCC[N@H+](CC2CCC2)C1	ZINC000095405117	374909201	/nfs/dbraw/zinc/90/92/01/374909201.db2.gz	MOVIOWNWWNGVMR-CQSZACIVSA-N	1	0	288.457	1.826	50	0		CDAARO
CC(C)N(C[C@H](C)O)C(=O)[C@@H](C)N1CCSCC1	ZINC000095979386	375047211	/nfs/dbraw/zinc/04/72/11/375047211.db2.gz	YEEGYMSVTMRODX-NWDGAFQWSA-N	1	0	274.430	1.042	50	0		CDAARO
COC[C@@H](Nc1ccc(N2CC[NH+](C)CC2)nc1)C1CC1	ZINC000097037930	375139491	/nfs/dbraw/zinc/13/94/91/375139491.db2.gz	DNGBJXUTLYNCSM-OAHLLOKOSA-N	1	0	290.411	1.670	50	0		CDAARO
CC1CC[NH+](CCCCNC(=O)C(=O)N2CCCC2)CC1	ZINC000253407717	189989650	/nfs/dbraw/zinc/98/96/50/189989650.db2.gz	ILJVDVUEYVNZKF-UHFFFAOYSA-N	1	0	295.427	1.237	50	0		CDAARO
CC[NH+](CC)CCNC(=O)C(=O)c1c[nH]c2ccccc12	ZINC000004163106	375901223	/nfs/dbraw/zinc/90/12/23/375901223.db2.gz	LKRCDVQQISTGHC-UHFFFAOYSA-N	1	0	287.363	1.809	50	0		CDAARO
C[C@H](C(=O)NCC1(CO)CCOCC1)[NH+]1[C@H](C)CC[C@H]1C	ZINC000240744112	376016456	/nfs/dbraw/zinc/01/64/56/376016456.db2.gz	HUPMDIAOQFDEDH-MGPQQGTHSA-N	1	0	298.427	1.153	50	0		CDAARO
CC[NH+](CC)CCN1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000096499935	284624603	/nfs/dbraw/zinc/62/46/03/284624603.db2.gz	WFJBSCWGXITUQX-QLFBSQMISA-N	1	0	270.417	1.597	50	0		CDAARO
COc1ccc(CNC(=O)[C@H]2CCC[NH2+]2)cc1OC	ZINC000000251664	169587658	/nfs/dbraw/zinc/58/76/58/169587658.db2.gz	SJKGZYHZANRZEI-LLVKDONJSA-N	1	0	264.325	1.072	50	0		CDAARO
O=C1CC[C@H]([NH2+]CC2(CO)CCCC2)CCN1CC1CC1	ZINC000067964894	296329070	/nfs/dbraw/zinc/32/90/70/296329070.db2.gz	CKZNHIQRRKDDIS-HNNXBMFYSA-N	1	0	294.439	1.920	50	0		CDAARO
COc1ccccc1/C=C\C(=O)N1CCC[C@@H]1C[NH3+]	ZINC000493086392	253365650	/nfs/dbraw/zinc/36/56/50/253365650.db2.gz	OHPILIUEELZXPA-LJTDUEICSA-N	1	0	260.337	1.658	50	0		CDAARO
Cc1cc(=O)[nH]c2c1c(=O)[nH]n2[C@@H]1C[C@H](C)[N@@H+](C)C[C@H]1C	ZINC000103951330	390404118	/nfs/dbraw/zinc/40/41/18/390404118.db2.gz	MVFIEUFRENOXDE-OUAUKWLOSA-N	1	0	290.367	1.228	50	0		CDAARO
C[C@]1(C[NH3+])CCN(C(=O)c2ccnc(C3CC3)n2)C1	ZINC000262043689	390504329	/nfs/dbraw/zinc/50/43/29/390504329.db2.gz	QIRFVFMBWBIKMC-CQSZACIVSA-N	1	0	260.341	1.165	50	0		CDAARO
CC[N@@H+]1CC[C@@H](CNC(=O)c2ccncc2F)C1	ZINC000096420691	390514347	/nfs/dbraw/zinc/51/43/47/390514347.db2.gz	AGYCZXTXPNQVHB-JTQLQIEISA-N	1	0	251.305	1.292	50	0		CDAARO
CN(CC[NH+](C)C)c1ncnc2c1Cc1ccccc1OC2	ZINC000096150793	390913114	/nfs/dbraw/zinc/91/31/14/390913114.db2.gz	XUOXGTJULSEVKB-UHFFFAOYSA-N	1	0	298.390	1.958	50	0		CDAARO
CC[C@@]1(C(=O)N[C@@H](C)c2cn(C)nc2C)CCC[NH2+]1	ZINC000184102902	391710747	/nfs/dbraw/zinc/71/07/47/391710747.db2.gz	UBPBFPJBDAWGKB-HZMBPMFUSA-N	1	0	264.373	1.438	50	0		CDAARO
Cc1ccccc1[C@H](O)CNC(=O)[C@@H](C)[C@@H](C)[NH3+]	ZINC000192051904	130359781	/nfs/dbraw/zinc/35/97/81/130359781.db2.gz	SPRVIHKWFOFDIB-DMDPSCGWSA-N	1	0	250.342	1.128	50	0		CDAARO
C[N@H+](CCO)C[C@@H]1COCCN1C(=O)CCC1CCCC1	ZINC000085469771	397611135	/nfs/dbraw/zinc/61/11/35/397611135.db2.gz	XIKSCQQOMJRGDM-OAHLLOKOSA-N	1	0	298.427	1.108	50	0		CDAARO
CCOC(=O)[C@@H]1C[NH2+]C[C@]12CCN(C(=O)OC(C)(C)C)C2	ZINC000091303164	285885908	/nfs/dbraw/zinc/88/59/08/285885908.db2.gz	LKKYIMUKDUHHII-NHYWBVRUSA-N	1	0	298.383	1.396	50	0		CDAARO
O=C(NCC(F)(F)F)N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1	ZINC000095950728	147113646	/nfs/dbraw/zinc/11/36/46/147113646.db2.gz	BRKOMTFIDAWSSG-RKDXNWHRSA-N	1	0	265.279	1.475	50	0		CDAARO
COc1ccc(C2([C@@H](O)C[NH3+])CCCC2)cc1OC	ZINC000003157366	169862253	/nfs/dbraw/zinc/86/22/53/169862253.db2.gz	GRCUYEZEYQMJGM-AWEZNQCLSA-N	1	0	265.353	1.835	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1cc2ccccc2oc1=O	ZINC000004516941	169976338	/nfs/dbraw/zinc/97/63/38/169976338.db2.gz	KYLFFCVLPDFWKM-UHFFFAOYSA-N	1	0	274.320	1.475	50	0		CDAARO
COc1cc(NC(=O)C[NH2+]CC(C)C)cc(OC)c1OC	ZINC000006650163	170222177	/nfs/dbraw/zinc/22/21/77/170222177.db2.gz	HFFZFCBIXSBUKI-UHFFFAOYSA-N	1	0	296.367	1.897	50	0		CDAARO
C[NH+](C)CCNS(=O)(=O)c1ccc2c(c1)CCCC2	ZINC000006671044	170225134	/nfs/dbraw/zinc/22/51/34/170225134.db2.gz	JHFUGTHUTUIDLH-UHFFFAOYSA-N	1	0	282.409	1.405	50	0		CDAARO
COc1ccccc1CC(=O)NC1CC[NH+](C)CC1	ZINC000006700192	170228937	/nfs/dbraw/zinc/22/89/37/170228937.db2.gz	YPCWURVLIGXDBJ-UHFFFAOYSA-N	1	0	262.353	1.448	50	0		CDAARO
[NH3+]C[C@H](c1cccnc1)S(=O)(=O)c1cccs1	ZINC000008031076	170315229	/nfs/dbraw/zinc/31/52/29/170315229.db2.gz	COILNLCMPPWTPR-SNVBAGLBSA-N	1	0	268.363	1.617	50	0		CDAARO
[NH3+]CCS[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1=O	ZINC000018276888	170749464	/nfs/dbraw/zinc/74/94/64/170749464.db2.gz	NFANMHFDNNUPEV-SNVBAGLBSA-N	1	0	284.768	1.664	50	0		CDAARO
CCC[NH2+]Cc1nc(=O)c2c3c(sc2[nH]1)CCC3	ZINC000018937931	170750752	/nfs/dbraw/zinc/75/07/52/170750752.db2.gz	UZWKMASDLFYFDF-UHFFFAOYSA-N	1	0	263.366	1.973	50	0		CDAARO
CCOC(=O)CCN1CC[NH+](CCc2ccccc2)CC1	ZINC000020231046	171093819	/nfs/dbraw/zinc/09/38/19/171093819.db2.gz	DPPUVEUXUSMCIX-UHFFFAOYSA-N	1	0	290.407	1.800	50	0		CDAARO
NS(=O)(=O)c1ccc(CC[NH2+]Cc2ccncc2)cc1	ZINC000020457698	171208949	/nfs/dbraw/zinc/20/89/49/171208949.db2.gz	ARMMJGZHXPIXME-UHFFFAOYSA-N	1	0	291.376	1.061	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COc2ccc(C)cc2)CC1	ZINC000020707241	171269922	/nfs/dbraw/zinc/26/99/22/171269922.db2.gz	XESYSLHPNHXOGU-OAHLLOKOSA-N	1	0	278.396	1.372	50	0		CDAARO
OCC[C@H]1CN(Cc2cccnc2)CC[N@@H+]1C1CCCC1	ZINC000020992013	171283674	/nfs/dbraw/zinc/28/36/74/171283674.db2.gz	XDRGHQBVNRUVNP-KRWDZBQOSA-N	1	0	289.423	1.893	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1ccc(Cl)c(N)c1	ZINC000022176158	171370454	/nfs/dbraw/zinc/37/04/54/171370454.db2.gz	TZFDNBRMNYIRLB-UHFFFAOYSA-N	1	0	269.776	1.994	50	0		CDAARO
C[C@@H](c1cccnc1)[NH+]1CCC(CNS(C)(=O)=O)CC1	ZINC000285418941	196279392	/nfs/dbraw/zinc/27/93/92/196279392.db2.gz	JNKVEXSPRGCZJV-LBPRGKRZSA-N	1	0	297.424	1.404	50	0		CDAARO
CCCN(C(=O)c1ccc(OC)cc1)[C@@H]1CC[NH2+]C1	ZINC000037540155	173261999	/nfs/dbraw/zinc/26/19/99/173261999.db2.gz	DOWJSUFAOXVZNO-CYBMUJFWSA-N	1	0	262.353	1.909	50	0		CDAARO
CC(C)C[NH2+]C[C@H](O)COCCOc1ccc(F)cc1	ZINC000038642114	174150871	/nfs/dbraw/zinc/15/08/71/174150871.db2.gz	OLKQYJBCTFYMIM-AWEZNQCLSA-N	1	0	285.359	1.828	50	0		CDAARO
COc1cc(C)c(CN2CC[N@H+](C)[C@H](CCO)C2)cc1C	ZINC000039551081	174170251	/nfs/dbraw/zinc/17/02/51/174170251.db2.gz	DJLXKNRCDIQDCZ-MRXNPFEDSA-N	1	0	292.423	1.810	50	0		CDAARO
O=C(CCN1CC[NH2+]CC1)c1ccc2[nH]c(=O)oc2c1	ZINC000041570483	174568733	/nfs/dbraw/zinc/56/87/33/174568733.db2.gz	JSBBLOGNDYVWIC-UHFFFAOYSA-N	1	0	275.308	1.011	50	0	in-vitro	CDAARO
CCc1cc(N(C)Cc2cnn(C)c2)nc(N(C)C)[nH+]1	ZINC000065383816	175725674	/nfs/dbraw/zinc/72/56/74/175725674.db2.gz	UBMNESDRFYILIT-UHFFFAOYSA-N	1	0	274.372	1.475	50	0		CDAARO
OC1CC[NH+](CCCn2ccnc2-c2c[nH]cn2)CC1	ZINC000071746768	176258712	/nfs/dbraw/zinc/25/87/12/176258712.db2.gz	MGNSCFMMLOVLQR-UHFFFAOYSA-N	1	0	275.356	1.120	50	0		CDAARO
CCc1ccc(CN(C)C(=O)[C@H]([NH3+])CC(C)C)nc1	ZINC000071752784	176260274	/nfs/dbraw/zinc/26/02/74/176260274.db2.gz	ZNFDLOVJEZWPRH-CQSZACIVSA-N	1	0	263.385	1.976	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CN1CCN(C(=O)C(C)(C)C)CC1	ZINC000071885839	176289727	/nfs/dbraw/zinc/28/97/27/176289727.db2.gz	WMMZGCWMSWNBDF-CQSZACIVSA-N	1	0	281.444	1.661	50	0		CDAARO
CC[C@H]1CN(Cc2cccnc2N)CC[N@@H+]1C(C)C	ZINC000072154081	176327864	/nfs/dbraw/zinc/32/78/64/176327864.db2.gz	IEWQSWNCRXZRAE-AWEZNQCLSA-N	1	0	262.401	1.968	50	0		CDAARO
NC(=O)[C@]1(Cc2cccc(-c3cncnc3)c2)CCC[NH2+]1	ZINC000072352828	176374236	/nfs/dbraw/zinc/37/42/36/176374236.db2.gz	IELUHLCPYPVFIQ-MRXNPFEDSA-N	1	0	282.347	1.294	50	0		CDAARO
Cn1cccc1C(=O)N1CCC(C[NH+]2CCOCC2)CC1	ZINC000078639002	177363693	/nfs/dbraw/zinc/36/36/93/177363693.db2.gz	LQZLJHVQRIZZBV-UHFFFAOYSA-N	1	0	291.395	1.210	50	0		CDAARO
O=C(CC[C@@H]1CCC[N@H+](Cc2cnc[nH]2)C1)NC1CC1	ZINC000011663478	260049899	/nfs/dbraw/zinc/04/98/99/260049899.db2.gz	TXFJTQRKMJTBPQ-LBPRGKRZSA-N	1	0	276.384	1.681	50	0		CDAARO
CC(C)c1nnc2n1CCN(C[C@@H]1CCC[NH2+]C1)[C@H]2C	ZINC000261765024	276077051	/nfs/dbraw/zinc/07/70/51/276077051.db2.gz	MQGFMBIJCJJLIO-QWHCGFSZSA-N	1	0	277.416	1.778	50	0		CDAARO
CCN1CC2(CC1=O)CC[NH+](C[C@H]1CCCCO1)CC2	ZINC000095513019	276358183	/nfs/dbraw/zinc/35/81/83/276358183.db2.gz	QKONRWPYBHWAKS-CQSZACIVSA-N	1	0	280.412	1.890	50	0		CDAARO
CC(=O)N1CCCSC[C@H]1C[NH+]1CCCCC1	ZINC000085473260	276971117	/nfs/dbraw/zinc/97/11/17/276971117.db2.gz	ILRAEQHIJORTQV-CYBMUJFWSA-N	1	0	256.415	1.826	50	0		CDAARO
C[N@@H+]1CC[C@H]2CN(c3nccnc3N3CCCC3)C[C@H]21	ZINC000077439504	277179436	/nfs/dbraw/zinc/17/94/36/277179436.db2.gz	RSMQLTFIQBZCOE-QWHCGFSZSA-N	1	0	273.384	1.217	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN(c2ccc(C[NH3+])cn2)CC1	ZINC000072225561	277188827	/nfs/dbraw/zinc/18/88/27/277188827.db2.gz	LFJRSFAURAIOAB-UHFFFAOYSA-N	1	0	292.383	1.597	50	0		CDAARO
CNC(=O)c1nn(C)c2c1C[C@H]([NH+]1CCC(C)CC1)CC2	ZINC000014752639	277262181	/nfs/dbraw/zinc/26/21/81/277262181.db2.gz	ZNAYTMJHDWUHMJ-GFCCVEGCSA-N	1	0	290.411	1.369	50	0		CDAARO
CC(C)C[C@@H]1CCN(c2ncnc3c2CC[NH2+]C3)C1	ZINC000067447352	277454566	/nfs/dbraw/zinc/45/45/66/277454566.db2.gz	ZCRCJMOSPSIJAQ-LBPRGKRZSA-N	1	0	260.385	1.995	50	0		CDAARO
COc1ccnc(N2CC[C@H]([NH+]3CCCCC3)C2)n1	ZINC000264547589	278066571	/nfs/dbraw/zinc/06/65/71/278066571.db2.gz	CFIJGRDLTQULHD-LBPRGKRZSA-N	1	0	262.357	1.550	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)c1cccc2cn[nH]c21	ZINC000299748335	278316998	/nfs/dbraw/zinc/31/69/98/278316998.db2.gz	GYTVBVIRLSANKK-ZWNOBZJWSA-N	1	0	272.352	1.905	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(CO[C@H](C[NH3+])C2)CC1	ZINC000091303577	278384391	/nfs/dbraw/zinc/38/43/91/278384391.db2.gz	KZIVKLLJQLIJKP-NSHDSACASA-N	1	0	270.373	1.751	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(CO[C@@H](C[NH3+])C2)CC1	ZINC000091303576	278384407	/nfs/dbraw/zinc/38/44/07/278384407.db2.gz	KZIVKLLJQLIJKP-LLVKDONJSA-N	1	0	270.373	1.751	50	0		CDAARO
C[C@@H]1[C@@H](c2ccccc2)[N@H+](C)CC[C@@]12NC(=O)NC2=O	ZINC000005559814	279095390	/nfs/dbraw/zinc/09/53/90/279095390.db2.gz	FQTIIVLASVNVSP-IFUGULHKSA-N	1	0	273.336	1.278	50	0		CDAARO
ClC1=CC[C@@H]2C[N@H+](CCN3CCOCC3)C[C@H]2C1	ZINC000022864893	279289961	/nfs/dbraw/zinc/28/99/61/279289961.db2.gz	NTRSYCHJIBTEDS-CHWSQXEVSA-N	1	0	270.804	1.783	50	0		CDAARO
CCOc1ncccc1NC(=O)NC[C@@H]1CCC[N@H+](C)C1	ZINC000108433489	279306648	/nfs/dbraw/zinc/30/66/48/279306648.db2.gz	KVGGMCBSSJRUCN-LBPRGKRZSA-N	1	0	292.383	1.944	50	0		CDAARO
C[C@H]([NH3+])c1nnnn1-c1cccc(Br)c1	ZINC000062493998	279423430	/nfs/dbraw/zinc/42/34/30/279423430.db2.gz	RAPPANCYTWPMAK-LURJTMIESA-N	1	0	268.118	1.445	50	0		CDAARO
CC[C@H](C(=O)N[C@@H]1CCCCC[C@@H]1CO)[NH+](C)C	ZINC000095443471	280684086	/nfs/dbraw/zinc/68/40/86/280684086.db2.gz	OFDYGMKALQZFSO-JHJVBQTASA-N	1	0	256.390	1.384	50	0		CDAARO
C[C@H]1CC[N@H+](CC(=O)NCc2nc3cc(F)ccc3[nH]2)C1	ZINC000553497333	290122323	/nfs/dbraw/zinc/12/23/23/290122323.db2.gz	BUOJILJYPHZPDS-JTQLQIEISA-N	1	0	290.342	1.660	50	0		CDAARO
COc1ccc2c3c1O[C@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)[NH2+]CC[C@]314	ZINC000004217170	295278565	/nfs/dbraw/zinc/27/85/65/295278565.db2.gz	HKOIXWVRNLGFOR-KOFBORESSA-N	1	0	285.343	1.159	50	0	world	CDAARO
Cc1nn(-c2ccccc2)cc1C(=O)NC[C@H]1CCC[NH2+]1	ZINC000178759721	315959563	/nfs/dbraw/zinc/95/95/63/315959563.db2.gz	BBWMLKMWAPNSSC-CYBMUJFWSA-N	1	0	284.363	1.663	50	0		CDAARO
C[C@H](Cn1cncn1)[NH2+]CCCOC1CCCC1	ZINC000534583293	328312531	/nfs/dbraw/zinc/31/25/31/328312531.db2.gz	JUMGYPNLOXYRJW-GFCCVEGCSA-N	1	0	252.362	1.606	50	0		CDAARO
COc1cc(C(=O)NCC2(C[NH+]3CCCC3)CC2)ccn1	ZINC000534586985	328315880	/nfs/dbraw/zinc/31/58/80/328315880.db2.gz	WDBNTGXHBHWQPU-UHFFFAOYSA-N	1	0	289.379	1.696	50	0		CDAARO
COc1nccnc1NC[C@H](c1cccc(C)c1)[NH+](C)C	ZINC000534666897	328345565	/nfs/dbraw/zinc/34/55/65/328345565.db2.gz	OBHCMCKOPYRIEQ-CQSZACIVSA-N	1	0	286.379	1.930	50	0		CDAARO
CN(Cc1ccc2nsnc2c1)C(=O)[C@H]1C=CC[NH2+]1	ZINC000534663500	328351552	/nfs/dbraw/zinc/35/15/52/328351552.db2.gz	XNPOXEWJTBDGRK-LLVKDONJSA-N	1	0	274.349	1.178	50	0		CDAARO
Cc1ncn(C)c1C(=O)N[C@@H](C)C1CC[NH+](C)CC1	ZINC000534676207	328351828	/nfs/dbraw/zinc/35/18/28/328351828.db2.gz	CMKWLEFUQWHHNX-JTQLQIEISA-N	1	0	264.373	1.189	50	0		CDAARO
CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)NC[C@H]1CCCCO1	ZINC000096436229	329526349	/nfs/dbraw/zinc/52/63/49/329526349.db2.gz	CEJJGMRBYNDVFF-HUUCEWRRSA-N	1	0	298.427	1.465	50	0		CDAARO
COc1cc(F)ccc1C[N@@H+]1C[C@@H]2COCC[C@]2(CO)C1	ZINC001772712699	1159446967	/nfs/dbraw/zinc/44/69/67/1159446967.db2.gz	WQXWCMYMGOMYNA-CZUORRHYSA-N	1	0	295.354	1.665	50	0		CDAARO
C[N@H+](CCCn1cccn1)CCC1(O)CCCC1	ZINC000670434328	482968692	/nfs/dbraw/zinc/96/86/92/482968692.db2.gz	UNRLJWUJWAGADF-UHFFFAOYSA-N	1	0	251.374	1.900	50	0		CDAARO
COc1ccc2[nH]c(CNC(=O)[C@@H]3C=CC[NH2+]3)cc2c1	ZINC000670446555	482998087	/nfs/dbraw/zinc/99/80/87/482998087.db2.gz	MOXCYKWNAJXPRQ-AWEZNQCLSA-N	1	0	271.320	1.321	50	0		CDAARO
Cc1ccc2ncn([C@@H]3COC4(C3)CC[NH2+]CC4)c(=O)c2c1	ZINC000670451527	483013338	/nfs/dbraw/zinc/01/33/38/483013338.db2.gz	OSIDPTDNVOPGPK-ZDUSSCGKSA-N	1	0	299.374	1.789	50	0		CDAARO
c1c[nH]c(CC[NH+]2CCN(c3nc4ccccc4o3)CC2)n1	ZINC000670451742	483014216	/nfs/dbraw/zinc/01/42/16/483014216.db2.gz	PEPUHAQOEAOPED-UHFFFAOYSA-N	1	0	297.362	1.916	50	0		CDAARO
CC(C)(C)NC(=O)CC[N@@H+]1CCC[C@H](CCCO)C1	ZINC000670457426	483037730	/nfs/dbraw/zinc/03/77/30/483037730.db2.gz	IPMHNWUVVAMDTR-CYBMUJFWSA-N	1	0	270.417	1.776	50	0		CDAARO
Cc1nccn1C[C@@H]1CCC[N@H+](CCN2CCCC2=O)C1	ZINC000670463537	483052951	/nfs/dbraw/zinc/05/29/51/483052951.db2.gz	ITJQAWSRIIMWML-OAHLLOKOSA-N	1	0	290.411	1.526	50	0		CDAARO
CCC(=O)N1CCC[C@H]1[C@H]1CCC[N@@H+]1CCn1cccn1	ZINC000084718648	483317857	/nfs/dbraw/zinc/31/78/57/483317857.db2.gz	UIGPWOPFHNWAJL-CABCVRRESA-N	1	0	290.411	1.749	50	0		CDAARO
CC(C)COc1ccccc1CNC(=O)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000299747025	519765124	/nfs/dbraw/zinc/76/51/24/519765124.db2.gz	BWELRUUBCSAIJX-ZIAGYGMSSA-N	1	0	292.379	1.060	50	0		CDAARO
C[NH2+]CC(=O)N1CC[C@@H](c2ccc3ccccc3c2)[C@H](O)C1	ZINC000067983364	521960269	/nfs/dbraw/zinc/96/02/69/521960269.db2.gz	WCCHJAIJWUVZHE-DLBZAZTESA-N	1	0	298.386	1.736	50	0		CDAARO
CN(CCCNC(=O)[C@@H]1CCC[NH2+]C1)c1ccccc1	ZINC000019408852	522762894	/nfs/dbraw/zinc/76/28/94/522762894.db2.gz	BWSCVYRBWZJHTH-CQSZACIVSA-N	1	0	275.396	1.629	50	0		CDAARO
O=C(NCCCOC1CCCCC1)[C@@H]1CCC[NH2+]C1	ZINC000040829770	527683069	/nfs/dbraw/zinc/68/30/69/527683069.db2.gz	FRCHQWMTPAZAKN-CYBMUJFWSA-N	1	0	268.401	1.842	50	0		CDAARO
CCNC(=O)N1CCC([NH2+]C[C@](C)(O)[C@H](C)CC)CC1	ZINC000096492712	528125947	/nfs/dbraw/zinc/12/59/47/528125947.db2.gz	NRCVVNFRXIFIPG-DOMZBBRYSA-N	1	0	285.432	1.567	50	0		CDAARO
CC(C)CS(=O)(=O)N1CCC(CC[NH+](C)C)CC1	ZINC000096502869	528204681	/nfs/dbraw/zinc/20/46/81/528204681.db2.gz	UZVFAQOZMYWIRV-UHFFFAOYSA-N	1	0	276.446	1.636	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@@H]([NH3+])C(C)(C)C)C1	ZINC000958527868	613973265	/nfs/dbraw/zinc/97/32/65/613973265.db2.gz	HKDKSINENXVMRU-VIFPVBQESA-N	1	0	258.362	1.342	50	0		CDAARO
CC[NH2+]CCNC(=O)c1cc(-c2ccccc2O)n[nH]1	ZINC000888095983	617757458	/nfs/dbraw/zinc/75/74/58/617757458.db2.gz	NIHJYLDLIKRJPU-UHFFFAOYSA-N	1	0	274.324	1.122	50	0		CDAARO
CN(C[C@@H]1Cc2ccccc2C[N@@H+]1C)c1nnc(CN)o1	ZINC001772704033	1159440010	/nfs/dbraw/zinc/44/00/10/1159440010.db2.gz	BFWXLYALUXCVHE-ZDUSSCGKSA-N	1	0	287.367	1.021	50	0		CDAARO
CC/C(C)=C/CC[N@@H+]1CCO[C@@H](C(=O)N(C)C)C1	ZINC000822289026	1161927964	/nfs/dbraw/zinc/92/79/64/1161927964.db2.gz	UUCLKKDKHPKVCY-BWODNOAJSA-N	1	0	254.374	1.522	50	0		CDAARO
CCc1nn(C)c(NC(=O)CC2CC[NH2+]CC2)c1C	ZINC001704355672	1177690817	/nfs/dbraw/zinc/69/08/17/1177690817.db2.gz	WNGHPYBBWQLPFB-UHFFFAOYSA-N	1	0	264.373	1.619	50	0		CDAARO
C[N@@H+](Cc1cc(=O)c2cccc(Cl)c2[nH]1)C[C@H](O)CO	ZINC001704348797	1177697851	/nfs/dbraw/zinc/69/78/51/1177697851.db2.gz	WYQBPAALGHIBQC-JTQLQIEISA-N	1	0	296.754	1.379	50	0		CDAARO
CCN(C)C(=O)[C@@H](C)[N@H+](C)CCc1c(C)n[nH]c1C	ZINC001704351426	1177698774	/nfs/dbraw/zinc/69/87/74/1177698774.db2.gz	IKIUKWZMDKHQHM-GFCCVEGCSA-N	1	0	266.389	1.368	50	0		CDAARO
O[C@H](Cn1cc(C[C@@H]2CC[NH2+]C2)nn1)c1ccccc1	ZINC000585135456	1164217293	/nfs/dbraw/zinc/21/72/93/1164217293.db2.gz	KSSICCQUBFAYRH-SWLSCSKDSA-N	1	0	272.352	1.164	50	0		CDAARO
CCCO[C@@H]1CCC[N@H+](CC(=O)NC2CCOCC2)CC1	ZINC000108397677	736862486	/nfs/dbraw/zinc/86/24/86/736862486.db2.gz	MFHUPCOOSIJGJV-OAHLLOKOSA-N	1	0	298.427	1.563	50	0		CDAARO
C/C=C(\C)C[NH+]1CCC(Cn2cc(CCCO)nn2)CC1	ZINC000020452742	736973216	/nfs/dbraw/zinc/97/32/16/736973216.db2.gz	AFZSLADOSKKGOT-LZWSPWQCSA-N	1	0	292.427	1.881	50	0		CDAARO
CCn1cc(CN2CC[N@H+](C(C)C)[C@@H](CCO)C2)cn1	ZINC000023153396	737879692	/nfs/dbraw/zinc/87/96/92/737879692.db2.gz	YERCPNLFYDEVSO-HNNXBMFYSA-N	1	0	280.416	1.180	50	0		CDAARO
CN1CC[N@@H+]([C@H]2CCc3ccccc3C2)CCC1=O	ZINC000015001438	738557680	/nfs/dbraw/zinc/55/76/80/738557680.db2.gz	UTWWNULLMWJFNU-HNNXBMFYSA-N	1	0	258.365	1.708	50	0		CDAARO
O[C@H]1CCC[N@H+](CCNc2ncc(Cl)cc2F)C1	ZINC000032576280	738813306	/nfs/dbraw/zinc/81/33/06/738813306.db2.gz	GMLAAEDKCXECOL-JTQLQIEISA-N	1	0	273.739	1.743	50	0		CDAARO
O[C@@H]1CN(Cc2ncc[nH]2)CC[C@H]1[NH+]1CCCCCC1	ZINC000012304670	736383948	/nfs/dbraw/zinc/38/39/48/736383948.db2.gz	AQBXSSBJDFYEGP-ZIAGYGMSSA-N	1	0	278.400	1.221	50	0		CDAARO
[NH3+]C[C@H]1CC[N@H+](Cc2ccccc2Cn2cccn2)C1	ZINC000067725966	737695528	/nfs/dbraw/zinc/69/55/28/737695528.db2.gz	QQDLRMGIVLAACV-CQSZACIVSA-N	1	0	270.380	1.712	50	0		CDAARO
COc1ccc(C[N@H+]2C[C@@H]3[C@H](O)CC[C@@H]3C2)c(OC)c1	ZINC000675011254	899863510	/nfs/dbraw/zinc/86/35/10/899863510.db2.gz	MQPJQNNJERNMHV-BYCMXARLSA-N	1	0	277.364	1.907	50	0		CDAARO
Cc1nc(CO[C@@H]2CCC[N@@H+](C3CCOCC3)C2)no1	ZINC000675017734	899870876	/nfs/dbraw/zinc/87/08/76/899870876.db2.gz	YKOLODHCQPMEFI-CYBMUJFWSA-N	1	0	281.356	1.538	50	0		CDAARO
C[C@@H]([NH2+]Cc1ccsc1S(N)(=O)=O)C1CC1	ZINC000952883703	910455378	/nfs/dbraw/zinc/45/53/78/910455378.db2.gz	OTZVTJMAZCPZQL-SSDOTTSWSA-N	1	0	260.384	1.284	50	0		CDAARO
C[C@H](Nc1cccc(C(N)=O)n1)C1CC[NH+](C)CC1	ZINC000820838699	925552585	/nfs/dbraw/zinc/55/25/85/925552585.db2.gz	ZRVYNINYDYGVDB-JTQLQIEISA-N	1	0	262.357	1.323	50	0		CDAARO
CC(C)(CN1CCOCC1)C[N@@H+]1CC[C@H](C(C)(C)O)C1	ZINC000821285357	925576999	/nfs/dbraw/zinc/57/69/99/925576999.db2.gz	HWIWONUZPCYGEJ-AWEZNQCLSA-N	1	0	284.444	1.438	50	0		CDAARO
CCCc1nc(NCC[NH+]2CCC(CO)CC2)no1	ZINC000823023354	925666794	/nfs/dbraw/zinc/66/67/94/925666794.db2.gz	VYLVNXFHRXFGND-UHFFFAOYSA-N	1	0	268.361	1.138	50	0		CDAARO
CCS(=O)(=O)N[C@@H](C[NH+]1CCCC1)C(C)(C)C	ZINC000823412716	925693588	/nfs/dbraw/zinc/69/35/88/925693588.db2.gz	LNFAQRQZKIYLCS-NSHDSACASA-N	1	0	262.419	1.436	50	0		CDAARO
CN(Cc1ccccc1)S(=O)(=O)NC[C@H]1CCC[N@@H+]1C	ZINC000823773835	925726617	/nfs/dbraw/zinc/72/66/17/925726617.db2.gz	QOLXKRQJZBFUTC-CQSZACIVSA-N	1	0	297.424	1.047	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CN1CCC(OCCOC)CC1	ZINC000824445040	925822572	/nfs/dbraw/zinc/82/25/72/925822572.db2.gz	JFEBEMNFJNZWKN-CQSZACIVSA-N	1	0	270.417	1.598	50	0		CDAARO
Cc1ccc(C)c(OCCNC(=O)N2CC[C@H]([NH3+])C2)c1	ZINC000826951606	925925809	/nfs/dbraw/zinc/92/58/09/925925809.db2.gz	GYUSMKVLMAHXJB-ZDUSSCGKSA-N	1	0	277.368	1.425	50	0		CDAARO
Nc1ncc(C[NH+]2CCC(Cn3ccnc3)CC2)s1	ZINC000827590624	925948622	/nfs/dbraw/zinc/94/86/22/925948622.db2.gz	MZELDEDXQATLPN-UHFFFAOYSA-N	1	0	277.397	1.834	50	0		CDAARO
Cc1nc(N)nc(NCC[N@@H+]2CCC[C@H](CO)C2)c1Cl	ZINC000828711178	926168531	/nfs/dbraw/zinc/16/85/31/926168531.db2.gz	NGYZSOLDPQHTBH-JTQLQIEISA-N	1	0	299.806	1.137	50	0		CDAARO
C[C@@H](C[NH+]1CCCC1)C(=O)NCc1cccc(CO)c1	ZINC000828827562	926193345	/nfs/dbraw/zinc/19/33/45/926193345.db2.gz	DGVPQZSJRFFOLE-ZDUSSCGKSA-N	1	0	276.380	1.527	50	0		CDAARO
CCCn1nc(C)cc1NC(=O)[C@@H]1CCCC[NH2+]1	ZINC001529173604	969003756	/nfs/dbraw/zinc/00/37/56/969003756.db2.gz	MZMMFOKEAMGIRO-NSHDSACASA-N	1	0	250.346	1.682	50	0		CDAARO
CC(=O)c1ccc(NCC[N@@H+]2CCCC[C@H]2CO)nc1	ZINC001506397436	975147520	/nfs/dbraw/zinc/14/75/20/975147520.db2.gz	NCTOURPIPOVPJY-AWEZNQCLSA-N	1	0	277.368	1.543	50	0		CDAARO
CN(Cc1nc2cc(Cl)ccc2[nH]1)C(=O)[C@H]1CCC[NH2+]1	ZINC001506408758	975152720	/nfs/dbraw/zinc/15/27/20/975152720.db2.gz	PPVVNOCJDGSHNR-LLVKDONJSA-N	1	0	292.770	1.927	50	0		CDAARO
Cc1cnc(CN2CCC[N@H+](Cc3ccccn3)CC2)cn1	ZINC001506418109	975157330	/nfs/dbraw/zinc/15/73/30/975157330.db2.gz	DMIRYLHTDVRRSP-UHFFFAOYSA-N	1	0	297.406	1.888	50	0		CDAARO
COCC[C@H]1CCC[N@H+](CCn2c(=O)cc(C)[nH]c2=O)C1	ZINC001506425206	975159105	/nfs/dbraw/zinc/15/91/05/975159105.db2.gz	OFOOCUJTLUWCPS-CYBMUJFWSA-N	1	0	295.383	1.006	50	0		CDAARO
Cc1c(NC(=O)CC2C[NH2+]C2)cccc1C(=O)N(C)C	ZINC001506424500	975159295	/nfs/dbraw/zinc/15/92/95/975159295.db2.gz	KHRLSHQFSWVEAC-UHFFFAOYSA-N	1	0	275.352	1.245	50	0		CDAARO
OCC[NH+](CCO)Cc1ccc(Br)c(F)c1	ZINC000096452798	230376368	/nfs/dbraw/zinc/37/63/68/230376368.db2.gz	FGQRZIZAAXHYBA-UHFFFAOYSA-N	1	0	292.148	1.375	50	0		CDAARO
Cc1nonc1CNC(=O)Cc1cnc2c(C)cccn12	ZINC000584902372	341986880	/nfs/dbraw/zinc/98/68/80/341986880.db2.gz	XCCFBENLFUBIRK-UHFFFAOYSA-N	1	0	285.307	1.193	50	0		CDAARO
Cc1csc(C[NH2+][C@H]2CCCCC[C@@H]2C(N)=O)n1	ZINC000097375076	342002782	/nfs/dbraw/zinc/00/27/82/342002782.db2.gz	WJNJEGXBLSJXOI-QWRGUYRKSA-N	1	0	267.398	1.975	50	0		CDAARO
Cc1cc([C@@H]2CCCN(C(=O)[C@H]3CCCC[N@H+]3C)C2)[nH]n1	ZINC000084110276	539086184	/nfs/dbraw/zinc/08/61/84/539086184.db2.gz	GWOYZULSCDQUQW-UKRRQHHQSA-N	1	0	290.411	1.908	50	0		CDAARO
CCOc1cccc(NC(=O)NCC[NH+](C)C)n1	ZINC000095943361	185037289	/nfs/dbraw/zinc/03/72/89/185037289.db2.gz	YSCPCNUWRUACIE-UHFFFAOYSA-N	1	0	252.318	1.163	50	0		CDAARO
CC(C)[N@@H+]1CCCN(C(=O)c2nccn3ccnc23)CC1	ZINC000095962370	185044465	/nfs/dbraw/zinc/04/44/65/185044465.db2.gz	VZILEFAYAIDHBO-UHFFFAOYSA-N	1	0	287.367	1.286	50	0		CDAARO
CNc1cc(C(=O)N2CCC[C@H](C[NH3+])C2)cc(Cl)n1	ZINC000095971556	185048994	/nfs/dbraw/zinc/04/89/94/185048994.db2.gz	DXTBXXAVJSFSIT-SECBINFHSA-N	1	0	282.775	1.588	50	0		CDAARO
Cc1cc(N(CC[NH+](C)C)Cc2cccnc2)ncn1	ZINC000095972071	185049367	/nfs/dbraw/zinc/04/93/67/185049367.db2.gz	KPBXIDQAVIMQBA-UHFFFAOYSA-N	1	0	271.368	1.748	50	0		CDAARO
CC1(C)[C@H]([NH2+]CCOC[C@@H]2CCCO2)[C@@H]2CCCO[C@@H]21	ZINC000095987917	185057140	/nfs/dbraw/zinc/05/71/40/185057140.db2.gz	HHEAYRIWFSXUAZ-XQLPTFJDSA-N	1	0	283.412	1.975	50	0		CDAARO
[NH3+]CCc1ccc(C(=O)NCc2cccc(CO)c2)cc1	ZINC000227281062	342089776	/nfs/dbraw/zinc/08/97/76/342089776.db2.gz	LRVXTQLNBVNRJB-UHFFFAOYSA-N	1	0	284.359	1.610	50	0		CDAARO
CC1(C)C[C@@H](O)CCN(C(=O)CC2CC[NH2+]CC2)C1	ZINC000395358085	342089961	/nfs/dbraw/zinc/08/99/61/342089961.db2.gz	VSPFHSRIZKWPDY-ZDUSSCGKSA-N	1	0	268.401	1.386	50	0		CDAARO
CCc1cc(C(=O)N[C@@H]2C[NH2+]C[C@@H]2OC)oc1CC	ZINC000195554098	342625797	/nfs/dbraw/zinc/62/57/97/342625797.db2.gz	WJBZIYRSMSHIAB-MFKMUULPSA-N	1	0	266.341	1.121	50	0		CDAARO
O[C@H]1CN(CCCc2cccnc2)C[C@@H]1[NH+]1CCCCC1	ZINC000244678751	361856607	/nfs/dbraw/zinc/85/66/07/361856607.db2.gz	IJEWNUGCCOKROG-IRXDYDNUSA-N	1	0	289.423	1.545	50	0		CDAARO
Cc1ccn(CCN2CCC([NH+]3CCSCC3)CC2)n1	ZINC000244748685	361861667	/nfs/dbraw/zinc/86/16/67/361861667.db2.gz	OMLICLOLTFOBGX-UHFFFAOYSA-N	1	0	294.468	1.705	50	0		CDAARO
CSCCN(C)c1cc([C@H]2C[C@@H]([NH3+])C2)nc(N)n1	ZINC000244774263	361863837	/nfs/dbraw/zinc/86/38/37/361863837.db2.gz	PQWKROOJYPNONG-DTORHVGOSA-N	1	0	267.402	1.063	50	0		CDAARO
O=C1NCCN1C1CC[NH+](CC2(O)CCCCC2)CC1	ZINC000065511448	361908879	/nfs/dbraw/zinc/90/88/79/361908879.db2.gz	BNFJKFFSBCWDQB-UHFFFAOYSA-N	1	0	281.400	1.171	50	0		CDAARO
CO[C@@H]1CC[C@H]2OCC[N@H+](CCCCCO)[C@@H]2C1	ZINC000097021417	185153777	/nfs/dbraw/zinc/15/37/77/185153777.db2.gz	DSRCOAFQYOTZAX-MGPQQGTHSA-N	1	0	257.374	1.417	50	0		CDAARO
COC(=O)c1cc(C[NH2+][C@H](C)[C@@H]2CCOC2)oc1C	ZINC000097034931	185156914	/nfs/dbraw/zinc/15/69/14/185156914.db2.gz	FYZSMVYYYOBMEO-MWLCHTKSSA-N	1	0	267.325	1.889	50	0		CDAARO
CN(C[C@@H]1CCCCO1)[C@H]1CCC[C@H]1S(C)(=O)=O	ZINC000245339365	342216293	/nfs/dbraw/zinc/21/62/93/342216293.db2.gz	SGQPAUNMPHTOCQ-RWMBFGLXSA-N	1	0	275.414	1.453	50	0		CDAARO
Cc1ccc(CN2CC[NH2+]C[C@@H]2[C@@H](C)O)cc1F	ZINC000072233479	342273157	/nfs/dbraw/zinc/27/31/57/342273157.db2.gz	ATGXCDYQDUKQRG-BXUZGUMPSA-N	1	0	252.333	1.289	50	0		CDAARO
CCCNC(=O)N1CCC(C[NH3+])(C(F)(F)F)CC1	ZINC000725264801	539162020	/nfs/dbraw/zinc/16/20/20/539162020.db2.gz	ZQGXYDXJKGVNIA-UHFFFAOYSA-N	1	0	267.295	1.709	50	0		CDAARO
CO[C@@H](C[NH2+]CCc1ccncc1C)C1CCOCC1	ZINC000585116601	362045416	/nfs/dbraw/zinc/04/54/16/362045416.db2.gz	CHWQMXIPFQOYDZ-INIZCTEOSA-N	1	0	278.396	1.964	50	0		CDAARO
Cc1nnc2n1C[C@@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1C1CC1)CC2	ZINC000585123194	362052261	/nfs/dbraw/zinc/05/22/61/362052261.db2.gz	MPALWFUWACZIAY-HBEIAFGSSA-N	1	0	260.385	1.926	50	0		CDAARO
CCCCS(=O)(=O)NCC1([NH+](C)C)CCCCC1	ZINC000078322401	342335588	/nfs/dbraw/zinc/33/55/88/342335588.db2.gz	BYNXWQJNLBDSKT-UHFFFAOYSA-N	1	0	276.446	1.970	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)CC[C@@H]1CC[C@H](C)O1	ZINC000262586010	290690295	/nfs/dbraw/zinc/69/02/95/290690295.db2.gz	OTMMATUDRJDRDH-AVGNSLFASA-N	1	0	254.374	1.545	50	0		CDAARO
C[C@@H]1CN(C(=O)CCc2nc3ccccc3[nH]2)C[C@@H](C)[NH2+]1	ZINC000179160974	362253737	/nfs/dbraw/zinc/25/37/37/362253737.db2.gz	JESMJWNZGNQNBC-VXGBXAGGSA-N	1	0	286.379	1.704	50	0		CDAARO
CCSCC[C@H](C)NC(=O)N1CCN(CC)CC1	ZINC000084789240	362271324	/nfs/dbraw/zinc/27/13/24/362271324.db2.gz	YIFQJPVYWZZPHY-LBPRGKRZSA-N	1	0	273.446	1.865	50	0		CDAARO
CCn1ccnc1CN(C)c1cc([C@H]2C[C@H]([NH3+])C2)ncn1	ZINC000252522861	362391900	/nfs/dbraw/zinc/39/19/00/362391900.db2.gz	BIBCRHULGAQIRW-HAQNSBGRSA-N	1	0	286.383	1.534	50	0		CDAARO
C[C@H]([NH2+][C@@H]1CCCC1(C)C)C(=O)NC[C@H]1CCCO1	ZINC000191307234	362410673	/nfs/dbraw/zinc/41/06/73/362410673.db2.gz	XGDGAEZWESZAQU-YNEHKIRRSA-N	1	0	268.401	1.838	50	0		CDAARO
CCOC(=O)c1csc(CN(C)CCCO)n1	ZINC000292875105	362508364	/nfs/dbraw/zinc/50/83/64/362508364.db2.gz	HYDNFQLEFAHSQN-UHFFFAOYSA-N	1	0	258.343	1.134	50	0		CDAARO
CCOc1cc(N2CCN(c3cc[nH+]cc3)CC2)ncn1	ZINC000120794474	136580397	/nfs/dbraw/zinc/58/03/97/136580397.db2.gz	MWPJLGOAYGUXEY-UHFFFAOYSA-N	1	0	285.351	1.597	50	0		CDAARO
CCC[NH+](CCC)CC1=C(C(=O)OCC)CNC(=O)N1	ZINC000036744624	362911251	/nfs/dbraw/zinc/91/12/51/362911251.db2.gz	DSLHKQSRHCFQSB-UHFFFAOYSA-N	1	0	283.372	1.238	50	0		CDAARO
Cc1cc(O)ccc1C(=O)NCC[N@@H+]1CCC[C@H](CO)C1	ZINC000584884533	349342636	/nfs/dbraw/zinc/34/26/36/349342636.db2.gz	KCAHCGUXJJIEPS-ZDUSSCGKSA-N	1	0	292.379	1.135	50	0		CDAARO
COCC1(CNC(=O)[C@H]2CCC[NH2+]C2)CCCC1	ZINC000584886364	349345092	/nfs/dbraw/zinc/34/50/92/349345092.db2.gz	KYNGYSCTCFCAJQ-LBPRGKRZSA-N	1	0	254.374	1.309	50	0		CDAARO
C[NH+]1CCC2(CCN(C(=O)c3cnc(N)s3)C2)CC1	ZINC000584887506	349345875	/nfs/dbraw/zinc/34/58/75/349345875.db2.gz	YYNHLVDZSOMAMR-UHFFFAOYSA-N	1	0	280.397	1.114	50	0		CDAARO
Cc1nn(CCC[NH2+][C@H]2CCCOC2)c(C)c1C	ZINC000584888819	349347113	/nfs/dbraw/zinc/34/71/13/349347113.db2.gz	DIUZYRCEHYUUES-AWEZNQCLSA-N	1	0	251.374	1.967	50	0		CDAARO
C[N@@H+]1CC[C@@H](Cn2cnc3cccc(F)c3c2=O)C1	ZINC000584889181	349347945	/nfs/dbraw/zinc/34/79/45/349347945.db2.gz	FVCAVHJQTDTRAH-SNVBAGLBSA-N	1	0	261.300	1.487	50	0		CDAARO
CN(Cc1cnn2cccnc12)C[C@@H]1CCCC[N@@H+]1C	ZINC000584895335	349356086	/nfs/dbraw/zinc/35/60/86/349356086.db2.gz	JJLSHIHUVMNJKL-AWEZNQCLSA-N	1	0	273.384	1.645	50	0		CDAARO
CN1CCO[C@@H](C[NH2+]Cc2ccc(Cl)cc2)C1	ZINC000105472075	186059195	/nfs/dbraw/zinc/05/91/95/186059195.db2.gz	ZKLYCPWTVSHGAL-ZDUSSCGKSA-N	1	0	254.761	1.760	50	0		CDAARO
COc1cccc([C@H]2CN(C(=O)C=C(C)C)C[C@@H]2[NH3+])c1	ZINC000091746251	180244720	/nfs/dbraw/zinc/24/47/20/180244720.db2.gz	CAQICBVWQHJAGW-CABCVRRESA-N	1	0	274.364	1.915	50	0		CDAARO
CCN1CCC(CNc2ccncn2)([NH+](C)C)CC1	ZINC000091848708	180271056	/nfs/dbraw/zinc/27/10/56/180271056.db2.gz	VXEUMVIKAQKFRX-UHFFFAOYSA-N	1	0	263.389	1.305	50	0		CDAARO
CCc1cc(C[NH+]2CCC3(CC2)OCCC[C@@H]3O)on1	ZINC000091872080	180277912	/nfs/dbraw/zinc/27/79/12/180277912.db2.gz	NCTPGIPZEOIOOI-AWEZNQCLSA-N	1	0	280.368	1.743	50	0		CDAARO
CN1CCO[C@H]2CN(Cc3cnc(C(C)(C)C)s3)C[C@@H]21	ZINC000108327812	186210754	/nfs/dbraw/zinc/21/07/54/186210754.db2.gz	ACJPGZQYCQZIEE-STQMWFEESA-N	1	0	295.452	1.955	50	0		CDAARO
C[C@@]1(CO)CCCN1C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000121952294	187007030	/nfs/dbraw/zinc/00/70/30/187007030.db2.gz	VXLZVGIMJLESKC-INIZCTEOSA-N	1	0	297.443	1.852	50	0		CDAARO
CCCc1cc(C(=O)NC[C@H](C)C[NH+](C)C)[nH]n1	ZINC000644810280	358486495	/nfs/dbraw/zinc/48/64/95/358486495.db2.gz	FFODGLXHEWGFGY-JTQLQIEISA-N	1	0	252.362	1.290	50	0		CDAARO
[NH3+][C@@H]1CCCN(S(=O)(=O)c2ccc(F)c(F)c2)C1	ZINC000037116475	363396835	/nfs/dbraw/zinc/39/68/35/363396835.db2.gz	CQKFTQSNXMEVBH-MRVPVSSYSA-N	1	0	276.308	1.077	50	0		CDAARO
NC(=O)C1([NH+]2CCCC2)CCN(Cc2ccccc2)CC1	ZINC000000393554	355908806	/nfs/dbraw/zinc/90/88/06/355908806.db2.gz	LVKUSLBPUHAEAQ-UHFFFAOYSA-N	1	0	287.407	1.602	50	0		CDAARO
COc1ccc(NC(=S)NCC[NH+](C)C)cc1	ZINC000000460027	355912497	/nfs/dbraw/zinc/91/24/97/355912497.db2.gz	KJWXBRPRFNDJDU-UHFFFAOYSA-N	1	0	253.371	1.543	50	0		CDAARO
O=C1NCC2(CC[NH+](CCc3ccccc3)CC2)O1	ZINC000000001441	355879849	/nfs/dbraw/zinc/87/98/49/355879849.db2.gz	FVNFBBAOMBJTST-UHFFFAOYSA-N	1	0	260.337	1.804	50	0	world	CDAARO
CC(C)[N@H+](C)CC(=O)Nc1cnn(CC(F)F)c1	ZINC000116844192	355944142	/nfs/dbraw/zinc/94/41/42/355944142.db2.gz	RELWSRBIRRFNHM-UHFFFAOYSA-N	1	0	260.288	1.427	50	0		CDAARO
OCC[NH2+]Cc1cnn(-c2ccc(Cl)cc2)c1	ZINC000002025602	355958094	/nfs/dbraw/zinc/95/80/94/355958094.db2.gz	VSMKFHPKBIOYDY-UHFFFAOYSA-N	1	0	251.717	1.608	50	0		CDAARO
CN(C)C(=O)OCC[N@H+](C)CCOc1ccccc1F	ZINC000097373605	356094693	/nfs/dbraw/zinc/09/46/93/356094693.db2.gz	PHIBGJIJTQQZHS-UHFFFAOYSA-N	1	0	284.331	1.835	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2ccc(C(N)=O)s2)[C@@H]1C[NH3+]	ZINC000299739075	356267151	/nfs/dbraw/zinc/26/71/51/356267151.db2.gz	KGSYODOZTGVROB-RKDXNWHRSA-N	1	0	281.381	1.046	50	0		CDAARO
C[NH+](C)[C@H](CNc1ccc2nnnn2n1)Cc1ccccc1	ZINC000012854384	356327288	/nfs/dbraw/zinc/32/72/88/356327288.db2.gz	PWEJWVRUYKRQKZ-ZDUSSCGKSA-N	1	0	297.366	1.104	50	0		CDAARO
CN(C)c1ncccc1CNC(=O)c1ccccc1O	ZINC000032686802	356334937	/nfs/dbraw/zinc/33/49/37/356334937.db2.gz	YLEOEKDIYMJVEF-UHFFFAOYSA-N	1	0	271.320	1.783	50	0		CDAARO
COc1cc(C[NH2+]Cc2cccnc2)ccc1OCCO	ZINC000013730818	356354698	/nfs/dbraw/zinc/35/46/98/356354698.db2.gz	BFANYUVWKGGLLJ-UHFFFAOYSA-N	1	0	288.347	1.751	50	0		CDAARO
CSc1ccc(CN(C)Cc2nc(N)nc(N)n2)cc1	ZINC000032751448	356358936	/nfs/dbraw/zinc/35/89/36/356358936.db2.gz	XEPHALWQOXKQTH-UHFFFAOYSA-N	1	0	290.396	1.390	50	0		CDAARO
C[NH+](C)CCNC(=O)c1cccc(C(F)(F)F)c1	ZINC000016603452	356443025	/nfs/dbraw/zinc/44/30/25/356443025.db2.gz	WHTQXOTZZMMXKW-UHFFFAOYSA-N	1	0	260.259	1.997	50	0		CDAARO
CC[NH+]1CCC(NC(=O)COc2ccc(F)cc2)CC1	ZINC000016604715	356443121	/nfs/dbraw/zinc/44/31/21/356443121.db2.gz	KNABTSGNZCERCC-UHFFFAOYSA-N	1	0	280.343	1.805	50	0		CDAARO
CC(C)[NH+]1CCN(Cc2nc3ccccc3c(=O)[nH]2)CC1	ZINC000019447995	356485421	/nfs/dbraw/zinc/48/54/21/356485421.db2.gz	ZBDMRMPWGVLJTK-UHFFFAOYSA-N	1	0	286.379	1.449	50	0		CDAARO
Cc1ccccc1NC(=O)NCCN1CC[NH2+]CC1	ZINC000019861800	356511053	/nfs/dbraw/zinc/51/10/53/356511053.db2.gz	SYWGBNWTNZAIMR-UHFFFAOYSA-N	1	0	262.357	1.022	50	0		CDAARO
C[NH2+]C[C@H](c1ccc(OC)cc1)N1CCOCC1	ZINC000019862044	356511295	/nfs/dbraw/zinc/51/12/95/356511295.db2.gz	GHZJFSPZQRGQBT-CQSZACIVSA-N	1	0	250.342	1.288	50	0		CDAARO
C(C[NH2+][C@H]1[C@H]2CCO[C@H]2C12CCC2)CO[C@@H]1CCOC1	ZINC000194077357	358506291	/nfs/dbraw/zinc/50/62/91/358506291.db2.gz	RFMRMUZNNZFYAS-APIJFGDWSA-N	1	0	281.396	1.729	50	0		CDAARO
C[N@H+](CCCNc1ccc2nnnn2n1)C1CCCCC1	ZINC000012869792	363499154	/nfs/dbraw/zinc/49/91/54/363499154.db2.gz	YADBVYOEHAQBJV-UHFFFAOYSA-N	1	0	289.387	1.586	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)cc2c1OCO2	ZINC000023281692	356638293	/nfs/dbraw/zinc/63/82/93/356638293.db2.gz	YFPBFMBQHWUFTF-LLVKDONJSA-N	1	0	292.335	1.121	50	0		CDAARO
c1ccc(CC[NH+]2CCN(c3ncccn3)CC2)cc1	ZINC000023281372	356638386	/nfs/dbraw/zinc/63/83/86/356638386.db2.gz	UNGOCXURFURISX-UHFFFAOYSA-N	1	0	268.364	1.841	50	0		CDAARO
Cc1cc(NC(=O)C[NH+]2C[C@@H](C)C[C@H](C)C2)n(C)n1	ZINC000029597026	356739756	/nfs/dbraw/zinc/73/97/56/356739756.db2.gz	LZBXWGCXYPADTN-QWRGUYRKSA-N	1	0	264.373	1.645	50	0		CDAARO
CCC[NH2+]CCNS(=O)(=O)c1cccc2cnccc21	ZINC000027549726	356710375	/nfs/dbraw/zinc/71/03/75/356710375.db2.gz	CKDFSYRDWGXMGE-UHFFFAOYSA-N	1	0	293.392	1.513	50	0		CDAARO
O=S(=O)(N[C@H]1CCC[NH2+]C1)c1cc(F)ccc1Cl	ZINC000097896817	356779594	/nfs/dbraw/zinc/77/95/94/356779594.db2.gz	JLYRRNNXHNCWMY-VIFPVBQESA-N	1	0	292.763	1.509	50	0		CDAARO
COc1cccc([C@H](O)C[NH2+]Cc2ccccn2)c1	ZINC000032110628	356775250	/nfs/dbraw/zinc/77/52/50/356775250.db2.gz	ACNFLRAIRKXFGE-OAHLLOKOSA-N	1	0	258.321	1.913	50	0		CDAARO
[NH3+][C@@H]1CCC2(C[C@H]1OCc1ccccc1)OCCO2	ZINC000037981085	356949669	/nfs/dbraw/zinc/94/96/69/356949669.db2.gz	BJBTZUJRKVTZDI-ZIAGYGMSSA-N	1	0	263.337	1.826	50	0		CDAARO
[NH3+][C@@H](Cc1ccccc1)C(=O)NCc1cccnc1	ZINC000057332500	357354523	/nfs/dbraw/zinc/35/45/23/357354523.db2.gz	APQHKTDKDIVIPY-AWEZNQCLSA-N	1	0	255.321	1.268	50	0		CDAARO
COc1ccc(C(=O)N2CCC[C@H]([NH+](C)C)C2)cc1	ZINC000058368852	357397671	/nfs/dbraw/zinc/39/76/71/357397671.db2.gz	SFHYWPCBSPGHPV-ZDUSSCGKSA-N	1	0	262.353	1.861	50	0		CDAARO
Cc1nc(CC(=O)NCCNc2cc[nH+]cc2C)cs1	ZINC000065455608	357542072	/nfs/dbraw/zinc/54/20/72/357542072.db2.gz	IBCUGYRAILDBMP-UHFFFAOYSA-N	1	0	290.392	1.926	50	0		CDAARO
COc1cc(C)ccc1OCCN1CCC[C@H]1C(N)=O	ZINC000065491983	357544869	/nfs/dbraw/zinc/54/48/69/357544869.db2.gz	ASRRPCGALGSGRT-LBPRGKRZSA-N	1	0	278.352	1.332	50	0		CDAARO
C[N@@H+]1CCCN(Cc2nnc(CCc3ccccc3)[nH]2)CC1	ZINC000065506644	357545715	/nfs/dbraw/zinc/54/57/15/357545715.db2.gz	HXLPLOPLSOZUQZ-UHFFFAOYSA-N	1	0	299.422	1.727	50	0		CDAARO
CCC[C@H](CCc1ccccc1)NC(=O)[C@H]1C[NH2+]CCO1	ZINC000187889422	357549519	/nfs/dbraw/zinc/54/95/19/357549519.db2.gz	QLBCFSIRLMEIKJ-HZPDHXFCSA-N	1	0	290.407	1.893	50	0		CDAARO
Cc1ccccc1C[C@@]1(C2CC[NH2+]CC2)NC(=O)NC1=O	ZINC000067756955	357624928	/nfs/dbraw/zinc/62/49/28/357624928.db2.gz	AXQQNEBOYBBPBQ-INIZCTEOSA-N	1	0	287.363	1.115	50	0		CDAARO
CC(C)[NH+]1CCC(CNS(=O)(=O)N2CCCC2)CC1	ZINC000067833726	357629804	/nfs/dbraw/zinc/62/98/04/357629804.db2.gz	IVRHSBSSBRWHEC-UHFFFAOYSA-N	1	0	289.445	1.037	50	0		CDAARO
CSC(C)(C)C[C@H](C)[NH2+]CCS(=O)(=O)N(C)C	ZINC000067642894	357616494	/nfs/dbraw/zinc/61/64/94/357616494.db2.gz	SNMYCPAFCLWRJH-JTQLQIEISA-N	1	0	282.475	1.388	50	0		CDAARO
C[C@H](C[NH+]1CCC2(CC1)NCCNC2=O)c1ccccc1	ZINC000067868037	357633837	/nfs/dbraw/zinc/63/38/37/357633837.db2.gz	YUZVYRGEGCCOEY-CQSZACIVSA-N	1	0	287.407	1.344	50	0		CDAARO
Cc1cc(F)cc(CN2CC[C@]([NH3+])(C(=O)[O-])C2)c1	ZINC000067947665	357638112	/nfs/dbraw/zinc/63/81/12/357638112.db2.gz	ZSWZXIUEJDERGD-CYBMUJFWSA-N	1	0	252.289	1.122	50	0		CDAARO
[NH3+]C1CCN(C(=O)c2cc(-c3ccccc3)n[nH]2)CC1	ZINC000070451517	357724610	/nfs/dbraw/zinc/72/46/10/357724610.db2.gz	NVYOMHKHVOQBKQ-UHFFFAOYSA-N	1	0	270.336	1.640	50	0		CDAARO
CC[NH+](CC)CCN1c2ccccc2[C@@H](NC(C)=O)C1=O	ZINC000004722589	357816829	/nfs/dbraw/zinc/81/68/29/357816829.db2.gz	YXWTVIXRNPWMIS-OAHLLOKOSA-N	1	0	289.379	1.552	50	0		CDAARO
CCc1cnc(C)nc1N1CCO[C@H](CC[NH+](C)C)C1	ZINC000071765236	357780153	/nfs/dbraw/zinc/78/01/53/357780153.db2.gz	GHNZXRUZFWKXHU-CQSZACIVSA-N	1	0	278.400	1.504	50	0		CDAARO
c1nc2c(c(N3CCOC4(CCCC4)C3)n1)CC[NH2+]CC2	ZINC000072433302	357836075	/nfs/dbraw/zinc/83/60/75/357836075.db2.gz	SNOXFTLPPOCBNU-UHFFFAOYSA-N	1	0	288.395	1.314	50	0		CDAARO
CCCc1cnc(C)nc1NC[C@@H]1CC[NH2+]C[C@H]1O	ZINC000072454438	357837030	/nfs/dbraw/zinc/83/70/30/357837030.db2.gz	NWHIYIQTGIKMIH-WCQYABFASA-N	1	0	264.373	1.120	50	0		CDAARO
C[NH+](C)CCNC(=O)C(=O)Nc1nc(C(C)(C)C)cs1	ZINC000097117605	357990197	/nfs/dbraw/zinc/99/01/97/357990197.db2.gz	FACDNNLJMLCXGN-UHFFFAOYSA-N	1	0	298.412	1.057	50	0		CDAARO
CCS(=O)(=O)NCCC[NH2+]C1C[C@H](C)C[C@@H](C)C1	ZINC000097229307	358043266	/nfs/dbraw/zinc/04/32/66/358043266.db2.gz	HZYAOINMQVEPOC-VXGBXAGGSA-N	1	0	276.446	1.730	50	0		CDAARO
[NH3+]C1(C(=O)N2CCC[C@@H](c3nccn3CC3CC3)C2)CC1	ZINC000082106662	358147082	/nfs/dbraw/zinc/14/70/82/358147082.db2.gz	SVCMWNWSXJLIOY-CYBMUJFWSA-N	1	0	288.395	1.490	50	0		CDAARO
Cc1cn2cc(C(=O)N3CC([NH+]4CCCCC4)C3)ccc2n1	ZINC000082106409	358147117	/nfs/dbraw/zinc/14/71/17/358147117.db2.gz	ZTQWJMSDUJWVPG-UHFFFAOYSA-N	1	0	298.390	1.953	50	0		CDAARO
CC(C)OC[C@H](O)C[N@H+](C)CCOc1ccccc1	ZINC000098066280	358354781	/nfs/dbraw/zinc/35/47/81/358354781.db2.gz	OMQWRDOGTSACFD-CQSZACIVSA-N	1	0	267.369	1.783	50	0		CDAARO
COc1cccc([C@@H]2CN(C(=O)[C@@H]([NH3+])C(C)C)CCO2)c1	ZINC000195554404	358556706	/nfs/dbraw/zinc/55/67/06/358556706.db2.gz	ABUACHFVWCPLLF-GJZGRUSLSA-N	1	0	292.379	1.578	50	0		CDAARO
CCc1oc(C(=O)NC[C@@H]2CCC[NH2+]C2)cc1C	ZINC000195542798	358559914	/nfs/dbraw/zinc/55/99/14/358559914.db2.gz	PPEWZIBSMJRXLJ-LLVKDONJSA-N	1	0	250.342	1.880	50	0		CDAARO
C/C=C/CC(=O)N1CC[N@H+](C)[C@]2(C1)CCC(=O)N(C)CC2	ZINC000095379125	358689537	/nfs/dbraw/zinc/68/95/37/358689537.db2.gz	FEJZNGQUSGDAKO-DWTRPJMMSA-N	1	0	293.411	1.108	50	0		CDAARO
O=c1cc(C[NH2+]CCc2c[nH]cn2)[nH]c2ccc(F)cc12	ZINC000095380247	358690514	/nfs/dbraw/zinc/69/05/14/358690514.db2.gz	IVFIRDQLFWHRDI-UHFFFAOYSA-N	1	0	286.310	1.723	50	0		CDAARO
CCC[C@@H](Nc1cc(C(C)C)[nH+]c(N)n1)C(=O)NC	ZINC000095381393	358690613	/nfs/dbraw/zinc/69/06/13/358690613.db2.gz	MPZXPYNIOAQANM-SECBINFHSA-N	1	0	265.361	1.509	50	0		CDAARO
O=C(c1cc(-c2ccccn2)n[nH]1)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000097514221	358781620	/nfs/dbraw/zinc/78/16/20/358781620.db2.gz	QPKMSLYVANWRKT-NEPJUHHUSA-N	1	0	297.362	1.438	50	0		CDAARO
Cc1ccc(C(=O)N2CC[C@H](N3CC[NH+](C)CC3)C2)s1	ZINC000215534625	358894333	/nfs/dbraw/zinc/89/43/33/358894333.db2.gz	POLHKLAJFBICMI-ZDUSSCGKSA-N	1	0	293.436	1.518	50	0		CDAARO
[NH3+]C1CC(c2cc(N[C@H](CO)c3ccccc3)ncn2)C1	ZINC000219233827	359083755	/nfs/dbraw/zinc/08/37/55/359083755.db2.gz	KKVWSCBHRIPXSR-SSDMNJCBSA-N	1	0	284.363	1.827	50	0		CDAARO
O=C(CCc1ccccc1)C(=O)NC[C@@H]1CCCCC[NH2+]1	ZINC000219901917	359137456	/nfs/dbraw/zinc/13/74/56/359137456.db2.gz	TYLAQYZVNCHZBC-HNNXBMFYSA-N	1	0	288.391	1.837	50	0		CDAARO
C[C@@]1(O)CCCN(C(=O)CCCn2ccnc2)CC1	ZINC000221398804	359245456	/nfs/dbraw/zinc/24/54/56/359245456.db2.gz	KPFQMEFPWYIRIG-CQSZACIVSA-N	1	0	265.357	1.427	50	0		CDAARO
COCCCNC(=O)C[N@@H+]1CC[C@H](Nc2ccccc2)C1	ZINC000089410279	359266503	/nfs/dbraw/zinc/26/65/03/359266503.db2.gz	KSGNLXYCCZALFU-HNNXBMFYSA-N	1	0	291.395	1.326	50	0		CDAARO
C[C@@H]1CCC[C@H]1OC[C@@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000222484490	359348091	/nfs/dbraw/zinc/34/80/91/359348091.db2.gz	NOPQVBCPBSUPGR-NIFZNCRKSA-N	1	0	271.401	1.662	50	0		CDAARO
Nc1cccc(C(=O)N2CCC[C@@H](C[NH+]3CCCC3)C2)n1	ZINC000223334441	359417302	/nfs/dbraw/zinc/41/73/02/359417302.db2.gz	WDTHFYKAHQHYDQ-ZDUSSCGKSA-N	1	0	288.395	1.612	50	0		CDAARO
C[NH+](C)CCNc1cnn(-c2ccccc2)c(=O)c1Cl	ZINC000000118611	359397409	/nfs/dbraw/zinc/39/74/09/359397409.db2.gz	MCUNRGBAJOWOMC-UHFFFAOYSA-N	1	0	292.770	1.859	50	0		CDAARO
Cc1noc(C)c1C[NH+]1CCC2(CC1)C[C@H](O)CCO2	ZINC000257191066	359537353	/nfs/dbraw/zinc/53/73/53/359537353.db2.gz	OVOBDFLPVQFAGB-CYBMUJFWSA-N	1	0	280.368	1.797	50	0		CDAARO
COCCn1c(C)cnc1CO[C@H]1CCC[N@H+](C)C1	ZINC000257191944	359589426	/nfs/dbraw/zinc/58/94/26/359589426.db2.gz	RWKXWOPYIGOYGJ-ZDUSSCGKSA-N	1	0	267.373	1.449	50	0		CDAARO
C[NH+](C)CCN(Cc1ccco1)S(=O)(=O)C1CC1	ZINC000119376070	359899527	/nfs/dbraw/zinc/89/95/27/359899527.db2.gz	UZIQFCYEIPCFJF-UHFFFAOYSA-N	1	0	272.370	1.135	50	0		CDAARO
Cc1ccc2c(c1)[C@H]([NH2+]CCN1CCCS1(=O)=O)CC2	ZINC000089519435	360134883	/nfs/dbraw/zinc/13/48/83/360134883.db2.gz	NWIWYUBLOWXVBJ-OAHLLOKOSA-N	1	0	294.420	1.607	50	0		CDAARO
Cc1nc(CN2CCC[C@@H]([NH2+]C[C@H]3CCCCO3)C2)no1	ZINC000247964537	360276148	/nfs/dbraw/zinc/27/61/48/360276148.db2.gz	PYKGXQHVNLCPEC-ZIAGYGMSSA-N	1	0	294.399	1.501	50	0		CDAARO
COc1cccc2c1OC[C@@H]([NH2+]CCN1CCOC1=O)C2	ZINC000011874052	360384893	/nfs/dbraw/zinc/38/48/93/360384893.db2.gz	ORXZSNSZEDGPEZ-LBPRGKRZSA-N	1	0	292.335	1.041	50	0		CDAARO
Cc1nc([C@H]2CCOC2)cc(N2CCC(C[NH3+])CC2)n1	ZINC000426492728	360573769	/nfs/dbraw/zinc/57/37/69/360573769.db2.gz	AUBCELDWWRVJHR-ZDUSSCGKSA-N	1	0	276.384	1.464	50	0		CDAARO
Cc1ccc(OCC(=O)N2CC[C@@H](C[NH3+])C2)cc1C	ZINC000178534929	189124702	/nfs/dbraw/zinc/12/47/02/189124702.db2.gz	DHEKFWLHSWEPHZ-ZDUSSCGKSA-N	1	0	262.353	1.489	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cc(F)cc3nccnc32)C1	ZINC000178985658	189159465	/nfs/dbraw/zinc/15/94/65/189159465.db2.gz	GTSQEOKIYCCFHC-JTQLQIEISA-N	1	0	288.326	1.450	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2sc(C)cc2OC)C1	ZINC000179018673	189162301	/nfs/dbraw/zinc/16/23/01/189162301.db2.gz	NVRVSDSSNXRXIB-SNVBAGLBSA-N	1	0	268.382	1.747	50	0		CDAARO
COc1cccc(OC)c1CC(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179095958	189169155	/nfs/dbraw/zinc/16/91/55/189169155.db2.gz	YOARHHGQGBVPFC-NSHDSACASA-N	1	0	278.352	1.067	50	0		CDAARO
c1cc2cnccc2c(CN2C[C@@H]3[NH2+]CCO[C@H]3C2)c1	ZINC000426537719	360999166	/nfs/dbraw/zinc/99/91/66/360999166.db2.gz	OTPVRKJRKUQKCX-HOTGVXAUSA-N	1	0	269.348	1.407	50	0		CDAARO
[NH3+][C@H]1CN(Cc2cnc(N3CCCC3)nc2)C[C@@H]1C1CC1	ZINC000092004543	283643183	/nfs/dbraw/zinc/64/31/83/283643183.db2.gz	GFZNGCZGWIFMIM-CABCVRRESA-N	1	0	287.411	1.246	50	0		CDAARO
Clc1cnn(CCN2CC[N@@H+]3CCC[C@@H]3C2)c1	ZINC000335568707	361513796	/nfs/dbraw/zinc/51/37/96/361513796.db2.gz	YKRLUBGTHCWXNB-GFCCVEGCSA-N	1	0	254.765	1.317	50	0		CDAARO
Cc1ccc(S[C@H](C)C(=O)N2CC[NH2+]CC2)cc1	ZINC000019686577	364078711	/nfs/dbraw/zinc/07/87/11/364078711.db2.gz	ATBKWVLGADCDFE-GFCCVEGCSA-N	1	0	264.394	1.907	50	0		CDAARO
O=C(Nc1ccc2ccccc2c1)[C@H]1C[C@H](O)C[NH2+]1	ZINC000000402965	364190203	/nfs/dbraw/zinc/19/02/03/364190203.db2.gz	RPDYJTXWIGUABB-UONOGXRCSA-N	1	0	256.305	1.501	50	0		CDAARO
CSc1ccc(CNC(=O)NC[C@@H]2CCC[NH2+]2)cc1	ZINC000417255613	364342747	/nfs/dbraw/zinc/34/27/47/364342747.db2.gz	PTHPARGPQWKRDJ-LBPRGKRZSA-N	1	0	279.409	1.960	50	0		CDAARO
CCOC(=O)[C@]1(C(C)C)CC[N@H+](C[C@@H](O)C(F)(F)F)C1	ZINC000248742630	364441235	/nfs/dbraw/zinc/44/12/35/364441235.db2.gz	QPHCDQWMHLTTEK-ZYHUDNBSSA-N	1	0	297.317	1.821	50	0		CDAARO
O=S1(=O)CCC[C@H]1C[NH2+]Cc1cccc2cccnc21	ZINC000089808004	366937736	/nfs/dbraw/zinc/93/77/36/366937736.db2.gz	ZBXCENZENRQGME-AWEZNQCLSA-N	1	0	290.388	1.902	50	0		CDAARO
O=C([C@H]1CCOC1)N1CCC[C@@H]1C[NH+]1CCCC1	ZINC000066943830	296125239	/nfs/dbraw/zinc/12/52/39/296125239.db2.gz	GARQBOVUXTXDBF-QWHCGFSZSA-N	1	0	252.358	1.110	50	0		CDAARO
Cc1c[nH+]c(C)n1CCNS(=O)(=O)c1cccs1	ZINC000575554971	369133864	/nfs/dbraw/zinc/13/38/64/369133864.db2.gz	ILKUFDNNOGATHO-UHFFFAOYSA-N	1	0	285.394	1.540	50	0		CDAARO
CCN1C[C@H](C[N@H+](C)CCC(N)=O)Oc2ccccc21	ZINC000012550698	369127521	/nfs/dbraw/zinc/12/75/21/369127521.db2.gz	VGBHQLGKEZCOTR-LBPRGKRZSA-N	1	0	277.368	1.081	50	0		CDAARO
OCCC[N@@H+]1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1	ZINC000376456476	371219402	/nfs/dbraw/zinc/21/94/02/371219402.db2.gz	XRYBPOWNDNNKKI-CZUORRHYSA-N	1	0	291.395	1.758	50	0		CDAARO
CC(=O)N1CCC([N@@H+]2CC[C@@H](O)CC(C)(C)C2)CC1	ZINC000670445211	482995922	/nfs/dbraw/zinc/99/59/22/482995922.db2.gz	QXQVSTSWEODCBT-CQSZACIVSA-N	1	0	268.401	1.480	50	0		CDAARO
Cc1cccc2[nH]c(CNC(=O)[C@@H]3CCC[NH2+]CC3)nc21	ZINC000299786939	372762542	/nfs/dbraw/zinc/76/25/42/372762542.db2.gz	RVYBJKSQNPXUIJ-GFCCVEGCSA-N	1	0	286.379	1.877	50	0		CDAARO
Cc1n[nH]c(C2CC[NH+](CCn3cccn3)CC2)n1	ZINC000299789437	372764107	/nfs/dbraw/zinc/76/41/07/372764107.db2.gz	XAUCWDDLVPNJGN-UHFFFAOYSA-N	1	0	260.345	1.189	50	0		CDAARO
CC[NH+](CC)[C@H]1CCN(CCC(=O)Nc2cccnc2)C1	ZINC000244882461	189914333	/nfs/dbraw/zinc/91/43/33/189914333.db2.gz	XSELNYVTNQYGLL-HNNXBMFYSA-N	1	0	290.411	1.826	50	0		CDAARO
Cc1noc(C)c1CN(C)C(=O)[C@@H]([NH3+])c1ccccc1	ZINC000037819144	373425806	/nfs/dbraw/zinc/42/58/06/373425806.db2.gz	XBBVVUMRPKEBIV-AWEZNQCLSA-N	1	0	273.336	1.950	50	0		CDAARO
Cc1c[nH]cc1C(=O)N1CCOC[C@@H]1[C@@H]1CCC[N@H+]1C	ZINC000520566405	373824446	/nfs/dbraw/zinc/82/44/46/373824446.db2.gz	XXVQAFHFSGAGHJ-UONOGXRCSA-N	1	0	277.368	1.258	50	0		CDAARO
Cc1cc(C)cc(C(=O)NC[C@@H]2C[N@@H+]3CCC[C@H]3CO2)c1	ZINC000247892380	541958403	/nfs/dbraw/zinc/95/84/03/541958403.db2.gz	VXTUMJSMPBLLIC-JKSUJKDBSA-N	1	0	288.391	1.896	50	0		CDAARO
CC(C)[NH+]1CCN(C[C@@H]2COc3ccccc3O2)CC1	ZINC000019703109	374776749	/nfs/dbraw/zinc/77/67/49/374776749.db2.gz	VJEXBVRKTISHJF-CQSZACIVSA-N	1	0	276.380	1.852	50	0	biogenic	CDAARO
CC(C)OC[C@@H](O)C[N@@H+]1CCc2ccc(O)cc2C1	ZINC000095426441	374926528	/nfs/dbraw/zinc/92/65/28/374926528.db2.gz	HULZCWKTKITVDH-HNNXBMFYSA-N	1	0	265.353	1.536	50	0		CDAARO
C[NH+](C)CC(=O)NC1(c2nccs2)CCCC1	ZINC000097165036	375152772	/nfs/dbraw/zinc/15/27/72/375152772.db2.gz	VLCSXIWVOYUCOO-UHFFFAOYSA-N	1	0	253.371	1.590	50	0		CDAARO
CC[NH+](CC)[C@H]1CCN(C(=O)c2ccc(O)cc2O)C1	ZINC000097236763	375156254	/nfs/dbraw/zinc/15/62/54/375156254.db2.gz	XUTPSGOJBOWQIN-NSHDSACASA-N	1	0	278.352	1.654	50	0		CDAARO
CCCCOc1ncccc1CNC(=O)[C@H]1CCC[N@@H+]1C	ZINC000299499921	375176226	/nfs/dbraw/zinc/17/62/26/375176226.db2.gz	KHEGUEJTDHVYNS-CQSZACIVSA-N	1	0	291.395	1.971	50	0		CDAARO
C[C@H]1CN(CCSc2nnnn2C(C)(C)C)CCO1	ZINC000188275509	375662530	/nfs/dbraw/zinc/66/25/30/375662530.db2.gz	QXDRWHNRCGNWBN-JTQLQIEISA-N	1	0	285.417	1.241	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CC[C@H]3C[NH2+]C[C@H]32)s1	ZINC000036265634	375819077	/nfs/dbraw/zinc/81/90/77/375819077.db2.gz	HBKITAHOMAWSQT-VHSXEESVSA-N	1	0	272.395	1.039	50	0		CDAARO
C[C@@H]1CCCN(C(=O)/C=C\c2ccccn2)[C@@H]1C[NH3+]	ZINC000606441875	375823621	/nfs/dbraw/zinc/82/36/21/375823621.db2.gz	PXLBDFBYEAZJHP-GGJXWIKRSA-N	1	0	259.353	1.681	50	0		CDAARO
Cc1ccc([C@@H](CNC(=O)C2(C)COC2)[NH+](C)C)cc1	ZINC000360315203	375824068	/nfs/dbraw/zinc/82/40/68/375824068.db2.gz	COENGIALCNSWOR-CQSZACIVSA-N	1	0	276.380	1.750	50	0		CDAARO
CC1CC[NH+](CC(=O)NCC[C@H]2CCOC2)CC1	ZINC000345720042	375824101	/nfs/dbraw/zinc/82/41/01/375824101.db2.gz	LYGSLURCWJPNEG-ZDUSSCGKSA-N	1	0	254.374	1.261	50	0		CDAARO
C[C@@H]1CN(C(=O)CCCOc2ccccc2F)CC[NH2+]1	ZINC000188446313	375839785	/nfs/dbraw/zinc/83/97/85/375839785.db2.gz	MZLUXKZGDBLUQL-GFCCVEGCSA-N	1	0	280.343	1.805	50	0		CDAARO
CN(C)c1ncc(-c2cnn(C)c2)c([C@H]2CC[NH2+]C2)n1	ZINC000242688158	376021047	/nfs/dbraw/zinc/02/10/47/376021047.db2.gz	VHNXABCBAGXMDM-JTQLQIEISA-N	1	0	272.356	1.020	50	0		CDAARO
CCc1ccc(-n2cc(C(=O)NCC[NH+](C)C)nn2)cc1	ZINC000067262139	376956749	/nfs/dbraw/zinc/95/67/49/376956749.db2.gz	AOBUZZKSOIDLNR-UHFFFAOYSA-N	1	0	287.367	1.121	50	0		CDAARO
Cc1cncc(N2CCOC3(CC[NH+](C)CC3)C2)n1	ZINC000645385974	377266267	/nfs/dbraw/zinc/26/62/67/377266267.db2.gz	XMYZWDMSXRNLRG-UHFFFAOYSA-N	1	0	262.357	1.086	50	0		CDAARO
C[N@@H+]1CCN2CCN(C(=O)C/C=C/c3ccccc3)C[C@H]2C1	ZINC000248160371	377205063	/nfs/dbraw/zinc/20/50/63/377205063.db2.gz	XENJWNKWNLJGSA-ZGRWHYIRSA-N	1	0	299.418	1.548	50	0		CDAARO
CN(Cc1cnccn1)c1cc([C@H]2C[C@H]([NH3+])C2)ncn1	ZINC000244633511	377792987	/nfs/dbraw/zinc/79/29/87/377792987.db2.gz	GEFSUDDUCMQSQM-XYPYZODXSA-N	1	0	270.340	1.108	50	0		CDAARO
Cc1n[nH]c(C)c1CN(C)c1cc([C@H]2C[C@@H]([NH3+])C2)ncn1	ZINC000244678858	377793396	/nfs/dbraw/zinc/79/33/96/377793396.db2.gz	ILMLXHUKHZRKDT-TXEJJXNPSA-N	1	0	286.383	1.658	50	0		CDAARO
COc1ccc(/C=C/C(=O)NOC[C@@H](C)[NH3+])cc1OC	ZINC000493133993	253379254	/nfs/dbraw/zinc/37/92/54/253379254.db2.gz	UMTLKQVFCRAMIA-BREXMAIKSA-N	1	0	280.324	1.112	50	0		CDAARO
CCOc1cc(/C=C\C(=O)N2CC[C@@H]([NH3+])C2)ccc1OC	ZINC000493782363	253554805	/nfs/dbraw/zinc/55/48/05/253554805.db2.gz	GSEIHNWMSZNIHE-SCXUMTSISA-N	1	0	290.363	1.667	50	0		CDAARO
Cc1nnc(NC(=O)N2CCC[C@@H](C[NH3+])C2)s1	ZINC000055108988	390488881	/nfs/dbraw/zinc/48/88/81/390488881.db2.gz	CLXKKHISIHKFLA-QMMMGPOBSA-N	1	0	255.347	1.049	50	0		CDAARO
Cn1ccnc1C[NH2+][C@](C)(CO)C1CCCCC1	ZINC000096417587	390512131	/nfs/dbraw/zinc/51/21/31/390512131.db2.gz	WTNTXMXOQRBKSW-CQSZACIVSA-N	1	0	251.374	1.841	50	0		CDAARO
O=C(C1CCC1)N1CCCN(C2CC[NH2+]CC2)CC1	ZINC000067847223	390575607	/nfs/dbraw/zinc/57/56/07/390575607.db2.gz	GMVMAYNBGAVLSZ-UHFFFAOYSA-N	1	0	265.401	1.073	50	0		CDAARO
COCCC[NH+]1CCN(Cc2ccc(Cl)cn2)CC1	ZINC000097086357	390673258	/nfs/dbraw/zinc/67/32/58/390673258.db2.gz	WOQGAWGLNRXTMR-UHFFFAOYSA-N	1	0	283.803	1.889	50	0		CDAARO
C[C@H]1C[NH2+]C[C@H](C)N1Cc1ccc(-n2cncn2)cc1	ZINC000097095578	390676546	/nfs/dbraw/zinc/67/65/46/390676546.db2.gz	HJXAZNUEGUXJOV-STQMWFEESA-N	1	0	271.368	1.450	50	0		CDAARO
COc1ccccc1OCC[NH2+]Cc1c[nH]nc1C	ZINC000097159537	390801133	/nfs/dbraw/zinc/80/11/33/390801133.db2.gz	BCYGKIJNDLPNAE-UHFFFAOYSA-N	1	0	261.325	1.895	50	0		CDAARO
O=C(NCc1ccc2sccc2c1)[C@@H]1C[NH2+]CCO1	ZINC000215574186	390995533	/nfs/dbraw/zinc/99/55/33/390995533.db2.gz	PAPWLARQPZEUJL-LBPRGKRZSA-N	1	0	276.361	1.506	50	0		CDAARO
Clc1cnn(CCN2CCC[N@@H+]3CCC[C@H]3C2)c1	ZINC000244831487	391044440	/nfs/dbraw/zinc/04/44/40/391044440.db2.gz	UEPUPWMXLOSMIL-ZDUSSCGKSA-N	1	0	268.792	1.707	50	0		CDAARO
COc1cccc(C(=O)N2CC[N@H+](C)C(C)(C)C2)c1	ZINC000408516120	533400034	/nfs/dbraw/zinc/40/00/34/533400034.db2.gz	QPULHZNIBINCRS-UHFFFAOYSA-N	1	0	262.353	1.861	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2Cc3ccccc3C[NH2+]2)C[C@@H](C)O1	ZINC000019474679	391321111	/nfs/dbraw/zinc/32/11/11/391321111.db2.gz	OJBMKRPUCMZCIY-LALPHHSUSA-N	1	0	274.364	1.337	50	0		CDAARO
Cc1cc(-c2cnc3ncnn3c2C2CC[NH2+]CC2)on1	ZINC000299804004	391721530	/nfs/dbraw/zinc/72/15/30/391721530.db2.gz	QAWXWOJHBBWBQI-UHFFFAOYSA-N	1	0	284.323	1.555	50	0		CDAARO
COc1ccc(Cl)cc1CN1CCN(CCC[NH3+])CC1	ZINC000036867438	392020096	/nfs/dbraw/zinc/02/00/96/392020096.db2.gz	MOPNAIPJNSZTMT-UHFFFAOYSA-N	1	0	297.830	1.815	50	0		CDAARO
CO[C@H](C[NH3+])CC(=O)N(C)[C@@H]1CCc2ccccc2C1	ZINC000262745413	131257868	/nfs/dbraw/zinc/25/78/68/131257868.db2.gz	AFHIAOASWQBIIR-CABCVRRESA-N	1	0	276.380	1.366	50	0		CDAARO
CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CCO[C@@H](C(N)=O)C1	ZINC000249092201	392443422	/nfs/dbraw/zinc/44/34/22/392443422.db2.gz	NPDGOOAUTQYALC-RWMBFGLXSA-N	1	0	252.358	1.165	50	0		CDAARO
CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CCO[C@@H](C(N)=O)C1	ZINC000249092204	392443641	/nfs/dbraw/zinc/44/36/41/392443641.db2.gz	NPDGOOAUTQYALC-YNEHKIRRSA-N	1	0	252.358	1.165	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)c1ccc2c(c1)CCO2	ZINC000122566328	392654846	/nfs/dbraw/zinc/65/48/46/392654846.db2.gz	UWLBSDXPYUKTQI-CYBMUJFWSA-N	1	0	260.337	1.446	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@H]1[NH2+][C@H](C)C(=O)N(CC)CC	ZINC000107504634	392738076	/nfs/dbraw/zinc/73/80/76/392738076.db2.gz	DCMODUOHPKERKF-BPLDGKMQSA-N	1	0	297.443	1.480	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1C[C@H](C)OC[C@@H]1c1ccccc1	ZINC000253432746	392720549	/nfs/dbraw/zinc/72/05/49/392720549.db2.gz	NKALIXWFNBCPJQ-FPMFFAJLSA-N	1	0	262.353	1.712	50	0		CDAARO
CCc1nc(CN2CC[C@@H](C[NH+]3CCOCC3)C2)cs1	ZINC000129455797	392816476	/nfs/dbraw/zinc/81/64/76/392816476.db2.gz	HLSJMXFTAGUYOC-ZDUSSCGKSA-N	1	0	295.452	1.860	50	0		CDAARO
C[C@H]1CN(Cc2ccccc2)CCN1C(=O)[C@H]1CC[NH2+]C1	ZINC000269264350	132146132	/nfs/dbraw/zinc/14/61/32/132146132.db2.gz	OHCFKCGIPUGXCX-HOCLYGCPSA-N	1	0	287.407	1.329	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](C(=O)N2CCN(c3ccc(O)cc3)CC2)C1	ZINC000091546292	135072274	/nfs/dbraw/zinc/07/22/74/135072274.db2.gz	LOVTUSVNAOKKRV-CHWSQXEVSA-N	1	0	289.379	1.168	50	0		CDAARO
C[C@@H]([NH2+]Cc1nnnn1C1CC1)C(C)(C)C(F)F	ZINC000657922390	413090033	/nfs/dbraw/zinc/09/00/33/413090033.db2.gz	ODQPFZLOHIVCMU-SSDOTTSWSA-N	1	0	259.304	1.777	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CCCC[C@H]2[NH3+])cc1	ZINC000012650617	292182305	/nfs/dbraw/zinc/18/23/05/292182305.db2.gz	VVOFSHARRCJLLA-CHWSQXEVSA-N	1	0	268.382	1.543	50	0		CDAARO
CNC(=O)c1cccc(NC(=O)C[N@@H+]2CCCC[C@H]2C)c1	ZINC000007525258	170289001	/nfs/dbraw/zinc/28/90/01/170289001.db2.gz	IDMHMLJQYDULMC-GFCCVEGCSA-N	1	0	289.379	1.859	50	0		CDAARO
[NH2+]=C(Nc1ccc(F)cc1)Nc1nc2c(c(=O)[nH]1)CCC2	ZINC000009486004	170378737	/nfs/dbraw/zinc/37/87/37/170378737.db2.gz	SZOJDHCZFLLZCQ-UHFFFAOYSA-N	1	0	287.298	1.856	50	0		CDAARO
Cc1ccccc1C[N@@H+](C)Cc1cc(=O)n(C)c(=O)n1C	ZINC000009881956	170388460	/nfs/dbraw/zinc/38/84/60/170388460.db2.gz	RTZZVOXODUUXKV-UHFFFAOYSA-N	1	0	287.363	1.024	50	0		CDAARO
CC(C)(C)CN1CCC[C@](O)(C[NH2+]C2CCCC2)C1=O	ZINC000012596674	170499929	/nfs/dbraw/zinc/49/99/29/170499929.db2.gz	MFYKETKMSCUGIG-INIZCTEOSA-N	1	0	282.428	1.918	50	0		CDAARO
CC[NH+]1CCN(CCOc2ccc(F)cc2)CC1	ZINC000020406355	171182389	/nfs/dbraw/zinc/18/23/89/171182389.db2.gz	GONACZQXVNDBTJ-UHFFFAOYSA-N	1	0	252.333	1.842	50	0		CDAARO
[NH3+]CCc1ccc(S(=O)(=O)N2CCCCC2)s1	ZINC000035206627	172051027	/nfs/dbraw/zinc/05/10/27/172051027.db2.gz	INOFADRYFQAUMI-UHFFFAOYSA-N	1	0	274.411	1.424	50	0		CDAARO
CCc1cccc(OCC[N@H+](C)C[C@@H]2COCCO2)c1	ZINC000661603885	414201789	/nfs/dbraw/zinc/20/17/89/414201789.db2.gz	MAIZKAJUKJMYMZ-MRXNPFEDSA-N	1	0	279.380	1.975	50	0		CDAARO
C[N@H+](Cc1ccc(OC(F)(F)F)cc1)[C@@H]1COC[C@H]1O	ZINC000286202953	196524454	/nfs/dbraw/zinc/52/44/54/196524454.db2.gz	XZNSSZCDMHGQHG-VXGBXAGGSA-N	1	0	291.269	1.777	50	0		CDAARO
CCCN(Cc1ccccc1OC)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000055254395	175574832	/nfs/dbraw/zinc/57/48/32/175574832.db2.gz	NXQSNLDHJBOWTD-AWEZNQCLSA-N	1	0	274.364	1.962	50	0		CDAARO
CC(C)NC(=O)CN[C@H](C)C[NH+]1CCCCCC1	ZINC000071278579	176108215	/nfs/dbraw/zinc/10/82/15/176108215.db2.gz	GTRDBUHRUKDCON-CYBMUJFWSA-N	1	0	255.406	1.365	50	0		CDAARO
Cc1nn(CCO)cc1CN1CC([N@H+]2CCCC[C@@H]2C)C1	ZINC000071278998	176108251	/nfs/dbraw/zinc/10/82/51/176108251.db2.gz	FKBLPZUOADOHFY-ZDUSSCGKSA-N	1	0	292.427	1.242	50	0		CDAARO
CC[NH+](CC)CCNc1nc2ccccc2c(=O)n1C	ZINC000071283006	176109426	/nfs/dbraw/zinc/10/94/26/176109426.db2.gz	TYPAVOLMAPYMOU-UHFFFAOYSA-N	1	0	274.368	1.687	50	0		CDAARO
CC(=O)C(=O)N1C[C@@H](c2ccccc2)[C@@H]2[C@H]1C1CC[NH+]2CC1	ZINC000071750854	176260318	/nfs/dbraw/zinc/26/03/18/176260318.db2.gz	UDBGYTCGDFPGFF-GVDBMIGSSA-N	1	0	298.386	1.664	50	0		CDAARO
Cc1ccc(O[C@H](C)C(=O)NCC[NH+](C)C)cc1C	ZINC000072119141	176319697	/nfs/dbraw/zinc/31/96/97/176319697.db2.gz	ABLWASRRLXJTAN-CYBMUJFWSA-N	1	0	264.369	1.749	50	0		CDAARO
CCCc1cc(NC[C@@H]2C[NH2+]CCOC2)nc(C)n1	ZINC000072130636	176321308	/nfs/dbraw/zinc/32/13/08/176321308.db2.gz	FCOIJBIDKMPSPY-LBPRGKRZSA-N	1	0	264.373	1.385	50	0		CDAARO
O=C(NC[C@@H]1CCCO1)c1ccc(C2CC[NH2+]CC2)nc1	ZINC000072343446	176372030	/nfs/dbraw/zinc/37/20/30/176372030.db2.gz	HARJQOAKVMCVTJ-AWEZNQCLSA-N	1	0	289.379	1.457	50	0		CDAARO
CN(C)C(=O)CCc1cccc(C2CC[NH2+]CC2)n1	ZINC000072344501	176372943	/nfs/dbraw/zinc/37/29/43/176372943.db2.gz	WBHVYIYKPCTASM-UHFFFAOYSA-N	1	0	261.369	1.569	50	0		CDAARO
O=C(CCC[N@H+]1CCOC[C@H](CO)C1)c1ccc(F)cc1	ZINC000077343325	177254647	/nfs/dbraw/zinc/25/46/47/177254647.db2.gz	JICZSNJEOBJDJL-ZDUSSCGKSA-N	1	0	295.354	1.729	50	0		CDAARO
O[C@@H]1COCC[N@H+](C/C=C/c2ccc(F)cc2)C1	ZINC000077485620	177273564	/nfs/dbraw/zinc/27/35/64/177273564.db2.gz	CEYXLEVTVMJMHN-YUKKFKLSSA-N	1	0	251.301	1.532	50	0		CDAARO
O=C(N[C@@H]1CCSc2c(F)cccc21)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000276644939	274986897	/nfs/dbraw/zinc/98/68/97/274986897.db2.gz	NECWZFMNDSWACM-GGZOMVNGSA-N	1	0	296.367	1.202	50	0		CDAARO
O=C([C@H]1C[C@H](O)C[NH2+]1)N1CC2(CCCC2)c2ccccc21	ZINC000252519015	275009788	/nfs/dbraw/zinc/00/97/88/275009788.db2.gz	AQXGWCXECJTIAE-GXTWGEPZSA-N	1	0	286.375	1.568	50	0		CDAARO
C[NH+]1CCC(c2n[nH]c(=O)n2CC2CCCCC2)CC1	ZINC000065384218	277035236	/nfs/dbraw/zinc/03/52/36/277035236.db2.gz	XZQGUQVMEMYNFP-UHFFFAOYSA-N	1	0	278.400	1.961	50	0		CDAARO
COc1ccsc1C(=O)N1CCCC[C@@H]1C[NH3+]	ZINC000128860186	278070381	/nfs/dbraw/zinc/07/03/81/278070381.db2.gz	CUZGYHNHUIPFNQ-SECBINFHSA-N	1	0	254.355	1.710	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]C[C@@](C)(O)CN2CCOCC2)[C@H](C)C1	ZINC000241316704	278610702	/nfs/dbraw/zinc/61/07/02/278610702.db2.gz	LUGRNEHMSOUNKL-LVQVYYBASA-N	1	0	284.444	1.484	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1cc(=O)[nH]c2cc(F)ccc21	ZINC000124370292	278837309	/nfs/dbraw/zinc/83/73/09/278837309.db2.gz	YNKPVIHQYYCZES-SECBINFHSA-N	1	0	289.310	1.101	50	0		CDAARO
C[C@@H]1CN(C)c2ccccc2N(C(=O)[C@H]2CC[NH2+]C2)C1	ZINC000269273841	296970309	/nfs/dbraw/zinc/97/03/09/296970309.db2.gz	YYRYXWQJDRQPFZ-OLZOCXBDSA-N	1	0	273.380	1.715	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@H]2COc3ccc(Cl)cc3C2)C1	ZINC000178516703	295258123	/nfs/dbraw/zinc/25/81/23/295258123.db2.gz	PAIOCXSARRSALD-CMPLNLGQSA-N	1	0	294.782	1.698	50	0		CDAARO
O=C(NCCF)NC1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1	ZINC000390834688	295644695	/nfs/dbraw/zinc/64/46/95/295644695.db2.gz	PAFZGGOQTVGMNP-STQMWFEESA-N	1	0	287.379	1.023	50	0		CDAARO
Cc1cc(C)c(S(=O)(=O)N2CCC([NH3+])CC2)c(C)c1	ZINC000020267708	301192027	/nfs/dbraw/zinc/19/20/27/301192027.db2.gz	HKZWWALFVUNEFM-UHFFFAOYSA-N	1	0	282.409	1.724	50	0		CDAARO
Cc1cc(C(F)(F)F)cc(N2CCO[C@@H](C[NH3+])C2)n1	ZINC000534577304	328310390	/nfs/dbraw/zinc/31/03/90/328310390.db2.gz	NSFWXMKQNNWKEL-JTQLQIEISA-N	1	0	275.274	1.573	50	0		CDAARO
O=C(c1ccccc1N1CCCC1)N1C[C@@H]2CC[NH2+][C@@H]2C1	ZINC000534584075	328310452	/nfs/dbraw/zinc/31/04/52/328310452.db2.gz	FMWFOUSCEOSGRL-DZGCQCFKSA-N	1	0	285.391	1.721	50	0		CDAARO
CCC[C@H](CNc1ncccc1C(N)=O)[NH+](C)C	ZINC000534582440	328312271	/nfs/dbraw/zinc/31/22/71/328312271.db2.gz	BCDLZHOXDHQNOG-SNVBAGLBSA-N	1	0	250.346	1.323	50	0		CDAARO
CC(C)[N@H+](C)CCNC(=O)NC[C@H](O)c1cccc(O)c1	ZINC000534646492	328329682	/nfs/dbraw/zinc/32/96/82/328329682.db2.gz	JLYUBAFUZLNLBH-AWEZNQCLSA-N	1	0	295.383	1.065	50	0		CDAARO
[NH3+][C@@H]1CCCN(Cc2nc(C(F)(F)F)no2)C1	ZINC000534646510	328329833	/nfs/dbraw/zinc/32/98/33/328329833.db2.gz	VDNGRARVRZUHAP-ZCFIWIBFSA-N	1	0	250.224	1.012	50	0		CDAARO
C[C@@H](C(=O)NCCn1ccnn1)[N@H+](C)C1CCCCC1	ZINC000534655987	328339942	/nfs/dbraw/zinc/33/99/42/328339942.db2.gz	VSJNCYGVHGKFHM-LBPRGKRZSA-N	1	0	279.388	1.047	50	0		CDAARO
C[C@H](NC(=O)C[NH2+][C@H]1CCC(C)(C)C[C@@H]1C)C(=O)N(C)C	ZINC000097099865	323207467	/nfs/dbraw/zinc/20/74/67/323207467.db2.gz	UFBRVSPVLCKVAZ-AVGNSLFASA-N	1	0	297.443	1.384	50	0		CDAARO
O=c1onc(-c2ccccn2)n1CCC[NH+]1CCCCC1	ZINC000195576208	323572579	/nfs/dbraw/zinc/57/25/79/323572579.db2.gz	MQTUEOJDCQLFLM-UHFFFAOYSA-N	1	0	288.351	1.774	50	0		CDAARO
FC(F)(F)[C@@]1(c2nc(-c3ccncc3)no2)CC[NH2+]C1	ZINC000111240729	330381624	/nfs/dbraw/zinc/38/16/24/330381624.db2.gz	HHBHCPRLXOKQFR-NSHDSACASA-N	1	0	284.241	1.925	50	0		CDAARO
CN(Cc1ccccc1F)C(=O)C[C@H]1CC[NH2+]C1	ZINC000089741515	330387554	/nfs/dbraw/zinc/38/75/54/330387554.db2.gz	RMCTYTDYDQXXIY-LLVKDONJSA-N	1	0	250.317	1.784	50	0		CDAARO
Cc1ccc(-c2cc3c(=O)n(CC[NH3+])ccn3n2)c(C)c1	ZINC000263618393	333239598	/nfs/dbraw/zinc/23/95/98/333239598.db2.gz	STKFZWZKCJJFKC-UHFFFAOYSA-N	1	0	282.347	1.739	50	0		CDAARO
CC[C@@H]1CN(c2nnc(COC)o2)CC[N@@H+]1C(C)C	ZINC001772703243	1159438160	/nfs/dbraw/zinc/43/81/60/1159438160.db2.gz	KGGBVXOVVXPGBV-LLVKDONJSA-N	1	0	268.361	1.525	50	0		CDAARO
Cc1cc(N2CCC3(CC2)C[C@](C)(O)[C@@H](O)CO3)cc[nH+]1	ZINC001772705022	1159440689	/nfs/dbraw/zinc/44/06/89/1159440689.db2.gz	WCXVQMGDBYUWQR-GJZGRUSLSA-N	1	0	292.379	1.261	50	0		CDAARO
CNC(=O)[C@H](CC(C)C)[NH2+][C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000108113970	482449826	/nfs/dbraw/zinc/44/98/26/482449826.db2.gz	DZSZXGKBDDXOQF-MELADBBJSA-N	1	0	269.433	1.465	50	0		CDAARO
C[C@@H]1OCC[C@H]1[NH2+]Cc1ccnc(OCC(F)F)c1	ZINC000091411388	482564496	/nfs/dbraw/zinc/56/44/96/482564496.db2.gz	UABMYZZZDSPKFA-GXSJLCMTSA-N	1	0	272.295	1.993	50	0		CDAARO
COc1ccccc1C[NH2+]C[C@@H](OC)[C@H]1CCOC1	ZINC000585093630	482828991	/nfs/dbraw/zinc/82/89/91/482828991.db2.gz	PZNCWJCCKHDIAI-DZGCQCFKSA-N	1	0	265.353	1.836	50	0		CDAARO
Cc1cc(C)nc(NCC[N@@H+]2CCC[C@H](CO)C2)n1	ZINC000670435531	482972011	/nfs/dbraw/zinc/97/20/11/482972011.db2.gz	YXHYHXHHOGYUKM-ZDUSSCGKSA-N	1	0	264.373	1.210	50	0		CDAARO
C[NH+](C)[C@H]1CN(Cc2cccc3cnccc32)C[C@@H]1O	ZINC000670439032	482982714	/nfs/dbraw/zinc/98/27/14/482982714.db2.gz	IMMMKNPDGPIESN-HOTGVXAUSA-N	1	0	271.364	1.342	50	0		CDAARO
OC[C@H]1CCC[N@H+](CCNc2ncc(Cl)cn2)C1	ZINC000670452038	483014357	/nfs/dbraw/zinc/01/43/57/483014357.db2.gz	XBDNBIJQMGIINO-JTQLQIEISA-N	1	0	270.764	1.246	50	0		CDAARO
c1cnn(CCC[NH+]2CCC(c3nnc[nH]3)CC2)c1	ZINC000670470042	483067691	/nfs/dbraw/zinc/06/76/91/483067691.db2.gz	WKMSOPQALCPJLP-UHFFFAOYSA-N	1	0	260.345	1.271	50	0		CDAARO
COc1cc2c(cc1C[N@H+](C)C[C@@H]1CCOC1)OCCO2	ZINC000670470900	483072969	/nfs/dbraw/zinc/07/29/69/483072969.db2.gz	UCZHAIRYTSLUOP-LBPRGKRZSA-N	1	0	293.363	1.935	50	0		CDAARO
CNC(=O)C1CC[NH+]([C@@H](C)C(=O)N2CCCCCC2)CC1	ZINC000053847091	483516937	/nfs/dbraw/zinc/51/69/37/483516937.db2.gz	WUDVTAKJTXKJCK-ZDUSSCGKSA-N	1	0	295.427	1.236	50	0		CDAARO
Cc1ccc(CCNC(=O)C2(O)CC[NH+](C)CC2)cc1C	ZINC000097742880	533794929	/nfs/dbraw/zinc/79/49/29/533794929.db2.gz	ZQKGPEOXAIWWSV-UHFFFAOYSA-N	1	0	290.407	1.419	50	0		CDAARO
CC[C@H]1CN(C(=O)COCC(F)(F)C(F)F)CC[NH2+]1	ZINC000067872286	523223024	/nfs/dbraw/zinc/22/30/24/523223024.db2.gz	UETOEIFCSCEHQI-QMMMGPOBSA-N	1	0	286.269	1.114	50	0		CDAARO
CCn1cc(C[N@H+](C)[C@@H]2Cc3ccccc3[C@H]2O)cn1	ZINC000241774131	523365639	/nfs/dbraw/zinc/36/56/39/523365639.db2.gz	RNHQKNQMJUQKCG-HZPDHXFCSA-N	1	0	271.364	1.993	50	0		CDAARO
CC(C)[N@H+](C)CCNC(=O)N1C[C@@H](C)S[C@@H](C)C1	ZINC000096439884	528820298	/nfs/dbraw/zinc/82/02/98/528820298.db2.gz	OFPZJJYOJOKUEN-TXEJJXNPSA-N	1	0	273.446	1.862	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+]CC2(OC)CCOCC2)C1(C)C	ZINC000097034774	567902958	/nfs/dbraw/zinc/90/29/58/567902958.db2.gz	WCGAEYDDDLHWHX-CHWSQXEVSA-N	1	0	271.401	1.975	50	0		CDAARO
C[C@@H]1CC[C@H]([NH3+])[C@H]([C@@H]2CC[C@H](C(F)(F)F)NC2)N1	ZINC000757216095	577036314	/nfs/dbraw/zinc/03/63/14/577036314.db2.gz	XPGJYWYAEPVISB-NZFPMDFQSA-N	1	0	265.323	1.385	50	0		CDAARO
CC(C)[C@@H]([NH3+])[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1	ZINC000958528426	614119814	/nfs/dbraw/zinc/11/98/14/614119814.db2.gz	OPCBBJZQVXDNLK-ZWNOBZJWSA-N	1	0	258.362	1.342	50	0		CDAARO
COc1cccc(N2CCC([N@@H+]3C[C@@H](O)[C@H](F)C3)CC2)c1	ZINC000952983985	617302876	/nfs/dbraw/zinc/30/28/76/617302876.db2.gz	XRQMKLXTYWGQIA-HZPDHXFCSA-N	1	0	294.370	1.679	50	0		CDAARO
CC(C)C[N@@H+]1CCCN(C(=O)CCc2cn[nH]c2)CC1	ZINC000982135086	614088446	/nfs/dbraw/zinc/08/84/46/614088446.db2.gz	QEUJZOBFYYMJNO-UHFFFAOYSA-N	1	0	278.400	1.533	50	0		CDAARO
COC(=O)c1ccc(=O)n(CC[NH+]2CCCCC2)c1	ZINC000000487842	617621217	/nfs/dbraw/zinc/62/12/17/617621217.db2.gz	CCPUFSRSQSLFFN-UHFFFAOYSA-N	1	0	264.325	1.121	50	0	biogenic	CDAARO
OC[C@H](O)C1CC[NH+](C2Cc3ccccc3C2)CC1	ZINC001772701055	1159436808	/nfs/dbraw/zinc/43/68/08/1159436808.db2.gz	BIMFHRFUCBOOJG-INIZCTEOSA-N	1	0	261.365	1.219	50	0		CDAARO
COCCOCC[N@@H+]1CCC[C@@]2(CCC[C@H]2OC)C1	ZINC001704339991	1177695223	/nfs/dbraw/zinc/69/52/23/1177695223.db2.gz	AVGXIFDPOFNXOF-CABCVRRESA-N	1	0	271.401	1.931	50	0		CDAARO
CCc1nccc(C[N@@H+]2CCC[C@H](c3cc(=O)[nH]cn3)C2)n1	ZINC001704349068	1177696920	/nfs/dbraw/zinc/69/69/20/1177696920.db2.gz	IROFDEQHKBDBPP-LBPRGKRZSA-N	1	0	299.378	1.914	50	0		CDAARO
Cc1nc(CN2CC[NH+](C3CCCC3)CC2)cc(=O)[nH]1	ZINC001704346924	1177697716	/nfs/dbraw/zinc/69/77/16/1177697716.db2.gz	BKWXSKYDXSODBN-UHFFFAOYSA-N	1	0	276.384	1.551	50	0		CDAARO
CC[N@H+](CCn1cccn1)Cc1cc(=O)c(OC)c[nH]1	ZINC001704352343	1177698859	/nfs/dbraw/zinc/69/88/59/1177698859.db2.gz	DEVRIYSAKIVHTC-UHFFFAOYSA-N	1	0	276.340	1.102	50	0		CDAARO
c1c(C[N@H+]2C[C@@H]3CC=CC[C@@H]3C2)nn2c1CNCC2	ZINC000072156785	740248780	/nfs/dbraw/zinc/24/87/80/740248780.db2.gz	SVGRTZKXZKIOTM-BETUJISGSA-N	1	0	258.369	1.384	50	0		CDAARO
O=C(NCC1CCOCC1)[C@H]1[NH2+]CC12CCCC2	ZINC000852800985	741129193	/nfs/dbraw/zinc/12/91/93/741129193.db2.gz	VMVYFYAQJAKWNH-GFCCVEGCSA-N	1	0	252.358	1.061	50	0		CDAARO
CO[C@]12CC[N@H+](CCCn3ccnc3C)[C@H]1C[C@@H](O)CC2	ZINC000299782949	742330883	/nfs/dbraw/zinc/33/08/83/742330883.db2.gz	XWSZKWWUUXPANI-HRCADAONSA-N	1	0	293.411	1.586	50	0		CDAARO
O=C1CN(CCC[NH+]2CCCC2)CCN1c1cccs1	ZINC000186073616	739463389	/nfs/dbraw/zinc/46/33/89/739463389.db2.gz	BKALWUGWYSLVNQ-UHFFFAOYSA-N	1	0	293.436	1.883	50	0		CDAARO
Cc1nc(C)c(C(=O)N(C)CC[N@H+](C)C2CCCC2)[nH]1	ZINC000952969606	740746970	/nfs/dbraw/zinc/74/69/70/740746970.db2.gz	ONSSZLMZKTUQQW-UHFFFAOYSA-N	1	0	278.400	1.973	50	0		CDAARO
CCCn1cnnc1CN(C)CC[C@H]1CCC[N@@H+]1C	ZINC000244659629	742515682	/nfs/dbraw/zinc/51/56/82/742515682.db2.gz	HGDMXDWNJZJPSF-CYBMUJFWSA-N	1	0	265.405	1.604	50	0		CDAARO
Cc1nc2c(c(NCc3[nH]nc4c3CCC4)n1)CC[NH2+]CC2	ZINC000198893066	906352869	/nfs/dbraw/zinc/35/28/69/906352869.db2.gz	NGHYYGHPVXJXRI-UHFFFAOYSA-N	1	0	298.394	1.297	50	0		CDAARO
CC1(CCC(=O)NCC2CC[NH+](CCO)CC2)CC1	ZINC000952868748	910417188	/nfs/dbraw/zinc/41/71/88/910417188.db2.gz	SOKJIRMHTAPPHI-UHFFFAOYSA-N	1	0	268.401	1.387	50	0		CDAARO
CCC[C@H](CNS(=O)(=O)CC1CCCC1)[NH+](C)C	ZINC000822790892	925649663	/nfs/dbraw/zinc/64/96/63/925649663.db2.gz	CAWYAVPJARSSMU-CYBMUJFWSA-N	1	0	276.446	1.826	50	0		CDAARO
Cc1ncc(C(=O)NCc2ccccc2C[NH+](C)C)cn1	ZINC000823714953	925722444	/nfs/dbraw/zinc/72/24/44/925722444.db2.gz	ADXJFHNQTYKWBQ-UHFFFAOYSA-N	1	0	284.363	1.777	50	0		CDAARO
CN(Cc1ccccc1)S(=O)(=O)NC[C@@H]1CCC[N@@H+]1C	ZINC000823773832	925728396	/nfs/dbraw/zinc/72/83/96/925728396.db2.gz	QOLXKRQJZBFUTC-AWEZNQCLSA-N	1	0	297.424	1.047	50	0		CDAARO
O=C(O[C@H]1CCOC1)N1CCN(c2cc[nH+]cc2)CC1	ZINC000585135255	931028244	/nfs/dbraw/zinc/02/82/44/931028244.db2.gz	ZVTRUYIIQRFFAJ-ZDUSSCGKSA-N	1	0	277.324	1.129	50	0		CDAARO
C[N@@H+](Cc1ncccc1O)C[C@@H](O)c1ccccc1	ZINC000019144456	935710903	/nfs/dbraw/zinc/71/09/03/935710903.db2.gz	NUKVMJWPWGDDRQ-OAHLLOKOSA-N	1	0	258.321	1.953	50	0		CDAARO
CCc1noc(NC(=O)CC2CC[NH2+]CC2)c1C	ZINC001529159602	968996823	/nfs/dbraw/zinc/99/68/23/968996823.db2.gz	VMLXQNYMJJHSPC-UHFFFAOYSA-N	1	0	251.330	1.874	50	0		CDAARO
C[C@H](C[N@H+](C)CCOCc1ccccc1)N1CCOCC1	ZINC001529168157	969002567	/nfs/dbraw/zinc/00/25/67/969002567.db2.gz	XBTDLXFEFVFFMU-MRXNPFEDSA-N	1	0	292.423	1.856	50	0		CDAARO
Cn1ccnc1SCC[NH2+]C1CSCCSC1	ZINC001506401582	975150267	/nfs/dbraw/zinc/15/02/67/975150267.db2.gz	JUWHZDCKMDSANY-UHFFFAOYSA-N	1	0	289.495	1.950	50	0		CDAARO
Cn1ccnc1-c1ccc(N2CC[NH+](CC3CC3)CC2)nn1	ZINC001506404809	975151487	/nfs/dbraw/zinc/15/14/87/975151487.db2.gz	JAODVBPFLZJJLX-UHFFFAOYSA-N	1	0	298.394	1.409	50	0		CDAARO
COc1nccnc1N1CCC[C@@]2(CC[N@H+](C)C2)C1	ZINC001506415791	975155940	/nfs/dbraw/zinc/15/59/40/975155940.db2.gz	CRVWDGQJWBZBIA-AWEZNQCLSA-N	1	0	262.357	1.407	50	0		CDAARO
Oc1cccc([C@H](O)C[NH2+]C2CSCCSC2)c1	ZINC001506429662	975161729	/nfs/dbraw/zinc/16/17/29/975161729.db2.gz	SSBWQGCJYCHSPQ-CYBMUJFWSA-N	1	0	285.434	1.864	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)NCc1cccs1)C1CCOCC1	ZINC000096492031	230383020	/nfs/dbraw/zinc/38/30/20/230383020.db2.gz	SQVWIMIXMJAPKF-LLVKDONJSA-N	1	0	282.409	1.769	50	0		CDAARO
NC(=O)CC[NH2+]Cc1c(Cl)cccc1N1CCCC1	ZINC000096494750	230383826	/nfs/dbraw/zinc/38/38/26/230383826.db2.gz	RLGZUWWDTSKYCM-UHFFFAOYSA-N	1	0	281.787	1.905	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C(=O)c1cncn1C	ZINC000584903143	341986527	/nfs/dbraw/zinc/98/65/27/341986527.db2.gz	KVIUDNCPCLSOBD-UHFFFAOYSA-N	1	0	264.373	1.367	50	0		CDAARO
CCC[NH+]1CCC(CC(=O)N[C@@H](C)c2ncnn2C)CC1	ZINC000095505021	185000943	/nfs/dbraw/zinc/00/09/43/185000943.db2.gz	HVNLFKZINRQLQF-LBPRGKRZSA-N	1	0	293.415	1.504	50	0		CDAARO
[NH3+][C@@H]1[C@@H]2CC[C@H]1CN(C(=O)NCc1cccs1)C2	ZINC000426360402	230415478	/nfs/dbraw/zinc/41/54/78/230415478.db2.gz	PNYRAKLKZOVRDX-PEGIJTEDSA-N	1	0	265.382	1.627	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)NCC[C@H]1CC[NH2+]C1	ZINC000110797229	230394065	/nfs/dbraw/zinc/39/40/65/230394065.db2.gz	HFHNZZZUVDOJDY-LLVKDONJSA-N	1	0	286.372	1.412	50	0		CDAARO
CCS(=O)(=O)C[C@@H](C)[NH2+]C1CCN(C(C)C)CC1	ZINC000121067359	230394339	/nfs/dbraw/zinc/39/43/39/230394339.db2.gz	IQCDTMJKXVMABC-GFCCVEGCSA-N	1	0	276.446	1.272	50	0		CDAARO
COc1ccccc1C[N@@H+]1CC[C@H](N2CCOCC2)C1	ZINC000121062134	230394377	/nfs/dbraw/zinc/39/43/77/230394377.db2.gz	VYURPSICDREIIN-HNNXBMFYSA-N	1	0	276.380	1.602	50	0		CDAARO
c1cnnc(N2CCC[C@@H]([NH2+]C[C@H]3CCCCO3)C2)c1	ZINC000106774217	349480195	/nfs/dbraw/zinc/48/01/95/349480195.db2.gz	AXXLNGAKKUAGNM-ZIAGYGMSSA-N	1	0	276.384	1.604	50	0		CDAARO
Cc1ccc(N2C(=O)C[C@H]([NH2+]CC3CC3)C2=O)cc1	ZINC000095630529	185016912	/nfs/dbraw/zinc/01/69/12/185016912.db2.gz	IVXQJYGHXIWMRO-ZDUSSCGKSA-N	1	0	258.321	1.627	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)NCc1ccccn1)c1ccncc1	ZINC000097370706	342002181	/nfs/dbraw/zinc/00/21/81/342002181.db2.gz	FDRKYYZVUDCPQJ-GFCCVEGCSA-N	1	0	270.336	1.444	50	0		CDAARO
C[C@@H]1CCC[C@H](CC[N@@H+]2C[C@H](O)C[C@@H]2C(N)=O)C1	ZINC000095965053	185045461	/nfs/dbraw/zinc/04/54/61/185045461.db2.gz	KNSWWDSUJMWVIR-FDYHWXHSSA-N	1	0	254.374	1.123	50	0		CDAARO
COC(=O)c1ccc([C@H](C)[N@@H+]2CC[C@H](C)[C@@H](O)C2)o1	ZINC000095984152	185055717	/nfs/dbraw/zinc/05/57/17/185055717.db2.gz	AMLHDQJIXRPLBT-DCAQKATOSA-N	1	0	267.325	1.830	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)Cn2cncn2)C12CCCC2	ZINC000095987845	185056955	/nfs/dbraw/zinc/05/69/55/185056955.db2.gz	YFSPACUHLLVHFM-BFHYXJOUSA-N	1	0	278.400	1.994	50	0		CDAARO
C[C@H]1CC[NH2+]C[C@H]1NS(=O)(=O)CCc1cccs1	ZINC000241277706	361752499	/nfs/dbraw/zinc/75/24/99/361752499.db2.gz	LILLJUFVGRCLPS-CMPLNLGQSA-N	1	0	288.438	1.208	50	0		CDAARO
O=C(NCc1cccc(OCC(F)F)n1)[C@@H]1CCC[NH2+]1	ZINC000195555032	342626151	/nfs/dbraw/zinc/62/61/51/342626151.db2.gz	KLRGJYSEGMSIFW-JTQLQIEISA-N	1	0	285.294	1.094	50	0		CDAARO
CCC(=O)N1CC[C@@H]([NH2+]C2Cc3ccccc3C2)C1	ZINC000095423901	539087997	/nfs/dbraw/zinc/08/79/97/539087997.db2.gz	AYSLHYMUDHPSKN-CQSZACIVSA-N	1	0	258.365	1.754	50	0		CDAARO
C[C@H](Cn1ccnc1)NC(=O)N[C@@H](C)[C@H]1CCCO1	ZINC000252512089	361853519	/nfs/dbraw/zinc/85/35/19/361853519.db2.gz	MHNJDJKCXWKEKX-GRYCIOLGSA-N	1	0	266.345	1.138	50	0		CDAARO
COCc1cc(C(=O)N2CC[NH2+]C[C@@H]2C)ccc1F	ZINC000125435881	187184695	/nfs/dbraw/zinc/18/46/95/187184695.db2.gz	IKWOXFNIEDBBKC-JTQLQIEISA-N	1	0	266.316	1.406	50	0		CDAARO
C[N@@H+]1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccco3)[C@@H]2C1	ZINC000685939752	539045601	/nfs/dbraw/zinc/04/56/01/539045601.db2.gz	HXZSYWQLVLBTLQ-AAVRWANBSA-N	1	0	274.364	1.936	50	0		CDAARO
C[N@H+]([C@H]1CCC[C@H]1S(C)(=O)=O)[C@@H]1C=CCCC1	ZINC000248034023	539063911	/nfs/dbraw/zinc/06/39/11/539063911.db2.gz	ITBGSKFSEXMHMF-FRRDWIJNSA-N	1	0	257.399	1.993	50	0		CDAARO
CC[C@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)C(=O)N1CCOCC1	ZINC000096479172	529656084	/nfs/dbraw/zinc/65/60/84/529656084.db2.gz	YSXKTDZKHZXBBH-QWHCGFSZSA-N	1	0	298.427	1.560	50	0		CDAARO
C[C@H](NC(=O)[C@H](C)[NH+]1[C@H](C)CC[C@H]1C)[C@H]1CN(C)CCO1	ZINC000252487309	342382110	/nfs/dbraw/zinc/38/21/10/342382110.db2.gz	VIWHFHNPZPIKEC-NIFZNCRKSA-N	1	0	297.443	1.083	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CN(C(=O)c2coc3ccccc23)CCO1	ZINC000127892222	187338782	/nfs/dbraw/zinc/33/87/82/187338782.db2.gz	VKYPVMHZMBIJJK-YGRLFVJLSA-N	1	0	274.320	1.621	50	0		CDAARO
Cc1nc(CC(C)C)c(C(=O)N[C@@H]2CC[NH2+]C2)s1	ZINC000127948928	187342326	/nfs/dbraw/zinc/34/23/26/187342326.db2.gz	NDXLLKIXYDUPNC-SNVBAGLBSA-N	1	0	267.398	1.742	50	0		CDAARO
COc1cc(C)c(C[NH2+][C@H]2CCN(C)C2=O)cc1OC	ZINC000083471277	362247800	/nfs/dbraw/zinc/24/78/00/362247800.db2.gz	IQRCHXMNUZKVOI-LBPRGKRZSA-N	1	0	278.352	1.333	50	0		CDAARO
COc1cc(C)c(C[NH2+][C@H]2CC(=O)N(C)C2)cc1OC	ZINC000083454662	362247909	/nfs/dbraw/zinc/24/79/09/362247909.db2.gz	LXDOVFVIRWRVSD-LBPRGKRZSA-N	1	0	278.352	1.333	50	0		CDAARO
Cc1c(NC(=O)C[N@H+]2C[C@@H]3CC(C)=CC[C@@H]3C2)cnn1C	ZINC000252483759	362385699	/nfs/dbraw/zinc/38/56/99/362385699.db2.gz	FHYDWJJFHNIEGK-KGLIPLIRSA-N	1	0	288.395	1.955	50	0		CDAARO
CCn1c(CN2C[C@@H](C)O[C@@H](C)C2)nnc1[C@H]1C[C@@H]([NH3+])C1	ZINC000252569009	362393257	/nfs/dbraw/zinc/39/32/57/362393257.db2.gz	VTWXLVMQTKRECA-MPZDIEGVSA-N	1	0	293.415	1.112	50	0		CDAARO
CC(=O)NC[C@@H]1C[N@H+](C[C@H]2C(C)=CCC[C@@H]2C)CCO1	ZINC000191073433	362398763	/nfs/dbraw/zinc/39/87/63/362398763.db2.gz	NECLUUSXMKWBHS-IMJJTQAJSA-N	1	0	280.412	1.816	50	0		CDAARO
Nc1cc(CN2CCO[C@@H](c3nccs3)C2)ccn1	ZINC000191490246	362446858	/nfs/dbraw/zinc/44/68/58/362446858.db2.gz	WTISXJNGIHOXLQ-LLVKDONJSA-N	1	0	276.365	1.694	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1C(=O)NCCc1nc2ccccc2[nH]1	ZINC000097743530	530051863	/nfs/dbraw/zinc/05/18/63/530051863.db2.gz	IYMFAXLMBNQXCC-CQSZACIVSA-N	1	0	286.379	1.706	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+][C@@H](C)[C@@H]2CN(C)CCO2)C1(C)C	ZINC000095988104	362647353	/nfs/dbraw/zinc/64/73/53/362647353.db2.gz	OMBYQXWKUWRLHY-XDQVBPFNSA-N	1	0	270.417	1.499	50	0		CDAARO
CC[C@@H](NC(=O)N1CC[C@@H](C[NH+](C)C)C1)c1noc(C)n1	ZINC000130234234	346647485	/nfs/dbraw/zinc/64/74/85/346647485.db2.gz	FCNQJRMTYWTAEI-NWDGAFQWSA-N	1	0	295.387	1.422	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1n1cnc2c(C)cccc2c1=O	ZINC000584886376	349344961	/nfs/dbraw/zinc/34/49/61/349344961.db2.gz	DSOMOIUZZCUHLZ-KBPBESRZSA-N	1	0	287.363	1.597	50	0		CDAARO
COCCc1noc([C@@H](C)[NH2+]C2CCOCC2)n1	ZINC000584887296	349345747	/nfs/dbraw/zinc/34/57/47/349345747.db2.gz	YMXJWLDXXPRCTL-SECBINFHSA-N	1	0	255.318	1.088	50	0		CDAARO
CCc1csc(CC[NH2+][C@@H](C)CS(C)(=O)=O)n1	ZINC000584891698	349350844	/nfs/dbraw/zinc/35/08/44/349350844.db2.gz	RLKUTCJTRNETHB-VIFPVBQESA-N	1	0	276.427	1.271	50	0		CDAARO
C[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)[C@H]1CC[C@@H](O)CC1)C2	ZINC000584892535	349351682	/nfs/dbraw/zinc/35/16/82/349351682.db2.gz	OYTYVXPKAVPBKF-IJEWVQPXSA-N	1	0	280.412	1.482	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]CCc1cnn(C)c1	ZINC000584892856	349352612	/nfs/dbraw/zinc/35/26/12/349352612.db2.gz	ATELRMKCNHHZDE-GFCCVEGCSA-N	1	0	261.373	1.400	50	0		CDAARO
CN(C)C(=O)CC[C@@H]1CCC[N@@H+](C2CCOCC2)C1	ZINC000584892785	349352636	/nfs/dbraw/zinc/35/26/36/349352636.db2.gz	GGEXRNQKZJQIHJ-ZDUSSCGKSA-N	1	0	268.401	1.746	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H]1CN(C(=O)[C@H]1CC[C@H](O)CC1)C2	ZINC000584894240	349354277	/nfs/dbraw/zinc/35/42/77/349354277.db2.gz	LZOZNUBFYTZVSY-AJNGGQMLSA-N	1	0	280.412	1.480	50	0		CDAARO
O=C(NC1(CO)CCCCCC1)[C@@H]1CC12CC[NH2+]CC2	ZINC000584895285	349355823	/nfs/dbraw/zinc/35/58/23/349355823.db2.gz	ZLIGQMBNNAQZJY-ZDUSSCGKSA-N	1	0	280.412	1.578	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C(=O)c1cn[nH]c1	ZINC000584897986	349359903	/nfs/dbraw/zinc/35/99/03/349359903.db2.gz	QUYUALXKHUUKOD-UHFFFAOYSA-N	1	0	250.346	1.356	50	0		CDAARO
Cc1onc(C(=O)N(C)CC[N@H+](C)C2CCCC2)c1CO	ZINC000584898584	349360735	/nfs/dbraw/zinc/36/07/35/349360735.db2.gz	MPGAYSYWYINZFD-UHFFFAOYSA-N	1	0	295.383	1.422	50	0		CDAARO
CN(CCC1(O)CCCC1)C(=O)[C@H]1CC[N@H+](C)C1	ZINC000584899685	349361389	/nfs/dbraw/zinc/36/13/89/349361389.db2.gz	JHPKHAPMWXQRDA-LBPRGKRZSA-N	1	0	254.374	1.092	50	0		CDAARO
C[C@H]([NH2+]C[C@]1(O)CCOC1)c1ccc(F)cc1F	ZINC000090850233	180046157	/nfs/dbraw/zinc/04/61/57/180046157.db2.gz	QLEPXFNGJBUKCW-TVQRCGJNSA-N	1	0	257.280	1.767	50	0		CDAARO
Cn1ccnc1-c1ccc(N2C[C@@H]3CC[N@H+](C)[C@@H]3C2)nn1	ZINC000091364540	180142559	/nfs/dbraw/zinc/14/25/59/180142559.db2.gz	SVCALXDAQVUCLC-WCQYABFASA-N	1	0	284.367	1.017	50	0		CDAARO
Cc1cccc(S(=O)(=O)N[C@@H]2CCC[NH2+][C@H]2C)c1	ZINC000091496962	180172495	/nfs/dbraw/zinc/17/24/95/180172495.db2.gz	OYPFHDCQEYMPRI-WCQYABFASA-N	1	0	268.382	1.414	50	0		CDAARO
Cc1nc(C[N@@H+]2C[C@@H](C)[C@](O)(C(C)C)C2)n(C)c1C	ZINC000091586130	180199661	/nfs/dbraw/zinc/19/96/61/180199661.db2.gz	JGQUKGCLUGHKGW-IAQYHMDHSA-N	1	0	265.401	1.876	50	0		CDAARO
CCC[C@@]1(CO)CCC[N@H+](CCC(=O)N2CCCC2)C1	ZINC000091604932	180204653	/nfs/dbraw/zinc/20/46/53/180204653.db2.gz	XGZAIUINPKDVAL-MRXNPFEDSA-N	1	0	282.428	1.874	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2ccc(-n3ccnc3)cc2)C[C@@H]1C1CC1	ZINC000091616938	180208899	/nfs/dbraw/zinc/20/88/99/180208899.db2.gz	PGJYKFJGFLFXDL-CVEARBPZSA-N	1	0	296.374	1.682	50	0		CDAARO
CCCc1n[nH]cc1C(=O)N1C[C@H]([NH3+])[C@@H](CCC)C1	ZINC000091526748	180179163	/nfs/dbraw/zinc/17/91/63/180179163.db2.gz	FTOZYNNZWOMVCV-JQWIXIFHSA-N	1	0	264.373	1.562	50	0		CDAARO
Cc1nc(CN2C[C@@H](CO)C[C@H](C[NH+]3CCCC3)C2)co1	ZINC000091714007	180231512	/nfs/dbraw/zinc/23/15/12/180231512.db2.gz	MFBROPLOMWVHOK-CABCVRRESA-N	1	0	293.411	1.509	50	0		CDAARO
COCCC[N@@H+]1CC[C@H](CNc2ccncn2)C1	ZINC000091933469	180288413	/nfs/dbraw/zinc/28/84/13/180288413.db2.gz	GDRWIFJULDUEAW-GFCCVEGCSA-N	1	0	250.346	1.247	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)C2CCOCC2)C[C@@H]1c1ccccc1	ZINC000092038994	180311028	/nfs/dbraw/zinc/31/10/28/180311028.db2.gz	YGOQPVQNSFLYLB-CABCVRRESA-N	1	0	274.364	1.366	50	0		CDAARO
CN(C)[C@H](C(=O)NC[C@@H]1CCC[N@@H+]1C)c1ccccc1	ZINC000106158160	186104205	/nfs/dbraw/zinc/10/42/05/186104205.db2.gz	SDYDSPXRLDXMIA-GJZGRUSLSA-N	1	0	275.396	1.500	50	0		CDAARO
CCN(CC)c1nc(N)cc(N2C[C@@H](C)O[C@@H](C)C2)n1	ZINC000065399270	363043651	/nfs/dbraw/zinc/04/36/51/363043651.db2.gz	BVQPKPULQMPDEN-PHIMTYICSA-N	1	0	279.388	1.519	50	0		CDAARO
O=C(CC[NH+]1CCCC1)NC[C@H]1COc2ccccc2O1	ZINC000000379340	355907235	/nfs/dbraw/zinc/90/72/35/355907235.db2.gz	LGIMQBGKELFJBB-ZDUSSCGKSA-N	1	0	290.363	1.429	50	0		CDAARO
COc1cccc(OC[C@H](O)C[NH+]2CCCCC2)c1	ZINC000000250508	355899282	/nfs/dbraw/zinc/89/92/82/355899282.db2.gz	SATJSPFNHMXELY-CYBMUJFWSA-N	1	0	265.353	1.921	50	0		CDAARO
CCOc1ccc(OCCOCC[NH2+]CCOC)cc1	ZINC000003003150	355990993	/nfs/dbraw/zinc/99/09/93/355990993.db2.gz	FVPXUGLPQWMNDN-UHFFFAOYSA-N	1	0	283.368	1.717	50	0		CDAARO
COc1cccc(C[NH2+]CCCN2CCOCC2)c1	ZINC000002510435	355972104	/nfs/dbraw/zinc/97/21/04/355972104.db2.gz	MJDPYPBTAKZGRD-UHFFFAOYSA-N	1	0	264.369	1.507	50	0		CDAARO
C[C@H](c1ccsc1)N1CCN(C(=O)C[NH+](C)C)CC1	ZINC000097379048	356106727	/nfs/dbraw/zinc/10/67/27/356106727.db2.gz	MFCLFWNXXGYDMO-GFCCVEGCSA-N	1	0	281.425	1.515	50	0		CDAARO
CCN1CCC[C@@H]1C[NH2+]C[C@@H](O)COc1cccc(C)c1	ZINC000022918991	356268585	/nfs/dbraw/zinc/26/85/85/356268585.db2.gz	IMTNEWYWNBRNEN-HZPDHXFCSA-N	1	0	292.423	1.809	50	0		CDAARO
c1coc(C[NH2+][C@@H]2CCCN(c3ncccn3)C2)c1	ZINC000011710974	356277841	/nfs/dbraw/zinc/27/78/41/356277841.db2.gz	UHSWGXPLTREWQR-GFCCVEGCSA-N	1	0	258.325	1.828	50	0		CDAARO
CC(C)[NH2+][C@@H]1CC(=O)N(CCc2ccc(F)cc2)C1	ZINC000012588173	356310606	/nfs/dbraw/zinc/31/06/06/356310606.db2.gz	RNVGPEFQEJUNLU-CQSZACIVSA-N	1	0	264.344	1.967	50	0		CDAARO
CNC(=O)NC(=O)C[N@@H+]1CCC[C@@H]1c1ccccc1	ZINC000014077193	356372921	/nfs/dbraw/zinc/37/29/21/356372921.db2.gz	GIEXRSAISGJRDB-GFCCVEGCSA-N	1	0	261.325	1.279	50	0		CDAARO
CN1C(=O)N(Cc2ccccc2)C(=O)C12CC[NH+](C)CC2	ZINC000014540929	356390771	/nfs/dbraw/zinc/39/07/71/356390771.db2.gz	WCEFHJCZXKKHEX-UHFFFAOYSA-N	1	0	287.363	1.545	50	0		CDAARO
Cc1cc(N2CC[NH2+]CC2)c(Cl)cc1S(C)(=O)=O	ZINC000015021295	356404405	/nfs/dbraw/zinc/40/44/05/356404405.db2.gz	CXWYOIWVCHEFMO-UHFFFAOYSA-N	1	0	288.800	1.462	50	0		CDAARO
COc1ccc(CN2CC[NH2+]CC2)c(OC)c1OC	ZINC000019358638	356482430	/nfs/dbraw/zinc/48/24/30/356482430.db2.gz	UHWVSEOVJBQKBE-UHFFFAOYSA-N	1	0	266.341	1.118	50	0	world	CDAARO
CC[NH2+]Cc1nc2cc(OC)c(OC)cc2c(=O)[nH]1	ZINC000019229996	356477967	/nfs/dbraw/zinc/47/79/67/356477967.db2.gz	SEXRDGFJSQWDRA-UHFFFAOYSA-N	1	0	263.297	1.050	50	0		CDAARO
OCC[NH+]1CCN(CCOc2cccc(Cl)c2)CC1	ZINC000019293459	356479307	/nfs/dbraw/zinc/47/93/07/356479307.db2.gz	LATFXRKUFCCRSM-UHFFFAOYSA-N	1	0	284.787	1.329	50	0		CDAARO
CC[NH+]1CCN(CCCOc2ccc(CO)cc2)CC1	ZINC000023076589	356626414	/nfs/dbraw/zinc/62/64/14/356626414.db2.gz	OYPHVBCRSKIEPB-UHFFFAOYSA-N	1	0	278.396	1.585	50	0		CDAARO
OCc1cn(CC2CC[NH+](C[C@H]3CC=CCC3)CC2)nn1	ZINC000023398614	356642754	/nfs/dbraw/zinc/64/27/54/356642754.db2.gz	AMLXRALZLZNINB-AWEZNQCLSA-N	1	0	290.411	1.839	50	0		CDAARO
COC(C[NH2+]Cc1c[nH]nc1-c1cccs1)OC	ZINC000024984030	356664945	/nfs/dbraw/zinc/66/49/45/356664945.db2.gz	KLBNHEDVOLTROX-UHFFFAOYSA-N	1	0	267.354	1.847	50	0		CDAARO
COC(=O)c1ccc(OC[C@H](O)C[NH2+]C(C)C)cc1	ZINC000026781692	356698966	/nfs/dbraw/zinc/69/89/66/356698966.db2.gz	IKLHTJKCEKYJKI-GFCCVEGCSA-N	1	0	267.325	1.211	50	0	in-vitro	CDAARO
COc1ccc(Cl)cc1CN(C)C(=O)[C@H]1C[NH2+]CCO1	ZINC000187275975	356703735	/nfs/dbraw/zinc/70/37/35/356703735.db2.gz	ZITZYCUVWFTCHR-CYBMUJFWSA-N	1	0	298.770	1.295	50	0		CDAARO
CCOC(=O)C1=C(C[N@H+](C)[C@H](C)C(C)(C)C)NC(=O)NC1	ZINC000027134952	356703875	/nfs/dbraw/zinc/70/38/75/356703875.db2.gz	XUQLUYJHBFHCKZ-SNVBAGLBSA-N	1	0	297.399	1.483	50	0		CDAARO
CNC(=O)NC(=O)C[NH2+][C@H](c1cccs1)C(C)C	ZINC000029189817	356732351	/nfs/dbraw/zinc/73/23/51/356732351.db2.gz	JVOBLWKIOBDIPB-NSHDSACASA-N	1	0	269.370	1.490	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]C2CCC(O)CC2)CC1	ZINC000000221027	356734964	/nfs/dbraw/zinc/73/49/64/356734964.db2.gz	FVGPKNMSYMETPL-UHFFFAOYSA-N	1	0	270.373	1.500	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cc3ccccn3c2)C1	ZINC000269146065	356808675	/nfs/dbraw/zinc/80/86/75/356808675.db2.gz	FTDQVCVAEIJWCP-LBPRGKRZSA-N	1	0	257.337	1.621	50	0		CDAARO
Cc1cc(N2CCN(c3ccccc3)C(=O)[C@@H]2C)nc(N)[nH+]1	ZINC000032519411	356781754	/nfs/dbraw/zinc/78/17/54/356781754.db2.gz	JHVYPKQLDJRPNG-LBPRGKRZSA-N	1	0	297.362	1.609	50	0		CDAARO
C[NH2+][C@@H](C)c1ccccc1N1CCCS1(=O)=O	ZINC000036880974	356889130	/nfs/dbraw/zinc/88/91/30/356889130.db2.gz	LMHWTQLDJHLWMX-JTQLQIEISA-N	1	0	254.355	1.507	50	0		CDAARO
CN(C(=O)[C@@H]([NH3+])c1ccccc1)[C@@H]1CCSC1	ZINC000037175058	356902508	/nfs/dbraw/zinc/90/25/08/356902508.db2.gz	CXSIIEMTTWJLEK-NEPJUHHUSA-N	1	0	250.367	1.650	50	0		CDAARO
CCN(Cc1noc(CC(C)C)n1)C(=O)[C@H]1CC[NH2+]C1	ZINC000055393307	357333070	/nfs/dbraw/zinc/33/30/70/357333070.db2.gz	YLXJBXCENGRTFP-NSHDSACASA-N	1	0	280.372	1.226	50	0		CDAARO
[NH3+]C[C@H](CO)Cc1ccc(F)c(Br)c1	ZINC000063065180	357502671	/nfs/dbraw/zinc/50/26/71/357502671.db2.gz	ISGGGXAZUODMDG-MRVPVSSYSA-N	1	0	262.122	1.698	50	0		CDAARO
COC(=O)[C@@H](O)C1CC[NH+](CCc2ccc(C)cc2)CC1	ZINC000095432429	357522364	/nfs/dbraw/zinc/52/23/64/357522364.db2.gz	QJJSCDHVTWKVOR-INIZCTEOSA-N	1	0	291.391	1.783	50	0		CDAARO
O=C(Cc1ccc2c(c1)OCO2)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065404650	357538046	/nfs/dbraw/zinc/53/80/46/357538046.db2.gz	RSSHTNAWRBTGSR-OLZOCXBDSA-N	1	0	288.347	1.311	50	0		CDAARO
CCC1(CC)CN(C(=O)[C@@H]2CC[N@H+](CCOC)C2)CCO1	ZINC000065419850	357540094	/nfs/dbraw/zinc/54/00/94/357540094.db2.gz	GANFBFLVIALRKU-CQSZACIVSA-N	1	0	298.427	1.372	50	0		CDAARO
CNc1ccnc(N(C)CCCn2nc(C)cc2C)n1	ZINC000065493845	357544444	/nfs/dbraw/zinc/54/44/44/357544444.db2.gz	ZIHKYZLWQYRPRK-UHFFFAOYSA-N	1	0	274.372	1.858	50	0		CDAARO
C[NH+]1CCC(Cc2noc(CCn3cccc3)n2)CC1	ZINC000067724425	357621144	/nfs/dbraw/zinc/62/11/44/357621144.db2.gz	MHLIADPBRROCED-UHFFFAOYSA-N	1	0	274.368	1.998	50	0		CDAARO
C=Cc1ccc(C(=O)N2C[C@H]([NH3+])C[C@H]2C(=O)NCC)cc1	ZINC000067896379	357636434	/nfs/dbraw/zinc/63/64/34/357636434.db2.gz	NKNPWQDBYLNPQA-KGLIPLIRSA-N	1	0	287.363	1.008	50	0		CDAARO
Cc1cnn(-c2ccc(C(=O)N3CC[NH2+][C@H](C)C3)cc2)c1	ZINC000188432927	357682745	/nfs/dbraw/zinc/68/27/45/357682745.db2.gz	SGACGUYCDJSQIH-CYBMUJFWSA-N	1	0	284.363	1.615	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCN(Cc2c(F)cccc2F)C1	ZINC000072480376	357838905	/nfs/dbraw/zinc/83/89/05/357838905.db2.gz	FJRUVSISPAUJOE-AWEZNQCLSA-N	1	0	270.323	1.463	50	0		CDAARO
COc1ccc(OC)c(CN2CC[NH+](C)CC2)c1	ZINC000019359130	358056834	/nfs/dbraw/zinc/05/68/34/358056834.db2.gz	ZXZHTPATOFDCDJ-UHFFFAOYSA-N	1	0	250.342	1.451	50	0		CDAARO
O=C(COc1cccc(Cl)c1)NC[C@@H]1C[C@H](F)C[NH2+]1	ZINC000082091303	358146059	/nfs/dbraw/zinc/14/60/59/358146059.db2.gz	BKZAREPAZPSFBS-QWRGUYRKSA-N	1	0	286.734	1.535	50	0		CDAARO
CN(CCc1ccccn1)C(=O)[C@H]([NH3+])c1ccccc1	ZINC000019844225	358163177	/nfs/dbraw/zinc/16/31/77/358163177.db2.gz	IOZFXTIKDODFKD-OAHLLOKOSA-N	1	0	269.348	1.783	50	0		CDAARO
Cc1cccc(NC[C@@H]2CCN(CCS(C)(=O)=O)C2)[nH+]1	ZINC000097203976	358191457	/nfs/dbraw/zinc/19/14/57/358191457.db2.gz	PKOLPDFDTNTVDV-ZDUSSCGKSA-N	1	0	297.424	1.168	50	0		CDAARO
C(c1noc(C2CCCCC2)n1)N1CC[NH2+]CC1	ZINC000088611556	358377439	/nfs/dbraw/zinc/37/74/39/358377439.db2.gz	ITFPGGCXTPSFGS-UHFFFAOYSA-N	1	0	250.346	1.523	50	0		CDAARO
c1csc([C@H]([NH2+]CCCn2ccnn2)c2ncc[nH]2)c1	ZINC000195115510	358551149	/nfs/dbraw/zinc/55/11/49/358551149.db2.gz	PUGSCPAVHKYJPX-LBPRGKRZSA-N	1	0	288.380	1.832	50	0		CDAARO
Cc1cccc(O[C@H](C)C(=O)N2CCC[C@H]([NH3+])C2)c1	ZINC000195109940	358551260	/nfs/dbraw/zinc/55/12/60/358551260.db2.gz	VAISZUWMUPEBKS-OLZOCXBDSA-N	1	0	262.353	1.712	50	0		CDAARO
O=S(=O)(/C=C/c1ccccc1)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000247508909	358551272	/nfs/dbraw/zinc/55/12/72/358551272.db2.gz	PDHTVMCUUHTGJD-JQVXPOPVSA-N	1	0	292.404	1.767	50	0		CDAARO
CC1=CCC[C@H](C)[C@H]1C[N@H+]1C[C@@H](C)O[C@H](C(N)=O)C1	ZINC000195575902	358567675	/nfs/dbraw/zinc/56/76/75/358567675.db2.gz	PMKCMSBMXOZEQH-CRWXNKLISA-N	1	0	266.385	1.553	50	0		CDAARO
C[N@@H+]1CCC[C@H](Cn2ncc3ccccc3c2=O)C1	ZINC000095371441	358687721	/nfs/dbraw/zinc/68/77/21/358687721.db2.gz	GFELSUAJINSLMT-LBPRGKRZSA-N	1	0	257.337	1.738	50	0		CDAARO
OCCC[N@@H+]1C[C@@H]2CC[C@H](C1)N(Cc1ccccc1)C2	ZINC000095388956	358692249	/nfs/dbraw/zinc/69/22/49/358692249.db2.gz	BNCUINIGONTOFP-DLBZAZTESA-N	1	0	274.408	1.965	50	0		CDAARO
CC(C)(C)OC(=O)CN(CC1CC1)C1CC([NH3+])C1	ZINC000097102798	358751145	/nfs/dbraw/zinc/75/11/45/358751145.db2.gz	BGFJQEMDQHFIKB-UHFFFAOYSA-N	1	0	254.374	1.530	50	0		CDAARO
OCCOc1ccccc1C[N@@H+]1CCC[C@@H]1CCO	ZINC000097468690	358778870	/nfs/dbraw/zinc/77/88/70/358778870.db2.gz	QLCNFAOUSGXVPK-CQSZACIVSA-N	1	0	265.353	1.405	50	0		CDAARO
O=C(C[C@H]1COCC[NH2+]1)NCc1ccc2c(c1)CCCC2	ZINC000097694793	358793938	/nfs/dbraw/zinc/79/39/38/358793938.db2.gz	UFTNVDXTNLJFJG-INIZCTEOSA-N	1	0	288.391	1.560	50	0		CDAARO
OCCOc1cccc(CN2CC([NH+]3CCCCC3)C2)c1	ZINC000097772746	358797123	/nfs/dbraw/zinc/79/71/23/358797123.db2.gz	RQKQXNKFSOLQCC-UHFFFAOYSA-N	1	0	290.407	1.728	50	0		CDAARO
[NH3+][C@H](Cc1ccccc1)c1nnc(C2CCOCC2)[nH]1	ZINC000097775969	358798835	/nfs/dbraw/zinc/79/88/35/358798835.db2.gz	DBEPIBVFQMAVIX-CYBMUJFWSA-N	1	0	272.352	1.941	50	0		CDAARO
C1=CCN(c2nc(-c3ccncc3)nc3c2CC[NH2+]CC3)C1	ZINC000101171052	358840451	/nfs/dbraw/zinc/84/04/51/358840451.db2.gz	YZFXECMGJYOGDG-UHFFFAOYSA-N	1	0	293.374	1.603	50	0		CDAARO
COC[C@H]1CCC[N@H+](Cc2ccc(OC)nc2)C1	ZINC000215965720	358913017	/nfs/dbraw/zinc/91/30/17/358913017.db2.gz	RUWVSHSXRSIVJX-ZDUSSCGKSA-N	1	0	250.342	1.949	50	0		CDAARO
Cc1ccnn1CCC(=O)N1CCC[N@@H+]2CCC[C@H]2C1	ZINC000222373410	359338385	/nfs/dbraw/zinc/33/83/85/359338385.db2.gz	HUDRKRTVUYVSRZ-AWEZNQCLSA-N	1	0	276.384	1.278	50	0		CDAARO
Cc1cc(C[NH+]2CCC3(CC2)C[C@@H](O)CCO3)n(C)n1	ZINC000257190287	359538174	/nfs/dbraw/zinc/53/81/74/359538174.db2.gz	MCQBVNAYQVAVDA-AWEZNQCLSA-N	1	0	279.384	1.234	50	0		CDAARO
Cc1noc([C@@H]2C[N@H+](Cc3c(C)noc3C)C[C@H]2CO)n1	ZINC000257189165	359531144	/nfs/dbraw/zinc/53/11/44/359531144.db2.gz	NMKXWLBSNPIDNP-WCQYABFASA-N	1	0	292.339	1.191	50	0		CDAARO
COCCC(=O)N1CCCCC[C@H]1CN1CCOCC1	ZINC000257195493	359613757	/nfs/dbraw/zinc/61/37/57/359613757.db2.gz	WFUCYXHBGPRVQC-AWEZNQCLSA-N	1	0	284.400	1.126	50	0		CDAARO
Cc1ccccc1C[C@H](C)[NH2+]CC(=O)N1CCOCC1	ZINC000095988830	359723254	/nfs/dbraw/zinc/72/32/54/359723254.db2.gz	DNMCBMSXPWWKEA-AWEZNQCLSA-N	1	0	276.380	1.374	50	0		CDAARO
C[NH2+]CCC(=O)N1CCOC[C@H]1Cc1ccccc1	ZINC000262223752	359773045	/nfs/dbraw/zinc/77/30/45/359773045.db2.gz	PKFHHNWRZZVUIL-CQSZACIVSA-N	1	0	262.353	1.066	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2n[nH]c3ccc(C)cc32)C1	ZINC000408525450	359935685	/nfs/dbraw/zinc/93/56/85/359935685.db2.gz	JJTAQOADZMHZDG-LLVKDONJSA-N	1	0	272.352	1.553	50	0		CDAARO
[NH3+]CCc1n[nH]c(=O)n1-c1cccc2ccccc21	ZINC000065509141	360094191	/nfs/dbraw/zinc/09/41/91/360094191.db2.gz	WCIPAWLMTACQLZ-UHFFFAOYSA-N	1	0	254.293	1.215	50	0		CDAARO
COCCOC1CC[NH+](Cc2cncn2C)CC1	ZINC000177082515	189027553	/nfs/dbraw/zinc/02/75/53/189027553.db2.gz	PSIVRSNPCJKSPY-UHFFFAOYSA-N	1	0	253.346	1.048	50	0		CDAARO
CCc1ccc([C@H](C)[NH2+]CC(C)(C)NS(C)(=O)=O)o1	ZINC000089581847	360493351	/nfs/dbraw/zinc/49/33/51/360493351.db2.gz	DXJFQFUEFXOREU-JTQLQIEISA-N	1	0	288.413	1.820	50	0		CDAARO
Cc1nc([C@@H]2CCOC2)cc(N(C)CCC[NH+](C)C)n1	ZINC000426574910	360684230	/nfs/dbraw/zinc/68/42/30/360684230.db2.gz	LYSFRDFDOWJENZ-CYBMUJFWSA-N	1	0	278.400	1.677	50	0		CDAARO
Cc1nnsc1CN(C)C(=O)NCC(C)(C)C[NH+](C)C	ZINC000426428859	360669229	/nfs/dbraw/zinc/66/92/29/360669229.db2.gz	QRCYOGAEQKBUKT-UHFFFAOYSA-N	1	0	299.444	1.576	50	0		CDAARO
O=C(Cc1ccccc1Br)NC[C@@H]1CCC[NH2+]1	ZINC000178764933	189144306	/nfs/dbraw/zinc/14/43/06/189144306.db2.gz	PJOMGKKRMCNSKO-NSHDSACASA-N	1	0	297.196	1.860	50	0		CDAARO
CCCN(C(=O)Cc1ccc2c(c1)OCO2)[C@H]1CC[NH2+]C1	ZINC000178903392	189153379	/nfs/dbraw/zinc/15/33/79/189153379.db2.gz	JWBIJBCASHUXLR-ZDUSSCGKSA-N	1	0	290.363	1.558	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)/C=C/c2ccccc2OC)C1	ZINC000178986354	189159685	/nfs/dbraw/zinc/15/96/85/189159685.db2.gz	VIBSDUFTVKOOJD-SBDDDAINSA-N	1	0	274.364	1.776	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cc3c(c(Cl)c2)OCO3)C1	ZINC000179021853	189162431	/nfs/dbraw/zinc/16/24/31/189162431.db2.gz	ITQUZZFIHJALRV-VIFPVBQESA-N	1	0	296.754	1.750	50	0		CDAARO
CC(C)Nc1ncccc1C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179062578	189166125	/nfs/dbraw/zinc/16/61/25/189166125.db2.gz	PPABRBQKSRIZPM-LLVKDONJSA-N	1	0	262.357	1.336	50	0		CDAARO
C[C@@H]1C[NH+](C[C@@H](O)COC2CCCCC2)C[C@@H](C)O1	ZINC000012414139	361229641	/nfs/dbraw/zinc/22/96/41/361229641.db2.gz	WRNHQEHAJUBKFK-MGPQQGTHSA-N	1	0	271.401	1.806	50	0		CDAARO
C[C@@H](Oc1ccccc1)C(=O)NCC1(C)CC[NH2+]CC1	ZINC000181281456	189292599	/nfs/dbraw/zinc/29/25/99/189292599.db2.gz	VLDDIUHDQOJHCQ-CYBMUJFWSA-N	1	0	276.380	1.960	50	0		CDAARO
Cc1ccc(S(=O)(=O)N(C)C2CC[NH2+]CC2)cc1C	ZINC000036300031	361490166	/nfs/dbraw/zinc/49/01/66/361490166.db2.gz	KHIPNHISBAWFBK-UHFFFAOYSA-N	1	0	282.409	1.676	50	0		CDAARO
Fc1ccc(N2CC[NH+](CCc3ccncc3)CC2)nc1	ZINC000367628899	364014051	/nfs/dbraw/zinc/01/40/51/364014051.db2.gz	AITHTFLFPLUHSU-UHFFFAOYSA-N	1	0	286.354	1.980	50	0		CDAARO
C[NH+](C)CCCNc1c(=O)c(=O)c1NC1CCCCC1	ZINC000101687209	364033163	/nfs/dbraw/zinc/03/31/63/364033163.db2.gz	OQHQFCPIXVOYAH-UHFFFAOYSA-N	1	0	279.384	1.391	50	0		CDAARO
COc1ccc(OCCC[N@@H+]2CC[C@@H](O)[C@@H](CO)C2)cc1	ZINC000412104401	240014371	/nfs/dbraw/zinc/01/43/71/240014371.db2.gz	NJCSAWHHEDERKJ-CZUORRHYSA-N	1	0	295.379	1.139	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)Cn1cccn1	ZINC000249689655	365162822	/nfs/dbraw/zinc/16/28/22/365162822.db2.gz	JLXXMVFNFGBNBX-ZIAGYGMSSA-N	1	0	276.384	1.358	50	0		CDAARO
O=S(=O)(CCC1CC1)N[C@H]1CC[N@H+](CC2CC2)C1	ZINC000089598163	366881371	/nfs/dbraw/zinc/88/13/71/366881371.db2.gz	NJZZIWUWPZYNGB-ZDUSSCGKSA-N	1	0	272.414	1.190	50	0		CDAARO
CC(=O)N1CCN(C(=O)CC[NH2+]C[C@H]2CC=CCC2)CC1	ZINC000089954483	366982092	/nfs/dbraw/zinc/98/20/92/366982092.db2.gz	KCRNKPYQASXLME-HNNXBMFYSA-N	1	0	293.411	1.013	50	0		CDAARO
CC[NH+](CC)[C@H]1CCN(C(=O)Nc2cccnn2)C1	ZINC000089967865	366986998	/nfs/dbraw/zinc/98/69/98/366986998.db2.gz	YXFXAFVXHKSCJI-NSHDSACASA-N	1	0	263.345	1.425	50	0		CDAARO
CCNC(=O)NC(=O)C[N@@H+]1CCC[C@@H]2CCCC[C@@H]21	ZINC000007587553	367286325	/nfs/dbraw/zinc/28/63/25/367286325.db2.gz	HNJQZQMDECKFBC-RYUDHWBXSA-N	1	0	267.373	1.487	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@H]1NC(=O)c1cc(F)ccc1F	ZINC000094345386	367398504	/nfs/dbraw/zinc/39/85/04/367398504.db2.gz	TXMKFQLMJRWGAD-QPUJVOFHSA-N	1	0	254.280	1.693	50	0		CDAARO
CCOCC(=O)N1CCN(c2cnccc2C)CC1	ZINC000252500986	367651442	/nfs/dbraw/zinc/65/14/42/367651442.db2.gz	UASYDJXRSWBEFA-UHFFFAOYSA-N	1	0	263.341	1.075	50	0		CDAARO
CCn1nccc1C(=O)NCCn1c(C)c[nH+]c1C1CC1	ZINC000575555241	369130649	/nfs/dbraw/zinc/13/06/49/369130649.db2.gz	ZAHVIYJQOSDOMY-UHFFFAOYSA-N	1	0	287.367	1.715	50	0		CDAARO
COc1ccc(Cl)cc1CN(C)C(=O)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000276619300	193403387	/nfs/dbraw/zinc/40/33/87/193403387.db2.gz	IRYDWOKEBBARMR-VXGBXAGGSA-N	1	0	298.770	1.030	50	0		CDAARO
COc1ccc(CN(C)C(=O)[C@@H]2CSCN2)cc1F	ZINC000037758204	370060768	/nfs/dbraw/zinc/06/07/68/370060768.db2.gz	ICIUKKZQGKSPOM-NSHDSACASA-N	1	0	284.356	1.455	50	0		CDAARO
C[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(Br)o1	ZINC000575605157	370604188	/nfs/dbraw/zinc/60/41/88/370604188.db2.gz	NIFDLIBZEFRVLB-MTBHXBHISA-N	1	0	285.141	1.332	50	0		CDAARO
O=C(c1cscn1)N1CCC([C@H]2CC[NH2+]C2)CC1	ZINC000377752757	371680824	/nfs/dbraw/zinc/68/08/24/371680824.db2.gz	XPUDENGKLBZTHI-NSHDSACASA-N	1	0	265.382	1.605	50	0		CDAARO
CC(C)(C)[C@@H]([NH3+])C(=O)N1CCN(c2ccc(O)cc2)CC1	ZINC000097020435	541878028	/nfs/dbraw/zinc/87/80/28/541878028.db2.gz	GOLDLQKSMAYABB-AWEZNQCLSA-N	1	0	291.395	1.414	50	0		CDAARO
Cc1nc2ccccn2c1CN(C)C(=O)C[C@H]1CC[NH2+]C1	ZINC000299789535	372765248	/nfs/dbraw/zinc/76/52/48/372765248.db2.gz	WWWGQYHCGBNGAY-CYBMUJFWSA-N	1	0	286.379	1.601	50	0		CDAARO
COCCC[N@@H+]1CC[C@H](CNC(=O)Cc2cc(C)no2)C1	ZINC000299778373	372755146	/nfs/dbraw/zinc/75/51/46/372755146.db2.gz	RUDUGWPLMIEXCK-CYBMUJFWSA-N	1	0	295.383	1.000	50	0		CDAARO
O=C(NC1CCCC1)NC1CC[NH+](C2CC2)CC1	ZINC000031030631	373068553	/nfs/dbraw/zinc/06/85/53/373068553.db2.gz	FYPNFTLZQDEAQC-UHFFFAOYSA-N	1	0	251.374	1.855	50	0		CDAARO
CCOC(CN1CC[C@@H]2CC[N@H+](C)C[C@H]21)OCC	ZINC000253417103	373725562	/nfs/dbraw/zinc/72/55/62/373725562.db2.gz	QBFKFYOKDYAHRC-QWHCGFSZSA-N	1	0	256.390	1.412	50	0		CDAARO
C[C@@H]1C[N@@H+](C2CCN(c3cnccn3)CC2)CCO1	ZINC000253418794	373728607	/nfs/dbraw/zinc/72/86/07/373728607.db2.gz	HOECEYPPJZQOOC-GFCCVEGCSA-N	1	0	262.357	1.166	50	0		CDAARO
C[NH+](C)CCN(C(=O)c1ccsc1)C1CCOCC1	ZINC000206665754	374179362	/nfs/dbraw/zinc/17/93/62/374179362.db2.gz	WMCGNCJEOJUEPW-UHFFFAOYSA-N	1	0	282.409	1.931	50	0		CDAARO
O[C@@H](COc1ccccc1)C[N@@H+]1CCCSCC1	ZINC000095442036	374942259	/nfs/dbraw/zinc/94/22/59/374942259.db2.gz	DEOSBEGXFTULPH-CYBMUJFWSA-N	1	0	267.394	1.865	50	0		CDAARO
O=C(OC[C@@H]1CC(=O)N(C2CC2)C1)c1ccn2c[nH+]cc2c1	ZINC000095455095	374953506	/nfs/dbraw/zinc/95/35/06/374953506.db2.gz	IHYJALFJRYZATN-LLVKDONJSA-N	1	0	299.330	1.502	50	0		CDAARO
Cc1ccc(CC(=O)N2CCC[C@@H]([C@H](C)[NH3+])C2)cn1	ZINC000299738819	375199188	/nfs/dbraw/zinc/19/91/88/375199188.db2.gz	GWEGYSOPVGKASS-GXTWGEPZSA-N	1	0	261.369	1.518	50	0		CDAARO
Cc1nn(C)cc1C(=O)N1CC[C@@H]([NH+]2CCCCC2)C1	ZINC000334456679	375421338	/nfs/dbraw/zinc/42/13/38/375421338.db2.gz	AXHMUKREZXOAIU-CYBMUJFWSA-N	1	0	276.384	1.429	50	0		CDAARO
COc1ccc(/C(C)=C\C(=O)N2CC[NH2+][C@@H](C)C2)cc1	ZINC000606441656	375823309	/nfs/dbraw/zinc/82/33/09/375823309.db2.gz	JGARUMSFFBYLGH-UKVQZPPCSA-N	1	0	274.364	1.919	50	0		CDAARO
O=C(C[C@@H]1CCOC1)NC1CC[NH+](C2CCCC2)CC1	ZINC000370083613	375829891	/nfs/dbraw/zinc/82/98/91/375829891.db2.gz	RIGAMAAYOASUMM-ZDUSSCGKSA-N	1	0	280.412	1.936	50	0		CDAARO
C[C@@H]1CCCC[C@@H]1NC(=O)C[N@@H+]1C[C@@H](C(N)=O)CC[C@H]1C	ZINC000241157264	376016747	/nfs/dbraw/zinc/01/67/47/376016747.db2.gz	JWFSIKRIXKYOBV-MQYQWHSLSA-N	1	0	295.427	1.267	50	0		CDAARO
CCNC(=O)NC(=O)C[N@@H+]1CC[C@H]2CCCC[C@H]2C1	ZINC000242389255	376021162	/nfs/dbraw/zinc/02/11/62/376021162.db2.gz	ZVNGGNLCNZEFBK-NEPJUHHUSA-N	1	0	267.373	1.344	50	0		CDAARO
CCc1csc(C[NH2+][C@@H](C)Cn2cncn2)n1	ZINC000067713996	377230865	/nfs/dbraw/zinc/23/08/65/377230865.db2.gz	KAWPQQXPMZSIGU-VIFPVBQESA-N	1	0	251.359	1.475	50	0		CDAARO
Cc1ccccc1C[NH2+]C[C@H](O)CN1CCCC1=O	ZINC000001391345	377591367	/nfs/dbraw/zinc/59/13/67/377591367.db2.gz	AMTALYNWDRKLON-AWEZNQCLSA-N	1	0	262.353	1.068	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)/C=C\C2CCOCC2)C1	ZINC000493201878	253398600	/nfs/dbraw/zinc/39/86/00/253398600.db2.gz	GKYAAFSXNOIXPA-WSNITJDQSA-N	1	0	266.385	1.427	50	0		CDAARO
C[NH+](C)[C@H]1CCN(C(=O)Nc2cncc(F)c2)C1	ZINC000281300835	195187949	/nfs/dbraw/zinc/18/79/49/195187949.db2.gz	DFDPACJPQFFYEN-NSHDSACASA-N	1	0	252.293	1.389	50	0		CDAARO
Cc1cccnc1[C@H]([NH2+]C[C@H](O)Cn1cccn1)C(C)C	ZINC000096424381	256758340	/nfs/dbraw/zinc/75/83/40/256758340.db2.gz	PGUJKMLEIZPVBJ-LSDHHAIUSA-N	1	0	288.395	1.934	50	0		CDAARO
O=C(NC1CCC1)NC1CC[NH+](C[C@H]2CCOC2)CC1	ZINC000096413101	256789829	/nfs/dbraw/zinc/78/98/29/256789829.db2.gz	TZKPNFAASATQSU-GFCCVEGCSA-N	1	0	281.400	1.339	50	0		CDAARO
Cc1ccc(OCC(=O)NCC[NH+](C)C)c(C)c1	ZINC000002820126	390179898	/nfs/dbraw/zinc/17/98/98/390179898.db2.gz	FKRJFOPFBLRMKJ-UHFFFAOYSA-N	1	0	250.342	1.360	50	0		CDAARO
CC(=O)c1c(C)n(O)c2cc(F)c(F)cc2[n+]1=O	ZINC000104104836	390686322	/nfs/dbraw/zinc/68/63/22/390686322.db2.gz	AIGZNYSLJRGREB-UHFFFAOYSA-N	1	0	255.200	1.582	50	0		CDAARO
C[C@@H](C[N@@H+]1CCC[C@H](C)C1)NS(=O)(=O)C1CC1	ZINC000249202082	390940832	/nfs/dbraw/zinc/94/08/32/390940832.db2.gz	RCRFTSJBSAQOJU-QWRGUYRKSA-N	1	0	260.403	1.189	50	0		CDAARO
COCCN1CC[N@H+](CC2CCCCC2)CCC1=O	ZINC000014951110	391016323	/nfs/dbraw/zinc/01/63/23/391016323.db2.gz	KTLLVLPIAPODBK-UHFFFAOYSA-N	1	0	268.401	1.747	50	0		CDAARO
[NH3+]C[C@@H]1CN(Cc2cccc3cnccc32)CCO1	ZINC000426535478	391567131	/nfs/dbraw/zinc/56/71/31/391567131.db2.gz	LWJYAGPOVBBZHQ-CQSZACIVSA-N	1	0	257.337	1.394	50	0		CDAARO
CCOC(=O)[C@@]12C[NH2+]C[C@@H]1CN(C(=O)OC(C)(C)C)CC2	ZINC000169805703	391832255	/nfs/dbraw/zinc/83/22/55/391832255.db2.gz	SKWXVQUQTDRGMH-ABAIWWIYSA-N	1	0	298.383	1.396	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)COc2ccc(F)cc2)C1	ZINC000253433327	131143246	/nfs/dbraw/zinc/14/32/46/131143246.db2.gz	VUDUCYRUMQPPRO-VXGBXAGGSA-N	1	0	280.343	1.790	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)[C@H]2Cc3cc(Cl)ccc3O2)C1	ZINC000269153224	132122095	/nfs/dbraw/zinc/12/20/95/132122095.db2.gz	WNUSLJSORVGAAR-QMTHXVAHSA-N	1	0	294.782	1.711	50	0		CDAARO
O=C(Cn1cccn1)NCC1CCN(c2cc[nH+]cc2)CC1	ZINC000093065901	135078910	/nfs/dbraw/zinc/07/89/10/135078910.db2.gz	MEZVVLXCELUUSC-UHFFFAOYSA-N	1	0	299.378	1.311	50	0		CDAARO
c1coc([C@@H](CNc2ccc3nnnn3n2)[NH+]2CCCC2)c1	ZINC000024989500	397787053	/nfs/dbraw/zinc/78/70/53/397787053.db2.gz	FCKNPALWWKVCNO-LLVKDONJSA-N	1	0	299.338	1.361	50	0		CDAARO
O[C@@H](C[NH+]1CCC(c2cc[nH]n2)CC1)C(F)(F)F	ZINC000181670530	148216589	/nfs/dbraw/zinc/21/65/89/148216589.db2.gz	FMDDSAJLMXMMNY-JTQLQIEISA-N	1	0	263.263	1.512	50	0		CDAARO
C[C@@H]1CN(C(=O)NCc2cccc(Cl)c2)CC[NH2+]1	ZINC000334900635	150052443	/nfs/dbraw/zinc/05/24/43/150052443.db2.gz	DUCGBOHMATUSPO-SNVBAGLBSA-N	1	0	267.760	1.843	50	0		CDAARO
OC[C@@H]1CCCN1c1cc(NCC[C@H]2CCCO2)ncn1	ZINC000257365196	289391228	/nfs/dbraw/zinc/39/12/28/289391228.db2.gz	HFIBCFSPSGJWCT-QWHCGFSZSA-N	1	0	292.383	1.419	50	0		CDAARO
COC(=O)c1c(C)[nH]c(C(=O)NCC[NH+]2CCCC2)c1C	ZINC000008922024	170359234	/nfs/dbraw/zinc/35/92/34/170359234.db2.gz	JYWMTQBJHWBBKB-UHFFFAOYSA-N	1	0	293.367	1.244	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]Cc2ccncc2)CC1	ZINC000019965216	170946672	/nfs/dbraw/zinc/94/66/72/170946672.db2.gz	LVWOQSPFIAQDAY-UHFFFAOYSA-N	1	0	263.341	1.792	50	0		CDAARO
C[NH+](C)[C@@H]1CCN(Cc2nc(Cc3ccsc3)no2)C1	ZINC000020868056	171276902	/nfs/dbraw/zinc/27/69/02/171276902.db2.gz	HAQKUYRWGWKALR-GFCCVEGCSA-N	1	0	292.408	1.858	50	0		CDAARO
COc1cc(CN(C)CC[NH+](C)C)cc(OC)c1	ZINC000022455109	171388183	/nfs/dbraw/zinc/38/81/83/171388183.db2.gz	HYBHPPWAJDDQJO-UHFFFAOYSA-N	1	0	252.358	1.697	50	0		CDAARO
C[NH+](C)[C@@H](CNc1ccc2nnnn2n1)c1ccsc1	ZINC000026720513	171496700	/nfs/dbraw/zinc/49/67/00/171496700.db2.gz	IUIJYVGXRQWQGK-JTQLQIEISA-N	1	0	289.368	1.296	50	0		CDAARO
C[NH+](C)CCNC(=O)Cc1csc(-c2cccnc2)n1	ZINC000031868202	171651588	/nfs/dbraw/zinc/65/15/88/171651588.db2.gz	DRHSCEOWVKYAOY-UHFFFAOYSA-N	1	0	290.392	1.425	50	0		CDAARO
CN(Cc1cccnc1)C(=O)[C@H]([NH3+])c1ccccc1	ZINC000036771585	172690638	/nfs/dbraw/zinc/69/06/38/172690638.db2.gz	NSDKCDBMQUKRPD-CQSZACIVSA-N	1	0	255.321	1.740	50	0		CDAARO
Cn1c(C[N@H+](C)[C@H]2CCc3ccccc32)cc(=O)n(C)c1=O	ZINC000040489808	174291532	/nfs/dbraw/zinc/29/15/32/174291532.db2.gz	BNKFELYVKOVJMM-HNNXBMFYSA-N	1	0	299.374	1.203	50	0		CDAARO
CC(C)[NH+]1CCN(Cc2nnc(-c3ccco3)o2)CC1	ZINC000044910581	175275793	/nfs/dbraw/zinc/27/57/93/175275793.db2.gz	YKBGFWLQMMLBMP-UHFFFAOYSA-N	1	0	276.340	1.856	50	0		CDAARO
CCOc1ccnc(N2CC[C@@H]([NH+](CC)CC)C2)n1	ZINC000065406595	175731215	/nfs/dbraw/zinc/73/12/15/175731215.db2.gz	OUQWQNFWRIOZON-GFCCVEGCSA-N	1	0	264.373	1.796	50	0		CDAARO
C[NH+](C)[C@H]1CN(c2nccc(C3CCCC3)n2)C[C@@H]1O	ZINC000071750070	176259443	/nfs/dbraw/zinc/25/94/43/176259443.db2.gz	XNBBPOAWKASCAT-KBPBESRZSA-N	1	0	276.384	1.245	50	0		CDAARO
NC(=O)C[N@@H+]1CCC[C@@H](CCc2ccc(F)cc2)C1	ZINC000072130878	176321470	/nfs/dbraw/zinc/32/14/70/176321470.db2.gz	NJJKMCDZIZHKCV-ZDUSSCGKSA-N	1	0	264.344	1.956	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCN(C(=O)c2cc3sccc3[nH]2)C1	ZINC000072137167	176322725	/nfs/dbraw/zinc/32/27/25/176322725.db2.gz	CJCXPLBGJMFWJZ-CQSZACIVSA-N	1	0	293.392	1.368	50	0		CDAARO
Cc1nc(C2CC[NH+](Cc3cccnc3N)CC2)cc(=O)[nH]1	ZINC000072151408	176327325	/nfs/dbraw/zinc/32/73/25/176327325.db2.gz	UZCIIMGZRDXESV-UHFFFAOYSA-N	1	0	299.378	1.847	50	0		CDAARO
COc1ccc(NC(=O)C[C@H]2COCC[NH2+]2)c(C)c1	ZINC000072162276	176329801	/nfs/dbraw/zinc/32/98/01/176329801.db2.gz	SHKCZMXIIAPJIK-NSHDSACASA-N	1	0	264.325	1.321	50	0		CDAARO
Cc1nc(C(C)C)sc1C(=O)N[C@H]1CC[C@H]1[NH3+]	ZINC000072168995	176332092	/nfs/dbraw/zinc/33/20/92/176332092.db2.gz	BQDVMRFXFPAPGW-BDAKNGLRSA-N	1	0	253.371	1.794	50	0		CDAARO
Cc1cc(Nc2cnccn2)nc([C@H]2CCC[NH2+]C2)n1	ZINC000072356447	176375708	/nfs/dbraw/zinc/37/57/08/176375708.db2.gz	UORBETJLMLCWHN-NSHDSACASA-N	1	0	270.340	1.786	50	0		CDAARO
C[C@@H]1C[N@H+](C2CCN(C(=O)c3cc[nH]c3)CC2)C[C@H](C)O1	ZINC000072409611	176398602	/nfs/dbraw/zinc/39/86/02/176398602.db2.gz	ZIKKZCWJIBKEGL-BETUJISGSA-N	1	0	291.395	1.729	50	0		CDAARO
CCCc1cc(NC[C@@H]2CCC[NH2+]2)n2nccc2n1	ZINC000072412108	176399052	/nfs/dbraw/zinc/39/90/52/176399052.db2.gz	FAPRYUYQZNZYBE-LBPRGKRZSA-N	1	0	259.357	1.846	50	0		CDAARO
CCc1cc(N(C)CC[NH+](C)C)n2nc(C)c(C)c2n1	ZINC000077320054	177251656	/nfs/dbraw/zinc/25/16/56/177251656.db2.gz	SRDQFSAPHOZDJM-UHFFFAOYSA-N	1	0	275.400	1.906	50	0		CDAARO
CN(Cc1nc2cc(Cl)ccc2[nH]1)C[C@@]1(O)CC[NH2+]C1	ZINC000077358886	177257029	/nfs/dbraw/zinc/25/70/29/177257029.db2.gz	OJADTYXDMIGTIB-CQSZACIVSA-N	1	0	294.786	1.373	50	0		CDAARO
O=C(c1ccccc1)C1CCN(C[C@]2(O)CC[NH2+]C2)CC1	ZINC000077406564	177263771	/nfs/dbraw/zinc/26/37/71/177263771.db2.gz	COKAOFDPPCIBPK-KRWDZBQOSA-N	1	0	288.391	1.306	50	0		CDAARO
[NH3+]C1CCN(CC(=O)NC2CCCCCC2)CC1	ZINC000036754750	260156072	/nfs/dbraw/zinc/15/60/72/260156072.db2.gz	KPXQGMAWTWFSIT-UHFFFAOYSA-N	1	0	253.390	1.249	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2ccc3nccn3c2)[C@H]1C[NH3+]	ZINC000179223507	274289279	/nfs/dbraw/zinc/28/92/79/274289279.db2.gz	MXNUFPGUPSUPEG-YPMHNXCESA-N	1	0	272.352	1.534	50	0		CDAARO
C[NH+]1CCC2(CC1)C[C@H](NC=O)c1ccccc1O2	ZINC000003419254	277035834	/nfs/dbraw/zinc/03/58/34/277035834.db2.gz	ISPACVVZRNDVLR-ZDUSSCGKSA-N	1	0	260.337	1.721	50	0		CDAARO
CC(=O)c1cc(CN2CCC[C@](O)(C[NH+](C)C)C2)cs1	ZINC000215553269	277105644	/nfs/dbraw/zinc/10/56/44/277105644.db2.gz	WJZXJJDAHMRPEJ-HNNXBMFYSA-N	1	0	296.436	1.839	50	0		CDAARO
CC(C)C[N@@H+]1CCCn2nc(CNC(=O)N(C)C)cc2C1	ZINC000082106596	277399415	/nfs/dbraw/zinc/39/94/15/277399415.db2.gz	RUBVWSAVQKBRQP-UHFFFAOYSA-N	1	0	293.415	1.516	50	0		CDAARO
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N1CC[NH2+]C[C@@H]1C	ZINC000126023608	278108897	/nfs/dbraw/zinc/10/88/97/278108897.db2.gz	ICOMDHXXJVIDRB-WDMOLILDSA-N	1	0	260.337	1.371	50	0		CDAARO
C[C@@H](O)C[NH+](Cc1ccccc1Cl)C[C@@H](C)O	ZINC000000214572	278394657	/nfs/dbraw/zinc/39/46/57/278394657.db2.gz	LPFZHQQEAZUCTP-GHMZBOCLSA-N	1	0	257.761	1.904	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1ccc(-n2ccnc2)cc1	ZINC000125566794	279907175	/nfs/dbraw/zinc/90/71/75/279907175.db2.gz	VYBHJWFRLGLMNT-LBPRGKRZSA-N	1	0	270.336	1.306	50	0		CDAARO
CNC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]([NH3+])C2)cc1	ZINC000255230330	289362058	/nfs/dbraw/zinc/36/20/58/289362058.db2.gz	PWRWNYJOKIGDOH-DEBLGDTFSA-N	1	0	287.363	1.009	50	0		CDAARO
Cc1ncc(/C=C\C(=O)N2CC[NH2+]C[C@H]2C)s1	ZINC000255357931	289367429	/nfs/dbraw/zinc/36/74/29/289367429.db2.gz	KMMVKFCGOHLEEC-ZBJFTSOASA-N	1	0	251.355	1.285	50	0		CDAARO
O=C(C[NH+]1CCCCC1)NC(=O)NC1CCCCC1	ZINC000003347259	295499727	/nfs/dbraw/zinc/49/97/27/295499727.db2.gz	BQZLDCRSSZPWNS-UHFFFAOYSA-N	1	0	267.373	1.631	50	0		CDAARO
O=C(C[C@H]1CCOC1)NCC1(C[NH+]2CCCC2)CC1	ZINC000534578995	328310954	/nfs/dbraw/zinc/31/09/54/328310954.db2.gz	AVTXXFNERUQLRY-CYBMUJFWSA-N	1	0	266.385	1.405	50	0		CDAARO
Cc1ccccc1[C@@H](CNC(=O)C1(CO)CC1)[NH+](C)C	ZINC000534580351	328311527	/nfs/dbraw/zinc/31/15/27/328311527.db2.gz	QQNFDRBLXPXKOJ-CQSZACIVSA-N	1	0	276.380	1.486	50	0		CDAARO
CO[C@H]1CN(C)C[C@@H]1NC(=O)c1sccc1C	ZINC000534585449	328315019	/nfs/dbraw/zinc/31/50/19/328315019.db2.gz	WJERQILHLMFTTP-UWVGGRQHSA-N	1	0	254.355	1.115	50	0		CDAARO
C[C@H](C[NH+]1CCCCC1)C(=O)NCc1cccnc1N	ZINC000534645985	328332390	/nfs/dbraw/zinc/33/23/90/328332390.db2.gz	UFEIMASJUWXZHS-GFCCVEGCSA-N	1	0	276.384	1.402	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]CCN1CCC(CO)CC1	ZINC000534637018	328333972	/nfs/dbraw/zinc/33/39/72/328333972.db2.gz	VEETUCGVBNQIJM-AWEZNQCLSA-N	1	0	294.443	1.128	50	0		CDAARO
CCN(CC)C[C@@H](C)[NH2+]Cc1cccc(CO)c1	ZINC000534649998	328336556	/nfs/dbraw/zinc/33/65/56/328336556.db2.gz	HFOGTANLVBJBMY-CYBMUJFWSA-N	1	0	250.386	1.999	50	0		CDAARO
O=C(CN1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12)NCc1cccs1	ZINC000534650569	328337122	/nfs/dbraw/zinc/33/71/22/328337122.db2.gz	LOAMGPSXYFURFE-KPWCQOOUSA-N	1	0	291.420	1.047	50	0		CDAARO
Cc1sc2c(c1C)C(=O)N1C[C@H]([NH+](C)C)C[C@H]1C(=O)N2	ZINC000534659722	328342466	/nfs/dbraw/zinc/34/24/66/328342466.db2.gz	SDXJNAWLDHNBLC-ZJUUUORDSA-N	1	0	293.392	1.462	50	0		CDAARO
CC1(C)CC(CC(=O)NCCn2cncn2)CC(C)(C)[NH2+]1	ZINC000534660321	328342556	/nfs/dbraw/zinc/34/25/56/328342556.db2.gz	QGECGGYDPVYGOU-UHFFFAOYSA-N	1	0	293.415	1.341	50	0		CDAARO
Nc1ncc(C(=O)NCC2(C[NH+]3CCCC3)CC2)s1	ZINC000534674585	328349276	/nfs/dbraw/zinc/34/92/76/328349276.db2.gz	CXCMZHGRBKGDNO-UHFFFAOYSA-N	1	0	280.397	1.161	50	0		CDAARO
O=C(c1cncnc1)N1CCCC2(CC[NH2+]CC2)CC1	ZINC000534667040	328345860	/nfs/dbraw/zinc/34/58/60/328345860.db2.gz	NMYXPAPRKMFWBC-UHFFFAOYSA-N	1	0	274.368	1.473	50	0		CDAARO
Cc1cc(C(=O)NC[C@@H]2CC[NH2+]C[C@H]2O)sc1C	ZINC000534663332	328351136	/nfs/dbraw/zinc/35/11/36/328351136.db2.gz	OWOWTLWABMHEJI-WDEREUQCSA-N	1	0	268.382	1.065	50	0		CDAARO
CC(C)c1cccc(S(=O)(=O)N[C@H](C[NH3+])C2CC2)c1	ZINC000124649661	329527750	/nfs/dbraw/zinc/52/77/50/329527750.db2.gz	SGSRAEFHOKHKES-CQSZACIVSA-N	1	0	282.409	1.826	50	0		CDAARO
CCc1nnsc1C(=O)N1CCCC[C@H]1[C@@H](C)[NH3+]	ZINC000087455703	330373067	/nfs/dbraw/zinc/37/30/67/330373067.db2.gz	TXMLJYFMWXJBQI-SCZZXKLOSA-N	1	0	268.386	1.442	50	0		CDAARO
C[C@H](C(=O)NCc1ccc(=O)[nH]c1)[N@H+]1[C@H](C)CC[C@@H]1C	ZINC000195565300	336056460	/nfs/dbraw/zinc/05/64/60/336056460.db2.gz	XLBGFCDFMSQSGK-GRYCIOLGSA-N	1	0	277.368	1.665	50	0		CDAARO
C[C@@H](CC(N)=O)[NH2+]CC1(c2c(F)cccc2F)CC1	ZINC000090965249	482522526	/nfs/dbraw/zinc/52/25/26/482522526.db2.gz	UGPYTHPUKQDSIX-VIFPVBQESA-N	1	0	268.307	1.850	50	0		CDAARO
COc1ccc(CN(C)C(=O)[C@H]2CC[C@@H]([NH3+])C2)cc1F	ZINC000091540230	482569619	/nfs/dbraw/zinc/56/96/19/482569619.db2.gz	TUTUUSPWKFPXDU-NWDGAFQWSA-N	1	0	280.343	1.920	50	0		CDAARO
COCn1ccnc1C[N@@H+]1C[C@@H](C)[C@](O)(C2CC2)C1	ZINC000091746823	482579038	/nfs/dbraw/zinc/57/90/38/482579038.db2.gz	UYNAFRKWCMRHAK-RISCZKNCSA-N	1	0	265.357	1.080	50	0		CDAARO
O[C@@H]1CCCC[C@H]1[NH+]1CCN(c2ccccn2)CC1	ZINC000037490802	482858257	/nfs/dbraw/zinc/85/82/57/482858257.db2.gz	LYOQPSGCAAWIMC-ZIAGYGMSSA-N	1	0	261.369	1.507	50	0		CDAARO
COc1ccc(C[N@@H+]2CC[C@H](C(C)(C)O)C2)cc1O	ZINC000670445264	482996124	/nfs/dbraw/zinc/99/61/24/482996124.db2.gz	OGPICWMYBFGETD-LBPRGKRZSA-N	1	0	265.353	1.994	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN(C(=O)CCC(F)(F)F)C1	ZINC000670446513	482998081	/nfs/dbraw/zinc/99/80/81/482998081.db2.gz	PRCDWGUALDPNGR-SNVBAGLBSA-N	1	0	282.306	1.366	50	0		CDAARO
CCc1nccc(C[N@@H+]2CCC[C@H](c3nnc(C)[nH]3)C2)n1	ZINC000670447231	483000438	/nfs/dbraw/zinc/00/04/38/483000438.db2.gz	LMISDGQKYDHYPE-LBPRGKRZSA-N	1	0	286.383	1.845	50	0		CDAARO
O=C1N[C@H]2CCC[C@@H]1C[N@H+](Cc1ccc3c(c1)CCO3)C2	ZINC000670450445	483008329	/nfs/dbraw/zinc/00/83/29/483008329.db2.gz	YYRPMLIFJSJQIG-CABCVRRESA-N	1	0	286.375	1.722	50	0		CDAARO
Cc1cccc(CC[N@@H+]2CCC[C@@H](c3nnc[nH]3)C2)n1	ZINC000670454637	483028904	/nfs/dbraw/zinc/02/89/04/483028904.db2.gz	XUMHULKTMZBMBH-CYBMUJFWSA-N	1	0	271.368	1.930	50	0		CDAARO
CC(C)(C)NC(=O)CC[N@@H+]1CCC[C@@H](CCCO)C1	ZINC000670457429	483037675	/nfs/dbraw/zinc/03/76/75/483037675.db2.gz	IPMHNWUVVAMDTR-ZDUSSCGKSA-N	1	0	270.417	1.776	50	0		CDAARO
O=C([C@H]1CC=CCC1)N1CCC(O)(C[NH+]2CCCC2)CC1	ZINC000670461634	483045310	/nfs/dbraw/zinc/04/53/10/483045310.db2.gz	RGQHAFBEQSLTBX-HNNXBMFYSA-N	1	0	292.423	1.792	50	0		CDAARO
CCCOC[C@H]1CC[N@H+](CC(=O)N2CCCCC2)C1	ZINC000670461884	483049391	/nfs/dbraw/zinc/04/93/91/483049391.db2.gz	RYHICIFCQRTXCU-AWEZNQCLSA-N	1	0	268.401	1.747	50	0		CDAARO
CCOC(=O)N1CC[C@@H]([NH2+]CCn2nc(C)c(C)c2C)C1	ZINC000670462977	483050990	/nfs/dbraw/zinc/05/09/90/483050990.db2.gz	WMOMOIQFPAOPHR-CQSZACIVSA-N	1	0	294.399	1.629	50	0		CDAARO
COCCn1cnnc1[C@@H](C)[NH2+]C1Cc2ccccc2C1	ZINC000670474337	483085051	/nfs/dbraw/zinc/08/50/51/483085051.db2.gz	YBCTULPGRFFGDJ-GFCCVEGCSA-N	1	0	286.379	1.743	50	0		CDAARO
C[N@H+](CCNC(=O)[C@]1(C)CC1(Cl)Cl)C1CC1	ZINC000084673281	483310958	/nfs/dbraw/zinc/31/09/58/483310958.db2.gz	NPFJHBSKWFJQRG-JTQLQIEISA-N	1	0	265.184	1.781	50	0		CDAARO
COc1ccc(C(=O)NCCSC)c(OCC[NH3+])c1	ZINC000426562882	518144816	/nfs/dbraw/zinc/14/48/16/518144816.db2.gz	KVIFQTXBPKGOFM-UHFFFAOYSA-N	1	0	284.381	1.126	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000022038418	521685244	/nfs/dbraw/zinc/68/52/44/521685244.db2.gz	VRANUJVVTDQIPC-CQSZACIVSA-N	1	0	282.359	1.203	50	0		CDAARO
CO[C@]1(C)C[C@@H](NC(=O)[C@H]2CCC[NH2+]C2)C1(C)C	ZINC000246636382	521756916	/nfs/dbraw/zinc/75/69/16/521756916.db2.gz	KOLFHEAYEQJMLV-MISXGVKJSA-N	1	0	254.374	1.306	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F)[C@H]1CC[NH2+]C1	ZINC000252656867	523902638	/nfs/dbraw/zinc/90/26/38/523902638.db2.gz	WHYYFXQITIXYID-WCFLWFBJSA-N	1	0	280.318	1.889	50	0		CDAARO
O=C(NC[C@@H](O)c1ccccc1Cl)[C@H]1CC[NH2+]C1	ZINC000299740133	526489041	/nfs/dbraw/zinc/48/90/41/526489041.db2.gz	WDSJZOBWBABXAG-JOYOIKCWSA-N	1	0	268.744	1.099	50	0		CDAARO
Cc1nc(C[NH2+]C2CCN(C(=O)C3CC3)CC2)cs1	ZINC000035258661	526887516	/nfs/dbraw/zinc/88/75/16/526887516.db2.gz	QKTRJIFXYBMDRL-UHFFFAOYSA-N	1	0	279.409	1.942	50	0		CDAARO
CC(C)COC(=O)N1CCN(CC[C@H]2CCC[N@@H+]2C)CC1	ZINC000096489065	528073860	/nfs/dbraw/zinc/07/38/60/528073860.db2.gz	DTGQOERBFCTSLA-OAHLLOKOSA-N	1	0	297.443	1.881	50	0		CDAARO
COC1(C(=O)NC[C@H](C)c2ccc(F)cc2)CC[NH2+]CC1	ZINC000262608331	536532715	/nfs/dbraw/zinc/53/27/15/536532715.db2.gz	HNEZZNUBOQDBNF-LBPRGKRZSA-N	1	0	294.370	1.814	50	0		CDAARO
Cn1cc(C[NH2+]Cc2cccc(Cn3cncn3)c2)cn1	ZINC000097159090	538438059	/nfs/dbraw/zinc/43/80/59/538438059.db2.gz	IHHJAPGGYGLKOF-UHFFFAOYSA-N	1	0	282.351	1.350	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@](O)([C@H]([NH3+])c2ccns2)C1	ZINC000958528251	613978740	/nfs/dbraw/zinc/97/87/40/613978740.db2.gz	LLILTSKFDXHRON-MFKMUULPSA-N	1	0	299.396	1.515	50	0		CDAARO
CC(C)[C@H]([NH3+])[C@]1(O)CCN(C(=O)OC(C)(C)C)C1	ZINC000958528422	614228437	/nfs/dbraw/zinc/22/84/37/614228437.db2.gz	OPCBBJZQVXDNLK-GWCFXTLKSA-N	1	0	258.362	1.342	50	0		CDAARO
CC[C@H](O)C[NH+]1CCC(CNC(=O)C2CCC2)CC1	ZINC000952968295	615827155	/nfs/dbraw/zinc/82/71/55/615827155.db2.gz	FTVKGIVGNNZWAF-AWEZNQCLSA-N	1	0	268.401	1.386	50	0		CDAARO
CC(C)NC(=O)C[N@@H+]1CCSC[C@H]1C(C)(C)C	ZINC000871596647	630997923	/nfs/dbraw/zinc/99/79/23/630997923.db2.gz	YFPUTIIUJUWSKG-NSHDSACASA-N	1	0	258.431	1.975	50	0		CDAARO
COc1ccc(C[N@@H+]2C[C@@H]3COCC[C@]3(CO)C2)cc1F	ZINC001772701250	1159436839	/nfs/dbraw/zinc/43/68/39/1159436839.db2.gz	KAMZNMBDVHAIMQ-CZUORRHYSA-N	1	0	295.354	1.665	50	0		CDAARO
c1nc([C@@H]2CCCN2CCC[NH+]2CCCCC2)n[nH]1	ZINC000585133543	1164216149	/nfs/dbraw/zinc/21/61/49/1164216149.db2.gz	LNGXDYFZWOLCFS-ZDUSSCGKSA-N	1	0	263.389	1.818	50	0		CDAARO
O=C(c1cccs1)[C@H]1CCC[N@H+](CCn2cncn2)C1	ZINC001704349299	1177697006	/nfs/dbraw/zinc/69/70/06/1177697006.db2.gz	FEQUYFOKMRIJDY-LBPRGKRZSA-N	1	0	290.392	1.935	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](CCc3ccccc3)C[C@@H]2O)[nH]n1	ZINC001704353529	1177698380	/nfs/dbraw/zinc/69/83/80/1177698380.db2.gz	OPUWOIURGWMSMF-WBVHZDCISA-N	1	0	285.391	1.796	50	0		CDAARO
CNC(=O)c1c(C)c2cc(OC)ccc2n1CC[NH+](C)C	ZINC000005798687	1165164796	/nfs/dbraw/zinc/16/47/96/1165164796.db2.gz	FNJJSMVVLHLREG-UHFFFAOYSA-N	1	0	289.379	1.880	50	0		CDAARO
C[C@H](CCC(=O)NCCc1cc[nH]n1)[NH+]1CCCC1	ZINC000426673993	745610745	/nfs/dbraw/zinc/61/07/45/745610745.db2.gz	GJRHRTCGXNZWEU-GFCCVEGCSA-N	1	0	264.373	1.333	50	0		CDAARO
C[NH+](C)CCNS(=O)(=O)c1c(Cl)cccc1Cl	ZINC000002664315	745843726	/nfs/dbraw/zinc/84/37/26/745843726.db2.gz	VSPDKZBBSJQNTB-UHFFFAOYSA-N	1	0	297.207	1.833	50	0		CDAARO
Cc1cc(C)nc(NCC[N@@H+]2CCCC[C@H]2CO)n1	ZINC000952977776	748871108	/nfs/dbraw/zinc/87/11/08/748871108.db2.gz	ISBFHESLMCYOSV-ZDUSSCGKSA-N	1	0	264.373	1.352	50	0		CDAARO
C[NH+](C)C[C@H]1COC2(CCCC2)CN1C(=O)NCC1CC1	ZINC000864096556	749347347	/nfs/dbraw/zinc/34/73/47/749347347.db2.gz	FRMKYCYDDYGUEQ-AWEZNQCLSA-N	1	0	295.427	1.681	50	0		CDAARO
COCc1csc(CNCc2cnn(C)n2)c1	ZINC000695509598	899519907	/nfs/dbraw/zinc/51/99/07/899519907.db2.gz	JOZQPQWGIOHFIQ-UHFFFAOYSA-N	1	0	252.343	1.313	50	0		CDAARO
CN(C)C(=O)[C@@H]1CC[N@H+](C[C@H]2COC3(CCCCC3)O2)C1	ZINC000952883222	910452516	/nfs/dbraw/zinc/45/25/16/910452516.db2.gz	YAGHHSLSIIVZSL-KGLIPLIRSA-N	1	0	296.411	1.472	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2CCCCC[N@@H+]2C)C[C@H](C)O1	ZINC000825031263	925849722	/nfs/dbraw/zinc/84/97/22/925849722.db2.gz	IAURJXFOCIGWRU-FRRDWIJNSA-N	1	0	254.374	1.497	50	0		CDAARO
O=C1CC[C@H]([NH+]2CCC(Cn3ccnc3)CC2)CCN1	ZINC000828305665	926100482	/nfs/dbraw/zinc/10/04/82/926100482.db2.gz	RXRDGARDZUUREH-AWEZNQCLSA-N	1	0	276.384	1.264	50	0		CDAARO
Cc1[nH]ccc1C(=O)NCCC[N@@H+]1CCCC[C@H]1CO	ZINC000828710998	926168827	/nfs/dbraw/zinc/16/88/27/926168827.db2.gz	VOBPBLKUEPPRMD-ZDUSSCGKSA-N	1	0	279.384	1.290	50	0		CDAARO
CS(=O)(=O)N1CC[C@H](N2CCc3cccc(F)c3C2)C1	ZINC000585117386	930983679	/nfs/dbraw/zinc/98/36/79/930983679.db2.gz	ZWCNHWOUEAHNJX-LBPRGKRZSA-N	1	0	298.383	1.218	50	0		CDAARO
COc1ccccc1C[NH2+][C@@H](C)[C@@H]1CN(C)CCN1C	ZINC000585117533	930985171	/nfs/dbraw/zinc/98/51/71/930985171.db2.gz	JRCYAESXUDYRND-ZFWWWQNUSA-N	1	0	277.412	1.419	50	0		CDAARO
O=C(NCCc1ccccn1)[C@H]1CC[C@@H]2CCCC[N@H+]12	ZINC000585122387	930989243	/nfs/dbraw/zinc/98/92/43/930989243.db2.gz	ZCCFDUNEFGKILK-LSDHHAIUSA-N	1	0	273.380	1.757	50	0		CDAARO
CC(C)c1ccccc1S(=O)(=O)NC1C[NH2+]C1	ZINC000193174477	932867968	/nfs/dbraw/zinc/86/79/68/932867968.db2.gz	DENLDXSZRGEUGQ-UHFFFAOYSA-N	1	0	254.355	1.060	50	0		CDAARO
CCn1ncc(C)c1NC(=O)[C@@H]([NH3+])c1ccccc1	ZINC001529174497	969003643	/nfs/dbraw/zinc/00/36/43/969003643.db2.gz	WVFDSBMRWXVSQH-LBPRGKRZSA-N	1	0	258.325	1.850	50	0		CDAARO
CCc1nc2cc(NC(=O)CC[NH3+])ccc2n1CC	ZINC001506400253	975149312	/nfs/dbraw/zinc/14/93/12/975149312.db2.gz	CDEZSJTXZKYDPS-UHFFFAOYSA-N	1	0	260.341	1.906	50	0		CDAARO
Cc1cc(NCCCc2nn[nH]n2)c2cc(F)ccc2[nH+]1	ZINC001506409535	975153151	/nfs/dbraw/zinc/15/31/51/975153151.db2.gz	ISSUWSLHCGOMNF-UHFFFAOYSA-N	1	0	286.314	1.662	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)Nc1c2c(nn1C)CSC2	ZINC001506413620	975154749	/nfs/dbraw/zinc/15/47/49/975154749.db2.gz	JUOBBEUNPRKDAE-QMMMGPOBSA-N	1	0	286.426	1.186	50	0		CDAARO
C[NH+]1CCC(n2nccc2NC(=O)c2cscn2)CC1	ZINC001506419928	975158075	/nfs/dbraw/zinc/15/80/75/975158075.db2.gz	MHGCEALJQXKEAR-UHFFFAOYSA-N	1	0	291.380	1.859	50	0		CDAARO
Cc1cc(C)n(C2CN(C[C@@H]3CCC[N@@H+](C)C3)C2)n1	ZINC001506426387	975160487	/nfs/dbraw/zinc/16/04/87/975160487.db2.gz	OJIHBABFWQMYCP-CQSZACIVSA-N	1	0	262.401	1.698	50	0		CDAARO
Cc1cc(C[NH2+][C@@H](C)CN2CCOCC2)cnc1C	ZINC000584902720	341986990	/nfs/dbraw/zinc/98/69/90/341986990.db2.gz	WLIAATHYJSMVHK-ZDUSSCGKSA-N	1	0	263.385	1.509	50	0		CDAARO
O=C(NCC[N@H+]1CCC[C@H](CO)C1)c1ccncc1Cl	ZINC000584902505	341987009	/nfs/dbraw/zinc/98/70/09/341987009.db2.gz	MNEOOOZNAPCHGN-NSHDSACASA-N	1	0	297.786	1.169	50	0		CDAARO
c1nc2ncnc(N3C[C@H]4CC[C@H](C[N@H+]4CC4CC4)C3)c2[nH]1	ZINC000095512538	185001989	/nfs/dbraw/zinc/00/19/89/185001989.db2.gz	SUBCQXBOJGLCBD-CHWSQXEVSA-N	1	0	298.394	1.664	50	0		CDAARO
Nc1ncccc1CN1C[C@H]2CC[C@H](C[N@H+]2CC2CC2)C1	ZINC000095521529	185002449	/nfs/dbraw/zinc/00/24/49/185002449.db2.gz	OLQUVPVRMVHQAI-GOEBONIOSA-N	1	0	286.423	1.970	50	0		CDAARO
COC[C@@H](NC(=O)NC[C@@H]1CCC[N@H+](C)C1)c1ccco1	ZINC000107357426	398140900	/nfs/dbraw/zinc/14/09/00/398140900.db2.gz	RVKWNRGNOKZRIT-QWHCGFSZSA-N	1	0	295.383	1.608	50	0		CDAARO
Cc1nc(C(F)(F)F)ncc1CN1CCC[NH2+]CC1	ZINC000426563230	230423340	/nfs/dbraw/zinc/42/33/40/230423340.db2.gz	IJTBCHOLUAPEGP-UHFFFAOYSA-N	1	0	274.290	1.599	50	0		CDAARO
Cc1cc(C[NH2+][C@@H](C)CS(C)(=O)=O)cnc1C	ZINC000584903856	341993942	/nfs/dbraw/zinc/99/39/42/341993942.db2.gz	MCFABEOCCZNMLV-JTQLQIEISA-N	1	0	256.371	1.221	50	0		CDAARO
Cc1noc(C)c1CC(=O)N1CCC[C@H]1C[NH+]1CCCC1	ZINC000095956048	185042994	/nfs/dbraw/zinc/04/29/94/185042994.db2.gz	XKICSXQGYQBIQJ-AWEZNQCLSA-N	1	0	291.395	1.921	50	0		CDAARO
C[C@H](NC(=O)NC1CC[NH+](C)CC1)c1ccncc1F	ZINC000241634575	361753537	/nfs/dbraw/zinc/75/35/37/361753537.db2.gz	PNNOGVGHALLXSQ-JTQLQIEISA-N	1	0	280.347	1.675	50	0		CDAARO
CCn1nccc1C[NH2+][C@@H](C)CN1CCCC1=O	ZINC000125225450	187175576	/nfs/dbraw/zinc/17/55/76/187175576.db2.gz	OGBYNJWPVDFJGM-NSHDSACASA-N	1	0	250.346	1.004	50	0		CDAARO
O=C(N[C@H]1CCC[NH2+]C1)c1csc(-c2ccoc2)n1	ZINC000124235404	342130264	/nfs/dbraw/zinc/13/02/64/342130264.db2.gz	JNIBUSZYRZWQGS-JTQLQIEISA-N	1	0	277.349	1.885	50	0		CDAARO
Cc1nc[nH]c1CN1CC[N@H+](C2CCCC2)[C@H](CCO)C1	ZINC000039519259	282139907	/nfs/dbraw/zinc/13/99/07/282139907.db2.gz	OOMQZIHZOAAPLD-OAHLLOKOSA-N	1	0	292.427	1.529	50	0		CDAARO
Cc1nc2c(c(C)n1)C[C@H](C[N@H+](C)CCc1ccccn1)O2	ZINC000244584417	361853932	/nfs/dbraw/zinc/85/39/32/361853932.db2.gz	CYYFLQFQFWQPPG-OAHLLOKOSA-N	1	0	298.390	1.966	50	0		CDAARO
Cc1ncc(C[NH2+][C@H]2CCCc3nc(N(C)C)ncc32)cn1	ZINC000012298082	282156582	/nfs/dbraw/zinc/15/65/82/282156582.db2.gz	VZHNZUYPMHLNKF-AWEZNQCLSA-N	1	0	298.394	1.808	50	0		CDAARO
c1n[nH]cc1O[C@@H]1COC[C@@H]1[NH2+]C1CC2(CCC2)C1	ZINC000685940929	539045916	/nfs/dbraw/zinc/04/59/16/539045916.db2.gz	KOWBSXYXCBCDCZ-QWHCGFSZSA-N	1	0	263.341	1.478	50	0		CDAARO
CN(CC[NH+]1CCC(O)CC1)Cc1ccc(F)cc1	ZINC000020777114	539124924	/nfs/dbraw/zinc/12/49/24/539124924.db2.gz	CCQYCWUBIRWMCO-UHFFFAOYSA-N	1	0	266.360	1.714	50	0		CDAARO
CCO[C@H](C)c1nc(CC(=O)N2CC[NH2+]C[C@@H]2C)cs1	ZINC000125708552	187197089	/nfs/dbraw/zinc/19/70/89/187197089.db2.gz	DWPQLIOQXYTPBY-WDEREUQCSA-N	1	0	297.424	1.603	50	0		CDAARO
CC(C)O[C@@H](C[N@@H+]1CC[C@@H](C(N)=O)C1)c1ccccc1	ZINC000585085633	362012996	/nfs/dbraw/zinc/01/29/96/362012996.db2.gz	AYRKUGJELCTNCV-CABCVRRESA-N	1	0	276.380	1.960	50	0		CDAARO
CC[N@H+]1[C@H](C)CN(C(=O)CCc2ccncc2)C[C@@H]1C	ZINC000585130038	362062711	/nfs/dbraw/zinc/06/27/11/362062711.db2.gz	FZKICCXSDZVUEW-OKILXGFUSA-N	1	0	275.396	1.955	50	0		CDAARO
CO[C@@H](C)c1nc(C)c(C(=O)N(C)[C@H]2CC[NH2+]C2)s1	ZINC000179095206	362253863	/nfs/dbraw/zinc/25/38/63/362253863.db2.gz	DEXPCHCGWXVCFY-UWVGGRQHSA-N	1	0	283.397	1.593	50	0		CDAARO
C[NH+](C)[C@@H]1CCN(CC(=O)NCc2cccs2)C1	ZINC000252507803	362390621	/nfs/dbraw/zinc/39/06/21/362390621.db2.gz	WUCFOUFYKSZLIK-LLVKDONJSA-N	1	0	267.398	1.000	50	0		CDAARO
CN(Cc1cscn1)Cc1nnc([C@H]2C[C@@H]([NH3+])C2)n1C	ZINC000252537223	362391774	/nfs/dbraw/zinc/39/17/74/362391774.db2.gz	KTKGHHMDXVJUNU-AOOOYVTPSA-N	1	0	292.412	1.108	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@H](C)c1ccc(F)c(F)c1	ZINC000096490746	530014793	/nfs/dbraw/zinc/01/47/93/530014793.db2.gz	ICIDZRASBVVXSR-SECBINFHSA-N	1	0	292.351	1.555	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCNC(=O)c2ccc(O)cc2F)C1	ZINC000220507868	530060811	/nfs/dbraw/zinc/06/08/11/530060811.db2.gz	UXRYYWWNAJMOQC-LLVKDONJSA-N	1	0	280.343	1.993	50	0		CDAARO
CCOCc1nc2c(c(N3CC=CCC3)n1)CC[NH2+]CC2	ZINC000072428096	136481264	/nfs/dbraw/zinc/48/12/64/136481264.db2.gz	GUSLJDNSSJXBPR-UHFFFAOYSA-N	1	0	288.395	1.468	50	0		CDAARO
C[C@@H]1C[NH+](CCCCNC(=O)C2=CCCCO2)C[C@@H](C)O1	ZINC000085457339	179068060	/nfs/dbraw/zinc/06/80/60/179068060.db2.gz	HRCALQVMOAWVJK-ZIAGYGMSSA-N	1	0	296.411	1.686	50	0		CDAARO
CCn1cc([C@H]2OCC[C@H]2C[NH2+]C2CCOCC2)cn1	ZINC000089305949	346755885	/nfs/dbraw/zinc/75/58/85/346755885.db2.gz	CKMDKBBQNOVWAU-WFASDCNBSA-N	1	0	279.384	1.749	50	0		CDAARO
Cc1cnc(CN2CCC[C@@H]2C[N@@H+]2CCC[C@@H]2CO)o1	ZINC000085855722	179189329	/nfs/dbraw/zinc/18/93/29/179189329.db2.gz	AKFSWRSOWGLADH-ZIAGYGMSSA-N	1	0	279.384	1.404	50	0		CDAARO
O=C(C[C@H]1CCCOC1)N1CCC([NH+]2CCOCC2)CC1	ZINC000584886288	349344089	/nfs/dbraw/zinc/34/40/89/349344089.db2.gz	LQOFHCNHZJBSEA-CQSZACIVSA-N	1	0	296.411	1.126	50	0		CDAARO
CN(CC1(CO)CCCC1)C(=O)[C@H]1CCC[N@H+](C)C1	ZINC000584891843	349350984	/nfs/dbraw/zinc/35/09/84/349350984.db2.gz	KPIPORZJXGCWBX-ZDUSSCGKSA-N	1	0	268.401	1.339	50	0		CDAARO
Cc1nccn1CC[C@@H](C)[NH2+]CCN1CCCCC1=O	ZINC000584891773	349351021	/nfs/dbraw/zinc/35/10/21/349351021.db2.gz	LZRYRHKOJPIIGX-CYBMUJFWSA-N	1	0	278.400	1.572	50	0		CDAARO
C[C@H](C[NH+]1CCCC1)n1cnc2ncccc2c1=O	ZINC000584895880	349356864	/nfs/dbraw/zinc/35/68/64/349356864.db2.gz	FSAUKWZBUPVOAU-LLVKDONJSA-N	1	0	258.325	1.448	50	0		CDAARO
C/C(=C\c1ccccc1)C[N@@H+]1CC[C@H](NS(C)(=O)=O)C1	ZINC000271208972	191001696	/nfs/dbraw/zinc/00/16/96/191001696.db2.gz	TYCRJTBVENCTQV-VOMSXAGXSA-N	1	0	294.420	1.713	50	0		CDAARO
OCCn1ncnc1-c1ccc(C[NH+]2CCCCC2)cc1	ZINC000091365087	180142480	/nfs/dbraw/zinc/14/24/80/180142480.db2.gz	LMRFEGKWUZSEJE-UHFFFAOYSA-N	1	0	286.379	1.923	50	0		CDAARO
CCc1nccc(C[N@@H+]2CC[C@@](O)(CCOC)[C@H](C)C2)n1	ZINC000091476087	180166000	/nfs/dbraw/zinc/16/60/00/180166000.db2.gz	ISPWZRQRWMXDRT-CZUORRHYSA-N	1	0	293.411	1.648	50	0		CDAARO
CC[C@@H]1CN(S(C)(=O)=O)CC[C@H]1[NH2+]Cc1ccncc1	ZINC000252518057	350386346	/nfs/dbraw/zinc/38/63/46/350386346.db2.gz	YOHJKTFFEVJTDV-ZIAGYGMSSA-N	1	0	297.424	1.231	50	0		CDAARO
Cc1nnc([C@@H](C)N(C)CC2CC[NH+](C[C@H](C)O)CC2)o1	ZINC000106781329	186135249	/nfs/dbraw/zinc/13/52/49/186135249.db2.gz	IEJXQQYEQRQNOH-NWDGAFQWSA-N	1	0	296.415	1.464	50	0		CDAARO
CC(C)C[C@H](CO)NC(=O)NCC[N@@H+]1CCCC[C@@H]1C	ZINC000106801336	186137170	/nfs/dbraw/zinc/13/71/70/186137170.db2.gz	SVXQLUCUCPMFBU-UONOGXRCSA-N	1	0	285.432	1.567	50	0		CDAARO
CC[N@H+](C)C[C@@H]1CCN(C(=O)N[C@H](C)COC)C1	ZINC000106922885	186150930	/nfs/dbraw/zinc/15/09/30/186150930.db2.gz	ZMQHXJFWNZINSS-NEPJUHHUSA-N	1	0	257.378	1.005	50	0		CDAARO
COc1cc(C[NH2+][C@@H]2CCCOC2)cc2c1OCCO2	ZINC000109545843	186262121	/nfs/dbraw/zinc/26/21/21/186262121.db2.gz	HCMTVWRWKIUSGZ-GFCCVEGCSA-N	1	0	279.336	1.735	50	0		CDAARO
C[C@H](NC(=O)N1CC[C@H](C[NH+](C)C)C1)c1cnn(C)c1	ZINC000130124157	187471463	/nfs/dbraw/zinc/47/14/63/187471463.db2.gz	USLCLKVVQRYRES-NWDGAFQWSA-N	1	0	279.388	1.074	50	0		CDAARO
O=C1NCCCC[C@H]1NCc1ccc(F)cc1F	ZINC000036976788	363304567	/nfs/dbraw/zinc/30/45/67/363304567.db2.gz	GVGCBYCQRLUUME-GFCCVEGCSA-N	1	0	254.280	1.723	50	0		CDAARO
C[C@H](NC(=O)[C@H]1C[C@H](O)C[NH2+]1)c1ccc(Cl)s1	ZINC000037020921	363315245	/nfs/dbraw/zinc/31/52/45/363315245.db2.gz	LACVTBWBJBIWDU-BIIVOSGPSA-N	1	0	274.773	1.302	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=S)Nc1cccnc1	ZINC000037074076	363350673	/nfs/dbraw/zinc/35/06/73/363350673.db2.gz	LVKSWYDNCMJINN-GFCCVEGCSA-N	1	0	264.398	1.852	50	0		CDAARO
COCC[NH2+]CCNC(=O)c1cccc(C)c1F	ZINC000195547823	363453555	/nfs/dbraw/zinc/45/35/55/363453555.db2.gz	PYMNVTXKQWAMJQ-UHFFFAOYSA-N	1	0	254.305	1.100	50	0		CDAARO
COc1ccc(OCC(=O)O[C@@H]2C[NH+]3CCC2CC3)cc1	ZINC000000249806	355898965	/nfs/dbraw/zinc/89/89/65/355898965.db2.gz	UXKZILLANFPQSF-OAHLLOKOSA-N	1	0	291.347	1.711	50	0		CDAARO
O=C(CC[NH+]1CCCC1)Nc1ccc2c(c1)OCO2	ZINC000000257526	355899209	/nfs/dbraw/zinc/89/92/09/355899209.db2.gz	NTFSZUGSWQDIKB-UHFFFAOYSA-N	1	0	262.309	1.840	50	0		CDAARO
C[C@H](O)C[NH2+]C[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000002639611	355977717	/nfs/dbraw/zinc/97/77/17/355977717.db2.gz	ZYCUQNVZGLYZEI-WPRPVWTQSA-N	1	0	294.178	1.704	50	0		CDAARO
C[NH+](C)CCNC(=O)c1cc2ccccc2oc1=O	ZINC000004278414	356025579	/nfs/dbraw/zinc/02/55/79/356025579.db2.gz	ISZMBNDDWQZMTM-UHFFFAOYSA-N	1	0	260.293	1.084	50	0		CDAARO
CCCCc1c(C)nc(N2CC[NH+](C)CC2)[nH]c1=O	ZINC000008739187	356154612	/nfs/dbraw/zinc/15/46/12/356154612.db2.gz	HTDHQJIXUPGTCG-UHFFFAOYSA-N	1	0	264.373	1.585	50	0		CDAARO
CC[N@H+](CC(=O)NC1CCC2(CC1)OCCO2)C1CC1	ZINC000097478313	356164918	/nfs/dbraw/zinc/16/49/18/356164918.db2.gz	YXMNJAKLBMPPMQ-UHFFFAOYSA-N	1	0	282.384	1.273	50	0		CDAARO
S=C1N=NC(c2cccnc2)N1CCCn1ccnc1	ZINC000010312638	356255838	/nfs/dbraw/zinc/25/58/38/356255838.db2.gz	RUXMEIZFJGZVQY-UHFFFAOYSA-N	1	0	286.364	1.916	50	0		CDAARO
COc1ccc(CCN2C[C@H]([NH2+]C(C)C)CC2=O)cc1	ZINC000012594660	356310537	/nfs/dbraw/zinc/31/05/37/356310537.db2.gz	ZUPZRECWPURJIF-CQSZACIVSA-N	1	0	276.380	1.837	50	0		CDAARO
CSc1ccccc1C(=O)NC[C@H](C)N1CCOCC1	ZINC000032817375	356379996	/nfs/dbraw/zinc/37/99/96/356379996.db2.gz	KHZXHNDUUDKVAC-LBPRGKRZSA-N	1	0	294.420	1.859	50	0		CDAARO
NC(=O)NC(=O)C[NH2+][C@H](Cc1ccccc1)c1ccccc1	ZINC000014634167	356393748	/nfs/dbraw/zinc/39/37/48/356393748.db2.gz	KHLYZACJYPMLEG-OAHLLOKOSA-N	1	0	297.358	1.755	50	0		CDAARO
C[C@@H]1CN(c2ccc(F)cc2S(C)(=O)=O)CC[NH2+]1	ZINC000019735945	356498195	/nfs/dbraw/zinc/49/81/95/356498195.db2.gz	CKYIECKMKVIFFO-SECBINFHSA-N	1	0	272.345	1.027	50	0		CDAARO
CCS(=O)(=O)N1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1	ZINC000019850709	356509739	/nfs/dbraw/zinc/50/97/39/356509739.db2.gz	DSKJNSAMSJTGHR-OLZOCXBDSA-N	1	0	274.430	1.532	50	0		CDAARO
[NH3+]CCNCCOCCSc1ccc(Cl)cc1	ZINC000020118698	356525753	/nfs/dbraw/zinc/52/57/53/356525753.db2.gz	NDNLLGCIUMMUSN-UHFFFAOYSA-N	1	0	274.817	1.997	50	0		CDAARO
Nc1nnc(N2CCN(Cc3ccccc3)CC2)s1	ZINC000020576902	356548707	/nfs/dbraw/zinc/54/87/07/356548707.db2.gz	VSAMBERGEVBUPS-UHFFFAOYSA-N	1	0	275.381	1.443	50	0		CDAARO
O=C1O[C@H](C[NH+]2CCCC2)Cn2c3ccoc3cc21	ZINC000006345528	363532435	/nfs/dbraw/zinc/53/24/35/363532435.db2.gz	PWTQYATUDKDBEU-SNVBAGLBSA-N	1	0	260.293	1.869	50	0		CDAARO
Cc1ccccc1C1(C(=O)N2CC[NH2+][C@H](C)C2)CC1	ZINC000188385125	356713582	/nfs/dbraw/zinc/71/35/82/356713582.db2.gz	SIJGVLPYRHRARG-CYBMUJFWSA-N	1	0	258.365	1.847	50	0		CDAARO
CC(=O)N1CC[NH+]([C@H]2CCc3ccccc3C2)CC1	ZINC000023282567	356816669	/nfs/dbraw/zinc/81/66/69/356816669.db2.gz	MLNALDQTTAADNX-INIZCTEOSA-N	1	0	258.365	1.708	50	0		CDAARO
C[NH+](C)[C@@H]1CCN(c2ccc(Br)cn2)C1	ZINC000035898826	356853155	/nfs/dbraw/zinc/85/31/55/356853155.db2.gz	XTPJCCKHBQLBST-SNVBAGLBSA-N	1	0	270.174	1.984	50	0		CDAARO
CNC(=O)c1ccc(C[NH2+]C[C@@H]2CCCn3ccnc32)cc1	ZINC000083882291	357109602	/nfs/dbraw/zinc/10/96/02/357109602.db2.gz	AWQPKFIDAUCHCW-HNNXBMFYSA-N	1	0	298.390	1.910	50	0		CDAARO
Brc1cccc(OC[C@H]2CC[NH2+]C2)n1	ZINC000042774191	357079866	/nfs/dbraw/zinc/07/98/66/357079866.db2.gz	HQFMGGRGXPHAON-QMMMGPOBSA-N	1	0	257.131	1.832	50	0		CDAARO
CC(C)[NH2+]C[C@H](O)CN[C@@H](C)[C@@H]1COc2ccccc2O1	ZINC000004610568	357240894	/nfs/dbraw/zinc/24/08/94/357240894.db2.gz	AANQMDAPDINSQM-XEZPLFJOSA-N	1	0	294.395	1.163	50	0		CDAARO
CN(CCCNC(=O)C[C@H]1CC[NH2+]C1)c1ccccc1	ZINC000089717530	357507653	/nfs/dbraw/zinc/50/76/53/357507653.db2.gz	RSFSGLFJTBZVNS-CQSZACIVSA-N	1	0	275.396	1.629	50	0		CDAARO
C[N@@H+](Cc1ccccc1C(F)(F)F)C[C@@H](O)CO	ZINC000065380945	357533085	/nfs/dbraw/zinc/53/30/85/357533085.db2.gz	QSUARHPRHZGSPS-SNVBAGLBSA-N	1	0	263.259	1.490	50	0		CDAARO
CNC(=O)[C@@H](C)[N@H+](C)C1CCN(Cc2cccnc2)CC1	ZINC000065435475	357541499	/nfs/dbraw/zinc/54/14/99/357541499.db2.gz	WPBRKXOJGJMCIB-CYBMUJFWSA-N	1	0	290.411	1.112	50	0		CDAARO
O=C(COCc1ccccc1)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065467672	357543772	/nfs/dbraw/zinc/54/37/72/357543772.db2.gz	DVHQXHOZODAGMN-CABCVRRESA-N	1	0	274.364	1.556	50	0		CDAARO
[NH3+][C@@H](Cc1ccccc1)C(=O)Nc1cnc2n1CCCC2	ZINC000067786942	357628095	/nfs/dbraw/zinc/62/80/95/357628095.db2.gz	SCBOYIHTDFFGSC-ZDUSSCGKSA-N	1	0	284.363	1.728	50	0		CDAARO
C[C@H](Cn1cccn1)c1nc(CC2CC[NH+](C)CC2)no1	ZINC000067856710	357633042	/nfs/dbraw/zinc/63/30/42/357633042.db2.gz	MWHHVMJOGBEJBF-GFCCVEGCSA-N	1	0	289.383	1.954	50	0		CDAARO
Cc1cc(C(=O)NC[C@H]2CCC[N@@H+](CC(C)C)C2)[nH]n1	ZINC000067883779	357635114	/nfs/dbraw/zinc/63/51/14/357635114.db2.gz	WQGLZNBLIDAAAU-CYBMUJFWSA-N	1	0	278.400	1.816	50	0		CDAARO
CS(=O)(=O)N[C@](N)(Cc1ccccc1)c1ccccc1	ZINC000071618122	357838755	/nfs/dbraw/zinc/83/87/55/357838755.db2.gz	HMOGQBNLPAVMMP-OAHLLOKOSA-N	1	0	290.388	1.590	50	0		CDAARO
CC[C@@](C)(CNC(=O)/C=C/c1ccco1)N1CCOCC1	ZINC000036397034	357843679	/nfs/dbraw/zinc/84/36/79/357843679.db2.gz	MVYBXEBRJPDLCO-MOEXGYKKSA-N	1	0	292.379	1.910	50	0		CDAARO
Cc1occc1C(=O)NCC1([NH+](C)C)CCOCC1	ZINC000073131080	357867224	/nfs/dbraw/zinc/86/72/24/357867224.db2.gz	NBDRTGNDEVAYRU-UHFFFAOYSA-N	1	0	266.341	1.429	50	0		CDAARO
CCCc1cc(C(=O)NCC[N@@H+]2CCC[C@@H](CO)C2)no1	ZINC000082114804	358148049	/nfs/dbraw/zinc/14/80/49/358148049.db2.gz	SJCAQZBUIXHVFF-GFCCVEGCSA-N	1	0	295.383	1.061	50	0		CDAARO
C[NH+]1CCC(C)(C(=O)N2CCC[C@H](c3nnc[nH]3)C2)CC1	ZINC000426397338	358526230	/nfs/dbraw/zinc/52/62/30/358526230.db2.gz	DDVVDCXHGJYWFS-LBPRGKRZSA-N	1	0	291.399	1.243	50	0		CDAARO
C[N@@H+]1CCC[C@H](CN2C(=O)COc3ccc(F)cc32)C1	ZINC000095357631	358684850	/nfs/dbraw/zinc/68/48/50/358684850.db2.gz	BZRLDVPLCDXMBN-NSHDSACASA-N	1	0	278.327	1.893	50	0		CDAARO
CN(CCc1cnn(C)c1)C(=O)CCC[NH+]1CCCCC1	ZINC000095379643	358689422	/nfs/dbraw/zinc/68/94/22/358689422.db2.gz	NVWOBUKOSTTXLL-UHFFFAOYSA-N	1	0	292.427	1.687	50	0		CDAARO
Cc1n[nH]c(C)c1CNC(=O)CC[C@@H]1CCCC[N@H+]1C	ZINC000095389024	358692237	/nfs/dbraw/zinc/69/22/37/358692237.db2.gz	HKLNMGGJRPQQKY-ZDUSSCGKSA-N	1	0	278.400	1.907	50	0		CDAARO
OCCOc1ccccc1C[N@@H+]1CCC[C@H]1CCO	ZINC000097468693	358779169	/nfs/dbraw/zinc/77/91/69/358779169.db2.gz	QLCNFAOUSGXVPK-AWEZNQCLSA-N	1	0	265.353	1.405	50	0		CDAARO
COCc1ccc(C(=O)N2[C@@H]3CC[C@H]2C[NH2+]CC3)s1	ZINC000097681916	358792956	/nfs/dbraw/zinc/79/29/56/358792956.db2.gz	LWPIKSKGLGSEPT-MNOVXSKESA-N	1	0	280.393	1.861	50	0		CDAARO
Cc1cc(C)n2ncc(CN(C)Cc3cnccn3)c2n1	ZINC000097766624	358797978	/nfs/dbraw/zinc/79/79/78/358797978.db2.gz	BRTSLVAYRIKBSD-UHFFFAOYSA-N	1	0	282.351	1.768	50	0		CDAARO
C[NH+]1CCN([C@@H]2CCN(Cc3ccc(Cl)o3)C2)CC1	ZINC000215452853	358890376	/nfs/dbraw/zinc/89/03/76/358890376.db2.gz	PZSRQJOFORNUMT-GFCCVEGCSA-N	1	0	283.803	1.755	50	0		CDAARO
CC(=O)c1cc(C[N@@H+](C)C[C@H]2CC(=O)N(C)C2)n(C)c1	ZINC000215872636	358906872	/nfs/dbraw/zinc/90/68/72/358906872.db2.gz	XQKKABARBHNHPG-GFCCVEGCSA-N	1	0	277.368	1.138	50	0		CDAARO
COc1cc2c(cc1CN1CC[N@H+](C)[C@@H](CO)C1)CCC2	ZINC000216219934	358931608	/nfs/dbraw/zinc/93/16/08/358931608.db2.gz	CEBLAKLSOSYIJT-MRXNPFEDSA-N	1	0	290.407	1.292	50	0		CDAARO
CCc1ccc(C[N@H+]2C[C@H]3CCC[C@@H](C2)NC3=O)nc1	ZINC000216238792	358932788	/nfs/dbraw/zinc/93/27/88/358932788.db2.gz	MEHRXFZLOTWNLN-HIFRSBDPSA-N	1	0	273.380	1.745	50	0		CDAARO
CNC(=O)[C@@H]1C[N@H+](Cc2ccc(C)o2)C[C@H]1COC	ZINC000257176274	359068566	/nfs/dbraw/zinc/06/85/66/359068566.db2.gz	AIICELWPRSZMOK-WCQYABFASA-N	1	0	266.341	1.028	50	0		CDAARO
COCCN(C)c1ccc(CN2CCC[C@@H](C[NH3+])C2)cn1	ZINC000261921808	359090570	/nfs/dbraw/zinc/09/05/70/359090570.db2.gz	KOKWEGQYZYNNRI-AWEZNQCLSA-N	1	0	292.427	1.335	50	0		CDAARO
CC(C)(C)C[C@@H]([NH3+])C(=O)NCCCc1csc(N)n1	ZINC000219913172	359137189	/nfs/dbraw/zinc/13/71/89/359137189.db2.gz	DCFABUFRYVMMDV-SNVBAGLBSA-N	1	0	284.429	1.538	50	0		CDAARO
Cc1cc([C@H]2CCCN2C(=O)[C@H]2CCC[NH2+]C2)on1	ZINC000037820269	359231598	/nfs/dbraw/zinc/23/15/98/359231598.db2.gz	IKWLZMPEZQXATI-NWDGAFQWSA-N	1	0	263.341	1.646	50	0		CDAARO
O[C@H](c1cc2n(n1)CCC[N@@H+](C1CCOCC1)C2)C1CC1	ZINC000221428149	359247907	/nfs/dbraw/zinc/24/79/07/359247907.db2.gz	AGWVBALPALAHTR-INIZCTEOSA-N	1	0	291.395	1.711	50	0		CDAARO
COc1ccc(OC[C@H](O)C[NH2+]Cc2ccco2)cc1	ZINC000000236747	359359301	/nfs/dbraw/zinc/35/93/01/359359301.db2.gz	PFSWUAFEZYNSIZ-GFCCVEGCSA-N	1	0	277.320	1.818	50	0		CDAARO
CCc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)NC(N)=O)cc1	ZINC000024990404	359332526	/nfs/dbraw/zinc/33/25/26/359332526.db2.gz	FQPAYLZJLFVBNR-NXEZZACHSA-N	1	0	263.341	1.483	50	0		CDAARO
[NH3+][C@H]1[C@H]2CCO[C@H]2[C@@H]1NC(=O)CC1Cc2ccccc2C1	ZINC000223701751	359448806	/nfs/dbraw/zinc/44/88/06/359448806.db2.gz	KIDAEPLFWNHYQK-XLNGHYISSA-N	1	0	286.375	1.022	50	0		CDAARO
Cc1c[nH]c(CNC(=O)CC[NH+]2CCCCC2)c(C)c1=O	ZINC000223795362	359457122	/nfs/dbraw/zinc/45/71/22/359457122.db2.gz	VDESSPUAEMNTEV-UHFFFAOYSA-N	1	0	291.395	1.896	50	0		CDAARO
CCOC1CCN(c2cc(C3CC([NH3+])C3)nc(N)n2)CC1	ZINC000223924997	359471536	/nfs/dbraw/zinc/47/15/36/359471536.db2.gz	HCJQLBLHHOMFSV-UHFFFAOYSA-N	1	0	291.399	1.269	50	0		CDAARO
CN(C)S(=O)(=O)CCC[N@H+](C)CCc1ccccc1	ZINC000336797960	359851736	/nfs/dbraw/zinc/85/17/36/359851736.db2.gz	CEBAFJJZTUSQPB-UHFFFAOYSA-N	1	0	284.425	1.442	50	0		CDAARO
C[N@H+](CCCCNC(=O)c1ccc(C(N)=O)cc1)C1CC1	ZINC000408520621	359908978	/nfs/dbraw/zinc/90/89/78/359908978.db2.gz	OIRAXDLIPCKQKI-UHFFFAOYSA-N	1	0	289.379	1.390	50	0		CDAARO
CO[C@@H](C)C(=O)NC[C@@H](C1CCCCC1)[NH+](C)C	ZINC000089478446	359928662	/nfs/dbraw/zinc/92/86/62/359928662.db2.gz	WHJNOKYBUFZXHM-AAEUAGOBSA-N	1	0	256.390	1.648	50	0		CDAARO
CS(=O)(=O)c1ccc(CN2CC[N@@H+]3CCC[C@@H]3C2)cc1	ZINC000094449354	360098006	/nfs/dbraw/zinc/09/80/06/360098006.db2.gz	JVVILEJFWVNZFT-CQSZACIVSA-N	1	0	294.420	1.370	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)N[C@@H]1CCCC[C@@H]1CO	ZINC000231315706	360054500	/nfs/dbraw/zinc/05/45/00/360054500.db2.gz	QDVBLSFGMSFNRX-CHWSQXEVSA-N	1	0	254.374	1.043	50	0		CDAARO
CCN1C(=O)[C@H]2CC3(CN2C1=O)CC[NH+](CC1CC1)CC3	ZINC000409419984	360229386	/nfs/dbraw/zinc/22/93/86/360229386.db2.gz	IKJXPYXDSIEAHQ-CYBMUJFWSA-N	1	0	291.395	1.535	50	0		CDAARO
O=C(NC1CC1)C1(F)CC[NH+](Cc2cccnc2)CC1	ZINC000409421457	360230598	/nfs/dbraw/zinc/23/05/98/360230598.db2.gz	CGKLJFTWISTVGK-UHFFFAOYSA-N	1	0	277.343	1.664	50	0		CDAARO
CS[C@H](C)C(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1C	ZINC000248106338	360362258	/nfs/dbraw/zinc/36/22/58/360362258.db2.gz	GAYVOXCCMSEGAX-IJLUTSLNSA-N	1	0	256.415	1.823	50	0		CDAARO
Cc1cc(C)c(CN2CCC[C@H]([NH3+])C2)cc1Cn1cncn1	ZINC000426478114	360565170	/nfs/dbraw/zinc/56/51/70/360565170.db2.gz	NWGGGKMKLCQWKD-KRWDZBQOSA-N	1	0	299.422	1.866	50	0		CDAARO
COCCN(CC1CC1)C(=O)[C@@H](C)n1ccnc1C	ZINC000426533937	360681380	/nfs/dbraw/zinc/68/13/80/360681380.db2.gz	YGBSNWGJPCTWNB-LLVKDONJSA-N	1	0	265.357	1.638	50	0		CDAARO
Cn1ccc(C(=O)NC[C@H]2CC[N@@H+](C3CCCCC3)C2)n1	ZINC000426541482	360682368	/nfs/dbraw/zinc/68/23/68/360682368.db2.gz	PNDBXGMXQBYYHM-CYBMUJFWSA-N	1	0	290.411	1.805	50	0		CDAARO
Nc1cc(N2CC[C@]3(C2)CCC[N@H+](CC2CC2)C3)ncn1	ZINC000426372115	360660221	/nfs/dbraw/zinc/66/02/21/360660221.db2.gz	POVFHYTVHIMIFO-MRXNPFEDSA-N	1	0	287.411	1.761	50	0		CDAARO
COc1ccc(CC(=O)N2CC[C@@H](C[NH3+])C2)cc1F	ZINC000178515883	189122490	/nfs/dbraw/zinc/12/24/90/189122490.db2.gz	YJULBNJFBZSNPZ-NSHDSACASA-N	1	0	266.316	1.184	50	0		CDAARO
Cn1c(C[NH3+])nnc1SCc1noc(C2CCCC2)n1	ZINC000426394730	360663852	/nfs/dbraw/zinc/66/38/52/360663852.db2.gz	SBNPABXTLRZOKL-UHFFFAOYSA-N	1	0	294.384	1.607	50	0		CDAARO
CCCOCCSc1nnc([C@@H]2CCC[NH2+]C2)n1C	ZINC000426734015	360700154	/nfs/dbraw/zinc/70/01/54/360700154.db2.gz	MUBANQKSZOHSGQ-LLVKDONJSA-N	1	0	284.429	1.801	50	0		CDAARO
NC(=O)C1CC[NH+](Cc2cnn(-c3ccccc3)c2)CC1	ZINC000012791423	360803606	/nfs/dbraw/zinc/80/36/06/360803606.db2.gz	KISAZUXQSMTKHN-UHFFFAOYSA-N	1	0	284.363	1.570	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2nc(C(C)C)ncc2Cl)C1	ZINC000178966523	189157821	/nfs/dbraw/zinc/15/78/21/189157821.db2.gz	ZSTSWCFNXGVJMI-SNVBAGLBSA-N	1	0	296.802	1.935	50	0		CDAARO
Cc1ccc(CN2CC[C@H]([NH2+]Cc3ccnn3C)C2=O)cc1	ZINC000191797218	361322584	/nfs/dbraw/zinc/32/25/84/361322584.db2.gz	BBOJGZQHZDHXKV-INIZCTEOSA-N	1	0	298.390	1.619	50	0		CDAARO
Cc1cc(C)c(S(=O)(=O)N(C)C2CC[NH2+]CC2)c(C)c1	ZINC000036300188	361491076	/nfs/dbraw/zinc/49/10/76/361491076.db2.gz	IKAPXIWPAIUZSM-UHFFFAOYSA-N	1	0	296.436	1.984	50	0		CDAARO
C[C@@H]1CN(C(=O)c2cccc3ncccc32)CC[NH2+]1	ZINC000088058882	364050479	/nfs/dbraw/zinc/05/04/79/364050479.db2.gz	ULJBJOYTZBAPBO-LLVKDONJSA-N	1	0	255.321	1.669	50	0		CDAARO
NC(=O)NC(=O)CC[N@@H+](Cc1cccc(O)c1)CC1CC1	ZINC000089780634	366933651	/nfs/dbraw/zinc/93/36/51/366933651.db2.gz	SVIBVBBEGAKGRE-UHFFFAOYSA-N	1	0	291.351	1.189	50	0		CDAARO
CCNC(=O)NC(=O)[C@H](C)[N@H+](C)[C@@H](C)Cc1ccsc1	ZINC000089977462	366992737	/nfs/dbraw/zinc/99/27/37/366992737.db2.gz	PVLMFJZZDGRMOY-QWRGUYRKSA-N	1	0	297.424	1.845	50	0		CDAARO
C[C@H](Nc1ncnc2nc(N)ccc21)C(C)(C)C[NH+](C)C	ZINC000090095180	367013328	/nfs/dbraw/zinc/01/33/28/367013328.db2.gz	WIHIRZIFUCZNGX-JTQLQIEISA-N	1	0	288.399	1.995	50	0		CDAARO
C[C@H]([NH2+]C[C@@H]1CCCC[C@H]1O)C(=O)NC1CCCC1	ZINC000240555841	367274271	/nfs/dbraw/zinc/27/42/71/367274271.db2.gz	GXSYBPZPJKRURR-SGMGOOAPSA-N	1	0	268.401	1.574	50	0		CDAARO
CC(=O)c1ccc(OC[C@@H](O)C[NH2+]C(C)C)cc1	ZINC000000195591	367490560	/nfs/dbraw/zinc/49/05/60/367490560.db2.gz	LXTVJPGACWPWOL-ZDUSSCGKSA-N	1	0	251.326	1.627	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@H]1CC[NH2+]C[C@H]1C	ZINC000094345740	367520656	/nfs/dbraw/zinc/52/06/56/367520656.db2.gz	WSOQPGKUWNUNFQ-PWSUYJOCSA-N	1	0	286.372	1.410	50	0		CDAARO
CC[C@@H]1CN(S(C)(=O)=O)CC[C@H]1[NH2+]Cc1cccn1C	ZINC000252517839	367743317	/nfs/dbraw/zinc/74/33/17/367743317.db2.gz	SRJCUJJWDMOGNA-TZMCWYRMSA-N	1	0	299.440	1.175	50	0		CDAARO
CCOC[C@@H](O)C[N@@H+]1CC[C@@H](c2ccccn2)C1	ZINC000252527509	367784327	/nfs/dbraw/zinc/78/43/27/367784327.db2.gz	CSQLBMVRESQGGG-OLZOCXBDSA-N	1	0	250.342	1.268	50	0		CDAARO
CC[C@@H](C(=O)[O-])[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(C)C	ZINC000263569565	367965487	/nfs/dbraw/zinc/96/54/87/367965487.db2.gz	HNVHNBKCBFHQHL-AGIUHOORSA-N	1	0	254.374	1.797	50	0		CDAARO
COc1ncccc1C[NH+]1CCC(c2nnc[nH]2)CC1	ZINC000369328023	369742434	/nfs/dbraw/zinc/74/24/34/369742434.db2.gz	YTAYESCQAYOLCO-UHFFFAOYSA-N	1	0	273.340	1.588	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCN(c2ccccc2F)CC1	ZINC000037746708	370046360	/nfs/dbraw/zinc/04/63/60/370046360.db2.gz	VKBZIXPNLQQHLK-GFCCVEGCSA-N	1	0	265.332	1.212	50	0		CDAARO
COc1ccc(CN(C)C(=O)[C@H]2CCC[NH2+]C2)cc1F	ZINC000037758210	370060260	/nfs/dbraw/zinc/06/02/60/370060260.db2.gz	NUQGMLTYMZCRST-LBPRGKRZSA-N	1	0	280.343	1.792	50	0		CDAARO
C[N@H+]1C[C@H]2CN(c3cc(C4CCC4)ncn3)C[C@H]2C1	ZINC000575606460	370615530	/nfs/dbraw/zinc/61/55/30/370615530.db2.gz	HOBUYXUTUBPHDQ-BETUJISGSA-N	1	0	258.369	1.742	50	0		CDAARO
Cc1cc(C(=O)NCC2CC[NH+]([C@H]3CCOC3)CC2)no1	ZINC000575606842	370617367	/nfs/dbraw/zinc/61/73/67/370617367.db2.gz	MMQKUBGGPOVVCA-ZDUSSCGKSA-N	1	0	293.367	1.214	50	0		CDAARO
C[C@@H]1CCC[C@H](NC(=O)CCC(=O)NCC[NH+](C)C)[C@@H]1C	ZINC000006266008	371524160	/nfs/dbraw/zinc/52/41/60/371524160.db2.gz	BVMNLTCKDVFEQL-MCIONIFRSA-N	1	0	297.443	1.385	50	0		CDAARO
C[NH+]1CCC(OC(=O)N2CC[C@H](OCC3CC3)C2)CC1	ZINC000575617456	371770902	/nfs/dbraw/zinc/77/09/02/371770902.db2.gz	BOFVLRDMVFVCAZ-AWEZNQCLSA-N	1	0	282.384	1.718	50	0		CDAARO
CCCN(C(=O)c1cccc2cn[nH]c21)[C@H]1CC[NH2+]C1	ZINC000178910883	372222538	/nfs/dbraw/zinc/22/25/38/372222538.db2.gz	BBXVIKUMDGODNP-LBPRGKRZSA-N	1	0	272.352	1.777	50	0		CDAARO
C[NH2+][C@@H](C)C(=O)NCc1nc(C2CCCCC2)no1	ZINC000299798397	372768608	/nfs/dbraw/zinc/76/86/08/372768608.db2.gz	SZSSKWBYWAMUGI-VIFPVBQESA-N	1	0	266.345	1.341	50	0		CDAARO
C[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)[C@H](N)c1ccccc1	ZINC000094459944	373299894	/nfs/dbraw/zinc/29/98/94/373299894.db2.gz	POSFYXUKUUMCSE-BPLDGKMQSA-N	1	0	273.380	1.382	50	0		CDAARO
COCC[C@@H]1CCCC[N@H+](CCN2CCO[C@@H](C)C2)C1	ZINC000253397113	373686935	/nfs/dbraw/zinc/68/69/35/373686935.db2.gz	IHHVZVKZMZKQBQ-HOTGVXAUSA-N	1	0	284.444	1.846	50	0		CDAARO
O=C(Cc1ccc(F)c(F)c1)NC[C@@H]1CCC[NH2+]C1	ZINC000095045343	373692236	/nfs/dbraw/zinc/69/22/36/373692236.db2.gz	UVSVCABXDGLJRP-LLVKDONJSA-N	1	0	268.307	1.623	50	0		CDAARO
COC(=O)[C@@H]([N@@H+]1CC[C@@]2(CCOC2)C1)C1(OC)CCC1	ZINC000253431600	373746259	/nfs/dbraw/zinc/74/62/59/373746259.db2.gz	WKFBEGMBGKWGJN-TZMCWYRMSA-N	1	0	283.368	1.210	50	0		CDAARO
Cc1c[nH]cc1C(=O)N1CCOC[C@@H]1[C@H]1CCC[N@H+]1C	ZINC000520566406	373823967	/nfs/dbraw/zinc/82/39/67/373823967.db2.gz	XXVQAFHFSGAGHJ-ZIAGYGMSSA-N	1	0	277.368	1.258	50	0		CDAARO
C[NH+](C)CCNc1cc(I)ccn1	ZINC000230534136	374045375	/nfs/dbraw/zinc/04/53/75/374045375.db2.gz	DZHAOZCPRZQHOS-UHFFFAOYSA-N	1	0	291.136	1.660	50	0		CDAARO
CC(C)C[C@@H](C[NH3+])NS(=O)(=O)/C=C/c1ccccc1	ZINC000095394509	374066620	/nfs/dbraw/zinc/06/66/20/374066620.db2.gz	NXXZGOJRSZHELE-VFNNOXKTSA-N	1	0	282.409	1.950	50	0		CDAARO
O=S(=O)(N[C@H]1CCC[NH2+]C1)c1cc(F)c(F)cc1F	ZINC000193349394	374177367	/nfs/dbraw/zinc/17/73/67/374177367.db2.gz	CYNXKFUZMKXNGY-ZETCQYMHSA-N	1	0	294.298	1.134	50	0		CDAARO
CCOc1ccccc1OCC(=O)N(C)CC[NH+](C)C	ZINC000080387777	374464590	/nfs/dbraw/zinc/46/45/90/374464590.db2.gz	NKVRPTLTRNSUJS-UHFFFAOYSA-N	1	0	280.368	1.484	50	0		CDAARO
CC(=O)Nc1ccc(C[N@@H+]2CCC[C@H](CO)C2)cc1	ZINC000012379617	374496728	/nfs/dbraw/zinc/49/67/28/374496728.db2.gz	WISZMOROTTWOPT-AWEZNQCLSA-N	1	0	262.353	1.849	50	0		CDAARO
CCOc1ccc(CN2CC[NH+](C)CC2)cc1OC	ZINC000095350097	374885477	/nfs/dbraw/zinc/88/54/77/374885477.db2.gz	DQWFDQGLOGEPTJ-UHFFFAOYSA-N	1	0	264.369	1.841	50	0		CDAARO
CCc1cnc(N)nc1N[C@H]1Cc2ccccc2[C@@H]1[NH3+]	ZINC000095358552	374890246	/nfs/dbraw/zinc/89/02/46/374890246.db2.gz	LDSGHGZPRIKQKP-STQMWFEESA-N	1	0	269.352	1.658	50	0		CDAARO
CCS(=O)(=O)NCCC[NH2+][C@@H]1CCc2ccc(C)cc21	ZINC000095421395	374924163	/nfs/dbraw/zinc/92/41/63/374924163.db2.gz	NMSVRMTYKRLIKF-OAHLLOKOSA-N	1	0	296.436	1.901	50	0		CDAARO
COCC[NH+]1CCN(CCc2c(C)noc2C)CC1	ZINC000095440699	374943261	/nfs/dbraw/zinc/94/32/61/374943261.db2.gz	JQXBUOFZFXLBAR-UHFFFAOYSA-N	1	0	267.373	1.098	50	0		CDAARO
C[C@@H]1CC([NH2+]CC(C)(C)CCS(C)(=O)=O)C[C@@H](C)O1	ZINC000095988344	375048409	/nfs/dbraw/zinc/04/84/09/375048409.db2.gz	NTWVVVQVZYZKAZ-VXGBXAGGSA-N	1	0	291.457	1.993	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+]1C[C@H]1CCCC[C@@H]1C	ZINC000097108451	375149599	/nfs/dbraw/zinc/14/95/99/375149599.db2.gz	LHCNCBJSZGOJCB-RNJOBUHISA-N	1	0	255.358	1.421	50	0		CDAARO
O=c1[nH]c2ccccc2nc1C[N@H+](C[C@H]1CCOC1)C1CC1	ZINC000097201529	375154794	/nfs/dbraw/zinc/15/47/94/375154794.db2.gz	CALDFSMMCHBRII-GFCCVEGCSA-N	1	0	299.374	1.924	50	0		CDAARO
C[C@@H](NC(=O)CN(C)C1CC[NH+](C)CC1)c1ccccc1	ZINC000002638907	375281418	/nfs/dbraw/zinc/28/14/18/375281418.db2.gz	TVNZOLPLPLJKFC-CQSZACIVSA-N	1	0	289.423	1.890	50	0		CDAARO
CC(=O)c1c(C)[nH]c(C(=O)NCCC[NH+](C)C)c1C	ZINC000003379178	375671671	/nfs/dbraw/zinc/67/16/71/375671671.db2.gz	QPKFTHLABIXZTQ-UHFFFAOYSA-N	1	0	265.357	1.516	50	0		CDAARO
COc1c(C[NH2+][C@@H]2COc3ccccc3C2)c(C)nn1C	ZINC000058293119	375722343	/nfs/dbraw/zinc/72/23/43/375722343.db2.gz	DMFASHIASVVPEY-ZDUSSCGKSA-N	1	0	287.363	1.830	50	0		CDAARO
C[NH+](C)CCNC(=O)Cc1csc(-n2cccc2)n1	ZINC000031816999	375835818	/nfs/dbraw/zinc/83/58/18/375835818.db2.gz	ICYVVMGIBCJYOE-UHFFFAOYSA-N	1	0	278.381	1.154	50	0		CDAARO
CC(C)(C)OC(=O)N[C@H]1CC[C@H]([NH2+]C2COC2)CC1	ZINC000242425553	376021969	/nfs/dbraw/zinc/02/19/69/376021969.db2.gz	BOTMINKNJFEMCS-XYPYZODXSA-N	1	0	270.373	1.811	50	0		CDAARO
CCNc1ncc(C(=O)NCC[C@H]2CCC[N@H+](C)C2)cn1	ZINC000067563337	377158362	/nfs/dbraw/zinc/15/83/62/377158362.db2.gz	HNRWKWYQVXALPE-GFCCVEGCSA-N	1	0	291.399	1.370	50	0		CDAARO
O=C1CCCN1C[C@H](O)C[NH2+]Cc1cccc(Cl)c1	ZINC000001391344	377592170	/nfs/dbraw/zinc/59/21/70/377592170.db2.gz	LBQDUJBASLSXDF-CYBMUJFWSA-N	1	0	282.771	1.413	50	0		CDAARO
COCCN1C[C@H](Cc2cccc3c(N)cc[nH+]c23)CC1=O	ZINC000244723864	377792882	/nfs/dbraw/zinc/79/28/82/377792882.db2.gz	MIYAGNIVFHFXPR-GFCCVEGCSA-N	1	0	299.374	1.854	50	0		CDAARO
Cc1ccc(Cn2ncc3c2nc[nH+]c3NN)cc1	ZINC000000521922	169661573	/nfs/dbraw/zinc/66/15/73/169661573.db2.gz	CDTKKVKZZZGALS-UHFFFAOYSA-N	1	0	254.297	1.469	50	0		CDAARO
COc1ccc([C@@H](C)C[NH2+]C2(CO)CCOCC2)cc1	ZINC000096493575	533097192	/nfs/dbraw/zinc/09/71/92/533097192.db2.gz	MTKFVFRUAPQWOO-ZDUSSCGKSA-N	1	0	279.380	1.930	50	0		CDAARO
COC[C@H]([NH2+][C@@H]1CCN(CC(F)(F)F)C1)C1CC1	ZINC000096476819	533096647	/nfs/dbraw/zinc/09/66/47/533096647.db2.gz	CPRZCLYNHPUKMN-MNOVXSKESA-N	1	0	266.307	1.638	50	0		CDAARO
C[C@H](OC[C@@H]1CCCCO1)C(=O)N1CCC[C@@H](C)[C@@H]1C[NH3+]	ZINC000247331821	256849963	/nfs/dbraw/zinc/84/99/63/256849963.db2.gz	VEETYBIGFIDZMU-QPSCCSFWSA-N	1	0	298.427	1.546	50	0		CDAARO
Cc1cc(C)n2nc(N)[n+](CC(=O)c3ccccc3)c2n1	ZINC000001273420	169693131	/nfs/dbraw/zinc/69/31/31/169693131.db2.gz	WGMJXCFLBDVYHI-UHFFFAOYSA-N	1	0	282.327	1.099	50	0		CDAARO
CC1(C)NC(=[NH2+])NC(=N)N1c1cccc(C(F)(F)F)c1	ZINC000000098181	390134174	/nfs/dbraw/zinc/13/41/74/390134174.db2.gz	MMFKOLPHNNHIDJ-UHFFFAOYSA-N	1	0	285.273	1.891	50	0		CDAARO
CC1=C[C@H](C)[C@@H]2C(=O)N(Cc3ccc[n+](C)c3)C(=O)[C@@H]2C1	ZINC000105747009	390518520	/nfs/dbraw/zinc/51/85/20/390518520.db2.gz	PYBDZRRKYOKDCJ-CFVMTHIKSA-N	1	0	285.367	1.598	50	0		CDAARO
Cc1cccnc1[C@@H]([NH2+]CCN1C(=O)CNC1=O)C(C)C	ZINC000096424398	390515779	/nfs/dbraw/zinc/51/57/79/390515779.db2.gz	WSARPIMTUZKPOG-ZDUSSCGKSA-N	1	0	290.367	1.229	50	0		CDAARO
CC[C@@H](O)C[NH2+][C@@H](C)c1cn(-c2ccccc2)nn1	ZINC000097112554	390796235	/nfs/dbraw/zinc/79/62/35/390796235.db2.gz	TXCQIZNVYFKSLV-WCQYABFASA-N	1	0	260.341	1.689	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(=O)[C@]2(CC[NH2+]C2)C1	ZINC000096958695	390915436	/nfs/dbraw/zinc/91/54/36/390915436.db2.gz	OTVWZPBRDNHFQV-ZDUSSCGKSA-N	1	0	254.330	1.176	50	0		CDAARO
c1c(-c2nc(C3CC3)no2)nnn1[C@@H]1CCC[NH2+]C1	ZINC000096516261	391106303	/nfs/dbraw/zinc/10/63/03/391106303.db2.gz	WSWMHIZUHBYBHJ-SECBINFHSA-N	1	0	260.301	1.130	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@H](c2ccccc2)C[C@@]12NC(=O)NC2=O	ZINC000245380736	391346036	/nfs/dbraw/zinc/34/60/36/391346036.db2.gz	JIVUQMZFYBMAHJ-IFUGULHKSA-N	1	0	273.336	1.278	50	0		CDAARO
CC(C)[C@@H](CNC(=O)OC(C)(C)C)[NH+]1CCN(C)CC1	ZINC000083502355	391482292	/nfs/dbraw/zinc/48/22/92/391482292.db2.gz	HJXQAKDESBIICR-CYBMUJFWSA-N	1	0	285.432	1.783	50	0		CDAARO
CC(C)c1ccccc1S(=O)(=O)N[C@H](C[NH3+])C1CC1	ZINC000193293841	391625682	/nfs/dbraw/zinc/62/56/82/391625682.db2.gz	UTGCINIATFERKC-CYBMUJFWSA-N	1	0	282.409	1.826	50	0		CDAARO
COCCn1cc(C[NH2+][C@H]2COC(C)(C)C2)cn1	ZINC000418158891	391769751	/nfs/dbraw/zinc/76/97/51/391769751.db2.gz	YNCMAXLWAXPXEX-GFCCVEGCSA-N	1	0	253.346	1.187	50	0		CDAARO
[NH3+]C1(CNC(=O)NC2CCCCC2)CCOCC1	ZINC000626917326	391830600	/nfs/dbraw/zinc/83/06/00/391830600.db2.gz	XOZUOIIPKXSJDV-UHFFFAOYSA-N	1	0	255.362	1.126	50	0		CDAARO
Cc1ccc(CC(=O)N2CCCC[C@H]2[C@@H](C)[NH3+])cn1	ZINC000262749590	131258772	/nfs/dbraw/zinc/25/87/72/131258772.db2.gz	MCZSCKWEJQOHIS-OCCSQVGLSA-N	1	0	261.369	1.661	50	0		CDAARO
[NH3+][C@@H]1CCC[C@H](C(=O)NC[C@H](O)c2ccccc2F)C1	ZINC000269230771	132137473	/nfs/dbraw/zinc/13/74/73/132137473.db2.gz	OWIWTLNLZMMZLD-WDMOLILDSA-N	1	0	280.343	1.493	50	0		CDAARO
c1nc(N2CCCCC2)ncc1CN1CC[C@H]2C[NH2+]C[C@H]21	ZINC000426705539	285576121	/nfs/dbraw/zinc/57/61/21/285576121.db2.gz	BXDMKLSMMHYZRU-LSDHHAIUSA-N	1	0	287.411	1.261	50	0		CDAARO
CN(CC[NH+]1CCCC1)C(=O)c1ccc(Cl)cn1	ZINC000346073284	153043507	/nfs/dbraw/zinc/04/35/07/153043507.db2.gz	FAZPKURBQWREBJ-UHFFFAOYSA-N	1	0	267.760	1.903	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(S(=O)(=O)N2CCCCCC2)C1	ZINC000109840240	289374281	/nfs/dbraw/zinc/37/42/81/289374281.db2.gz	AGLUMLOHMQEDNA-ZDUSSCGKSA-N	1	0	289.445	1.133	50	0		CDAARO
CC[C@H](CO)[NH2+]Cc1cc(OC)c(OC)c(OC)c1	ZINC000006702954	170230173	/nfs/dbraw/zinc/23/01/73/170230173.db2.gz	WSGWOFSWORQFQN-LLVKDONJSA-N	1	0	269.341	1.573	50	0		CDAARO
O=c1nncc(NC2CC[NH+](Cc3ccccc3)CC2)[nH]1	ZINC000007996472	170312867	/nfs/dbraw/zinc/31/28/67/170312867.db2.gz	WFOBEQCBMYWPTR-UHFFFAOYSA-N	1	0	285.351	1.241	50	0		CDAARO
COc1ccc(C[NH2+]C[C@H](C)O)c(OC)c1OC	ZINC000008498005	170338174	/nfs/dbraw/zinc/33/81/74/170338174.db2.gz	FLBKNWGFRDZFFX-VIFPVBQESA-N	1	0	255.314	1.183	50	0		CDAARO
O=c1c2ccccc2nnn1CC[NH+]1CCCCC1	ZINC000009025605	170361741	/nfs/dbraw/zinc/36/17/41/170361741.db2.gz	QIGDZVZCJAOOGR-UHFFFAOYSA-N	1	0	258.325	1.277	50	0		CDAARO
C[C@H]1CCC[N@@H+]([C@@H](C(=O)NC(N)=O)c2ccccc2)C1	ZINC000012592697	170499511	/nfs/dbraw/zinc/49/95/11/170499511.db2.gz	YQZDTCLVHTYKIG-WCQYABFASA-N	1	0	275.352	1.655	50	0		CDAARO
C[N@@H+](Cc1cccc(-c2cn[nH]c2)c1)C[C@H]1COCCO1	ZINC000020598717	171266134	/nfs/dbraw/zinc/26/61/34/171266134.db2.gz	AKJYMCSXTJYACP-INIZCTEOSA-N	1	0	287.363	1.924	50	0		CDAARO
COc1ccc(CN2CC[NH2+]CC2)cc1Br	ZINC000022130544	171354645	/nfs/dbraw/zinc/35/46/45/171354645.db2.gz	MBFPYGGRESPQCT-UHFFFAOYSA-N	1	0	285.185	1.863	50	0		CDAARO
CC[NH+](CC)CCOc1cnc(Br)cn1	ZINC000035635806	172320726	/nfs/dbraw/zinc/32/07/26/172320726.db2.gz	OTUKXSGLXABEOK-UHFFFAOYSA-N	1	0	274.162	1.960	50	0		CDAARO
CCOc1ccc(OCCCC[NH2+]CCN)cc1	ZINC000039960871	174179857	/nfs/dbraw/zinc/17/98/57/174179857.db2.gz	VFDRFEPWJXBCNM-UHFFFAOYSA-N	1	0	252.358	1.793	50	0		CDAARO
c1ccc(-n2nnnc2SC[C@H]2CCCC[NH2+]2)cc1	ZINC000043495191	175058300	/nfs/dbraw/zinc/05/83/00/175058300.db2.gz	UVDOYOIPAFBNIJ-LLVKDONJSA-N	1	0	275.381	1.897	50	0		CDAARO
O=C(CCN1CCCCO1)NCCCC[NH+]1CCCC1	ZINC000063884697	175689997	/nfs/dbraw/zinc/68/99/97/175689997.db2.gz	OWOONPDAWLQZQD-UHFFFAOYSA-N	1	0	283.416	1.396	50	0		CDAARO
C[C@@H](Cn1cccn1)[NH2+]CCC(=O)NC1CCCCC1	ZINC000065501024	175744272	/nfs/dbraw/zinc/74/42/72/175744272.db2.gz	RDNOWPLVYGHUFE-ZDUSSCGKSA-N	1	0	278.400	1.700	50	0		CDAARO
Cc1ccccc1CSCCNC(=O)C1([NH3+])CC1	ZINC000071524318	176194158	/nfs/dbraw/zinc/19/41/58/176194158.db2.gz	QJUCSLUXPHXBPK-UHFFFAOYSA-N	1	0	264.394	1.836	50	0		CDAARO
CCCc1nc2c(cnn2C)c(NC2CC[NH2+]CC2)n1	ZINC000072126597	176320649	/nfs/dbraw/zinc/32/06/49/176320649.db2.gz	HORDCVLBFCDHFG-UHFFFAOYSA-N	1	0	274.372	1.480	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(C(=O)c2ccnn2C(F)F)CC1	ZINC000072134315	176321879	/nfs/dbraw/zinc/32/18/79/176321879.db2.gz	ZWFZXMVRAZEWQM-JTQLQIEISA-N	1	0	286.326	1.835	50	0		CDAARO
CCCc1ccc(C[N@@H+]2CCOC[C@@H](CO)C2)o1	ZINC000077321202	177252818	/nfs/dbraw/zinc/25/28/18/177252818.db2.gz	GPEMVFDNMIYGGF-GFCCVEGCSA-N	1	0	253.342	1.673	50	0		CDAARO
CN(C/C=C/c1ccccc1)C(=O)c1cn(CC[NH3+])nn1	ZINC000077452882	177270156	/nfs/dbraw/zinc/27/01/56/177270156.db2.gz	PBOZCDDXUDPLTF-VMPITWQZSA-N	1	0	285.351	1.022	50	0		CDAARO
CC[C@H]([NH3+])C(=O)Nc1nc2cc(F)ccc2n1C	ZINC000097019178	544551197	/nfs/dbraw/zinc/55/11/97/544551197.db2.gz	JSSGTLNCERDZRA-QMMMGPOBSA-N	1	0	250.277	1.388	50	0		CDAARO
CC[NH+](CC)CCN1C(=O)NC(=O)C(CC)(CC)C1=O	ZINC000013957371	276098265	/nfs/dbraw/zinc/09/82/65/276098265.db2.gz	DGIKLDLACPRKIR-UHFFFAOYSA-N	1	0	283.372	1.213	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]([C@@H]2NCCc3nc(N)sc32)C1	ZINC000106954638	276167990	/nfs/dbraw/zinc/16/79/90/276167990.db2.gz	UZMGXJDDFLOXRZ-KOLCDFICSA-N	1	0	266.414	1.644	50	0		CDAARO
C[C@@H]1CN(C(=O)CO[C@H]2CCCC[C@H]2C)C[C@H]1[NH+](C)C	ZINC000257366306	287888896	/nfs/dbraw/zinc/88/88/96/287888896.db2.gz	RBMNHFVUIRYNRT-TUVASFSCSA-N	1	0	282.428	1.990	50	0		CDAARO
C[NH+]1CCC2(CC1)OCCN2C(=O)Nc1ccccc1	ZINC000005208970	277036442	/nfs/dbraw/zinc/03/64/42/277036442.db2.gz	KDCLDDYCMBKEDW-UHFFFAOYSA-N	1	0	275.352	1.973	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)N1CCc2n[nH]cc2C1	ZINC000092065912	277042959	/nfs/dbraw/zinc/04/29/59/277042959.db2.gz	OUEVAEKCDUWRBK-CYBMUJFWSA-N	1	0	262.357	1.169	50	0		CDAARO
COC(=O)CCC[N@@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1	ZINC000252692359	277055443	/nfs/dbraw/zinc/05/54/43/277055443.db2.gz	BGELRDJIBNTCEL-DZGCQCFKSA-N	1	0	280.412	1.888	50	0		CDAARO
CC(C)C[C@H](C[NH3+])NS(=O)(=O)CC1CCCC1	ZINC000253415952	277483673	/nfs/dbraw/zinc/48/36/73/277483673.db2.gz	FOSRUVZSJYXDSY-GFCCVEGCSA-N	1	0	262.419	1.469	50	0		CDAARO
C[C@@]1(C(N)=O)CCCC[N@@H+]1Cc1cc2ccccc2[nH]c1=O	ZINC000097112707	279156620	/nfs/dbraw/zinc/15/66/20/279156620.db2.gz	PATTWNPPMADZCD-KRWDZBQOSA-N	1	0	299.374	1.758	50	0		CDAARO
O=c1c2c(ncn1C[C@H]1CCCO1)sc1c2CC[NH2+]C1	ZINC000082107019	280390806	/nfs/dbraw/zinc/39/08/06/280390806.db2.gz	HSFJISIYORYDNL-SECBINFHSA-N	1	0	291.376	1.283	50	0		CDAARO
CN(C)C(=O)c1ccc(C[NH2+]C[C@@H]2COc3ccccc32)[nH]1	ZINC000288535199	289030634	/nfs/dbraw/zinc/03/06/34/289030634.db2.gz	KLHBUQIUCFMCES-GFCCVEGCSA-N	1	0	299.374	1.982	50	0		CDAARO
CC[NH+]1C[C@@H](C)N(C(=O)c2ccc(C(N)=O)cc2)[C@H](C)C1	ZINC000562697305	293177100	/nfs/dbraw/zinc/17/71/00/293177100.db2.gz	VBVZNCOLCQGKRD-VXGBXAGGSA-N	1	0	289.379	1.340	50	0		CDAARO
Cc1cc2c(cc1C)O[C@@H](C(=O)N(C)[C@@H]1CC[NH2+]C1)C2	ZINC000179125540	301438007	/nfs/dbraw/zinc/43/80/07/301438007.db2.gz	DAWQPENOCVVXBI-UKRRQHHQSA-N	1	0	274.364	1.427	50	0		CDAARO
CC1(CCC(=O)NCC[NH+]2CCC(CO)CC2)CC1	ZINC000534575286	328309974	/nfs/dbraw/zinc/30/99/74/328309974.db2.gz	HUPRZUMAFUTBHA-UHFFFAOYSA-N	1	0	268.401	1.387	50	0		CDAARO
Cn1cccc1CCC(=O)NC(C)(C)C[NH+](C)C	ZINC000534589601	328317608	/nfs/dbraw/zinc/31/76/08/328317608.db2.gz	LYBTYFQTXUVYTG-UHFFFAOYSA-N	1	0	251.374	1.414	50	0		CDAARO
CC(C)c1nc(N2CCC[C@]3(CC[NH2+]C3)C2)no1	ZINC000534592701	328318534	/nfs/dbraw/zinc/31/85/34/328318534.db2.gz	GWFVNFPEDKEGKH-CYBMUJFWSA-N	1	0	250.346	1.773	50	0		CDAARO
Cc1cc(C)n(CCCC(=O)NC[C@H](C(C)C)[NH+](C)C)n1	ZINC000534630509	328331212	/nfs/dbraw/zinc/33/12/12/328331212.db2.gz	PQRHKMRRTVXQKK-OAHLLOKOSA-N	1	0	294.443	1.983	50	0		CDAARO
CCC[C@H](CNc1nc(C)ccc1C(N)=O)[NH+](C)C	ZINC000534649248	328343793	/nfs/dbraw/zinc/34/37/93/328343793.db2.gz	ATBUEGZITXHDNM-LLVKDONJSA-N	1	0	264.373	1.631	50	0		CDAARO
CNc1nc(NCCCc2nc3ccccc3[nH]2)cc(C)[nH+]1	ZINC000534656731	328340464	/nfs/dbraw/zinc/34/04/64/328340464.db2.gz	FMYCMJNAXOLARR-UHFFFAOYSA-N	1	0	296.378	1.592	50	0		CDAARO
CCS(=O)(=O)NC[C@@H](C)[NH2+]C1(c2ccc(C)cc2)CC1	ZINC000534658230	328341380	/nfs/dbraw/zinc/34/13/80/328341380.db2.gz	INXYGEMOKYGDQN-CYBMUJFWSA-N	1	0	296.436	1.902	50	0		CDAARO
CCCn1ccnc1CNC(=O)C[N@H+](C)C1CCCC1	ZINC000534665408	328345166	/nfs/dbraw/zinc/34/51/66/328345166.db2.gz	MUGBOZPLKFPKNT-UHFFFAOYSA-N	1	0	278.400	1.784	50	0		CDAARO
CCn1nccc1C[N@@H+]1CCOCC2(CCOCC2)C1	ZINC000097373166	323207796	/nfs/dbraw/zinc/20/77/96/323207796.db2.gz	PMUIGDFOWGAXOB-UHFFFAOYSA-N	1	0	279.384	1.532	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)c2cccc(-n3cncn3)c2)C1	ZINC000299739395	482447835	/nfs/dbraw/zinc/44/78/35/482447835.db2.gz	NYOSKVGPBPGVBQ-TZMCWYRMSA-N	1	0	299.378	1.467	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H]1CN(CC(C)(C)N1CCOCC1)C2	ZINC000670434352	482969290	/nfs/dbraw/zinc/96/92/90/482969290.db2.gz	ZSYGBZNOLRRJJX-HOTGVXAUSA-N	1	0	295.471	1.513	50	0		CDAARO
CN(Cc1cnccc1Cl)CC1CC[NH+](CCO)CC1	ZINC000670452903	483022744	/nfs/dbraw/zinc/02/27/44/483022744.db2.gz	JCQCFHUYWKPXDD-UHFFFAOYSA-N	1	0	297.830	1.871	50	0		CDAARO
O=C(NC1CC[NH+](C2CCOCC2)CC1)c1ccon1	ZINC000670461284	483044921	/nfs/dbraw/zinc/04/49/21/483044921.db2.gz	BHFXRKVGPRUMIO-UHFFFAOYSA-N	1	0	279.340	1.048	50	0		CDAARO
Cc1ncn(CC[NH2+][C@H](C)Cn2ccnc2C)c1C	ZINC000670460747	483046103	/nfs/dbraw/zinc/04/61/03/483046103.db2.gz	BHWCNHSSJYTGBZ-LLVKDONJSA-N	1	0	261.373	1.683	50	0		CDAARO
C[C@H](C[NH+]1CCCC1)C(=O)NCc1cnc2cnccn12	ZINC000670467417	483058853	/nfs/dbraw/zinc/05/88/53/483058853.db2.gz	SLEPAHBVCRWWLN-GFCCVEGCSA-N	1	0	287.367	1.077	50	0		CDAARO
CCCC[C@@H](C(N)=O)[N@@H+]1CC[C@H](Oc2ccccn2)C1	ZINC000084742894	483322337	/nfs/dbraw/zinc/32/23/37/483322337.db2.gz	HWAUFOAKFAUXJD-STQMWFEESA-N	1	0	277.368	1.579	50	0		CDAARO
Cc1nc(CSc2nnc(C3CC[NH2+]CC3)n2C)no1	ZINC000426677853	534404223	/nfs/dbraw/zinc/40/42/23/534404223.db2.gz	DYIYHVLQIJARDD-UHFFFAOYSA-N	1	0	294.384	1.266	50	0		CDAARO
CN(CCOCC1CC1)C(=O)NC1CC[NH+](C)CC1	ZINC000087133574	522888429	/nfs/dbraw/zinc/88/84/29/522888429.db2.gz	XKVJVTBAOPDMBL-UHFFFAOYSA-N	1	0	269.389	1.149	50	0		CDAARO
O=C(NCCCC[NH+]1CCCCCC1)c1cccc(=O)[nH]1	ZINC000215147040	527651082	/nfs/dbraw/zinc/65/10/82/527651082.db2.gz	SIAFMTROBUCDEB-UHFFFAOYSA-N	1	0	291.395	1.761	50	0		CDAARO
Cn1nnnc1SCCC[NH2+]Cc1ccco1	ZINC000004993839	527659577	/nfs/dbraw/zinc/65/95/77/527659577.db2.gz	PUWKXDJFCUNLON-UHFFFAOYSA-N	1	0	253.331	1.075	50	0		CDAARO
CCCCc1c(C)[nH+]c(N)nc1N1CCO[C@H](CCO)C1	ZINC000091574483	535077948	/nfs/dbraw/zinc/07/79/48/535077948.db2.gz	MTWYXSGXZSIDPW-GFCCVEGCSA-N	1	0	294.399	1.297	50	0		CDAARO
Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)C[NH+](C)C	ZINC000097162578	545522425	/nfs/dbraw/zinc/52/24/25/545522425.db2.gz	KTGBLBSWMXHZGA-SNVBAGLBSA-N	1	0	266.389	1.685	50	0		CDAARO
CC(C)c1ncc(C[NH2+]CCSc2nncn2C)cn1	ZINC000952968499	614324316	/nfs/dbraw/zinc/32/43/16/614324316.db2.gz	LYXNYEDWLCFSDF-UHFFFAOYSA-N	1	0	292.412	1.610	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@@H]([NH3+])c2ccsc2)C1	ZINC000958527927	613973389	/nfs/dbraw/zinc/97/33/89/613973389.db2.gz	ISVWFFOJCILFDC-JTQLQIEISA-N	1	0	284.381	1.730	50	0		CDAARO
Cn1cc([C@](C)(O)C[NH2+]Cc2cnc(C3CC3)o2)cn1	ZINC000888100636	617764323	/nfs/dbraw/zinc/76/43/23/617764323.db2.gz	XSTHAEVNMQSXPP-CQSZACIVSA-N	1	0	276.340	1.283	50	0		CDAARO
Cc1cccc(C)c1NC(=O)N1C[C@@H]2C[NH2+]C[C@@]2(CO)C1	ZINC001772702045	1159436874	/nfs/dbraw/zinc/43/68/74/1159436874.db2.gz	QHDSSKOELDLMFT-BBRMVZONSA-N	1	0	289.379	1.349	50	0		CDAARO
Cc1cccnc1N1CCN([C@@H]2C[NH+]3CCC2CC3)CC1	ZINC000825236511	1161938601	/nfs/dbraw/zinc/93/86/01/1161938601.db2.gz	GWVHGTLRAXTGRM-MRXNPFEDSA-N	1	0	286.423	1.606	50	0		CDAARO
O=C([C@@H]1CCOC1)N1CCC[N@H+](Cc2cccs2)CC1	ZINC000066916683	1171416531	/nfs/dbraw/zinc/41/65/31/1171416531.db2.gz	KJBXEBOQCPYLSJ-CYBMUJFWSA-N	1	0	294.420	1.819	50	0		CDAARO
Cc1cccc(CC[N@H+]2C[C@@H](Cc3cnccn3)[C@H](O)C2)n1	ZINC001704338881	1177695115	/nfs/dbraw/zinc/69/51/15/1177695115.db2.gz	JAVBWQIJDJMJOV-RHSMWYFYSA-N	1	0	298.390	1.258	50	0		CDAARO
[NH3+][C@@H]1C[C@H](O)[C@@H](N2CCN(c3cccc(Cl)c3)CC2)C1	ZINC000864097091	751479513	/nfs/dbraw/zinc/47/95/13/751479513.db2.gz	NLUGSPONEUHYGV-QEJZJMRPSA-N	1	0	295.814	1.313	50	0		CDAARO
CN1CCN(Cc2sccc2Cl)C[C@H]1CCO	ZINC000299872901	751840755	/nfs/dbraw/zinc/84/07/55/751840755.db2.gz	CJLMXSNFETVJAA-SNVBAGLBSA-N	1	0	274.817	1.900	50	0		CDAARO
Cc1nc(C)c(CSc2nnc(CC[NH3+])n2C)s1	ZINC000426518970	752794062	/nfs/dbraw/zinc/79/40/62/752794062.db2.gz	MTILAEITVRPXPV-UHFFFAOYSA-N	1	0	283.426	1.682	50	0		CDAARO
[NH3+][C@@H](c1ccsc1C(F)(F)F)C1(O)CNC1	ZINC000958527764	753453899	/nfs/dbraw/zinc/45/38/99/753453899.db2.gz	HNJKGIAOXABLAN-LURJTMIESA-N	1	0	252.261	1.101	50	0		CDAARO
Cc1ccnc(N2CCOC3(CC[NH+](C)CC3)C2)n1	ZINC000826772980	753488958	/nfs/dbraw/zinc/48/89/58/753488958.db2.gz	HXBCJIHRGSBZRQ-UHFFFAOYSA-N	1	0	262.357	1.086	50	0		CDAARO
C[C@H](CCN(C)CCc1nccn1C)[NH+]1CCCC1	ZINC001506395093	908876396	/nfs/dbraw/zinc/87/63/96/908876396.db2.gz	CATUQCDJPWAORV-CQSZACIVSA-N	1	0	264.417	1.769	50	0		CDAARO
C[N@H+](Cc1cc(-c2ccccn2)no1)[C@@H]1CCOC1	ZINC000823671482	925719452	/nfs/dbraw/zinc/71/94/52/925719452.db2.gz	YWKRWXKLQVWECP-LLVKDONJSA-N	1	0	259.309	1.957	50	0		CDAARO
CN1CCN([C@H]2COC[C@@H]2[NH2+]C2CCCCCC2)CC1	ZINC000823792628	925732448	/nfs/dbraw/zinc/73/24/48/925732448.db2.gz	AHHJRLXEHOBGDQ-HOTGVXAUSA-N	1	0	281.444	1.314	50	0		CDAARO
O=C(NCC1(C[NH+]2CCCC2)CC1)[C@H]1CCOC1	ZINC000827778721	925964282	/nfs/dbraw/zinc/96/42/82/925964282.db2.gz	QQQCXKOXACCWPK-LBPRGKRZSA-N	1	0	252.358	1.015	50	0		CDAARO
Cc1n[nH]c(C)c1NC(=O)N1CCC2(C[NH+](C)C2)C1	ZINC000585085579	930890461	/nfs/dbraw/zinc/89/04/61/930890461.db2.gz	KPHHRCNXUHKLBN-UHFFFAOYSA-N	1	0	263.345	1.196	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@@H]1C(=O)N[C@H]1CC[C@@H](CO)CC1	ZINC000585132259	931025669	/nfs/dbraw/zinc/02/56/69/931025669.db2.gz	RMVQFHAEKQRYIB-FRRDWIJNSA-N	1	0	268.401	1.527	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)Cc1ncc(Cl)s1	ZINC000585139485	931033398	/nfs/dbraw/zinc/03/33/98/931033398.db2.gz	AFFGZJUKSCWQMF-RKDXNWHRSA-N	1	0	287.816	1.890	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1Cn1ncc(N2CCCCC2)cc1=O	ZINC000095358755	934971735	/nfs/dbraw/zinc/97/17/35/934971735.db2.gz	KUSNCYGJZBZIGC-CQSZACIVSA-N	1	0	290.411	1.718	50	0		CDAARO
CC[NH+](CC)C[C@H]1CCCN1CCn1ccnc1	ZINC001506403671	975142981	/nfs/dbraw/zinc/14/29/81/975142981.db2.gz	UUZJUWRXRWUAAU-CQSZACIVSA-N	1	0	250.390	1.689	50	0		CDAARO
C[NH+](C)[C@H]1CN(c2nccc3ccccc32)C[C@@H]1O	ZINC001506397052	975147906	/nfs/dbraw/zinc/14/79/06/975147906.db2.gz	XZDJGYVIGDLPAT-KBPBESRZSA-N	1	0	257.337	1.346	50	0		CDAARO
CCn1cncc1C[NH2+][C@@H](C)Cn1nc(C)cc1C	ZINC001506403343	975150460	/nfs/dbraw/zinc/15/04/60/975150460.db2.gz	TVLPIPNENNKBPS-LBPRGKRZSA-N	1	0	261.373	1.895	50	0		CDAARO
CCc1nc(CN2CCCC[C@@H]([NH+](C)C)C2)no1	ZINC001506403266	975150653	/nfs/dbraw/zinc/15/06/53/975150653.db2.gz	SRSSZCBRRQCJQY-LLVKDONJSA-N	1	0	252.362	1.548	50	0		CDAARO
C[C@H](C[N@H+](C)CCO)NC1(c2cc(F)ccc2F)CC1	ZINC001506407898	975153260	/nfs/dbraw/zinc/15/32/60/975153260.db2.gz	KUXQCNDBPZSJKL-LLVKDONJSA-N	1	0	284.350	1.856	50	0		CDAARO
OCC[N@H+](CC[C@H]1CCOC1)Cc1cccs1	ZINC001506419148	975157206	/nfs/dbraw/zinc/15/72/06/975157206.db2.gz	YMZKHSJCONWIGI-LBPRGKRZSA-N	1	0	255.383	1.969	50	0		CDAARO
CC1=NO[C@](C)(C(=O)NCc2cccc(C[NH+](C)C)c2)C1	ZINC000584902776	341986945	/nfs/dbraw/zinc/98/69/45/341986945.db2.gz	NKYWBSFRTJUPFA-INIZCTEOSA-N	1	0	289.379	1.919	50	0		CDAARO
O=C1C[C@H]2CC[C@@H](CN1CCCOCc1ccccc1)[NH2+]2	ZINC000095521670	185002629	/nfs/dbraw/zinc/00/26/29/185002629.db2.gz	CEMASDYHOYVXAK-CVEARBPZSA-N	1	0	288.391	1.946	50	0		CDAARO
O=S(=O)(NCC[C@H]1CC[NH2+]C1)c1cc(F)ccc1F	ZINC000110797219	230394077	/nfs/dbraw/zinc/39/40/77/230394077.db2.gz	GSOWMTIIIIBNON-SECBINFHSA-N	1	0	290.335	1.243	50	0		CDAARO
Cc1nccn1CCN(C)C(=O)C[N@@H+]1C[C@@H]2CC[C@H]1C2	ZINC000222778932	230398534	/nfs/dbraw/zinc/39/85/34/230398534.db2.gz	NQSUZYQSAZCMDH-KGLIPLIRSA-N	1	0	276.384	1.134	50	0		CDAARO
CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1[C@H](C)c1nnc(C)o1	ZINC000106789055	349491303	/nfs/dbraw/zinc/49/13/03/349491303.db2.gz	RNZMYDCLKLYZIU-DDTOSNHZSA-N	1	0	292.383	1.914	50	0		CDAARO
O=C1C[C@H]([NH2+]CC2CC2)C(=O)N1c1ccc(F)cc1	ZINC000095630530	185017073	/nfs/dbraw/zinc/01/70/73/185017073.db2.gz	AOAKLZCIAGZKQF-LBPRGKRZSA-N	1	0	262.284	1.457	50	0		CDAARO
Cc1ccc(OC(F)F)c(C[NH2+][C@H](C)CC(N)=O)c1	ZINC000095969249	185047507	/nfs/dbraw/zinc/04/75/07/185047507.db2.gz	XQMYBBKOGKBOHN-SECBINFHSA-N	1	0	272.295	1.950	50	0		CDAARO
C[C@H](CS(C)(=O)=O)[NH2+]CCc1ccc(F)cc1F	ZINC000095985028	185054730	/nfs/dbraw/zinc/05/47/30/185054730.db2.gz	LVMZNIZROWJLSJ-SECBINFHSA-N	1	0	277.336	1.530	50	0		CDAARO
CCC[NH+]1CCC(NC[C@@H](O)c2ccncc2)CC1	ZINC000095985132	185055319	/nfs/dbraw/zinc/05/53/19/185055319.db2.gz	MXUPRHXCXXCALZ-OAHLLOKOSA-N	1	0	263.385	1.579	50	0		CDAARO
CCC(=O)N1CCC(CCC[NH+]2CCOCC2)CC1	ZINC000096003219	185062276	/nfs/dbraw/zinc/06/22/76/185062276.db2.gz	QHSYFPRWMIHSIQ-UHFFFAOYSA-N	1	0	268.401	1.747	50	0		CDAARO
OCCCC1CC[NH+](CCCN2CCOCC2)CC1	ZINC000096007917	185064030	/nfs/dbraw/zinc/06/40/30/185064030.db2.gz	FBVDFPDJUVEURR-UHFFFAOYSA-N	1	0	270.417	1.193	50	0		CDAARO
C[C@@H]1C[C@H]([NH2+]C[C@@H](O)CO)C[C@@H](c2ccccc2)C1	ZINC000238857286	361740613	/nfs/dbraw/zinc/74/06/13/361740613.db2.gz	YPSZPHVKLRDAEC-QCEMKRCNSA-N	1	0	263.381	1.902	50	0		CDAARO
CO[C@@H]1CCN(C(=O)CC[C@@H]2CC[C@H](C)O2)[C@H](C[NH3+])C1	ZINC000242292505	361755472	/nfs/dbraw/zinc/75/54/72/361755472.db2.gz	YMWFGDNPQADZJC-XDQVBPFNSA-N	1	0	284.400	1.299	50	0		CDAARO
CC(C)(C[NH+]1CCCC1)NC(=O)c1ccc(N)nc1	ZINC000308679284	342089756	/nfs/dbraw/zinc/08/97/56/342089756.db2.gz	KIIVJSVUYNOAKT-UHFFFAOYSA-N	1	0	262.357	1.268	50	0		CDAARO
CCNC(=O)N1CC[NH+](C2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000089977451	539087691	/nfs/dbraw/zinc/08/76/91/539087691.db2.gz	MHYLTMMDNDQXHG-RYUDHWBXSA-N	1	0	269.389	1.290	50	0		CDAARO
Cc1cc(C)nc(CCNC(=O)Nc2ccc(C[NH3+])cc2)n1	ZINC000096132363	185105001	/nfs/dbraw/zinc/10/50/01/185105001.db2.gz	LFDLLGBWOYJFOE-UHFFFAOYSA-N	1	0	299.378	1.916	50	0		CDAARO
CC(C)C[C@@H](NC(=O)C[C@@H]1C[NH2+]CCO1)C(C)(C)C	ZINC000195543577	342626648	/nfs/dbraw/zinc/62/66/48/342626648.db2.gz	FCIJEPBWVFZCPZ-CHWSQXEVSA-N	1	0	270.417	1.942	50	0		CDAARO
CC(=O)c1cc(C[N@H+]2C[C@@H]3C[C@H](O)[C@@H](O)C[C@@H]3C2)cs1	ZINC000243893138	361829024	/nfs/dbraw/zinc/82/90/24/361829024.db2.gz	AOGGRZJWHRZESF-CRWXNKLISA-N	1	0	295.404	1.514	50	0		CDAARO
C[N@H+](C[C@H]1COc2ccccc2O1)C1CCOCC1	ZINC000244633253	361855545	/nfs/dbraw/zinc/85/55/45/361855545.db2.gz	FZTXJUWNFKCTIQ-ZDUSSCGKSA-N	1	0	263.337	1.937	50	0		CDAARO
CC(C)[C@H]1C[N@H+](C)CCN1C(=O)NO[C@H]1CCCCO1	ZINC000252514922	361855811	/nfs/dbraw/zinc/85/58/11/361855811.db2.gz	FCANMRQJAYKPBQ-OLZOCXBDSA-N	1	0	285.388	1.426	50	0		CDAARO
COC[C@@H]1CC[N@H+](CCC(=O)NCc2ccccc2F)C1	ZINC000244831495	361864636	/nfs/dbraw/zinc/86/46/36/361864636.db2.gz	UERQVBUMCNWLDC-CYBMUJFWSA-N	1	0	294.370	1.800	50	0		CDAARO
C[C@@H](Cc1ccc(F)cc1)NC(=O)C[NH2+]C[C@H]1CCCO1	ZINC000097229054	342204899	/nfs/dbraw/zinc/20/48/99/342204899.db2.gz	GRUWFDVRQOFPOO-SWLSCSKDSA-N	1	0	294.370	1.642	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@@H]2CCC[C@@H](C(N)=O)C2)cc1	ZINC000097034919	185157680	/nfs/dbraw/zinc/15/76/80/185157680.db2.gz	DYLDOWJPAVZMJG-ZIAGYGMSSA-N	1	0	290.363	1.607	50	0		CDAARO
CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@H+](CCOC(C)=O)C1	ZINC000585141417	342219199	/nfs/dbraw/zinc/21/91/99/342219199.db2.gz	VLVVWKCIDAIAKJ-TZMCWYRMSA-N	1	0	284.400	1.566	50	0		CDAARO
CC(C)N1C(=O)N[C@]2(CC[N@H+](CC3CCCC3)C2)C1=O	ZINC000084597328	342265322	/nfs/dbraw/zinc/26/53/22/342265322.db2.gz	QDGYIILXKZCMDS-HNNXBMFYSA-N	1	0	279.384	1.581	50	0		CDAARO
O=C1NCCN1c1ccc(N[C@H]2C[NH+]3CCC2CC3)cc1	ZINC000037076252	539141767	/nfs/dbraw/zinc/14/17/67/539141767.db2.gz	XUVWGLAPEIAOLO-HNNXBMFYSA-N	1	0	286.379	1.722	50	0		CDAARO
CC[C@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)C(=O)N1CCOCC1	ZINC000096479176	529669735	/nfs/dbraw/zinc/66/97/35/529669735.db2.gz	YSXKTDZKHZXBBH-STQMWFEESA-N	1	0	298.427	1.560	50	0		CDAARO
CC(C)(C)OC(=O)[C@H]1CCCC[N@@H+]1C[C@@H]1CNC(=O)C1	ZINC000585094291	362021380	/nfs/dbraw/zinc/02/13/80/362021380.db2.gz	DPERJHVZHOMMST-NWDGAFQWSA-N	1	0	282.384	1.319	50	0		CDAARO
CCCCOc1ncccc1CNC(=O)[C@@H](C)[NH+](C)C	ZINC000585121083	362040231	/nfs/dbraw/zinc/04/02/31/362040231.db2.gz	FMQXKQJHQPELDA-GFCCVEGCSA-N	1	0	279.384	1.827	50	0		CDAARO
CO[C@H](C[NH2+]Cc1nncn1-c1ccccc1)C1CC1	ZINC000585117677	362046207	/nfs/dbraw/zinc/04/62/07/362046207.db2.gz	RDEKCASSGRIYHH-CQSZACIVSA-N	1	0	272.352	1.782	50	0		CDAARO
CC(C)[C@@H](C(=O)N1CC[C@H](O)C1)[NH+]1CCCCC1	ZINC000085379723	342381631	/nfs/dbraw/zinc/38/16/31/342381631.db2.gz	CFXCZBKRZHQYDN-STQMWFEESA-N	1	0	254.374	1.090	50	0		CDAARO
COC(=O)CC[N@@H+]1CCN(Cc2cccnc2C)[C@H](C)C1	ZINC000253369594	342416143	/nfs/dbraw/zinc/41/61/43/342416143.db2.gz	FHVXABKJNCBASF-CYBMUJFWSA-N	1	0	291.395	1.459	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)/C=C/c2ccc3c(c2)OCCO3)C1	ZINC000178514184	362245315	/nfs/dbraw/zinc/24/53/15/362245315.db2.gz	RLVLLDXNMFQEBC-OHVSUOQFSA-N	1	0	288.347	1.278	50	0		CDAARO
CCn1c(C)nnc1CN1CC[C@H](C[NH+]2CCCCC2)C1	ZINC000083836897	362255020	/nfs/dbraw/zinc/25/50/20/362255020.db2.gz	AIIUMBZFKYBXPU-OAHLLOKOSA-N	1	0	291.443	1.914	50	0		CDAARO
Cc1[nH]ccc1C(=O)NCCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000084028690	362259488	/nfs/dbraw/zinc/25/94/88/362259488.db2.gz	BVSYZHMKGKYRGH-BETUJISGSA-N	1	0	293.411	1.942	50	0		CDAARO
CCS(=O)(=O)NCC[NH2+]Cc1ccc(Cl)cc1C	ZINC000129194939	345272913	/nfs/dbraw/zinc/27/29/13/345272913.db2.gz	UIEPCYMBLKKWIE-UHFFFAOYSA-N	1	0	290.816	1.677	50	0		CDAARO
CCn1cc(CN2CC[NH+](C3CCOCC3)CC2)cn1	ZINC000097766758	185664805	/nfs/dbraw/zinc/66/48/05/185664805.db2.gz	JQXAXHAXTZMZGV-UHFFFAOYSA-N	1	0	278.400	1.200	50	0		CDAARO
Cc1ocnc1C(=O)N(CC[NH+](C)C)C[C@@H]1CCCO1	ZINC000097259258	282468087	/nfs/dbraw/zinc/46/80/87/282468087.db2.gz	ZFELKHCRNUTSAS-LBPRGKRZSA-N	1	0	281.356	1.166	50	0		CDAARO
OC[C@H]1CCC[N@@H+]1C[C@@H]1CCCN1c1ncc(Cl)cn1	ZINC000085689343	179116216	/nfs/dbraw/zinc/11/62/16/179116216.db2.gz	CWOLRFWBQSVZCT-QWHCGFSZSA-N	1	0	296.802	1.556	50	0		CDAARO
CC(C)(C)OC[C@H](O)C[NH+]1CCN(c2ccccc2)CC1	ZINC000020707150	136582649	/nfs/dbraw/zinc/58/26/49/136582649.db2.gz	ZVVXETOSGMTCDZ-MRXNPFEDSA-N	1	0	292.423	1.985	50	0		CDAARO
COc1ccc(S(=O)(=O)N[C@H]2CCC[NH2+]C2)c(C)c1	ZINC000193349796	362907416	/nfs/dbraw/zinc/90/74/16/362907416.db2.gz	VPOSZDCODRHQDP-NSHDSACASA-N	1	0	284.381	1.034	50	0		CDAARO
C[N@@H+]1CCCN(CC(=O)NCCCC[C@H]2CCCO2)CC1	ZINC000584899839	349361353	/nfs/dbraw/zinc/36/13/53/349361353.db2.gz	OBOXFFVECNZRTD-HNNXBMFYSA-N	1	0	297.443	1.089	50	0		CDAARO
C[N@@H+]1Cc2ccccc2C[C@@H]1CNC(=O)Cn1cccc1	ZINC000584899467	349361575	/nfs/dbraw/zinc/36/15/75/349361575.db2.gz	FNSVQBJSQMOZBJ-MRXNPFEDSA-N	1	0	283.375	1.661	50	0		CDAARO
O=C(NCc1ncc[nH]1)C1([NH+]2CCCC2)CCCC1	ZINC000065380684	362948214	/nfs/dbraw/zinc/94/82/14/362948214.db2.gz	POJDHSFDMSHFKP-UHFFFAOYSA-N	1	0	262.357	1.435	50	0		CDAARO
Cc1cc(C)c(C(=O)N2C[C@H]([NH3+])[C@@H](C(C)C)C2)cn1	ZINC000091625865	180209658	/nfs/dbraw/zinc/20/96/58/180209658.db2.gz	ROWGNVIDJMVJAT-KGLIPLIRSA-N	1	0	261.369	1.754	50	0		CDAARO
Cc1cc(C)c2[nH]c(C[NH2+][C@H]3CCCNC3=O)cc(=O)c2c1	ZINC000091680788	180226544	/nfs/dbraw/zinc/22/65/44/180226544.db2.gz	AMXHINHJEGJJBW-AWEZNQCLSA-N	1	0	299.374	1.513	50	0		CDAARO
[NH3+][C@H]1CN(S(=O)(=O)c2cccc(F)c2)C[C@@H]1C1CC1	ZINC000091779183	180251926	/nfs/dbraw/zinc/25/19/26/180251926.db2.gz	CNYBATTYEBUSTL-OLZOCXBDSA-N	1	0	284.356	1.184	50	0		CDAARO
CCC[N@@H+]1C[C@H]2CC[C@@H]1CN(C(=O)Cn1nccc1C)C2	ZINC000091858294	180274701	/nfs/dbraw/zinc/27/47/01/180274701.db2.gz	NIFQVKAFMYPOST-HUUCEWRRSA-N	1	0	290.411	1.524	50	0		CDAARO
COc1ccc(C[NH2+][C@H]2CCC[C@H]2O)c(OC)c1	ZINC000109554308	186262951	/nfs/dbraw/zinc/26/29/51/186262951.db2.gz	FRYKMYDSYUUBRI-QWHCGFSZSA-N	1	0	251.326	1.707	50	0		CDAARO
CCNC(=O)[C@H]1CCC[C@H](C(=O)NCC)C1[NH+]1CCCC1	ZINC000096026864	351475155	/nfs/dbraw/zinc/47/51/55/351475155.db2.gz	GOOWOXXQXVQZBW-STQMWFEESA-N	1	0	295.427	1.139	50	0		CDAARO
Cn1cccc1C(=O)N1CCC([NH2+]CC2CC2)CC1	ZINC000122262822	187023098	/nfs/dbraw/zinc/02/30/98/187023098.db2.gz	RHRLBBKEZPMWKK-UHFFFAOYSA-N	1	0	261.369	1.629	50	0		CDAARO
C[C@@H]([NH3+])CCNS(=O)(=O)c1cc(F)ccc1Cl	ZINC000123900079	187114255	/nfs/dbraw/zinc/11/42/55/187114255.db2.gz	OKCVZAREWUKYND-SSDOTTSWSA-N	1	0	280.752	1.495	50	0		CDAARO
CCSCC[N@@H+]1C[C@H](C(N)=O)[C@@H](c2ccccc2)C1	ZINC000411980050	363392402	/nfs/dbraw/zinc/39/24/02/363392402.db2.gz	NEJGNSPKJIPEHM-KGLIPLIRSA-N	1	0	278.421	1.940	50	0		CDAARO
OCC[NH+](CCO)Cc1csc2ccccc12	ZINC000000345337	355905403	/nfs/dbraw/zinc/90/54/03/355905403.db2.gz	OITQNBLXSYVVRW-UHFFFAOYSA-N	1	0	251.351	1.688	50	0		CDAARO
COC(=O)c1ccc(CSc2nc(N)cc(N)[nH+]2)cc1	ZINC000000567573	355917576	/nfs/dbraw/zinc/91/75/76/355917576.db2.gz	LGOUGJBIFOBRRV-UHFFFAOYSA-N	1	0	290.348	1.720	50	0	aggregator	CDAARO
[NH2+]=C1c2ccccc2CN1CCCN1CCOCC1	ZINC000002645161	356093040	/nfs/dbraw/zinc/09/30/40/356093040.db2.gz	DHAVIHWFLCHUIK-UHFFFAOYSA-N	1	0	259.353	1.550	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@H](C)c1ccc([S@@](C)=O)cc1	ZINC000097373433	356094624	/nfs/dbraw/zinc/09/46/24/356094624.db2.gz	NTLNYBMBBNLTFL-GIPWTMENSA-N	1	0	296.436	1.847	50	0		CDAARO
O=C1C[C@H]([NH2+]CC2CC2)CN1Cc1cccc(F)c1	ZINC000012763595	356322973	/nfs/dbraw/zinc/32/29/73/356322973.db2.gz	RAAOLDYXYFUHCG-AWEZNQCLSA-N	1	0	262.328	1.926	50	0		CDAARO
O=C1N(CC2CCCCC2)CCC[C@]1(O)C[NH2+]CC1CC1	ZINC000012030048	356286506	/nfs/dbraw/zinc/28/65/06/356286506.db2.gz	ADEFYTRGCJQQSX-KRWDZBQOSA-N	1	0	294.439	1.920	50	0		CDAARO
COc1cc(F)c(C[NH2+]C[C@@H]2COCCO2)cc1OC	ZINC000032603546	356305080	/nfs/dbraw/zinc/30/50/80/356305080.db2.gz	MRHMGMGPWPTJCE-LLVKDONJSA-N	1	0	285.315	1.348	50	0		CDAARO
COc1cccc(CN2CCC[C@@](O)(C[NH+](C)C)C2=O)c1	ZINC000012714419	356320680	/nfs/dbraw/zinc/32/06/80/356320680.db2.gz	WVHGYTFFCKFQIN-MRXNPFEDSA-N	1	0	292.379	1.110	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1C(=O)Nc1cccc(-n2cnnn2)c1	ZINC000012718385	356320896	/nfs/dbraw/zinc/32/08/96/356320896.db2.gz	AQNSOVOIMRZZSQ-ZDUSSCGKSA-N	1	0	286.339	1.085	50	0		CDAARO
C[C@@H](C(=O)NCc1ccc2c(c1)OCO2)[NH+]1CCCCC1	ZINC000015375977	356414770	/nfs/dbraw/zinc/41/47/70/356414770.db2.gz	QYAZVOWDOWYPED-LBPRGKRZSA-N	1	0	290.363	1.906	50	0		CDAARO
CN1CCC([N@@H+]2CCC[C@H](C(=O)N3CCCC3)C2)CC1	ZINC000014951820	356402584	/nfs/dbraw/zinc/40/25/84/356402584.db2.gz	SZCUNGREJZRXQL-AWEZNQCLSA-N	1	0	279.428	1.415	50	0		CDAARO
CC[NH+]1CCC(NC(=O)Cc2cccs2)CC1	ZINC000016579997	356442049	/nfs/dbraw/zinc/44/20/49/356442049.db2.gz	RCPJLQPSTLXXSB-UHFFFAOYSA-N	1	0	252.383	1.891	50	0		CDAARO
COc1ccccc1C(=O)O[C@@H](C)CN1CC[NH+](C)CC1	ZINC000019456183	356485948	/nfs/dbraw/zinc/48/59/48/356485948.db2.gz	SMDGVVGPMXNGMT-ZDUSSCGKSA-N	1	0	292.379	1.488	50	0		CDAARO
O=S(=O)([C@@H]1CCC[NH2+]C1)N1CCc2ccccc21	ZINC000019477523	356486755	/nfs/dbraw/zinc/48/67/55/356486755.db2.gz	DSRSUBHKUWCDAA-GFCCVEGCSA-N	1	0	266.366	1.131	50	0		CDAARO
CN1CC[NH+](C2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000019868075	356512510	/nfs/dbraw/zinc/51/25/10/356512510.db2.gz	QYPVLCYAALPFTR-UHFFFAOYSA-N	1	0	287.407	1.539	50	0		CDAARO
Cc1ccc(CN2CC[N@@H+](C(C)C)[C@@H](CCO)C2)o1	ZINC000019839966	356508362	/nfs/dbraw/zinc/50/83/62/356508362.db2.gz	DZRARZFQYOATNQ-AWEZNQCLSA-N	1	0	266.385	1.865	50	0		CDAARO
C[NH+](C)CC(C)(C)CNC(=O)c1ccccc1O	ZINC000019838257	356508913	/nfs/dbraw/zinc/50/89/13/356508913.db2.gz	DGAZYTWXUPWYEU-UHFFFAOYSA-N	1	0	250.342	1.710	50	0		CDAARO
C[N@@H+](CC(=O)N1CCNC1=O)CC1CCCCC1	ZINC000029523636	356738695	/nfs/dbraw/zinc/73/86/95/356738695.db2.gz	GPYVSHDSTUTVGS-UHFFFAOYSA-N	1	0	253.346	1.050	50	0		CDAARO
COc1ccccc1S(=O)(=O)CC1CC[NH2+]CC1	ZINC000034928971	356824732	/nfs/dbraw/zinc/82/47/32/356824732.db2.gz	HRBOXNDLHYGOKM-UHFFFAOYSA-N	1	0	269.366	1.469	50	0		CDAARO
O=c1ccccn1CC1(O)CC[NH+](Cc2ccccc2)CC1	ZINC000072318458	357230996	/nfs/dbraw/zinc/23/09/96/357230996.db2.gz	BGMVOROUOUVVRV-UHFFFAOYSA-N	1	0	298.386	1.875	50	0		CDAARO
Cc1ccc(CN(CCCO)C(=O)[C@@H]2CCC[N@H+]2C)s1	ZINC000055060747	357328361	/nfs/dbraw/zinc/32/83/61/357328361.db2.gz	UUPDEXBTQYBVGI-AWEZNQCLSA-N	1	0	296.436	1.862	50	0		CDAARO
C[C@H](c1nc(-c2cccs2)no1)N1CC[NH2+]CC1	ZINC000055460263	357334007	/nfs/dbraw/zinc/33/40/07/357334007.db2.gz	PXHCKHNTCUSXSA-SECBINFHSA-N	1	0	264.354	1.764	50	0		CDAARO
c1coc(CN2CCC3(CC2)[NH2+]CCc2nc[nH]c23)c1	ZINC000065387200	357535642	/nfs/dbraw/zinc/53/56/42/357535642.db2.gz	LFFWLEPHCDQIKG-UHFFFAOYSA-N	1	0	272.352	1.640	50	0		CDAARO
OCc1ccc(C[N@@H+]2CCCC[C@H]2CN2CCOCC2)o1	ZINC000065435986	357541174	/nfs/dbraw/zinc/54/11/74/357541174.db2.gz	MONIRQAYSWKTSK-AWEZNQCLSA-N	1	0	294.395	1.459	50	0		CDAARO
CCc1ccccc1-n1c(=O)[nH]nc1C1CC[NH+](C)CC1	ZINC000065530456	357547526	/nfs/dbraw/zinc/54/75/26/357547526.db2.gz	RWHBIBTXYCLPTB-UHFFFAOYSA-N	1	0	286.379	1.932	50	0		CDAARO
Cc1ccc(-c2n[nH]cc2C(=O)N2CCC([NH3+])CC2)cc1	ZINC000067172626	357597004	/nfs/dbraw/zinc/59/70/04/357597004.db2.gz	YWZJWEMHFUXNAW-UHFFFAOYSA-N	1	0	284.363	1.948	50	0		CDAARO
[NH3+]CC(=O)N1CCC(c2n[nH]cc2-c2ccccc2)CC1	ZINC000067434542	357608317	/nfs/dbraw/zinc/60/83/17/357608317.db2.gz	IXQHPUUSRWMFFA-UHFFFAOYSA-N	1	0	284.363	1.741	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](CNC(=O)c2cnn(CC)c2)C1	ZINC000067695101	357618724	/nfs/dbraw/zinc/61/87/24/357618724.db2.gz	IBFZKJRZKZMQOZ-ZDUSSCGKSA-N	1	0	278.400	1.755	50	0		CDAARO
O=C(NCC[NH+]1CCCCC1)OCC(F)(F)F	ZINC000068591611	357651517	/nfs/dbraw/zinc/65/15/17/357651517.db2.gz	JXDZXRNMAKLDQC-UHFFFAOYSA-N	1	0	254.252	1.761	50	0		CDAARO
CCc1ccccc1OCC(=O)N1CC[NH2+][C@H](C)C1	ZINC000188425173	357673576	/nfs/dbraw/zinc/67/35/76/357673576.db2.gz	DMWWWAVHCTVNLM-GFCCVEGCSA-N	1	0	262.353	1.448	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@@H]([NH3+])CN1Cc1cccc2[nH]ccc21	ZINC000067847816	357631196	/nfs/dbraw/zinc/63/11/96/357631196.db2.gz	NTQRMNNIAXGAFN-DOMZBBRYSA-N	1	0	286.379	1.206	50	0		CDAARO
Cc1occc1C(=O)N(CC[NH+](C)C)C[C@@H]1CCCO1	ZINC000067880878	357634806	/nfs/dbraw/zinc/63/48/06/357634806.db2.gz	NJMYAEUWNSLTGD-ZDUSSCGKSA-N	1	0	280.368	1.771	50	0		CDAARO
[NH3+]C1CN(c2cc(-c3ccccc3F)nc3ccnn32)C1	ZINC000072421923	357833405	/nfs/dbraw/zinc/83/34/05/357833405.db2.gz	ZRLCIQBEPNTKNA-UHFFFAOYSA-N	1	0	283.310	1.683	50	0		CDAARO
CCn1nc(CNC(=O)[C@H]2CC[C@@H]([NH3+])C2)c2ccccc21	ZINC000072431240	357835202	/nfs/dbraw/zinc/83/52/02/357835202.db2.gz	BDCMUUZUFVRPNE-NWDGAFQWSA-N	1	0	286.379	1.800	50	0		CDAARO
[NH3+][C@@H]1[C@H](C(=O)N2CCC(c3ncc[nH]3)CC2)[C@@H]2CC[C@H]1C2	ZINC000072433628	357835841	/nfs/dbraw/zinc/83/58/41/357835841.db2.gz	RBQKIODPZJDGFZ-RQJABVFESA-N	1	0	288.395	1.489	50	0		CDAARO
Cc1nc(CN2CCC([NH+]3CCC(O)CC3)CC2)co1	ZINC000072475899	357838154	/nfs/dbraw/zinc/83/81/54/357838154.db2.gz	KIKHYLUHXOBMEI-UHFFFAOYSA-N	1	0	279.384	1.404	50	0		CDAARO
C[C@H]([NH2+]CC(=O)NCc1ccccc1F)[C@H]1CCCO1	ZINC000097111735	357986494	/nfs/dbraw/zinc/98/64/94/357986494.db2.gz	INUITPNANDIHEM-SMDDNHRTSA-N	1	0	280.343	1.599	50	0		CDAARO
Cc1cc(C(=O)N(C)CC[C@H]([NH3+])C(C)C)n(C)n1	ZINC000097228990	358043788	/nfs/dbraw/zinc/04/37/88/358043788.db2.gz	AXTWVDIAKVXFEN-NSHDSACASA-N	1	0	252.362	1.174	50	0		CDAARO
O=C(CN1CCC[C@@H]([NH+]2CCCCCC2)C1)NCC1CC1	ZINC000089818980	358437067	/nfs/dbraw/zinc/43/70/67/358437067.db2.gz	YKEKDIBQOIVTKH-MRXNPFEDSA-N	1	0	293.455	1.853	50	0		CDAARO
COC[C@H](O)C[N@H+](C)C[C@@H](O)c1ccc(Cl)cc1	ZINC000195530854	358559299	/nfs/dbraw/zinc/55/92/99/358559299.db2.gz	FFIDXSZSAZAVAS-CHWSQXEVSA-N	1	0	273.760	1.313	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCC[C@H]2C[NH3+])c(F)c1	ZINC000195544560	358559785	/nfs/dbraw/zinc/55/97/85/358559785.db2.gz	CPTNCKMMCALMKZ-JQWIXIFHSA-N	1	0	286.372	1.540	50	0		CDAARO
CO[C@@H]1CCN(C(=O)CCc2cccs2)[C@@H](C[NH3+])C1	ZINC000195557547	358560956	/nfs/dbraw/zinc/56/09/56/358560956.db2.gz	XYEWXMJHTUYLIE-VXGBXAGGSA-N	1	0	282.409	1.645	50	0		CDAARO
Cc1nc(CCN(C)C(=O)CC[C@@H]2CCCC[N@@H+]2C)no1	ZINC000095357731	358684572	/nfs/dbraw/zinc/68/45/72/358684572.db2.gz	PSAUMDCVILBWJB-ZDUSSCGKSA-N	1	0	294.399	1.643	50	0		CDAARO
CCc1cnc(N)nc1N1CC[NH2+][C@@H](c2ccccc2)C1	ZINC000095361520	358685656	/nfs/dbraw/zinc/68/56/56/358685656.db2.gz	CXEPNUJECLFIOD-CQSZACIVSA-N	1	0	283.379	1.772	50	0		CDAARO
Cc1cc(Cl)ccc1C[NH2+]C[C@]1(O)CCOC1	ZINC000185308334	358779549	/nfs/dbraw/zinc/77/95/49/358779549.db2.gz	ILOCDYQAJASGEJ-CYBMUJFWSA-N	1	0	255.745	1.889	50	0		CDAARO
COCC1(C(=O)N2CCN[C@H](c3ccccc3)C2)CC1	ZINC000097568863	358784940	/nfs/dbraw/zinc/78/49/40/358784940.db2.gz	RUSVNUIJEKBZEZ-AWEZNQCLSA-N	1	0	274.364	1.586	50	0		CDAARO
Cc1ncc(C(=O)N(CC[NH+](C)C)Cc2ccccc2)cn1	ZINC000097635122	358788826	/nfs/dbraw/zinc/78/88/26/358788826.db2.gz	DDNCZYVZLAPMCO-UHFFFAOYSA-N	1	0	298.390	1.989	50	0		CDAARO
Cc1nccn1CC[N@@H+](C)Cc1cccc(C(=O)[O-])n1	ZINC000097680016	358792876	/nfs/dbraw/zinc/79/28/76/358792876.db2.gz	LJGKTUXRHJXEKD-UHFFFAOYSA-N	1	0	274.324	1.417	50	0		CDAARO
O=C(NCc1ccc2c(c1)CCCC2)[C@@H]1C[NH2+]CCO1	ZINC000097758063	358797973	/nfs/dbraw/zinc/79/79/73/358797973.db2.gz	HRJJYSUOFIBMRI-HNNXBMFYSA-N	1	0	274.364	1.170	50	0		CDAARO
O=C(C[C@@H]1C[NH2+]CCO1)NCc1ccc2sccc2c1	ZINC000215944789	358911145	/nfs/dbraw/zinc/91/11/45/358911145.db2.gz	PJAQRHWJNIYTGE-CYBMUJFWSA-N	1	0	290.388	1.896	50	0		CDAARO
CCCC[C@@H]1C=CCN1Cc1cc2n(n1)CC[NH2+]C2	ZINC000216006285	358917267	/nfs/dbraw/zinc/91/72/67/358917267.db2.gz	QMPDGKMOAFXFGG-CQSZACIVSA-N	1	0	260.385	1.917	50	0		CDAARO
CCOC(=O)C1CC[NH+](C2CCN(C)CC2)CC1	ZINC000000300887	358879496	/nfs/dbraw/zinc/87/94/96/358879496.db2.gz	GYRNYRHEGWCFOK-UHFFFAOYSA-N	1	0	254.374	1.356	50	0		CDAARO
CNC(=O)C[C@H](C)[N@H+](C)Cc1ccnc(C(C)C)n1	ZINC000215559301	358894188	/nfs/dbraw/zinc/89/41/88/358894188.db2.gz	NDXFNBRFTIUIFZ-NSHDSACASA-N	1	0	264.373	1.556	50	0		CDAARO
COc1ccc(C[N@H+](C)CC2CCOCC2)cn1	ZINC000215738747	358901071	/nfs/dbraw/zinc/90/10/71/358901071.db2.gz	SAZKYMONCWKVQG-UHFFFAOYSA-N	1	0	250.342	1.949	50	0		CDAARO
CC[NH2+]CC[C@H]1CCC(=O)N1CCCOC(C)C	ZINC000014958747	359071553	/nfs/dbraw/zinc/07/15/53/359071553.db2.gz	YAIIKSHECRDLAO-CYBMUJFWSA-N	1	0	256.390	1.792	50	0		CDAARO
C[NH+](C)[C@H]1CN(C(=O)c2ccc(Cl)cc2)C[C@@H]1O	ZINC000219008732	359074678	/nfs/dbraw/zinc/07/46/78/359074678.db2.gz	DQURTGQTPHBQKI-RYUDHWBXSA-N	1	0	268.744	1.087	50	0		CDAARO
CC[C@@H](Cn1ccnc1)NC(=O)CCn1cc(C)cn1	ZINC000219315282	359088145	/nfs/dbraw/zinc/08/81/45/359088145.db2.gz	SQTPUWALOQPOLU-ZDUSSCGKSA-N	1	0	275.356	1.373	50	0		CDAARO
CN1C(=O)[C@H]2C[N@H+](Cc3ccc(Cl)cc3)C[C@H]2C1=O	ZINC000257175996	359065457	/nfs/dbraw/zinc/06/54/57/359065457.db2.gz	BVCFDLVJYYNJQC-TXEJJXNPSA-N	1	0	278.739	1.387	50	0		CDAARO
c1ccc2c(c1)CC[C@@H]([NH2+]CCN1CCOCC1)C2	ZINC000023283413	359223880	/nfs/dbraw/zinc/22/38/80/359223880.db2.gz	ZCEHTMVINZHCQB-MRXNPFEDSA-N	1	0	260.381	1.466	50	0		CDAARO
C[NH+](C)CCNc1nc(N)nc(-c2cccs2)n1	ZINC000221272411	359224603	/nfs/dbraw/zinc/22/46/03/359224603.db2.gz	JIJUGDLPMAAXMO-UHFFFAOYSA-N	1	0	264.358	1.156	50	0		CDAARO
CCn1c(C)[n+](CC)c2cc(C(=O)N(C)C)ccc21	ZINC000000243465	359392000	/nfs/dbraw/zinc/39/20/00/359392000.db2.gz	PZTUVQBWRDAPTB-UHFFFAOYSA-N	1	0	260.361	1.979	50	0		CDAARO
C[C@@H](C(=O)NC1CCCC1)[NH+]1CCC2(CC1)OCCO2	ZINC000028077400	359523433	/nfs/dbraw/zinc/52/34/33/359523433.db2.gz	NVDHCANFLHOPED-LBPRGKRZSA-N	1	0	282.384	1.273	50	0		CDAARO
C[C@@H]([NH3+])CC(=O)N1CCc2c(cnn2-c2ccccc2)C1	ZINC000261867860	359570571	/nfs/dbraw/zinc/57/05/71/359570571.db2.gz	QILHLYHIUPMGPD-GFCCVEGCSA-N	1	0	284.363	1.494	50	0		CDAARO
Cc1ccc(OC[C@@H](O)C[NH2+]C2CCOCC2)c(C)c1	ZINC000032529878	359686351	/nfs/dbraw/zinc/68/63/51/359686351.db2.gz	QQILRJJNEYPFJZ-HNNXBMFYSA-N	1	0	279.380	1.812	50	0		CDAARO
CC(C)CCO[C@H](C)C(=O)N1CC[C@@H]([NH3+])C[C@H]1C	ZINC000408519135	359911350	/nfs/dbraw/zinc/91/13/50/359911350.db2.gz	DZCLLMKZDUWGIZ-JHJVBQTASA-N	1	0	256.390	1.776	50	0		CDAARO
CCC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@H+]1[C@H](CC)C(N)=O	ZINC000257365336	359945335	/nfs/dbraw/zinc/94/53/35/359945335.db2.gz	MPZQBWVCEQDELF-FRRDWIJNSA-N	1	0	281.400	1.116	50	0		CDAARO
Cc1nnc([C@H](C)N2CCCC[C@H]2Cn2cncn2)o1	ZINC000257365802	359945837	/nfs/dbraw/zinc/94/58/37/359945837.db2.gz	OTAKOOIBMYMHGI-JQWIXIFHSA-N	1	0	276.344	1.585	50	0		CDAARO
CCC[C@@H]([NH3+])c1cn(Cc2cnc(C)s2)nn1	ZINC000229970557	360205401	/nfs/dbraw/zinc/20/54/01/360205401.db2.gz	CCGLPIHXRZTQIP-SNVBAGLBSA-N	1	0	251.359	1.891	50	0		CDAARO
Cc1cnccc1CCNC(=O)N1CC[C@@H](C[NH+](C)C)C1	ZINC000130455869	360615243	/nfs/dbraw/zinc/61/52/43/360615243.db2.gz	HZENLQCWQSVPNG-AWEZNQCLSA-N	1	0	290.411	1.526	50	0		CDAARO
Cc1nccn1[C@H](C)C(=O)NCC[NH+]1CCCCCC1	ZINC000426571531	360684186	/nfs/dbraw/zinc/68/41/86/360684186.db2.gz	ARMJSHOPROFZIJ-CYBMUJFWSA-N	1	0	278.400	1.745	50	0		CDAARO
CC[N@@H+]1CCC[C@](C)(C(=O)NCCc2cc[nH]n2)C1	ZINC000426727313	360699842	/nfs/dbraw/zinc/69/98/42/360699842.db2.gz	CJQRMKWHALAICS-AWEZNQCLSA-N	1	0	264.373	1.190	50	0		CDAARO
CCC[C@H]([NH3+])C(=O)N1CCC[C@@H]1CN1C[C@@H](C)O[C@H](C)C1	ZINC000299740097	200851670	/nfs/dbraw/zinc/85/16/70/200851670.db2.gz	VQNUWUXIESAUJJ-TUVASFSCSA-N	1	0	297.443	1.214	50	0		CDAARO
Cc1cccc(C)c1NC(=O)NC[C@]1(O)CC[NH2+]C1	ZINC000299757707	200859348	/nfs/dbraw/zinc/85/93/48/200859348.db2.gz	AMNUCNACKJZTKD-AWEZNQCLSA-N	1	0	263.341	1.149	50	0		CDAARO
C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NS(=O)(=O)C1CC1	ZINC000189150264	361255202	/nfs/dbraw/zinc/25/52/02/361255202.db2.gz	RCRFTSJBSAQOJU-GHMZBOCLSA-N	1	0	260.403	1.189	50	0		CDAARO
C[C@H]1CN(Cc2cncs2)CC[N@@H+]1CC(C)(C)O	ZINC000188888129	189516780	/nfs/dbraw/zinc/51/67/80/189516780.db2.gz	HUBQMJXAXHABDM-NSHDSACASA-N	1	0	269.414	1.420	50	0		CDAARO
COc1ccccc1/C=C1/SC(=O)N(CC[NH3+])C1=O	ZINC000002584105	364589864	/nfs/dbraw/zinc/58/98/64/364589864.db2.gz	NSCDHFLVIQHIHK-DHZHZOJOSA-N	1	0	278.333	1.690	50	0		CDAARO
C[C@H](O)C(=O)N1CCC[N@H+](Cc2ccccc2)C[C@@H]1C	ZINC000270769757	364748984	/nfs/dbraw/zinc/74/89/84/364748984.db2.gz	HNSYUBGJGSYOJN-KBPBESRZSA-N	1	0	276.380	1.490	50	0		CDAARO
COCC[NH2+]CC(=O)N1CCc2ccccc2[C@@H]1C	ZINC000034928751	364995456	/nfs/dbraw/zinc/99/54/56/364995456.db2.gz	JTJWLTQJRXRJLQ-LBPRGKRZSA-N	1	0	262.353	1.368	50	0		CDAARO
C[C@H](Cc1cccs1)[N@H+](C)CCN1C(=O)CCC1=O	ZINC000089904278	366963733	/nfs/dbraw/zinc/96/37/33/366963733.db2.gz	IZBSYZUSNXMLDB-LLVKDONJSA-N	1	0	280.393	1.760	50	0		CDAARO
CCCC[NH2+][C@H]1CS(=O)(=O)C[C@@H]1N1CCCCC1	ZINC000089954769	366982310	/nfs/dbraw/zinc/98/23/10/366982310.db2.gz	BQAZSENWMDYWCG-STQMWFEESA-N	1	0	274.430	1.028	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)[C@@H]1COc2ccccc21	ZINC000122613959	367126282	/nfs/dbraw/zinc/12/62/82/367126282.db2.gz	VSQNQLAKQUGORK-DGCLKSJQSA-N	1	0	260.337	1.373	50	0		CDAARO
CC(C)C[C@H]([NH3+])C(=O)Nc1ccc(-n2cncn2)cc1	ZINC000037764825	370084410	/nfs/dbraw/zinc/08/44/10/370084410.db2.gz	YWPKDYBTSBKMJP-ZDUSSCGKSA-N	1	0	273.340	1.579	50	0		CDAARO
CC1CC[NH+](Cc2cc(=O)n3ccsc3n2)CC1	ZINC000003538728	370087146	/nfs/dbraw/zinc/08/71/46/370087146.db2.gz	XFMSMLRPVGIHCH-UHFFFAOYSA-N	1	0	263.366	1.988	50	0		CDAARO
Cc1nnc([C@H](C)NC[C@]2(O)CCC[N@@H+]3CCCC[C@@H]32)[nH]1	ZINC000063884844	371049244	/nfs/dbraw/zinc/04/92/44/371049244.db2.gz	JAFYYKKDPZOQEN-NJZAAPMLSA-N	1	0	293.415	1.143	50	0		CDAARO
COCC[N@@H+]1CCN(Cc2ccc3c[nH]nc3c2)C[C@H]1C	ZINC000179509471	372285799	/nfs/dbraw/zinc/28/57/99/372285799.db2.gz	WKTRUTXYJLGOSV-CYBMUJFWSA-N	1	0	288.395	1.715	50	0		CDAARO
O=S(=O)(Cc1ccccc1)N1CC[C@@H]2[NH2+]CCC[C@@H]2C1	ZINC000299788282	372761281	/nfs/dbraw/zinc/76/12/81/372761281.db2.gz	TZEGEJCWINGJHM-CABCVRRESA-N	1	0	294.420	1.590	50	0		CDAARO
Cc1ccc(COC[C@H](O)C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1	ZINC000222459620	373006865	/nfs/dbraw/zinc/00/68/65/373006865.db2.gz	NAFHMESIBRXAPD-YQQAZPJKSA-N	1	0	293.407	1.982	50	0		CDAARO
C[C@H]1C[N@@H+](C2CCN(c3cnccn3)CC2)CCO1	ZINC000253418796	373728419	/nfs/dbraw/zinc/72/84/19/373728419.db2.gz	HOECEYPPJZQOOC-LBPRGKRZSA-N	1	0	262.357	1.166	50	0		CDAARO
O=S(=O)(NCC[NH2+]C1CCCCCC1)C1CC1	ZINC000130127586	374365383	/nfs/dbraw/zinc/36/53/83/374365383.db2.gz	SBLFQHSIVHQDOD-UHFFFAOYSA-N	1	0	260.403	1.381	50	0		CDAARO
C[N@H+](CCN1CCOCC1)Cc1ccc2cc[nH]c2c1	ZINC000019741018	374782771	/nfs/dbraw/zinc/78/27/71/374782771.db2.gz	NCZJJBQLPBLAFU-UHFFFAOYSA-N	1	0	273.380	1.932	50	0		CDAARO
CCOC(=O)[C@@H](CC)N1CCC(c2cnn(C)c2)CC1	ZINC000266510154	374870878	/nfs/dbraw/zinc/87/08/78/374870878.db2.gz	DETLGVLPBUCFHQ-CQSZACIVSA-N	1	0	279.384	1.941	50	0		CDAARO
CCCC[N@H+](C)CCNC(=O)N1CCO[C@H](C)[C@@H]1C	ZINC000095422003	374923788	/nfs/dbraw/zinc/92/37/88/374923788.db2.gz	PDAJBIUDMKJSQW-QWHCGFSZSA-N	1	0	271.405	1.537	50	0		CDAARO
CC[C@H](NC(=O)NC1CC[NH+](CC)CC1)[C@@H]1CCCO1	ZINC000095440300	374942323	/nfs/dbraw/zinc/94/23/23/374942323.db2.gz	WXKPYXGLTFHHGC-KBPBESRZSA-N	1	0	283.416	1.728	50	0		CDAARO
CCOCC[N@@H+]1CCC[C@H](CNS(=O)(=O)C(C)C)C1	ZINC000095400869	374906749	/nfs/dbraw/zinc/90/67/49/374906749.db2.gz	SSSQCLZCOLJMQH-CYBMUJFWSA-N	1	0	292.445	1.063	50	0		CDAARO
C[C@H](CCc1cccc(F)c1)[NH+]1CCN(CCO)CC1	ZINC000097084193	375144979	/nfs/dbraw/zinc/14/49/79/375144979.db2.gz	JFWQMXYONCLBCT-CQSZACIVSA-N	1	0	280.387	1.757	50	0		CDAARO
Cn1cc(C(=O)NCCN2CCc3ccccc3C2)cn1	ZINC000031338866	375780675	/nfs/dbraw/zinc/78/06/75/375780675.db2.gz	AJNSAMHVXYLMAQ-UHFFFAOYSA-N	1	0	284.363	1.208	50	0		CDAARO
COc1cccc(NC(=O)CN2CC[N@@H+]3CCC[C@H]3C2)c1	ZINC000239275051	376015837	/nfs/dbraw/zinc/01/58/37/376015837.db2.gz	BCYPZJVAKVYPNN-AWEZNQCLSA-N	1	0	289.379	1.414	50	0		CDAARO
CSc1ncc(CN2CC[N@@H+]3CCCC[C@H]3C2)cn1	ZINC000244724393	376023057	/nfs/dbraw/zinc/02/30/57/376023057.db2.gz	MSZPINVQSXYXPR-ZDUSSCGKSA-N	1	0	278.425	1.869	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCO[C@H](c2ccccc2Cl)C1	ZINC000129741905	377442805	/nfs/dbraw/zinc/44/28/05/377442805.db2.gz	INOOKBWGCMMTOX-OLZOCXBDSA-N	1	0	282.771	1.977	50	0		CDAARO
CCC1=NO[C@@H](C[NH+]2CCC(n3cnnc3)CC2)C1	ZINC000244742007	377796281	/nfs/dbraw/zinc/79/62/81/377796281.db2.gz	OALAVKOXXNUOLQ-CYBMUJFWSA-N	1	0	263.345	1.470	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1c(C)noc1C	ZINC000069674658	378518077	/nfs/dbraw/zinc/51/80/77/378518077.db2.gz	YRKCXEOYLVUTOM-LLVKDONJSA-N	1	0	251.330	1.506	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1	ZINC000246750761	379644269	/nfs/dbraw/zinc/64/42/69/379644269.db2.gz	ZVKPLFGNDYTKEV-ILXRZTDVSA-N	1	0	281.444	1.837	50	0		CDAARO
CC[C@H](C)OCC(=O)N(C)[C@@H]1CC[N@H+](CC)C[C@H]1C	ZINC000246748778	379644784	/nfs/dbraw/zinc/64/47/84/379644784.db2.gz	PZEIRGNHXSZMQJ-HZSPNIEDSA-N	1	0	270.417	1.990	50	0		CDAARO
O=C(NC1CCC(O)CC1)N1CCC([NH+]2CCCC2)CC1	ZINC000042961396	295608868	/nfs/dbraw/zinc/60/88/68/295608868.db2.gz	LRQJHZHXJBYJSA-UHFFFAOYSA-N	1	0	295.427	1.560	50	0		CDAARO
CC(C)Cc1cc(C(=O)N[C@@H]2CC[C@@H]([NH3+])C2)n(C)n1	ZINC000071754601	256878684	/nfs/dbraw/zinc/87/86/84/256878684.db2.gz	HLYNXBZRBLUIQU-GHMZBOCLSA-N	1	0	264.373	1.228	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)c1ccc(F)cc1	ZINC000095431211	184981583	/nfs/dbraw/zinc/98/15/83/184981583.db2.gz	DIWUSCPYAHOMFA-UHFFFAOYSA-N	1	0	274.361	1.622	50	0		CDAARO
CCc1ocnc1C(=O)OC[C@H]1C[N@H+](CC(C)C)CCO1	ZINC000096420382	390513988	/nfs/dbraw/zinc/51/39/88/390513988.db2.gz	FTRYHCYICSRLAB-GFCCVEGCSA-N	1	0	296.367	1.751	50	0		CDAARO
CCNC(=O)N[C@@H]1CC[N@H+](Cc2cnc(C)s2)C[C@@H]1C	ZINC000096420279	390514224	/nfs/dbraw/zinc/51/42/24/390514224.db2.gz	LACLLWAMJGFKJS-GXFFZTMASA-N	1	0	296.440	1.981	50	0		CDAARO
Cc1ccc(CC2SC(NC(N)=[NH2+])=NC2=O)cc1	ZINC000084460070	390853653	/nfs/dbraw/zinc/85/36/53/390853653.db2.gz	NNOYQGOHZDCZFF-SECBINFHSA-N	1	0	262.338	1.019	50	0		CDAARO
CCc1ccc(CN2CC[NH+](C3CCOCC3)CC2)nc1	ZINC000215573749	390995879	/nfs/dbraw/zinc/99/58/79/390995879.db2.gz	ILSYYQFDWUAUQT-UHFFFAOYSA-N	1	0	289.423	1.941	50	0		CDAARO
C[NH+](C)CC(=O)NC1(Cc2cccc(F)c2)CCC1	ZINC000188886716	391057832	/nfs/dbraw/zinc/05/78/32/391057832.db2.gz	HHDCUUAXPLKIQT-UHFFFAOYSA-N	1	0	264.344	1.969	50	0		CDAARO
C[C@@H](C(=O)NC1CCC(C)CC1)[N@@H+]1C[C@@H](C)[C@H](C(N)=O)C1	ZINC000408046762	391156556	/nfs/dbraw/zinc/15/65/56/391156556.db2.gz	DLRBKIMNHLXFPN-OONHEIRLSA-N	1	0	295.427	1.123	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)[C@H]2CCOc3ccccc32)C1	ZINC000104201380	391496039	/nfs/dbraw/zinc/49/60/39/391496039.db2.gz	IRKBBIUKQDYPGS-YPMHNXCESA-N	1	0	260.337	1.360	50	0		CDAARO
O=S(=O)(c1ccc(Br)cc1)[C@@H]1CC[NH2+]C1	ZINC000071646223	296467619	/nfs/dbraw/zinc/46/76/19/296467619.db2.gz	DKBNOAFRMXGKST-SNVBAGLBSA-N	1	0	290.182	1.585	50	0		CDAARO
Cc1ccccc1[C@H](O)CNC(=O)[C@@H]([NH3+])C(C)(C)C	ZINC000237673869	131051975	/nfs/dbraw/zinc/05/19/75/131051975.db2.gz	LNVILWAFUMSOHQ-CHWSQXEVSA-N	1	0	264.369	1.518	50	0		CDAARO
CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)[C@H]1CCC[NH2+]C1	ZINC000246755488	131096778	/nfs/dbraw/zinc/09/67/78/131096778.db2.gz	PUWPONPSXPYXNB-MELADBBJSA-N	1	0	282.428	1.944	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](C(=O)N2CCCC[C@H]2c2cn[nH]c2)C1	ZINC000262653565	131248376	/nfs/dbraw/zinc/24/83/76/131248376.db2.gz	BCYWSHSDIRJCOM-RTXFEEFZSA-N	1	0	262.357	1.591	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)N(C)Cc1cc(C)ccc1OC	ZINC000007691810	392872844	/nfs/dbraw/zinc/87/28/44/392872844.db2.gz	FZMOPIKHQVLMAZ-NSHDSACASA-N	1	0	293.367	1.280	50	0		CDAARO
CCc1ccc([C@@H]2C[NH2+]CCN2C(=O)c2cn(C)cn2)cc1	ZINC000285897387	392936402	/nfs/dbraw/zinc/93/64/02/392936402.db2.gz	CSEZKYKDNAHDAG-INIZCTEOSA-N	1	0	298.390	1.769	50	0		CDAARO
CN(C(=O)C1(c2ccccc2F)CC1)[C@H]1CC[NH2+]C1	ZINC000269149339	132121361	/nfs/dbraw/zinc/12/13/61/132121361.db2.gz	MJDRWKFIDVBSAY-NSHDSACASA-N	1	0	262.328	1.678	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)[C@@H]2Cc3cc(Cl)ccc3O2)C1	ZINC000269171702	132124800	/nfs/dbraw/zinc/12/48/00/132124800.db2.gz	VHGFLNGIVDEPJT-RNCFNFMXSA-N	1	0	280.755	1.451	50	0		CDAARO
COc1ccccc1[C@@H]1C[NH2+]CCN1Cc1c[nH]nc1C	ZINC000261604988	140361959	/nfs/dbraw/zinc/36/19/59/140361959.db2.gz	AYIJFHBAYABIMW-HNNXBMFYSA-N	1	0	286.379	1.873	50	0		CDAARO
C[C@H]1CCC[C@H]1[NH2+]Cc1cnc(N2CCOCC2)nc1	ZINC000105505303	398042199	/nfs/dbraw/zinc/04/21/99/398042199.db2.gz	DHZRXRMSZDDLFI-GXTWGEPZSA-N	1	0	276.384	1.591	50	0		CDAARO
COc1cccc(CN2CC[NH2+][C@@H](C)[C@H]2C)c1OC	ZINC000097162672	397981295	/nfs/dbraw/zinc/98/12/95/397981295.db2.gz	CMDFEYASUYJHCK-NWDGAFQWSA-N	1	0	264.369	1.886	50	0		CDAARO
COCC1(C[NH2+][C@@H](C)CN2CCOCC2)CCC1	ZINC000385677491	398117277	/nfs/dbraw/zinc/11/72/77/398117277.db2.gz	FTWBGCCEQUJYRY-ZDUSSCGKSA-N	1	0	256.390	1.113	50	0		CDAARO
CCSC[C@@H](C)[NH2+]C1CCN(S(C)(=O)=O)CC1	ZINC000067770209	286701282	/nfs/dbraw/zinc/70/12/82/286701282.db2.gz	QQZVKYCKQVEGTC-SNVBAGLBSA-N	1	0	280.459	1.142	50	0		CDAARO
CN(CC[NH2+][C@H]1CCCC(C)(C)C1)S(C)(=O)=O	ZINC000067739588	289675008	/nfs/dbraw/zinc/67/50/08/289675008.db2.gz	HIJBVWJQEDNTPA-NSHDSACASA-N	1	0	262.419	1.436	50	0		CDAARO
COc1cccc2[nH]c(C(=O)NCC[NH+](C)C)cc21	ZINC000005271358	170081594	/nfs/dbraw/zinc/08/15/94/170081594.db2.gz	MGXJLNFAZZGBBW-UHFFFAOYSA-N	1	0	261.325	1.468	50	0		CDAARO
C[NH+](C)CCCNC(=O)Cc1cn2ccsc2n1	ZINC000006343600	170194420	/nfs/dbraw/zinc/19/44/20/170194420.db2.gz	SWQUHPMCIWNYRE-UHFFFAOYSA-N	1	0	266.370	1.006	50	0		CDAARO
CCOc1c(C[NH2+][C@@H](CC)CO)cccc1OC	ZINC000008326388	170331434	/nfs/dbraw/zinc/33/14/34/170331434.db2.gz	SHVQUJPLFJVUIO-LBPRGKRZSA-N	1	0	253.342	1.954	50	0		CDAARO
CC[NH+](CC)CCNC(=O)C(=O)Nc1ccc(Cl)cn1	ZINC000009306494	170371066	/nfs/dbraw/zinc/37/10/66/170371066.db2.gz	YJBMYXFIVALMOF-UHFFFAOYSA-N	1	0	298.774	1.132	50	0		CDAARO
CC[NH+]1CCC(NC(=O)c2ccc3c(c2)OCO3)CC1	ZINC000016603900	170704354	/nfs/dbraw/zinc/70/43/54/170704354.db2.gz	IWFRENGMLQLOIZ-UHFFFAOYSA-N	1	0	276.336	1.629	50	0		CDAARO
C[NH2+]C[C@@H](c1ccc(OC)cc1)N1CCOCC1	ZINC000019862047	170898808	/nfs/dbraw/zinc/89/88/08/170898808.db2.gz	GHZJFSPZQRGQBT-AWEZNQCLSA-N	1	0	250.342	1.288	50	0		CDAARO
CC[NH+]1CCN(Cc2nnc(-c3ccccc3)o2)CC1	ZINC000020589564	171261007	/nfs/dbraw/zinc/26/10/07/171261007.db2.gz	YVELLIIQHDVYRJ-UHFFFAOYSA-N	1	0	272.352	1.874	50	0		CDAARO
C[NH+]1CCN(CCCNC(=O)c2ccccc2Cl)CC1	ZINC000020818918	171273239	/nfs/dbraw/zinc/27/32/39/171273239.db2.gz	YVVOHPGGQLHTJT-UHFFFAOYSA-N	1	0	295.814	1.707	50	0		CDAARO
CCn1ccnc1CN1CC[N@H+](CC(C)C)[C@@H](CCO)C1	ZINC000020906051	171278945	/nfs/dbraw/zinc/27/89/45/171278945.db2.gz	QJDSGPARLBCLON-HNNXBMFYSA-N	1	0	294.443	1.428	50	0		CDAARO
COCCCNC(=O)[C@H](C)[NH2+][C@H]1CCCC[C@H]1C	ZINC000034938541	171898145	/nfs/dbraw/zinc/89/81/45/171898145.db2.gz	RIQBSKGFCAYSLS-AGIUHOORSA-N	1	0	256.390	1.696	50	0		CDAARO
CC[C@H](CO)[NH2+]Cc1cc(OC)c2c(c1)OCCO2	ZINC000037388191	173171602	/nfs/dbraw/zinc/17/16/02/173171602.db2.gz	WUSXKCDTCYEPTO-LLVKDONJSA-N	1	0	267.325	1.327	50	0		CDAARO
O=C(NC[C@H]1CCC[NH2+]C1)Nc1cccc(F)c1	ZINC000038076422	174087023	/nfs/dbraw/zinc/08/70/23/174087023.db2.gz	NRJBUWGDABYNSR-JTQLQIEISA-N	1	0	251.305	1.947	50	0		CDAARO
CCOC(=O)[C@@H](C[NH+](C)C)c1ccc(OC)cc1	ZINC000044699524	175235629	/nfs/dbraw/zinc/23/56/29/175235629.db2.gz	AYXZUXPFYCNRFQ-ZDUSSCGKSA-N	1	0	251.326	1.904	50	0	in-vitro	CDAARO
CC(C)C[C@@H]([NH3+])C(=O)N1CC(Oc2ccccc2F)C1	ZINC000071415609	176160516	/nfs/dbraw/zinc/16/05/16/176160516.db2.gz	YSQHNHQEHJTXJZ-CYBMUJFWSA-N	1	0	280.343	1.789	50	0		CDAARO
Cc1n[nH]c(C)c1CC[NH+]1CCC(N2CCCC2=O)CC1	ZINC000071748128	176258707	/nfs/dbraw/zinc/25/87/07/176258707.db2.gz	MMRQFBOESGRDHH-UHFFFAOYSA-N	1	0	290.411	1.656	50	0		CDAARO
CCc1nc(C)c([C@H]2C[N@H+](C)C[C@@H]2C(=O)N2CCCC2)[nH]1	ZINC000071757269	176260950	/nfs/dbraw/zinc/26/09/50/176260950.db2.gz	GHOYVSIYVFMFRB-STQMWFEESA-N	1	0	290.411	1.548	50	0		CDAARO
O[C@@]1(C[NH+]2CCCCC2)CCN(Cc2ccncc2)C1	ZINC000077503992	177275817	/nfs/dbraw/zinc/27/58/17/177275817.db2.gz	JOUJIJHPSIEXJL-MRXNPFEDSA-N	1	0	275.396	1.504	50	0		CDAARO
Cn1ccnc1CCNC(=O)[C@H](O)c1cccc(Cl)c1	ZINC000218969772	262348413	/nfs/dbraw/zinc/34/84/13/262348413.db2.gz	WIEKSCLCBXSJKA-CYBMUJFWSA-N	1	0	293.754	1.466	50	0		CDAARO
O=C(c1ccccc1-n1cccn1)N1CCC[NH2+]CC1	ZINC000238170776	275013983	/nfs/dbraw/zinc/01/39/83/275013983.db2.gz	FQGODOXQXIBSFC-UHFFFAOYSA-N	1	0	270.336	1.308	50	0		CDAARO
CC(C)[NH2+]C[C@H](O)CN[C@@H](C)[C@H]1COc2ccccc2O1	ZINC000245380595	275656980	/nfs/dbraw/zinc/65/69/80/275656980.db2.gz	AANQMDAPDINSQM-HEHGZKQESA-N	1	0	294.395	1.163	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)N1CCc2n[nH]cc2C1	ZINC000092065913	277042976	/nfs/dbraw/zinc/04/29/76/277042976.db2.gz	OUEVAEKCDUWRBK-ZDUSSCGKSA-N	1	0	262.357	1.169	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(N2CC[C@@H]([NH3+])C2)CC1	ZINC000026896581	277180966	/nfs/dbraw/zinc/18/09/66/277180966.db2.gz	AXSZRIFILNLUSR-LLVKDONJSA-N	1	0	269.389	1.419	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)[C@@H]2CSc3ccccc3O2)C1	ZINC000299739001	277279632	/nfs/dbraw/zinc/27/96/32/277279632.db2.gz	JJVOGNINPXWDHL-AAEUAGOBSA-N	1	0	292.404	1.608	50	0		CDAARO
COC(=O)N1CCC[C@H]([NH2+][C@H]2CCN(C3CC3)C2)C1	ZINC000089401069	277334697	/nfs/dbraw/zinc/33/46/97/277334697.db2.gz	DWHZMQTVBGTBTC-RYUDHWBXSA-N	1	0	267.373	1.044	50	0		CDAARO
COc1cc(OC)c2c(c1)OC1(CC[NH2+]CC1)CC2=O	ZINC000031817194	277834582	/nfs/dbraw/zinc/83/45/82/277834582.db2.gz	VLBMMUCSGPJGJY-UHFFFAOYSA-N	1	0	277.320	1.791	50	0		CDAARO
COc1cccc2ncnc(N3CC[NH+](C)CC3)c21	ZINC000095467669	278043466	/nfs/dbraw/zinc/04/34/66/278043466.db2.gz	FAZPRZRSTBLMBH-UHFFFAOYSA-N	1	0	258.325	1.390	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(N2CC[NH2+]CC2)CC1	ZINC000019851050	278382298	/nfs/dbraw/zinc/38/22/98/278382298.db2.gz	XMGAKAOAPIZUJG-UHFFFAOYSA-N	1	0	269.389	1.291	50	0		CDAARO
CCOCCN(CC)C(=O)[C@H]1CCCCC[C@@H]1[NH3+]	ZINC000094753871	279698425	/nfs/dbraw/zinc/69/84/25/279698425.db2.gz	IFNCCYJLTLHBSL-STQMWFEESA-N	1	0	256.390	1.779	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)[C@H]1SCCc2ccccc21	ZINC000126280603	279907319	/nfs/dbraw/zinc/90/73/19/279907319.db2.gz	INPAUQBVDAUMPN-FZMZJTMJSA-N	1	0	276.405	1.837	50	0		CDAARO
O=C1NCCC[C@]12CC[N@@H+](C1Cc3ccccc3C1)C2	ZINC000091713418	280288225	/nfs/dbraw/zinc/28/82/25/280288225.db2.gz	ZSEBFXMVGPVQJN-QGZVFWFLSA-N	1	0	270.376	1.756	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2COC[C@@H]2[NH+]2CCCC2)c(C)n1C	ZINC000299780191	280363508	/nfs/dbraw/zinc/36/35/08/280363508.db2.gz	AKZHHCXYJCAGEQ-GJZGRUSLSA-N	1	0	291.395	1.235	50	0		CDAARO
C[C@@H]1COC[C@@H](C)N1C(=O)c1ccc2c(c1)CC[NH2+]CC2	ZINC000276719677	288373938	/nfs/dbraw/zinc/37/39/38/288373938.db2.gz	PRINLSXHUWTNAV-CHWSQXEVSA-N	1	0	288.391	1.624	50	0		CDAARO
CN(C(=O)/C=C\c1c(F)cccc1F)[C@H]1CC[NH2+]C1	ZINC000255772215	289386527	/nfs/dbraw/zinc/38/65/27/289386527.db2.gz	NGDGWNCYBZPCJT-OMMCCPJFSA-N	1	0	266.291	1.798	50	0		CDAARO
CS(=O)(=O)NCC[NH+]1CCC2(CCCC2)CC1	ZINC000098012645	295527224	/nfs/dbraw/zinc/52/72/24/295527224.db2.gz	QJNRSDPGPSQYAB-UHFFFAOYSA-N	1	0	260.403	1.192	50	0		CDAARO
COC1(C[NH2+]Cc2cnn3ccccc23)CCOCC1	ZINC000178438018	315954689	/nfs/dbraw/zinc/95/46/89/315954689.db2.gz	BPGYLTSLSVARHD-UHFFFAOYSA-N	1	0	275.352	1.620	50	0		CDAARO
Nc1nc(NCCCOC2CCCCC2)cc2nncn21	ZINC000534585464	328314897	/nfs/dbraw/zinc/31/48/97/328314897.db2.gz	YSMGOCZBBXAISY-UHFFFAOYSA-N	1	0	290.371	1.688	50	0		CDAARO
[NH3+]C[C@@H]1CCN(CC(=O)NC2CCCCCCC2)C1	ZINC000534587810	328316411	/nfs/dbraw/zinc/31/64/11/328316411.db2.gz	PEIHNSMIUIUNMM-ZDUSSCGKSA-N	1	0	267.417	1.496	50	0		CDAARO
O=C(NCCc1c[nH]cn1)c1cc(C2CC[NH2+]CC2)ccn1	ZINC000534588240	328316456	/nfs/dbraw/zinc/31/64/56/328316456.db2.gz	KFYOTKZBIBTHLE-UHFFFAOYSA-N	1	0	299.378	1.244	50	0		CDAARO
CC[C@@H](NC(=O)C[N@H+](C)C(C)C)c1ncnn1CC	ZINC000534646504	328329673	/nfs/dbraw/zinc/32/96/73/328329673.db2.gz	QURMQEVZMKJFBN-LLVKDONJSA-N	1	0	267.377	1.206	50	0		CDAARO
CC(C)n1ccnc1CNC(=O)CCCn1cccn1	ZINC000534634854	328333293	/nfs/dbraw/zinc/33/32/93/328333293.db2.gz	VMDCCZDYSRBLPS-UHFFFAOYSA-N	1	0	275.356	1.757	50	0		CDAARO
CC[N@H+](C)C1(CNC(=O)C2(CO)CC2)CCCC1	ZINC000534647898	328342974	/nfs/dbraw/zinc/34/29/74/328342974.db2.gz	JLMFCHFSYDKNEJ-UHFFFAOYSA-N	1	0	254.374	1.140	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2csc(N)n2)CCCCCC1	ZINC000534669399	328346730	/nfs/dbraw/zinc/34/67/30/328346730.db2.gz	BHPJIOBSJRTXRI-UHFFFAOYSA-N	1	0	296.440	1.940	50	0		CDAARO
C[C@H]([NH2+][C@H]1CCCN(c2ccn(C)n2)C1=O)[C@@H]1CCCO1	ZINC000195560770	323571631	/nfs/dbraw/zinc/57/16/31/323571631.db2.gz	PKDVEXAPQXECKH-AVGNSLFASA-N	1	0	292.383	1.073	50	0		CDAARO
C[NH+]1CCC(OCCCn2ccnc2[C@@H]2CCOC2)CC1	ZINC000077420790	327132162	/nfs/dbraw/zinc/13/21/62/327132162.db2.gz	OKEJRSQJMCUDOT-CQSZACIVSA-N	1	0	293.411	1.888	50	0		CDAARO
COCC[C@H]1CCC[N@H+](CCn2cnnc2C)C1	ZINC000670455479	483031063	/nfs/dbraw/zinc/03/10/63/483031063.db2.gz	HUMZESFHUPGYQX-CYBMUJFWSA-N	1	0	252.362	1.335	50	0		CDAARO
Cc1cc(CNC(=O)[C@@H](C)C[NH+]2CCOCC2)cnc1C	ZINC000670456088	483032100	/nfs/dbraw/zinc/03/21/00/483032100.db2.gz	ZOISPLOVRAJCSQ-ZDUSSCGKSA-N	1	0	291.395	1.283	50	0		CDAARO
O=C(C1CCC1)N1CCC[N@H+](CC[C@@H]2CCOC2)CC1	ZINC000670460664	483042210	/nfs/dbraw/zinc/04/22/10/483042210.db2.gz	OIYLKOASCYZGMQ-CQSZACIVSA-N	1	0	280.412	1.747	50	0		CDAARO
C[NH+](C)[C@@H]1CCC[C@H]1NC(=O)Cn1nc2ccccc2n1	ZINC000670461041	483046328	/nfs/dbraw/zinc/04/63/28/483046328.db2.gz	SKHCCRAAXFRIJY-ZIAGYGMSSA-N	1	0	287.367	1.030	50	0		CDAARO
COc1nc(N(C)CCCC[NH+]2CCOCC2)ncc1F	ZINC000670465637	483055965	/nfs/dbraw/zinc/05/59/65/483055965.db2.gz	DWLSIDISGQXUCD-UHFFFAOYSA-N	1	0	298.362	1.173	50	0		CDAARO
Cc1nncn1CCN1CCC[N@@H+](C(C)C)CC1	ZINC000670469394	483063279	/nfs/dbraw/zinc/06/32/79/483063279.db2.gz	XVPWMADXWKGPEK-UHFFFAOYSA-N	1	0	251.378	1.003	50	0		CDAARO
Cc1cnn(C[C@H]2CCCN2C(=O)C[NH2+]C(C)(C)C)c1	ZINC000084265162	483269548	/nfs/dbraw/zinc/26/95/48/483269548.db2.gz	QTQRAUMHSJUIJS-CYBMUJFWSA-N	1	0	278.400	1.571	50	0		CDAARO
O=C(NC1CC1)[C@H]1CCC[N@H+](C[C@@H]2CCCCO2)C1	ZINC000084544097	483286618	/nfs/dbraw/zinc/28/66/18/483286618.db2.gz	WYMVRWQDRNDPBI-JSGCOSHPSA-N	1	0	266.385	1.546	50	0		CDAARO
CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1[NH2+]Cc1cccn1C	ZINC000084736388	483321488	/nfs/dbraw/zinc/32/14/88/483321488.db2.gz	SRJCUJJWDMOGNA-OCCSQVGLSA-N	1	0	299.440	1.175	50	0		CDAARO
CC[N@H+](C)[C@H](C)C(=O)Nc1ccc2c(c1)OCO2	ZINC000084760798	483324385	/nfs/dbraw/zinc/32/43/85/483324385.db2.gz	JSZCVJKTFKDMNQ-SECBINFHSA-N	1	0	250.298	1.694	50	0		CDAARO
Fc1cc2sc(N3CC[NH2+]CC3)nc2c(F)c1	ZINC000011919936	518196030	/nfs/dbraw/zinc/19/60/30/518196030.db2.gz	ZVGLKBTWBHSASG-UHFFFAOYSA-N	1	0	255.293	1.984	50	0		CDAARO
O[C@@H]1COCC[C@H]1[NH2+]C1CCN(Cc2ccccc2)CC1	ZINC000219833231	534419363	/nfs/dbraw/zinc/41/93/63/534419363.db2.gz	BQQNTMUVGADNQL-IAGOWNOFSA-N	1	0	290.407	1.390	50	0		CDAARO
CCN(CC)C(=O)[C@@H]1C[C@@H]([NH3+])CN1CCc1ccccc1	ZINC000067982707	520531262	/nfs/dbraw/zinc/53/12/62/520531262.db2.gz	YAACWQWFLGAXBQ-CVEARBPZSA-N	1	0	289.423	1.499	50	0		CDAARO
CO[C@]1(C)C[C@@H]([N@H+](C)C[C@@H](O)Cn2cccn2)C1(C)C	ZINC000247194221	521755012	/nfs/dbraw/zinc/75/50/12/521755012.db2.gz	BVTDFVLZXCWEKV-UMVBOHGHSA-N	1	0	281.400	1.379	50	0		CDAARO
COCCN1CCC[C@]2(CC[N@H+](Cc3ccoc3)C2)C1=O	ZINC000012303186	523837285	/nfs/dbraw/zinc/83/72/85/523837285.db2.gz	GWSDUQJXXPFGRX-MRXNPFEDSA-N	1	0	292.379	1.741	50	0		CDAARO
CC[NH2+]CCNC(=O)/C(C)=C/c1ccc(F)cc1	ZINC000096482546	528292073	/nfs/dbraw/zinc/29/20/73/528292073.db2.gz	XHNSYQKNPGVNQT-ZHACJKMWSA-N	1	0	250.317	1.955	50	0		CDAARO
CCn1cc(C2CCN(C(=O)[C@H]([NH3+])C(C)C)CC2)cn1	ZINC000269245091	536035066	/nfs/dbraw/zinc/03/50/66/536035066.db2.gz	LSLOYQIDNDWUMT-CQSZACIVSA-N	1	0	278.400	1.592	50	0		CDAARO
COC[C@@]1(C(=O)N2CCc3ccccc32)CC[NH2+]C1	ZINC000261592565	536813956	/nfs/dbraw/zinc/81/39/56/536813956.db2.gz	MKJGCAGBTFZCBE-OAHLLOKOSA-N	1	0	260.337	1.202	50	0		CDAARO
CC(C)c1nccn1CC(=O)NC(=O)NCc1ccco1	ZINC000097053487	567903517	/nfs/dbraw/zinc/90/35/17/567903517.db2.gz	WYBSLTHGKFSVIU-UHFFFAOYSA-N	1	0	290.323	1.626	50	0		CDAARO
CC(C)[NH2+]C1CCN(C[C@H](O)C(F)(F)F)CC1	ZINC000097141817	567904953	/nfs/dbraw/zinc/90/49/53/567904953.db2.gz	WHWBPOBTWPQBDS-JTQLQIEISA-N	1	0	254.296	1.372	50	0		CDAARO
COC1CC[NH+](CCNC(=O)c2ccc(O)cc2F)CC1	ZINC000097164357	567905298	/nfs/dbraw/zinc/90/52/98/567905298.db2.gz	IXSQALXZMZTPIG-UHFFFAOYSA-N	1	0	296.342	1.372	50	0		CDAARO
C[C@@H]1C[C@H](N)C[NH2+][C@@H]1[C@H]1CC[C@H](C(F)(F)F)NC1	ZINC000757213054	577036187	/nfs/dbraw/zinc/03/61/87/577036187.db2.gz	NNGYGHVINMQSEQ-KJPMQGKISA-N	1	0	265.323	1.242	50	0		CDAARO
C[C@@H]1C[C@H]([C@@H]2CC[C@H](C(F)(F)F)NC2)NC[C@@H]1[NH3+]	ZINC000757210042	577036204	/nfs/dbraw/zinc/03/62/04/577036204.db2.gz	HQFSEQAUFRVGQX-KAMPLNKDSA-N	1	0	265.323	1.242	50	0		CDAARO
CC1(NC(=O)[C@H]2CCC[N@H+](CC(N)=O)C2)CCCCCC1	ZINC000952981684	614918480	/nfs/dbraw/zinc/91/84/80/614918480.db2.gz	OMCVLZBIUDYEOE-ZDUSSCGKSA-N	1	0	295.427	1.413	50	0		CDAARO
CCCCN1CCN(C(=O)[C@H](CC)[N@H+](C)CC)CC1	ZINC000952969414	614996009	/nfs/dbraw/zinc/99/60/09/614996009.db2.gz	NESNQMMAKWNUND-AWEZNQCLSA-N	1	0	269.433	1.661	50	0		CDAARO
CCc1nccc(C[NH2+]Cc2cccc(CO)c2)n1	ZINC000952988604	615776191	/nfs/dbraw/zinc/77/61/91/615776191.db2.gz	PCQSLUHFIWGIPJ-UHFFFAOYSA-N	1	0	257.337	1.821	50	0		CDAARO
[NH3+]C1(CNC(=O)c2cc(-c3ccccc3O)n[nH]2)CCC1	ZINC000888096189	617759456	/nfs/dbraw/zinc/75/94/56/617759456.db2.gz	WZTXTNCILFOTNO-UHFFFAOYSA-N	1	0	286.335	1.394	50	0		CDAARO
OC[C@@]12C[N@H+](Cc3cccc4nonc43)C[C@@H]1COCC2	ZINC001772706526	1159441412	/nfs/dbraw/zinc/44/14/12/1159441412.db2.gz	SOYMWGZNOSMCEP-IUODEOHRSA-N	1	0	289.335	1.054	50	0		CDAARO
CCN(Cc1ccncc1)C1CN(C(=O)NCC(C)C)C1	ZINC000581775933	1159457982	/nfs/dbraw/zinc/45/79/82/1159457982.db2.gz	CFAXINUSHDCQNE-UHFFFAOYSA-N	1	0	290.411	1.953	50	0		CDAARO
[NH3+]CC(=O)N1CCC2(CC1)OCCc1sccc12	ZINC001704297305	1177678719	/nfs/dbraw/zinc/67/87/19/1177678719.db2.gz	LVEQVVVSUQIMJT-UHFFFAOYSA-N	1	0	266.366	1.097	50	0		CDAARO
Cc1cccc(CC[N@@H+]2C[C@H](O)[C@H](Cc3ccncc3)C2)n1	ZINC001704342343	1177694757	/nfs/dbraw/zinc/69/47/57/1177694757.db2.gz	NHEHADWNICHWDB-AEFFLSMTSA-N	1	0	297.402	1.863	50	0		CDAARO
Cc1cc(C(=O)NCCNc2cc[nH+]cc2C)c(C)n1C	ZINC001704352281	1177698408	/nfs/dbraw/zinc/69/84/08/1177698408.db2.gz	ATUOCYACEXDBOK-UHFFFAOYSA-N	1	0	286.379	1.609	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@@H](C)CN1c1cc(Cl)nc(N)n1	ZINC000108368347	719144513	/nfs/dbraw/zinc/14/45/13/719144513.db2.gz	AUBAJSJDJICIOF-JGVFFNPUSA-N	1	0	255.753	1.241	50	0		CDAARO
O[C@@]1(c2ccccc2)CC[N@H+](CCCCn2cncn2)C1	ZINC000019608009	754823657	/nfs/dbraw/zinc/82/36/57/754823657.db2.gz	ZXTCKJLQYBOQIJ-INIZCTEOSA-N	1	0	286.379	1.652	50	0		CDAARO
C[C@@H](C[N@H+](C)Cc1ccc2c(c1)CCO2)N1CCOCC1	ZINC000065509235	755156410	/nfs/dbraw/zinc/15/64/10/755156410.db2.gz	JZKABUDMFKIMSN-AWEZNQCLSA-N	1	0	290.407	1.774	50	0		CDAARO
CC[NH+](CC)[C@H]1CCN(C(=O)c2c(C)[nH]c(C)cc2=O)C1	ZINC000426746114	755309260	/nfs/dbraw/zinc/30/92/60/755309260.db2.gz	OMDYFYSBAGKYOS-ZDUSSCGKSA-N	1	0	291.395	1.548	50	0		CDAARO
Nc1cc(-c2cc3c(c(F)c2)O[C@H](C[NH3+])C3)ccn1	ZINC000067789491	756830854	/nfs/dbraw/zinc/83/08/54/756830854.db2.gz	OCKAPYWOAZXUPL-NSHDSACASA-N	1	0	259.284	1.732	50	0		CDAARO
C[C@H](CN1CCc2ccccc2C1)[NH2+]Cc1ncc[nH]1	ZINC000952989593	756867248	/nfs/dbraw/zinc/86/72/48/756867248.db2.gz	WLGGEECVGJUUGF-CYBMUJFWSA-N	1	0	270.380	1.946	50	0		CDAARO
CCc1cc(N(C)Cc2nonc2C)nc(N(C)C)[nH+]1	ZINC000065466151	758225838	/nfs/dbraw/zinc/22/58/38/758225838.db2.gz	UJZIVARGZCCXLM-UHFFFAOYSA-N	1	0	276.344	1.433	50	0		CDAARO
O[C@@H]1C[NH2+]CC[C@H]1Nc1ncc(Cl)cc1C(F)(F)F	ZINC000077485953	758384342	/nfs/dbraw/zinc/38/43/42/758384342.db2.gz	BNVAHCHWDAKQDE-RKDXNWHRSA-N	1	0	295.692	1.889	50	0		CDAARO
CCOC(=O)[C@@]1(Cc2ccccc2)CCC[N@H+](CCO)C1	ZINC000012578017	758752785	/nfs/dbraw/zinc/75/27/85/758752785.db2.gz	YHGWPDTZYMDCRM-QGZVFWFLSA-N	1	0	291.391	1.867	50	0		CDAARO
CC(C)[N@H+](C)C[C@@H](C)C(=O)NCc1csc(N)n1	ZINC000820636550	925540050	/nfs/dbraw/zinc/54/00/50/925540050.db2.gz	BAYQKZGPQQAZAS-SECBINFHSA-N	1	0	270.402	1.318	50	0		CDAARO
CCC1(CC)CC[N@@H+]([C@@H](C)CNS(=O)(=O)CC)C1	ZINC000822677180	925645981	/nfs/dbraw/zinc/64/59/81/925645981.db2.gz	HMOQBGUPMHIWCY-LBPRGKRZSA-N	1	0	276.446	1.826	50	0		CDAARO
COc1ncc(CN2CCC[C@H]([NH+](C)C)CC2)cn1	ZINC000824852023	925839522	/nfs/dbraw/zinc/83/95/22/925839522.db2.gz	NRLPIHNPKKFBHO-ZDUSSCGKSA-N	1	0	264.373	1.401	50	0		CDAARO
COCCC(=O)NCCn1c(C)c[nH+]c1C1CC1	ZINC000581812979	927202354	/nfs/dbraw/zinc/20/23/54/927202354.db2.gz	BLMROVSSXYSOFB-UHFFFAOYSA-N	1	0	251.330	1.222	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@H]1C(=O)NC1(CO)CCSCC1	ZINC000585120798	930992800	/nfs/dbraw/zinc/99/28/00/930992800.db2.gz	LTRSAISANGHLAB-NSHDSACASA-N	1	0	286.441	1.234	50	0		CDAARO
Cc1nc(NC[C@@H]2C[N@@H+](C)CCN2C)ccc1Cl	ZINC001506405621	975151573	/nfs/dbraw/zinc/15/15/73/975151573.db2.gz	KPHCMPLMEAXVIT-LLVKDONJSA-N	1	0	268.792	1.701	50	0		CDAARO
COCc1cc(C[NH2+][C@H]2CCN(c3ccccc3)C2)[nH]n1	ZINC001506427052	975160367	/nfs/dbraw/zinc/16/03/67/975160367.db2.gz	JZLFTJCVNKGWKF-ZDUSSCGKSA-N	1	0	286.379	1.925	50	0		CDAARO
Cc1cc(NC[C@H](O)C[NH+]2CCC(C)CC2)nc(C)n1	ZINC000096456196	230377272	/nfs/dbraw/zinc/37/72/72/230377272.db2.gz	BNMOLNJSNXHCKG-AWEZNQCLSA-N	1	0	278.400	1.598	50	0		CDAARO
COC[C@H](C)[NH2+]CC(=O)N[C@H](C)CCc1ccccc1	ZINC000002632891	230367439	/nfs/dbraw/zinc/36/74/39/230367439.db2.gz	QBNZJZNDRPVDEX-KGLIPLIRSA-N	1	0	278.396	1.748	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)c1ccsc1	ZINC000584901164	341986746	/nfs/dbraw/zinc/98/67/46/341986746.db2.gz	OEGIKBYCXQTSNH-QWRGUYRKSA-N	1	0	254.355	1.197	50	0		CDAARO
CCc1csc(CC[NH2+][C@H]2CCNC(=O)CC2)n1	ZINC000584904032	341994127	/nfs/dbraw/zinc/99/41/27/341994127.db2.gz	KAWAZDSJOFFSED-LLVKDONJSA-N	1	0	267.398	1.506	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]C[C@@H](Cc2cnn(C)c2)C(N)=O)[C@H](C)C1	ZINC000095940835	185036012	/nfs/dbraw/zinc/03/60/12/185036012.db2.gz	VTRNWUXGEIXWOT-GBOPCIDUSA-N	1	0	292.427	1.478	50	0		CDAARO
CCC[N@@H+]1CC[C@H](CNC(=O)NCc2c(C)noc2C)C1	ZINC000095955124	185042195	/nfs/dbraw/zinc/04/21/95/185042195.db2.gz	ICNKYLUZRSBEMG-CYBMUJFWSA-N	1	0	294.399	1.823	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@H]([NH2+][C@H]1CCOC1)C1CC1	ZINC000095968383	185046611	/nfs/dbraw/zinc/04/66/11/185046611.db2.gz	OPAANOLSBPJTJP-RYUDHWBXSA-N	1	0	270.373	1.668	50	0		CDAARO
Cc1ccc(NC(=O)C[N@H+]2CC[C@@H]([C@@H](C)O)C2)cc1C	ZINC000095993821	185059088	/nfs/dbraw/zinc/05/90/88/185059088.db2.gz	GEPLEIFDXSMMMT-ZIAGYGMSSA-N	1	0	276.380	1.945	50	0		CDAARO
CCc1ccc(S(=O)(=O)N[C@H]2CC[NH2+]C2)cc1CC	ZINC000095996587	185061214	/nfs/dbraw/zinc/06/12/14/185061214.db2.gz	SFAYMHDYICNREW-ZDUSSCGKSA-N	1	0	282.409	1.452	50	0		CDAARO
COC(=O)C1=NOC2(C1)CC[NH+](Cc1ccccn1)CC2	ZINC000096012848	185065818	/nfs/dbraw/zinc/06/58/18/185065818.db2.gz	CBXOEMRABBGQHC-UHFFFAOYSA-N	1	0	289.335	1.366	50	0		CDAARO
C[C@@H](c1ccncn1)[N@H+](C)CCC(=O)Nc1nccs1	ZINC000240517124	361747993	/nfs/dbraw/zinc/74/79/93/361747993.db2.gz	NVHSCKSLFOEQEF-JTQLQIEISA-N	1	0	291.380	1.955	50	0		CDAARO
CC(C)(C)[C@H](O)C[C@@H](CO)[NH2+]Cc1cnn2ccccc12	ZINC000241301041	361752312	/nfs/dbraw/zinc/75/23/12/361752312.db2.gz	LPXKIEWONAQRQE-DZGCQCFKSA-N	1	0	291.395	1.582	50	0		CDAARO
CC[N@@H+]1CC[C@@H]2[C@@H](C1)OCCN2C(=O)[C@H](C)CSC	ZINC000241316714	361752400	/nfs/dbraw/zinc/75/24/00/361752400.db2.gz	LUHUULSRFSAWEP-JHJVBQTASA-N	1	0	286.441	1.307	50	0		CDAARO
COCC1(CNC(=O)CC2CC[NH2+]CC2)CCC1	ZINC000310903883	342089780	/nfs/dbraw/zinc/08/97/80/342089780.db2.gz	BMRDYOQZVRUQOS-UHFFFAOYSA-N	1	0	254.374	1.309	50	0		CDAARO
[NH3+]CCn1cc(-c2nc(-c3cccs3)no2)nn1	ZINC000089696157	365681255	/nfs/dbraw/zinc/68/12/55/365681255.db2.gz	OTNUCGNZWUMZRM-UHFFFAOYSA-N	1	0	262.298	1.015	50	0		CDAARO
CCn1nccc1C[NH2+][C@H](C)CN1CCCC1=O	ZINC000125225623	187175382	/nfs/dbraw/zinc/17/53/82/187175382.db2.gz	OGBYNJWPVDFJGM-LLVKDONJSA-N	1	0	250.346	1.004	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1CCC(=O)NCc1cccs1	ZINC000244601897	361853669	/nfs/dbraw/zinc/85/36/69/361853669.db2.gz	DTWBGGGKCSOPLB-GFCCVEGCSA-N	1	0	281.425	1.568	50	0		CDAARO
C[N@H+](CC(=O)NCCc1cscn1)C1CCCC1	ZINC000244872939	361866600	/nfs/dbraw/zinc/86/66/00/361866600.db2.gz	WHIBDUZPVIXTKC-UHFFFAOYSA-N	1	0	267.398	1.676	50	0		CDAARO
COCCn1cncc1C[N@@H+]1CCC[C@@H](c2cc[nH]n2)C1	ZINC000244707981	361858907	/nfs/dbraw/zinc/85/89/07/361858907.db2.gz	KLHTWWDPNAMJGX-CYBMUJFWSA-N	1	0	289.383	1.632	50	0		CDAARO
O=C(OCCCn1ccccc1=O)c1ccn2c[nH+]cc2c1	ZINC000097034297	185156744	/nfs/dbraw/zinc/15/67/44/185156744.db2.gz	VTGCTKRSFWSXQN-UHFFFAOYSA-N	1	0	297.314	1.743	50	0		CDAARO
Cc1cnc(CN2CCN(c3nccs3)[C@@H](C)C2)cn1	ZINC000108075509	539037488	/nfs/dbraw/zinc/03/74/88/539037488.db2.gz	IRWRJESQPSWRDI-LBPRGKRZSA-N	1	0	289.408	1.952	50	0		CDAARO
CC(C)(C)OC(=O)[C@@H]1C[C@@H]([NH3+])[C@@H](n2cc(C3CC3)nn2)C1	ZINC000669371713	539071695	/nfs/dbraw/zinc/07/16/95/539071695.db2.gz	SGNUQEAGCSURPZ-WZRBSPASSA-N	1	0	292.383	1.776	50	0		CDAARO
[NH3+]CCn1cc(-c2cncc(Br)c2)nn1	ZINC000125200502	539083600	/nfs/dbraw/zinc/08/36/00/539083600.db2.gz	NQWXBHGAGDZHLJ-UHFFFAOYSA-N	1	0	268.118	1.061	50	0		CDAARO
COc1cc(CCC(=O)N2CC[NH2+]C[C@@H]2C)cc(OC)c1	ZINC000125809796	187200696	/nfs/dbraw/zinc/20/06/96/187200696.db2.gz	UXEPACJBQMVZEF-LBPRGKRZSA-N	1	0	292.379	1.457	50	0		CDAARO
CN1CCN(Cc2ccc(Cl)s2)[C@H](CO)C1	ZINC000585116657	362044431	/nfs/dbraw/zinc/04/44/31/362044431.db2.gz	DLXXQYFXQKTSRZ-VIFPVBQESA-N	1	0	260.790	1.510	50	0		CDAARO
CC[C@@H]1[C@@H](C(=O)Nc2ccc(C)[nH]c2=O)CC[N@@H+]1C	ZINC000585131519	362057868	/nfs/dbraw/zinc/05/78/68/362057868.db2.gz	XZNFSALCXMTRDD-CMPLNLGQSA-N	1	0	263.341	1.764	50	0		CDAARO
Cc1ncnc(N2CC[NH+](C[C@H]3CCOC3)CC2)c1C	ZINC000097642285	282225052	/nfs/dbraw/zinc/22/50/52/282225052.db2.gz	PKBCVJNFRQQRLD-CQSZACIVSA-N	1	0	276.384	1.252	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)CCCOc1ccccc1F	ZINC000126417425	187238567	/nfs/dbraw/zinc/23/85/67/187238567.db2.gz	YHCWKXOOZQWTNO-LBPRGKRZSA-N	1	0	280.343	1.805	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)COc2cc(C)ccc2C)C1	ZINC000179003257	362251032	/nfs/dbraw/zinc/25/10/32/362251032.db2.gz	DSHMTANFMSBRQX-AWEZNQCLSA-N	1	0	276.380	1.750	50	0		CDAARO
Cc1nccn1CCNC(=O)C[NH+]1CCCCCCC1	ZINC000252481631	362385899	/nfs/dbraw/zinc/38/58/99/362385899.db2.gz	CPRQJSGTQZQGTG-UHFFFAOYSA-N	1	0	278.400	1.574	50	0		CDAARO
Cc1ccc(-c2noc(CCN3CC[NH+](C)CC3)n2)cc1	ZINC000065288294	362816664	/nfs/dbraw/zinc/81/66/64/362816664.db2.gz	XHPQQLAWSHQWFY-UHFFFAOYSA-N	1	0	286.379	1.835	50	0		CDAARO
C/C(=C\c1ccccc1)C[NH2+]CC1(C(N)=O)CCOCC1	ZINC000086250798	179255910	/nfs/dbraw/zinc/25/59/10/179255910.db2.gz	ZDEQYPFYDRLTFM-SDNWHVSQSA-N	1	0	288.391	1.962	50	0		CDAARO
CN1C=C(C(=O)NCCC[NH+](C)C)C=C/C1=C/N=O	ZINC000034240815	348746468	/nfs/dbraw/zinc/74/64/68/348746468.db2.gz	GYIDKOGHDPYABU-XFXZXTDPSA-N	1	0	264.329	1.048	50	0		CDAARO
Cc1ccsc1C[N@@H+](C)CCCS(=O)(=O)N(C)C	ZINC000057871621	348849662	/nfs/dbraw/zinc/84/96/62/348849662.db2.gz	IZZSTPAMBKKSEB-UHFFFAOYSA-N	1	0	290.454	1.770	50	0		CDAARO
CN(CC1(CO)CCCC1)C(=O)C1CC[NH+](C)CC1	ZINC000584886482	349344568	/nfs/dbraw/zinc/34/45/68/349344568.db2.gz	JZPXEKLTAIPIQH-UHFFFAOYSA-N	1	0	268.401	1.339	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1C(=O)NCc1nc2cc(Cl)ccc2[nH]1	ZINC000584887386	349345935	/nfs/dbraw/zinc/34/59/35/349345935.db2.gz	FJPUYFAPSUQVOK-GFCCVEGCSA-N	1	0	292.770	1.927	50	0		CDAARO
CC[N@@H+]1CC[C@@H](CNC(=O)NCCc2csc(C)n2)C1	ZINC000089977182	179895579	/nfs/dbraw/zinc/89/55/79/179895579.db2.gz	AAFGRDYPELECER-LBPRGKRZSA-N	1	0	296.440	1.635	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN(C2CSCCSC2)C1	ZINC000584900324	349362357	/nfs/dbraw/zinc/36/23/57/349362357.db2.gz	FVZCZUTWEOSAGT-LBPRGKRZSA-N	1	0	290.498	1.345	50	0		CDAARO
CN(CCCC[NH+]1CCOCC1)c1ncccn1	ZINC000091270186	180118180	/nfs/dbraw/zinc/11/81/80/180118180.db2.gz	YJIAENBKUUOFID-UHFFFAOYSA-N	1	0	250.346	1.025	50	0		CDAARO
[NH3+][C@H]1CN(CCOc2ccc(F)cc2)C[C@@H]1C1CC1	ZINC000091616812	180208632	/nfs/dbraw/zinc/20/86/32/180208632.db2.gz	CZAAUWUGPVTQRE-CABCVRRESA-N	1	0	264.344	1.874	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@@H]1CC[C@@H]([NH3+])C1	ZINC000091545650	180186339	/nfs/dbraw/zinc/18/63/39/180186339.db2.gz	CIFTZGGGJYRGNY-NXEZZACHSA-N	1	0	253.371	1.537	50	0		CDAARO
c1cn(CC[N@@H+]2CCC[C@@H](c3nncn3C3CC3)C2)cn1	ZINC000091629828	180210381	/nfs/dbraw/zinc/21/03/81/180210381.db2.gz	USYKCAFTPZPGCZ-CYBMUJFWSA-N	1	0	286.383	1.689	50	0		CDAARO
Cc1cc(F)ccc1C(=O)N1C[C@H](CO)[C@H](C[NH+](C)C)C1	ZINC000091651547	180216945	/nfs/dbraw/zinc/21/69/45/180216945.db2.gz	NSHLZVDQVNJEIX-CHWSQXEVSA-N	1	0	294.370	1.376	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1Cc1cc(=O)c2cccc(F)c2[nH]1	ZINC000091657019	180217768	/nfs/dbraw/zinc/21/77/68/180217768.db2.gz	MLCGDEPDARVJBU-GFCCVEGCSA-N	1	0	289.354	1.980	50	0		CDAARO
Cc1c[nH+]ccc1NCCN1C[C@]2(CCOC2)CCC1=O	ZINC000091625687	180209273	/nfs/dbraw/zinc/20/92/73/180209273.db2.gz	FBBUMLSZQOHHBQ-MRXNPFEDSA-N	1	0	289.379	1.831	50	0		CDAARO
COCC[C@]1(CO)CCC[N@H+](Cc2ccncc2)C1	ZINC000091845614	180270301	/nfs/dbraw/zinc/27/03/01/180270301.db2.gz	AXABINBRAPAUBU-OAHLLOKOSA-N	1	0	264.369	1.693	50	0		CDAARO
Cc1nc(CCN(C)C(=O)CC[C@@H]2CCC[N@H+](C)C2)no1	ZINC000092045744	180310645	/nfs/dbraw/zinc/31/06/45/180310645.db2.gz	PTDBGVZTQXFKHQ-ZDUSSCGKSA-N	1	0	294.399	1.501	50	0		CDAARO
COc1ccccc1C[N@H+](C)C[C@H]1CCN(C(C)=O)C1	ZINC000092101489	180325446	/nfs/dbraw/zinc/32/54/46/180325446.db2.gz	XYYVIHHIPWABBG-CQSZACIVSA-N	1	0	276.380	1.995	50	0		CDAARO
Cc1cc(N2C[C@H](NC(=O)CO)[C@@H](C3CC3)C2)cc(C)[nH+]1	ZINC000092080725	180319018	/nfs/dbraw/zinc/31/90/18/180319018.db2.gz	QGCXZBHXTLIVTM-CABCVRRESA-N	1	0	289.379	1.022	50	0		CDAARO
C[C@H](CNC(=O)c1ccncc1)[N@@H+]1CCC[C@@H](C)C1	ZINC000106078693	186101727	/nfs/dbraw/zinc/10/17/27/186101727.db2.gz	FQNWIOPQFJSMNW-CHWSQXEVSA-N	1	0	261.369	1.932	50	0		CDAARO
Cc1ncc(CNC(=O)NC[C@H]2CCCC[N@@H+](C)C2)o1	ZINC000624193142	351474211	/nfs/dbraw/zinc/47/42/11/351474211.db2.gz	USQDSHPCHPHHQS-GFCCVEGCSA-N	1	0	280.372	1.514	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCCN1C(=O)/C=C/c1cncc(F)c1	ZINC000121981323	187008371	/nfs/dbraw/zinc/00/83/71/187008371.db2.gz	WSRBQGVYEWUSNW-CCJKYYKNSA-N	1	0	277.343	1.962	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)c1ccc(F)cc1F	ZINC000122616203	187041182	/nfs/dbraw/zinc/04/11/82/187041182.db2.gz	UTJYOXNIIFJOEL-SNVBAGLBSA-N	1	0	254.280	1.789	50	0		CDAARO
C[NH+](C)CCNC(=O)Cc1cc(-c2ccc(F)cc2)on1	ZINC000012864330	363307654	/nfs/dbraw/zinc/30/76/54/363307654.db2.gz	DJBUHSXOPMVGPE-UHFFFAOYSA-N	1	0	291.326	1.701	50	0		CDAARO
C[C@H]([NH3+])C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000121580877	366188612	/nfs/dbraw/zinc/18/86/12/366188612.db2.gz	WQYINDSPEMMTEK-UBHSHLNASA-N	1	0	262.353	1.448	50	0		CDAARO
C[N@@H+]1CCO[C@H]2CCN(c3ccncc3Cl)C[C@H]21	ZINC000285130094	283031954	/nfs/dbraw/zinc/03/19/54/283031954.db2.gz	SANOBTUFOWEENW-OLZOCXBDSA-N	1	0	267.760	1.644	50	0		CDAARO
CC1(C)NC(=[NH2+])NC(=N)N1c1ccc(Br)cc1	ZINC000000146421	355890866	/nfs/dbraw/zinc/89/08/66/355890866.db2.gz	LLRTYNPSGQWCLZ-UHFFFAOYSA-N	1	0	296.172	1.635	50	0		CDAARO
C[NH+](C)CCCOC(=O)c1ccc2c(c1)OCO2	ZINC000001819592	355952968	/nfs/dbraw/zinc/95/29/68/355952968.db2.gz	FZKYKLANNUIEKV-UHFFFAOYSA-N	1	0	251.282	1.524	50	0		CDAARO
O=C(CN1CCCCC1)N1CC(=O)Nc2ccccc21	ZINC000007752207	356106260	/nfs/dbraw/zinc/10/62/60/356106260.db2.gz	CZZLJXPBKACXPW-UHFFFAOYSA-N	1	0	273.336	1.458	50	0		CDAARO
CCOC(=O)c1cc(C[NH2+]CCc2ccncc2)on1	ZINC000012410846	356298537	/nfs/dbraw/zinc/29/85/37/356298537.db2.gz	ZXKQUHHULWEQCT-UHFFFAOYSA-N	1	0	275.308	1.579	50	0		CDAARO
C[N@H+](CCO)Cc1cc(=O)oc2cc3c(cc12)CCC3	ZINC000004353955	356312605	/nfs/dbraw/zinc/31/26/05/356312605.db2.gz	YVTKSUJWRCUHMQ-UHFFFAOYSA-N	1	0	273.332	1.706	50	0	biogenic	CDAARO
CN1CCC([N@@H+]2CCC[C@H](C(=O)NC3CCCC3)C2)CC1	ZINC000012706817	356318917	/nfs/dbraw/zinc/31/89/17/356318917.db2.gz	LVOMTRKEHLVGDJ-AWEZNQCLSA-N	1	0	293.455	1.851	50	0		CDAARO
[NH3+]CCc1c2c(c(Br)c3c1OCC3)OCC2	ZINC000013757088	356356854	/nfs/dbraw/zinc/35/68/54/356356854.db2.gz	YZDFADGMVOSVIX-UHFFFAOYSA-N	1	0	284.153	1.820	50	0	in-vitro	CDAARO
Cc1ncc2c(c1-c1noc(-c3cc[nH]n3)n1)CC[NH2+]C2	ZINC000020451209	358503113	/nfs/dbraw/zinc/50/31/13/358503113.db2.gz	ISEHYJJVSPAQRE-UHFFFAOYSA-N	1	0	282.307	1.476	50	0		CDAARO
COCC[NH2+]CC[C@@H]1CCC(=O)N1CCC(C)C	ZINC000014967197	356402171	/nfs/dbraw/zinc/40/21/71/356402171.db2.gz	AJJUPKDVXIWFEI-ZDUSSCGKSA-N	1	0	256.390	1.650	50	0		CDAARO
COc1ccccc1CNC(=O)C[NH+]1CCCCC1	ZINC000016442230	356439107	/nfs/dbraw/zinc/43/91/07/356439107.db2.gz	ZUSMCCNVHPGUSS-UHFFFAOYSA-N	1	0	262.353	1.797	50	0		CDAARO
CCOc1ccccc1CNCC[NH2+]C[C@@H](C)O	ZINC000019370630	356482783	/nfs/dbraw/zinc/48/27/83/356482783.db2.gz	KILLFNAAZZVBED-GFCCVEGCSA-N	1	0	252.358	1.145	50	0		CDAARO
O=C(CN1CC[NH2+]CC1)c1ccc(Br)cc1	ZINC000019673215	356495010	/nfs/dbraw/zinc/49/50/10/356495010.db2.gz	NOYCWKDPKBQIKR-UHFFFAOYSA-N	1	0	283.169	1.537	50	0		CDAARO
Cc1ccc(N2C(=O)C[C@H]([NH2+]C[C@@H]3CCCO3)C2=O)cc1	ZINC000019720181	356496796	/nfs/dbraw/zinc/49/67/96/356496796.db2.gz	ATIPQIZIPFWXSA-KBPBESRZSA-N	1	0	288.347	1.396	50	0		CDAARO
CCC[N@H+](CC1CC1)[C@H](C)C(=O)NC(=O)NCC	ZINC000096970311	283194726	/nfs/dbraw/zinc/19/47/26/283194726.db2.gz	BCFCTQJFJFOLAN-SNVBAGLBSA-N	1	0	255.362	1.343	50	0		CDAARO
Cc1c(C(=O)NC[C@H](c2ccsc2)[NH+](C)C)cnn1C	ZINC000025814971	356682990	/nfs/dbraw/zinc/68/29/90/356682990.db2.gz	NCUYDVMRQGZFBI-CYBMUJFWSA-N	1	0	292.408	1.823	50	0		CDAARO
CCNC(=O)CN(Cc1ccc(OC)cc1OC)C1CC1	ZINC000028978236	356728457	/nfs/dbraw/zinc/72/84/57/356728457.db2.gz	AXADUWPTGWKTSL-UHFFFAOYSA-N	1	0	292.379	1.804	50	0		CDAARO
COc1ccc(F)cc1-c1cc(N2CC[NH2+]CC2)ncn1	ZINC000032918552	356790721	/nfs/dbraw/zinc/79/07/21/356790721.db2.gz	HSHJYOKISATHCJ-UHFFFAOYSA-N	1	0	288.326	1.701	50	0		CDAARO
CCOC(=O)[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1O	ZINC000034184471	356810759	/nfs/dbraw/zinc/81/07/59/356810759.db2.gz	XEPZKCVKBIJDII-KBPBESRZSA-N	1	0	263.337	1.433	50	0		CDAARO
C[C@@H]1C[C@H](OC[C@@H](O)C[NH+]2CCN(C)CC2)CC(C)(C)C1	ZINC000022937539	357444629	/nfs/dbraw/zinc/44/46/29/357444629.db2.gz	YVAWMZJIRZQCSS-PMPSAXMXSA-N	1	0	298.471	1.826	50	0		CDAARO
Cc1cc(S(=O)(=O)NC[C@H]([NH3+])C(C)C)ccc1F	ZINC000095432095	357514079	/nfs/dbraw/zinc/51/40/79/357514079.db2.gz	AHGURLQTCSTTGW-LBPRGKRZSA-N	1	0	274.361	1.396	50	0		CDAARO
Cc1cc(C)n2ncc(CN3CCC[C@]4(CC[NH2+]C4)C3)c2n1	ZINC000067727154	357621671	/nfs/dbraw/zinc/62/16/71/357621671.db2.gz	NNBMQFWSWWEOKN-QGZVFWFLSA-N	1	0	299.422	1.922	50	0		CDAARO
Cn1nc(C(=O)N2CC[C@]3(C2)CCC[NH2+]C3)c2ccccc21	ZINC000067769671	357626599	/nfs/dbraw/zinc/62/65/99/357626599.db2.gz	VTCKHIZDWIEHOT-QGZVFWFLSA-N	1	0	298.390	1.789	50	0		CDAARO
Cc1nc(N(C)C)cc(NCCNC(=O)C(C)(C)C)[nH+]1	ZINC000067602195	357614288	/nfs/dbraw/zinc/61/42/88/357614288.db2.gz	KIPYJJNWQOUTAV-UHFFFAOYSA-N	1	0	279.388	1.425	50	0		CDAARO
CC(C)c1nccn1CCC(=O)N1CC[NH2+][C@H](C)C1	ZINC000188395144	357657797	/nfs/dbraw/zinc/65/77/97/357657797.db2.gz	DGDKBTVFGXGDFM-GFCCVEGCSA-N	1	0	264.373	1.217	50	0		CDAARO
COc1ccc(-n2cnnc2CC2CC[NH2+]CC2)cc1	ZINC000067878635	357635336	/nfs/dbraw/zinc/63/53/36/357635336.db2.gz	CPEDAEXSGIZFMH-UHFFFAOYSA-N	1	0	272.352	1.818	50	0		CDAARO
CCn1cnnc1CC[NH2+][C@@H]1CCN(Cc2ccccc2)C1	ZINC000067946339	357639003	/nfs/dbraw/zinc/63/90/03/357639003.db2.gz	LSSPMWYBFHRRED-MRXNPFEDSA-N	1	0	299.422	1.705	50	0		CDAARO
CC(=O)NCCC[N@H+]1CCN(C)C[C@@H]1c1ccccc1	ZINC000033135235	357697373	/nfs/dbraw/zinc/69/73/73/357697373.db2.gz	FHKRMXXSQZLIFR-MRXNPFEDSA-N	1	0	275.396	1.501	50	0		CDAARO
COCCCN(C(=O)c1cnsn1)C1CC[NH+](C)CC1	ZINC000072454468	357837054	/nfs/dbraw/zinc/83/70/54/357837054.db2.gz	WDVSGPRGCABFJO-UHFFFAOYSA-N	1	0	298.412	1.111	50	0		CDAARO
C[C@@H](CO)NC(=O)N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1	ZINC000097080683	357945113	/nfs/dbraw/zinc/94/51/13/357945113.db2.gz	RYXDPNHBGUSMKL-RWMBFGLXSA-N	1	0	283.416	1.319	50	0		CDAARO
Cc1cccc(N2CCN(C(=O)C[NH+]3CCCC3)CC2)n1	ZINC000097163290	358005007	/nfs/dbraw/zinc/00/50/07/358005007.db2.gz	ULMUOCMDVUQLGH-UHFFFAOYSA-N	1	0	288.395	1.134	50	0		CDAARO
CC(C)C[C@H](C[NH+](C)C)NC(=O)c1cnn(C)c1	ZINC000097359378	358209345	/nfs/dbraw/zinc/20/93/45/358209345.db2.gz	ZKVDNMIQNBGJRQ-GFCCVEGCSA-N	1	0	252.362	1.126	50	0		CDAARO
CCc1c(C(=O)N2CCC[C@H]([NH3+])C2)cnn1-c1ccccn1	ZINC000195118984	358551381	/nfs/dbraw/zinc/55/13/81/358551381.db2.gz	XPHSCEMFRAEYIA-LBPRGKRZSA-N	1	0	299.378	1.393	50	0		CDAARO
Cc1noc(C)c1C[NH+]1CCC2(CC1)OCCC[C@H]2O	ZINC000091793460	358527816	/nfs/dbraw/zinc/52/78/16/358527816.db2.gz	VLPWPODFJKUEKN-CQSZACIVSA-N	1	0	280.368	1.797	50	0		CDAARO
CC[NH+]1CCC(CC(=O)N[C@H](C)c2nncn2C)CC1	ZINC000095358888	358684652	/nfs/dbraw/zinc/68/46/52/358684652.db2.gz	HPYXYDVZPKVCAL-LLVKDONJSA-N	1	0	279.388	1.114	50	0		CDAARO
CCC[C@H]1CN(c2nc3ccccc3n2CCO)C[C@@H]1[NH3+]	ZINC000095360755	358685346	/nfs/dbraw/zinc/68/53/46/358685346.db2.gz	JWFBHFKRZUCWNL-STQMWFEESA-N	1	0	288.395	1.592	50	0		CDAARO
CCc1[nH+]c(N)nc(N[C@H](C)c2nnc(N)s2)c1C	ZINC000095370714	358687638	/nfs/dbraw/zinc/68/76/38/358687638.db2.gz	MOMWYDHVFDCGLT-ZCFIWIBFSA-N	1	0	279.373	1.536	50	0		CDAARO
CCOc1ccc(CCNC(=O)C[C@@H]2COCC[NH2+]2)cc1	ZINC000097259179	358762071	/nfs/dbraw/zinc/76/20/71/358762071.db2.gz	DNNBPCXHRBIAJG-CQSZACIVSA-N	1	0	292.379	1.123	50	0		CDAARO
O=C(C[C@H]1CC[NH2+]C1)NCCCc1ccccc1F	ZINC000097698612	358793613	/nfs/dbraw/zinc/79/36/13/358793613.db2.gz	LTPDOIVIXWORLD-GFCCVEGCSA-N	1	0	264.344	1.874	50	0		CDAARO
Cn1c(CO)nnc1C1CCN(Cc2nccs2)CC1	ZINC000097823598	358801439	/nfs/dbraw/zinc/80/14/39/358801439.db2.gz	ZTMODEMZJJYLJF-UHFFFAOYSA-N	1	0	293.396	1.144	50	0		CDAARO
C[N@@H+]1C[C@@H]2CC[C@H]1CN(C(=O)c1nc3ccccc3[nH]1)C2	ZINC000215212123	358878832	/nfs/dbraw/zinc/87/88/32/358878832.db2.gz	AGRAQTRJXCIIHQ-RYUDHWBXSA-N	1	0	284.363	1.729	50	0		CDAARO
Cc1nc(N)ncc1C(=O)N1CC[C@@H]([NH+]2CCCCC2)C1	ZINC000216186575	358930315	/nfs/dbraw/zinc/93/03/15/358930315.db2.gz	JVVYUWGFVDTDRE-GFCCVEGCSA-N	1	0	289.383	1.068	50	0		CDAARO
CCCOCCN1CCn2nc([C@H](O)C3CC3)cc2C1	ZINC000219925473	359139164	/nfs/dbraw/zinc/13/91/64/359139164.db2.gz	KPOYCOGSKKDRHG-OAHLLOKOSA-N	1	0	279.384	1.569	50	0		CDAARO
CC[NH+](CC)CCCNc1cn[nH]c(=O)c1Cl	ZINC000001917434	359142854	/nfs/dbraw/zinc/14/28/54/359142854.db2.gz	WWXVDYWQJBZEMU-UHFFFAOYSA-N	1	0	258.753	1.567	50	0		CDAARO
COc1cccc(C[N@H+]2C[C@@H](c3ccncc3)[C@H](CO)C2)n1	ZINC000257181073	359257061	/nfs/dbraw/zinc/25/70/61/359257061.db2.gz	FDUVMLVYQVQTKD-HOCLYGCPSA-N	1	0	299.374	1.693	50	0		CDAARO
C[C@H](C1CC1)[N@H+](C)CC(=O)Nc1sccc1C(N)=O	ZINC000032906873	359257202	/nfs/dbraw/zinc/25/72/02/359257202.db2.gz	DGLFMDAQFUCMBS-MRVPVSSYSA-N	1	0	281.381	1.516	50	0		CDAARO
C[C@@]1(O)CCOC2(CC[NH+](Cc3cccnc3)CC2)C1	ZINC000257191415	359586074	/nfs/dbraw/zinc/58/60/74/359586074.db2.gz	QFNPQFWWDPIZCU-OAHLLOKOSA-N	1	0	276.380	1.978	50	0		CDAARO
Cn1cc(-c2csc(CN3CCC([NH3+])CC3)n2)cn1	ZINC000261942902	359592314	/nfs/dbraw/zinc/59/23/14/359592314.db2.gz	MXRSVJYOIXWJDM-UHFFFAOYSA-N	1	0	277.397	1.467	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)N1CCOCC1)c1ccccc1N(C)C	ZINC000095988828	359723230	/nfs/dbraw/zinc/72/32/30/359723230.db2.gz	OCBSMSSYABUXJL-CYBMUJFWSA-N	1	0	291.395	1.262	50	0		CDAARO
Cc1cccc(NC(=O)CN2CCC3(CC2)OCCO3)c1	ZINC000014193217	366537366	/nfs/dbraw/zinc/53/73/66/366537366.db2.gz	ZJASDMHKOJVJDO-UHFFFAOYSA-N	1	0	290.363	1.772	50	0		CDAARO
CCOC[C@@H]1CCN(C(=O)C[N@@H+]2CC[C@H](C)C2)C1	ZINC000408517904	359902667	/nfs/dbraw/zinc/90/26/67/359902667.db2.gz	OOVDAYPLLGRWBJ-QWHCGFSZSA-N	1	0	254.374	1.213	50	0		CDAARO
CCc1ccc2occ(C(=O)N[C@H](CO)C[NH+](C)C)c2c1	ZINC000408517886	359902750	/nfs/dbraw/zinc/90/27/50/359902750.db2.gz	ZOPSMALUDXHASG-LBPRGKRZSA-N	1	0	290.363	1.648	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1CC(=O)N1CCc2sccc2C1	ZINC000089938928	360198103	/nfs/dbraw/zinc/19/81/03/360198103.db2.gz	DHRCGWMSTZSWLN-GFCCVEGCSA-N	1	0	293.436	1.269	50	0		CDAARO
O=C1C[C@H]([NH2+]C2CCOCC2)CN1CCc1ccccc1	ZINC000011874571	360381276	/nfs/dbraw/zinc/38/12/76/360381276.db2.gz	IRCFSYWKZQXVFT-INIZCTEOSA-N	1	0	288.391	1.599	50	0		CDAARO
Cc1ccccc1-n1c(C[NH3+])nnc1SCCO	ZINC000426548368	360677790	/nfs/dbraw/zinc/67/77/90/360677790.db2.gz	AVFLBYQMOUUOSL-UHFFFAOYSA-N	1	0	264.354	1.119	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)c1nc2ccccc2[nH]1	ZINC000426515773	360678545	/nfs/dbraw/zinc/67/85/45/360678545.db2.gz	SFWRJJGDUMPSRZ-STQMWFEESA-N	1	0	288.351	1.012	50	0		CDAARO
Cc1nc([C@H]2CCOC2)cc(N2CCC[NH2+]CC2)n1	ZINC000426531831	360681027	/nfs/dbraw/zinc/68/10/27/360681027.db2.gz	ROZYFGQUVHMFDW-LBPRGKRZSA-N	1	0	262.357	1.089	50	0		CDAARO
c1nc(NCC[NH+]2CCCCC2)cc([C@@H]2CCOC2)n1	ZINC000426582881	360685156	/nfs/dbraw/zinc/68/51/56/360685156.db2.gz	UBWPZAHFQMNCQJ-CYBMUJFWSA-N	1	0	276.384	1.300	50	0		CDAARO
C[C@@H]1CCC[C@H](C)[N@H+]1CC(=O)NCCc1cccc(=O)[nH]1	ZINC000426387995	360662714	/nfs/dbraw/zinc/66/27/14/360662714.db2.gz	RTGXCQJMENBZIA-BETUJISGSA-N	1	0	291.395	1.709	50	0		CDAARO
COCC[N@@H+](Cc1ccco1)C[C@@H](O)COC(C)(C)C	ZINC000036096427	360911314	/nfs/dbraw/zinc/91/13/14/360911314.db2.gz	IVAUUXHMGKTMOR-CYBMUJFWSA-N	1	0	285.384	1.904	50	0		CDAARO
Cc1nc(C[C@@H]2CCCN(C(=O)[C@@H]3CC[C@H]([NH3+])C3)C2)no1	ZINC000299740329	200852458	/nfs/dbraw/zinc/85/24/58/200852458.db2.gz	YMSZFGQUBMNJRV-XQQFMLRXSA-N	1	0	292.383	1.287	50	0		CDAARO
CCCn1ccnc1CNC(=O)[C@H]([NH3+])CC(C)(C)C	ZINC000244858461	361053043	/nfs/dbraw/zinc/05/30/43/361053043.db2.gz	VLNMDUKNARTUQN-LLVKDONJSA-N	1	0	266.389	1.673	50	0		CDAARO
Cc1nncn1-c1cccc(NC(=O)[C@@H]2CCC[NH2+]2)c1	ZINC000182851683	189337397	/nfs/dbraw/zinc/33/73/97/189337397.db2.gz	SDRAOELPIKHSFG-ZDUSSCGKSA-N	1	0	271.324	1.266	50	0		CDAARO
CC(C)(C)C[N@@H+]1CCN(Cc2cc[nH]n2)C[C@H]1CCO	ZINC000104305040	361586669	/nfs/dbraw/zinc/58/66/69/361586669.db2.gz	STIIZHREYPQGQT-CQSZACIVSA-N	1	0	280.416	1.324	50	0		CDAARO
CC[C@H]1COCCN1C(=O)C[C@@H]([NH3+])c1ccccc1	ZINC000036326652	361654477	/nfs/dbraw/zinc/65/44/77/361654477.db2.gz	JVASEWDVOCOGIL-UONOGXRCSA-N	1	0	262.353	1.714	50	0		CDAARO
CC(=O)c1ccc(C(=O)N2CCC[C@H]([NH+](C)C)C2)cc1O	ZINC000240551534	364439664	/nfs/dbraw/zinc/43/96/64/364439664.db2.gz	GUKPQRWJATURJR-ZDUSSCGKSA-N	1	0	290.363	1.761	50	0		CDAARO
O=C(N1CCC[C@H]([C@H]2CCCC[NH2+]2)C1)C(F)(F)F	ZINC000306254361	364902027	/nfs/dbraw/zinc/90/20/27/364902027.db2.gz	OTDXOACONCIDHG-VHSXEESVSA-N	1	0	264.291	1.929	50	0		CDAARO
O=C1CC[C@H]([NH2+][C@@H]2CCCOc3ccc(F)cc32)CN1	ZINC000098020491	364977509	/nfs/dbraw/zinc/97/75/09/364977509.db2.gz	SAQAQIVVWOIHAD-WCQYABFASA-N	1	0	278.327	1.908	50	0		CDAARO
CC(C)(C)n1cc(C[NH2+]C2(CCO)CCOCC2)cn1	ZINC000089761593	366929791	/nfs/dbraw/zinc/92/97/91/366929791.db2.gz	RODBFLDQGBLFQW-UHFFFAOYSA-N	1	0	281.400	1.659	50	0		CDAARO
CC(=O)Nc1ccc(C[NH2+]C2(CCO)CCOCC2)cc1	ZINC000089980248	367000572	/nfs/dbraw/zinc/00/05/72/367000572.db2.gz	OIXHACNZCWQMFW-UHFFFAOYSA-N	1	0	292.379	1.666	50	0		CDAARO
CCNC(=O)C(C)(C)CNC(=O)[C@H](C)[NH+]1[C@H](C)CC[C@H]1C	ZINC000252487594	367578180	/nfs/dbraw/zinc/57/81/80/367578180.db2.gz	ZILVRDFXAZGRLD-UPJWGTAASA-N	1	0	297.443	1.526	50	0		CDAARO
CCC[NH+]1CCC(NC(=O)c2cn(C(C)(C)C)nn2)CC1	ZINC000252487923	367577070	/nfs/dbraw/zinc/57/70/70/367577070.db2.gz	IEVBOVFTDSHLEI-UHFFFAOYSA-N	1	0	293.415	1.637	50	0		CDAARO
Cc1ccc([C@H](C)NC(=O)[C@H]2C[C@H](O)C[NH2+]2)cc1F	ZINC000094956486	367747088	/nfs/dbraw/zinc/74/70/88/367747088.db2.gz	RCCZIZIFKNWGKO-XHVZSJERSA-N	1	0	266.316	1.034	50	0		CDAARO
CC[C@@H]1CCCN(C(=O)[C@@H]2CN(C)CCO2)CC1	ZINC000081411104	369957384	/nfs/dbraw/zinc/95/73/84/369957384.db2.gz	IDPPPJSKYSJHDA-OLZOCXBDSA-N	1	0	254.374	1.356	50	0		CDAARO
CC[C@H]1CCCN(C(=O)[C@@H]2CN(C)CCO2)CC1	ZINC000081411105	369957763	/nfs/dbraw/zinc/95/77/63/369957763.db2.gz	IDPPPJSKYSJHDA-STQMWFEESA-N	1	0	254.374	1.356	50	0		CDAARO
O=C1NCCCC[C@H]1[N@@H+]1CCC[C@H](OCC2CC2)C1	ZINC000375321346	376204297	/nfs/dbraw/zinc/20/42/97/376204297.db2.gz	VCQHIASGRBGOKQ-UONOGXRCSA-N	1	0	266.385	1.546	50	0		CDAARO
CNC(=O)c1ccc(C[N@H+](C)CC2(C)COC2)cc1	ZINC000299762597	372748724	/nfs/dbraw/zinc/74/87/24/372748724.db2.gz	OCFVPPDRIOMKQB-UHFFFAOYSA-N	1	0	262.353	1.515	50	0		CDAARO
O=C(NCCCc1ccncc1)[C@H]1CC12CC[NH2+]CC2	ZINC000299774040	372753188	/nfs/dbraw/zinc/75/31/88/372753188.db2.gz	FDVMWWOBKQUOJB-CQSZACIVSA-N	1	0	273.380	1.520	50	0		CDAARO
COc1ccc(NC(=O)NC[C@@]2(O)CC[NH2+]C2)cc1Cl	ZINC000299782359	372758590	/nfs/dbraw/zinc/75/85/90/372758590.db2.gz	VPRZQAHPZJMUKG-CYBMUJFWSA-N	1	0	299.758	1.195	50	0		CDAARO
CN(C[C@@H]1CC[N@H+](C)C1(C)C)C(=O)CCCn1ccnc1	ZINC000299800829	372771255	/nfs/dbraw/zinc/77/12/55/372771255.db2.gz	JAKDNUXWTFNWEG-AWEZNQCLSA-N	1	0	292.427	1.852	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N(C)CCOc1ccccc1F	ZINC000037802462	373352830	/nfs/dbraw/zinc/35/28/30/373352830.db2.gz	YDLCUVRQBOHYBA-NSHDSACASA-N	1	0	254.305	1.400	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCN(S(C)(=O)=O)C2)C[C@H]1C	ZINC000253370407	373676639	/nfs/dbraw/zinc/67/66/39/373676639.db2.gz	QKFKGEZVYFDTDN-MQYQWHSLSA-N	1	0	288.457	1.682	50	0		CDAARO
COC[C@@H]1C[N@H+](Cc2cccnc2)C[C@H]1c1nc(C)no1	ZINC000253413607	373720798	/nfs/dbraw/zinc/72/07/98/373720798.db2.gz	VFMKFGNOWFDRQY-UONOGXRCSA-N	1	0	288.351	1.635	50	0		CDAARO
C[C@@H](C(=O)N1CCO[C@@H](C)[C@@H]1C)[C@H]([NH3+])c1ccccc1	ZINC000248921667	374206067	/nfs/dbraw/zinc/20/60/67/374206067.db2.gz	FFHNTCYWCXUHCO-OSFYFWSMSA-N	1	0	276.380	1.958	50	0		CDAARO
OC1(C[NH2+]Cc2ccc(-n3ccnc3)cc2)CCOCC1	ZINC000112717146	374228068	/nfs/dbraw/zinc/22/80/68/374228068.db2.gz	QHNUFPIZWWFEPF-UHFFFAOYSA-N	1	0	287.363	1.503	50	0		CDAARO
COc1cc(C[NH2+]CC2(O)CCCC2)cc2c1OCO2	ZINC000111385453	374186267	/nfs/dbraw/zinc/18/62/67/374186267.db2.gz	LXXVKDAGELRYHB-UHFFFAOYSA-N	1	0	279.336	1.819	50	0		CDAARO
COC(=O)[C@]1(C)C[C@H](CO)[C@@H](c2cccs2)N1C	ZINC000012336749	374492134	/nfs/dbraw/zinc/49/21/34/374492134.db2.gz	KKFUGEBPCPHMNW-CDMKHQONSA-N	1	0	269.366	1.665	50	0		CDAARO
OCC[C@H]1CN(Cc2ncc[nH]2)CC[N@@H+]1C1CCCC1	ZINC000019867808	374814797	/nfs/dbraw/zinc/81/47/97/374814797.db2.gz	FIMYYJCASVNWDA-AWEZNQCLSA-N	1	0	278.400	1.221	50	0		CDAARO
CC(C)OCCC[N@H+](C)[C@H]1CCN(CC(F)(F)F)C1=O	ZINC000095395832	374901832	/nfs/dbraw/zinc/90/18/32/374901832.db2.gz	KEPIXUKFQBKKKK-NSHDSACASA-N	1	0	296.333	1.897	50	0		CDAARO
C[C@H](NC(=O)N1CC[C@@H](C[NH+](C)C)C1)[C@H]1CCOC1	ZINC000252586145	189981577	/nfs/dbraw/zinc/98/15/77/189981577.db2.gz	NUNLYNCOPGGQOX-AVGNSLFASA-N	1	0	269.389	1.005	50	0		CDAARO
CC(C)OC[C@H](O)C[NH2+]C(C)(C)c1nccs1	ZINC000095426438	374926951	/nfs/dbraw/zinc/92/69/51/374926951.db2.gz	VSTWDBBWMNWTHO-SNVBAGLBSA-N	1	0	258.387	1.754	50	0		CDAARO
COC(=O)[C@H](O)C1CC[NH+](Cc2ccc(C)cc2)CC1	ZINC000095432444	374934890	/nfs/dbraw/zinc/93/48/90/374934890.db2.gz	SXJORPQYLLRWCE-OAHLLOKOSA-N	1	0	277.364	1.741	50	0		CDAARO
CC[C@@H](C)[C@@H]([NH2+]CC(=O)N(CC(C)C)C(C)C)C(N)=O	ZINC000095452692	374952080	/nfs/dbraw/zinc/95/20/80/374952080.db2.gz	VEEIXXWAZJAUDA-TZMCWYRMSA-N	1	0	285.432	1.369	50	0		CDAARO
CC[C@@H](C)[C@H]([NH2+]CC(=O)N(CC(C)C)C(C)C)C(N)=O	ZINC000095452690	374952168	/nfs/dbraw/zinc/95/21/68/374952168.db2.gz	VEEIXXWAZJAUDA-OCCSQVGLSA-N	1	0	285.432	1.369	50	0		CDAARO
Cc1cc(N2CCN(C(=O)CCc3cn[nH]c3)CC2)cc[nH+]1	ZINC000020999228	375032268	/nfs/dbraw/zinc/03/22/68/375032268.db2.gz	IGJBRIQWKIDOOQ-UHFFFAOYSA-N	1	0	299.378	1.395	50	0		CDAARO
CC[C@H](C(=O)N1CCC2(CC1)OCC(C)(C)CO2)[NH+](C)C	ZINC000096476741	375104302	/nfs/dbraw/zinc/10/43/02/375104302.db2.gz	LBKSYLNXWVZYHY-CYBMUJFWSA-N	1	0	298.427	1.718	50	0		CDAARO
Cn1ccc(CNC(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@H]32)c1	ZINC000096499812	375106969	/nfs/dbraw/zinc/10/69/69/375106969.db2.gz	KCNMLPRRRITDLH-HUUCEWRRSA-N	1	0	290.411	1.651	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNC(=O)NCC1(OC)CCC1	ZINC000097055046	375143329	/nfs/dbraw/zinc/14/33/29/375143329.db2.gz	IACYPBMFLZBBLR-CYBMUJFWSA-N	1	0	283.416	1.729	50	0		CDAARO
c1cnn(CCC[NH2+]Cc2c[nH]nc2-c2cccnc2)c1	ZINC000097159981	375150633	/nfs/dbraw/zinc/15/06/33/375150633.db2.gz	TZRYLMYIBNQRPL-UHFFFAOYSA-N	1	0	282.351	1.848	50	0		CDAARO
O[C@H](C[NH2+]CCCN1CCOCC1)c1ccccc1	ZINC000002634717	375277694	/nfs/dbraw/zinc/27/76/94/375277694.db2.gz	JPEWJEYYSKQDIB-OAHLLOKOSA-N	1	0	264.369	1.032	50	0		CDAARO
C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1CCN1CCOCC1	ZINC000075838152	377134519	/nfs/dbraw/zinc/13/45/19/377134519.db2.gz	LLBNVFZMNNUFBF-KFWWJZLASA-N	1	0	252.402	1.972	50	0		CDAARO
Cc1nccc(N2CCOC3(CC[NH+](C)CC3)C2)n1	ZINC000645384333	377195997	/nfs/dbraw/zinc/19/59/97/377195997.db2.gz	AFOVTTOOPJSQGW-UHFFFAOYSA-N	1	0	262.357	1.086	50	0		CDAARO
Cc1cc(C)nc(CCNC(=O)C[N@@H+]2C[C@@H]3CC[C@H]2C3)n1	ZINC000244795220	377796470	/nfs/dbraw/zinc/79/64/70/377796470.db2.gz	RBURWKUQAXGSDB-KGLIPLIRSA-N	1	0	288.395	1.236	50	0		CDAARO
COC(=O)CCN1CCN(C(=O)[C@@H]2C[C@H]2C2CC2)[C@@H](C)C1	ZINC000245338770	378070807	/nfs/dbraw/zinc/07/08/07/378070807.db2.gz	OLUHTICFPQSSKX-FPMFFAJLSA-N	1	0	294.395	1.128	50	0		CDAARO
O=C1[C@@H]2CC=C(Cl)C[C@@H]2C(=O)N1CC[NH+]1CCCC1	ZINC000002972858	284983129	/nfs/dbraw/zinc/98/31/29/284983129.db2.gz	UHZVARWABQKUTG-NEPJUHHUSA-N	1	0	282.771	1.600	50	0		CDAARO
COCC[NH2+]CC(=O)N[C@H]1CCCC[C@@H]1C(C)(C)C	ZINC000092495311	285076070	/nfs/dbraw/zinc/07/60/70/285076070.db2.gz	GTUAQPFNRUCIQJ-STQMWFEESA-N	1	0	270.417	1.944	50	0		CDAARO
[NH3+]CCS[C@H]1CC(=O)N(c2ccc(F)cc2)C1=O	ZINC000002221479	390141552	/nfs/dbraw/zinc/14/15/52/390141552.db2.gz	UOOBWGLMALEZNL-JTQLQIEISA-N	1	0	268.313	1.150	50	0		CDAARO
CC(C)C[N@@H+]1CCN(Cc2ccco2)[C@@H](CCO)C1	ZINC000032553501	390371171	/nfs/dbraw/zinc/37/11/71/390371171.db2.gz	WOIONVULGZVRAJ-AWEZNQCLSA-N	1	0	266.385	1.804	50	0		CDAARO
CC[N@H+](C)C[C@H]1CCN(S(=O)(=O)c2cccnc2)C1	ZINC000096428766	390518380	/nfs/dbraw/zinc/51/83/80/390518380.db2.gz	SREDJMYIDUSLFN-GFCCVEGCSA-N	1	0	283.397	1.044	50	0		CDAARO
CC[N@H+](C)C[C@@H]1CCN(S(=O)(=O)c2cccnc2)C1	ZINC000096428765	390518416	/nfs/dbraw/zinc/51/84/16/390518416.db2.gz	SREDJMYIDUSLFN-LBPRGKRZSA-N	1	0	283.397	1.044	50	0		CDAARO
C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)N(C)CCO	ZINC000097143544	390799545	/nfs/dbraw/zinc/79/95/45/390799545.db2.gz	INYQCPPIBGEEFN-HIFRSBDPSA-N	1	0	291.395	1.141	50	0		CDAARO
Cc1ccc(-c2n[nH]cc2C[NH2+]CC(=O)N2CCCC2)o1	ZINC000097159586	390801056	/nfs/dbraw/zinc/80/10/56/390801056.db2.gz	RQWTZJNUWQZWNU-UHFFFAOYSA-N	1	0	288.351	1.690	50	0		CDAARO
C[C@@H]1CC[N@H+](CC(=O)N[C@@H]2CCOC(C)(C)C2)C1	ZINC000408518000	390847698	/nfs/dbraw/zinc/84/76/98/390847698.db2.gz	RJLUFBWQISIMIP-VXGBXAGGSA-N	1	0	254.374	1.402	50	0		CDAARO
COC(=O)CN1CCC[N@H+](Cc2ccccc2OC)CC1	ZINC000096489965	533504479	/nfs/dbraw/zinc/50/44/79/533504479.db2.gz	CCCNTUGXMVFQHM-UHFFFAOYSA-N	1	0	292.379	1.376	50	0		CDAARO
C[C@H](CC(=O)N1CCCCCC1)[NH2+]CC(=O)NC(C)(C)C	ZINC000096476542	533624988	/nfs/dbraw/zinc/62/49/88/533624988.db2.gz	BTHDEXSTINSEMS-CYBMUJFWSA-N	1	0	297.443	1.672	50	0		CDAARO
CC(C)[N@H+](CCNC(=O)N1CCOC[C@@H]1C1CC1)C1CC1	ZINC000089896269	392517478	/nfs/dbraw/zinc/51/74/78/392517478.db2.gz	ZMKLEXXVVRQEMN-OAHLLOKOSA-N	1	0	295.427	1.680	50	0		CDAARO
Cc1ccccc1[C@@H]1CN(C(=O)[C@@H]2CC[NH2+]C2)[C@H](C)CO1	ZINC000269216420	132133496	/nfs/dbraw/zinc/13/34/96/132133496.db2.gz	KOQDWGPXXAIPMI-FMKPAKJESA-N	1	0	288.391	1.893	50	0		CDAARO
CC[NH+](CC)C1CCN(C(=O)Cc2cccnc2)CC1	ZINC000096410139	393181517	/nfs/dbraw/zinc/18/15/17/393181517.db2.gz	AJPUAJZPXHMLCM-UHFFFAOYSA-N	1	0	275.396	1.957	50	0		CDAARO
CC(C)SCC[N@@H+]1CCC[C@@H](NC(=O)N(C)C)C1	ZINC000452021263	393427446	/nfs/dbraw/zinc/42/74/46/393427446.db2.gz	SRZHGJPHLATIDF-GFCCVEGCSA-N	1	0	273.446	1.864	50	0		CDAARO
c1cc(CN2CCN([C@H]3CC[NH2+]C3)CC2)cs1	ZINC000261557489	140347350	/nfs/dbraw/zinc/34/73/50/140347350.db2.gz	RUNNHIZYJXKICE-ZDUSSCGKSA-N	1	0	251.399	1.228	50	0		CDAARO
COCC1(CNc2ncc(C)cn2)CC[NH2+]CC1	ZINC000261582825	140355815	/nfs/dbraw/zinc/35/58/15/140355815.db2.gz	RJGCVQDPMPXXKI-UHFFFAOYSA-N	1	0	250.346	1.213	50	0		CDAARO
CCOc1cc(N2CCC([NH2+]C3CC3)CC2)ncn1	ZINC000097096848	397958921	/nfs/dbraw/zinc/95/89/21/397958921.db2.gz	OFFDLTYECRLPLS-UHFFFAOYSA-N	1	0	262.357	1.596	50	0		CDAARO
COC[C@H]([NH2+][C@H](C)c1nccn1C)C1CCOCC1	ZINC000658098356	413197110	/nfs/dbraw/zinc/19/71/10/413197110.db2.gz	YCSMOQPPJVASBF-YPMHNXCESA-N	1	0	267.373	1.512	50	0		CDAARO
COc1cccc(C[NH2+]C2CCCC2)c1OCC(N)=O	ZINC000006747031	170239232	/nfs/dbraw/zinc/23/92/32/170239232.db2.gz	UCHXNDGLSKGGQX-UHFFFAOYSA-N	1	0	278.352	1.592	50	0		CDAARO
COc1cc(C[NH2+]CCN2CCCC2)cc(OC)c1OC	ZINC000020126717	171011064	/nfs/dbraw/zinc/01/10/64/171011064.db2.gz	MXGLNYSPZCOVBO-UHFFFAOYSA-N	1	0	294.395	1.898	50	0		CDAARO
C[C@H]1[C@@H]2CCC[N@@H+]2CCN1C(=O)c1ccc2c(c1)nnn2C	ZINC000020540860	171241380	/nfs/dbraw/zinc/24/13/80/171241380.db2.gz	HNLONUROJMOWNB-FZMZJTMJSA-N	1	0	299.378	1.277	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2cccc(OC)c2)CC1	ZINC000020608841	171267619	/nfs/dbraw/zinc/26/76/19/171267619.db2.gz	PKDSFNWRTXQXHV-UHFFFAOYSA-N	1	0	277.368	1.271	50	0		CDAARO
OCC1CC[NH+]([C@H]2CCCN(Cc3cccnc3)C2)CC1	ZINC000020919713	171280111	/nfs/dbraw/zinc/28/01/11/171280111.db2.gz	DXFLTAOKRCOCQY-KRWDZBQOSA-N	1	0	289.423	1.750	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COc2ccc(C)c(C)c2)CC1	ZINC000021486892	171304531	/nfs/dbraw/zinc/30/45/31/171304531.db2.gz	XZKJGRNQGJJLJN-MRXNPFEDSA-N	1	0	292.423	1.681	50	0		CDAARO
Cn1c(C[N@H+](C)[C@@H]2CCc3ccccc32)cc(=O)n(C)c1=O	ZINC000040489807	174291544	/nfs/dbraw/zinc/29/15/44/174291544.db2.gz	BNKFELYVKOVJMM-OAHLLOKOSA-N	1	0	299.374	1.203	50	0		CDAARO
C[NH+](C)CCSc1nc2ccccc2c2nnnn21	ZINC000040555390	174330571	/nfs/dbraw/zinc/33/05/71/174330571.db2.gz	RGFBLHAWTZMUAK-UHFFFAOYSA-N	1	0	274.353	1.326	50	0		CDAARO
Cc1n[nH]c(C)c1CCC[NH2+][C@@H](C)C(=O)NC1CCCC1	ZINC000067955791	175804164	/nfs/dbraw/zinc/80/41/64/175804164.db2.gz	BZKPBPMMSDTQEY-ZDUSSCGKSA-N	1	0	292.427	1.996	50	0		CDAARO
Cc1n[nH]c(C)c1CCC[NH2+][C@H](C)C(=O)NC1CCCC1	ZINC000067955793	175804221	/nfs/dbraw/zinc/80/42/21/175804221.db2.gz	BZKPBPMMSDTQEY-CYBMUJFWSA-N	1	0	292.427	1.996	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(Cc2nnc(C3CC3)o2)CC1	ZINC000072149597	176326230	/nfs/dbraw/zinc/32/62/30/176326230.db2.gz	OGBVRSCSYCQUGX-GFCCVEGCSA-N	1	0	264.373	1.863	50	0		CDAARO
C[N@@H+]1C[C@@H](c2cccc(O)c2)[C@@H]2[C@H]1C1CCN2CC1	ZINC000072163474	176330620	/nfs/dbraw/zinc/33/06/20/176330620.db2.gz	KDXMAZVYUPJESD-ARFHVFGLSA-N	1	0	258.365	1.884	50	0		CDAARO
CCc1ccccc1OCC[N@@H+]1CCOC[C@@H](O)C1	ZINC000077471520	177272380	/nfs/dbraw/zinc/27/23/80/177272380.db2.gz	BEAMBRVUCNUGEV-AWEZNQCLSA-N	1	0	265.353	1.321	50	0		CDAARO
CCc1ccc(C[N@@H+]2CCOC[C@@H](CO)C2)nc1	ZINC000077524420	177278081	/nfs/dbraw/zinc/27/80/81/177278081.db2.gz	SHPMAPKJVHXVIR-CYBMUJFWSA-N	1	0	250.342	1.085	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNS(=O)(=O)c1cc(N)ccc1C	ZINC000019991408	260115018	/nfs/dbraw/zinc/11/50/18/260115018.db2.gz	XBKLKOJPFCOWFW-ZDUSSCGKSA-N	1	0	297.424	1.340	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@H](c2ccccc2)[C@@H](C)[C@@]12NC(=O)NC2=O	ZINC000001095800	274340967	/nfs/dbraw/zinc/34/09/67/274340967.db2.gz	MMSXRWNFSXWXPU-BQNAKDMGSA-N	1	0	287.363	1.524	50	0		CDAARO
CC(C)c1ccc(OC[C@@H](O)CN2CC[NH+](C)CC2)cc1	ZINC000019367709	276055126	/nfs/dbraw/zinc/05/51/26/276055126.db2.gz	NSFVNTKHHAXOOF-INIZCTEOSA-N	1	0	292.423	1.797	50	0		CDAARO
CC[C@]1(C)CN(C(=O)N[C@H]2CC[C@@H]([NH+](C)C)C2)CCO1	ZINC000252551808	276678488	/nfs/dbraw/zinc/67/84/88/276678488.db2.gz	UHLHHHMWKJLOOF-GZBFAFLISA-N	1	0	283.416	1.680	50	0		CDAARO
COc1cc(NC(=O)C[NH2+]C[C@H]2CCCO2)cc(OC)c1	ZINC000065396526	277829514	/nfs/dbraw/zinc/82/95/14/277829514.db2.gz	CMPFVOAOUAHLPB-GFCCVEGCSA-N	1	0	294.351	1.411	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)c1cn2cccnc2n1	ZINC000299751190	278317326	/nfs/dbraw/zinc/31/73/26/278317326.db2.gz	PVBWNBKHXIQZNQ-ZYHUDNBSSA-N	1	0	273.340	1.071	50	0		CDAARO
C[C@H]1CCNC(=O)[C@@H]1[NH2+]Cc1ccc(Cl)cc1	ZINC000193592608	278372427	/nfs/dbraw/zinc/37/24/27/278372427.db2.gz	BHFNTYUJMQZJJC-JOYOIKCWSA-N	1	0	252.745	1.954	50	0		CDAARO
C[C@@H]1CCC[C@@H](C)N1C(=O)CSc1nc(N)cc(N)[nH+]1	ZINC000003605796	278493412	/nfs/dbraw/zinc/49/34/12/278493412.db2.gz	MRDLDXJPPWMYJS-RKDXNWHRSA-N	1	0	295.412	1.523	50	0		CDAARO
CC(C)CNC(=O)C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000002491687	278906468	/nfs/dbraw/zinc/90/64/68/278906468.db2.gz	VUMQMEVSMRDYRK-UHFFFAOYSA-N	1	0	283.416	1.184	50	0		CDAARO
C[C@H](C(=O)NC1CC1)[NH+]1CCc2ccccc2CC1	ZINC000071909403	279209860	/nfs/dbraw/zinc/20/98/60/279209860.db2.gz	RAIKGELZAJBXQM-GFCCVEGCSA-N	1	0	258.365	1.754	50	0		CDAARO
Clc1nnc2c([C@@H]3[NH2+]CCc4nc[nH]c43)c[nH]cc1-2	ZINC000065371948	279298253	/nfs/dbraw/zinc/29/82/53/279298253.db2.gz	WPGRMEQFHIVMEK-JTQLQIEISA-N	1	0	274.715	1.570	50	0		CDAARO
Cc1noc(-c2cccnc2N2CC[N@@H+]3CCC[C@H]3C2)n1	ZINC000246192005	280262352	/nfs/dbraw/zinc/26/23/52/280262352.db2.gz	MFVKRAIREDGSGX-LBPRGKRZSA-N	1	0	285.351	1.724	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@@H]1[NH2+][C@@H](C)C(=O)NC(C)(C)C	ZINC000089948629	280396372	/nfs/dbraw/zinc/39/63/72/280396372.db2.gz	MELUQDGOIMVLSN-YUTCNCBUSA-N	1	0	297.443	1.526	50	0		CDAARO
C[NH+](C)C[C@@H]1CSCC[C@]1(O)c1cccc(O)c1	ZINC000000347738	289203333	/nfs/dbraw/zinc/20/33/33/289203333.db2.gz	OXSWTJCCCLUDOE-OCCSQVGLSA-N	1	0	267.394	1.895	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C\C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000255106993	289356546	/nfs/dbraw/zinc/35/65/46/289356546.db2.gz	BOKLMCMFAPPSGU-UMCURTJPSA-N	1	0	282.775	1.215	50	0		CDAARO
CN(C(=O)/C=C\c1c(F)cccc1F)[C@@H]1CC[NH2+]C1	ZINC000255772266	289386523	/nfs/dbraw/zinc/38/65/23/289386523.db2.gz	NGDGWNCYBZPCJT-WWQCOOJYSA-N	1	0	266.291	1.798	50	0		CDAARO
COP(=O)(OC)[C@]1(O)C[C@H](C)[N@H+](C)C[C@@H]1C	ZINC000031812360	293376577	/nfs/dbraw/zinc/37/65/77/293376577.db2.gz	ANRNCSUBAGMGGV-LPEHRKFASA-N	1	0	251.263	1.521	50	0		CDAARO
Cn1c2ccccc2c(C(=O)N2CCCC[C@H]([NH3+])C2)cc1=O	ZINC000082107191	294188149	/nfs/dbraw/zinc/18/81/49/294188149.db2.gz	OOBULCZDXFOWQN-LBPRGKRZSA-N	1	0	299.374	1.492	50	0		CDAARO
COc1ccccc1CCC(=O)NC[C@@H]1C[C@H](F)C[NH2+]1	ZINC000216469742	295358729	/nfs/dbraw/zinc/35/87/29/295358729.db2.gz	CECJTCVLIIHACM-STQMWFEESA-N	1	0	280.343	1.444	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2cnc(N)s2)CCCCCC1	ZINC000534577641	328310394	/nfs/dbraw/zinc/31/03/94/328310394.db2.gz	BVZQIJGMVSKIBK-UHFFFAOYSA-N	1	0	296.440	1.940	50	0		CDAARO
[NH3+][C@@H]1[C@@H]2CC[C@H]1CN(C(=O)Cc1ccc(F)c(F)c1F)C2	ZINC000534587221	328315808	/nfs/dbraw/zinc/31/58/08/328315808.db2.gz	XNICUMYNLYLFJL-KEODLESXSA-N	1	0	298.308	1.842	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@H]2C(=O)Nc3ccc(Cl)cc3C(=O)N2C1	ZINC000534592160	328318601	/nfs/dbraw/zinc/31/86/01/328318601.db2.gz	PLWCHDFXQMKUOG-SKDRFNHKSA-N	1	0	293.754	1.437	50	0		CDAARO
Cc1cccc([C@H](CNC(=O)c2cc(N)n[nH]2)[NH+](C)C)c1	ZINC000534646032	328332539	/nfs/dbraw/zinc/33/25/39/328332539.db2.gz	YXQRIVABEKMPPI-ZDUSSCGKSA-N	1	0	287.367	1.163	50	0		CDAARO
CC(C)[C@@H](CNC(=O)c1ccc(F)c(O)c1)[NH+](C)C	ZINC000534637904	328334708	/nfs/dbraw/zinc/33/47/08/328334708.db2.gz	XLCXVNIWXRBVDI-GFCCVEGCSA-N	1	0	268.332	1.847	50	0		CDAARO
CCCc1nc(N2CCCC3(CC[NH2+]CC3)C2)no1	ZINC000534651700	328337407	/nfs/dbraw/zinc/33/74/07/328337407.db2.gz	SDEDHUZBPMMCRS-UHFFFAOYSA-N	1	0	264.373	1.992	50	0		CDAARO
Cc1cccc2oc(C[NH2+][C@H](C)CN3CCOCC3)nc21	ZINC000534676873	328352029	/nfs/dbraw/zinc/35/20/29/328352029.db2.gz	WPXZFFMLIWWTAK-CYBMUJFWSA-N	1	0	289.379	1.947	50	0		CDAARO
O=S1(=O)CCCN1c1cccc(C[NH2+][C@H]2CCOC2)c1	ZINC000185090330	323381742	/nfs/dbraw/zinc/38/17/42/323381742.db2.gz	NJRHAAYTXKMAIF-ZDUSSCGKSA-N	1	0	296.392	1.105	50	0		CDAARO
COC[C@@H](O)C[NH2+][C@@H](C)[C@@H]1COc2ccccc21	ZINC000185576280	323392658	/nfs/dbraw/zinc/39/26/58/323392658.db2.gz	FEMHEBPCTAKINK-GVXVVHGQSA-N	1	0	251.326	1.148	50	0		CDAARO
CCc1ccccc1OCC[N@H+]1C[C@@H]2[C@H](O)C[C@@H]2C1	ZINC001772707477	1159441706	/nfs/dbraw/zinc/44/17/06/1159441706.db2.gz	SZQQRNFWXTWRCR-QLFBSQMISA-N	1	0	261.365	1.940	50	0		CDAARO
CCN(CC)C(=O)N1CCC[C@H]1C[N@@H+]1CCC[C@H]1CO	ZINC000108127771	482450099	/nfs/dbraw/zinc/45/00/99/482450099.db2.gz	KGMNIUHAYFHWJW-KBPBESRZSA-N	1	0	283.416	1.369	50	0		CDAARO
CCO[C@@H]1C[C@@H]([N@H+](C)CCN2CCOC2=O)C1(C)C	ZINC000084800731	482507269	/nfs/dbraw/zinc/50/72/69/482507269.db2.gz	IVJLVIQVWXINQG-VXGBXAGGSA-N	1	0	270.373	1.574	50	0		CDAARO
OC[C@@H]([NH2+]C1CCN([C@H]2CCOC2)CC1)c1ccsc1	ZINC000585091227	482826326	/nfs/dbraw/zinc/82/63/26/482826326.db2.gz	NUZLOAZZZJXJEW-LSDHHAIUSA-N	1	0	296.436	1.624	50	0		CDAARO
Cc1ccc(N2CC[N@H+](CCOCCO)[C@H](C)C2)cc1	ZINC000670435524	482971990	/nfs/dbraw/zinc/97/19/90/482971990.db2.gz	OUFJATZWKPKZQJ-OAHLLOKOSA-N	1	0	278.396	1.514	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]Cc2cnc3cnccn23)n1	ZINC000670436368	482974956	/nfs/dbraw/zinc/97/49/56/482974956.db2.gz	WORXXNHLBMREKN-GFCCVEGCSA-N	1	0	284.367	1.721	50	0		CDAARO
CC[N@H+](C)[C@H](C)C(=O)N(C)Cc1cc(C)cc(C)n1	ZINC000670444965	482994821	/nfs/dbraw/zinc/99/48/21/482994821.db2.gz	FSSBEHHTOARGJY-CYBMUJFWSA-N	1	0	263.385	1.997	50	0		CDAARO
COC[C@H](C)NC(=O)C1CC[NH+](Cc2[nH]cnc2C)CC1	ZINC000670447769	483002138	/nfs/dbraw/zinc/00/21/38/483002138.db2.gz	NDHQSAMGKSVPPO-NSHDSACASA-N	1	0	294.399	1.081	50	0		CDAARO
CC(=O)N1CCC([N@H+]2C[C@H]3CCC[C@@H](C2)N(C)C3)CC1	ZINC000670454856	483030815	/nfs/dbraw/zinc/03/08/15/483030815.db2.gz	UQGBWPCWCIOLMH-HOCLYGCPSA-N	1	0	279.428	1.413	50	0		CDAARO
CN1C(=O)CCC12CC[NH+]([C@H]1CCSC1)CC2	ZINC000670462996	483050327	/nfs/dbraw/zinc/05/03/27/483050327.db2.gz	WJYZWFJQQAELNQ-NSHDSACASA-N	1	0	254.399	1.579	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN(Cc2cnccc2Cl)C1	ZINC000670466617	483056849	/nfs/dbraw/zinc/05/68/49/483056849.db2.gz	HQJDIKGIVRCMIQ-LBPRGKRZSA-N	1	0	283.803	1.745	50	0		CDAARO
CC(C)n1cnnc1CN1CC[C@@H](O)CC(C)(C)C1	ZINC000670466139	483057133	/nfs/dbraw/zinc/05/71/33/483057133.db2.gz	MVQPKRZDQXEVSG-GFCCVEGCSA-N	1	0	266.389	1.842	50	0		CDAARO
O=c1c2ccncc2ncn1CC[NH+]1CCCCC1	ZINC000194433265	483215448	/nfs/dbraw/zinc/21/54/48/483215448.db2.gz	RPITYEISJUJJHW-UHFFFAOYSA-N	1	0	258.325	1.277	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)c1cccc(C(C)=O)c1	ZINC000096483216	528949201	/nfs/dbraw/zinc/94/92/01/528949201.db2.gz	BMQFZUYYKMFODG-UHFFFAOYSA-N	1	0	298.408	1.685	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@H]1C[N@@H+](C)C[C@@H]1C	ZINC000076058277	538376486	/nfs/dbraw/zinc/37/64/86/538376486.db2.gz	HNXHOIFUTIJZKW-JQWIXIFHSA-N	1	0	286.372	1.363	50	0		CDAARO
[NH3+]CC(=O)N[C@H]1CCCN(Cc2ccc(Cl)cc2)C1	ZINC000072409823	567902787	/nfs/dbraw/zinc/90/27/87/567902787.db2.gz	AVEBHFIVNGVUPB-ZDUSSCGKSA-N	1	0	281.787	1.379	50	0		CDAARO
C[C@@H]1CC[NH2+]C[C@H]1c1ccc(NS(C)(=O)=O)cc1	ZINC000757213915	574906940	/nfs/dbraw/zinc/90/69/40/574906940.db2.gz	RZIZQCUAZLZPGL-ZWNOBZJWSA-N	1	0	268.382	1.771	50	0		CDAARO
CC(C)[C@@H]([NH3+])[C@@]1(O)CCCN(C(=O)OC(C)(C)C)C1	ZINC000958528197	614119629	/nfs/dbraw/zinc/11/96/29/614119629.db2.gz	NWVYDGZVAUNTTK-BXUZGUMPSA-N	1	0	272.389	1.732	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@@H]([NH3+])C2CCCC2)C1	ZINC000958528675	613973569	/nfs/dbraw/zinc/97/35/69/613973569.db2.gz	RZRCQHNRFHZMKY-NSHDSACASA-N	1	0	270.373	1.486	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@](O)([C@@H]([NH3+])c2ccns2)C1	ZINC000958528250	613980863	/nfs/dbraw/zinc/98/08/63/613980863.db2.gz	LLILTSKFDXHRON-GXFFZTMASA-N	1	0	299.396	1.515	50	0		CDAARO
CC(C)NC(=O)C[N@@H+]1CCSC[C@@H]1C(C)(C)C	ZINC000871596646	630998639	/nfs/dbraw/zinc/99/86/39/630998639.db2.gz	YFPUTIIUJUWSKG-LLVKDONJSA-N	1	0	258.431	1.975	50	0		CDAARO
COc1c(C)cnc(C[NH+]2CCC([C@@H](O)CO)CC2)c1C	ZINC001772711459	1159446050	/nfs/dbraw/zinc/44/60/50/1159446050.db2.gz	YJIBFUWXPHDWRB-HNNXBMFYSA-N	1	0	294.395	1.272	50	0		CDAARO
CCC1CC[NH+](CCNc2cc3nncn3c(N)n2)CC1	ZINC000822724726	1161929606	/nfs/dbraw/zinc/92/96/06/1161929606.db2.gz	PRIQLPRKSCSRNQ-UHFFFAOYSA-N	1	0	289.387	1.240	50	0		CDAARO
CN(C)c1nccnc1NC[C@@H](O)C[NH+]1CCCCCC1	ZINC001704302398	1177680229	/nfs/dbraw/zinc/68/02/29/1177680229.db2.gz	JHRJFJRALFNTFB-CYBMUJFWSA-N	1	0	293.415	1.191	50	0		CDAARO
CC(=O)c1cnc(NCC[C@H]2CCC[N@H+]2C)nc1C	ZINC001704325070	1177687670	/nfs/dbraw/zinc/68/76/70/1177687670.db2.gz	CQAGAYXUTSSZPS-GFCCVEGCSA-N	1	0	262.357	1.884	50	0		CDAARO
CC(C)C[N@@H+]1CCN(Cc2cccnc2)C[C@H]1CCO	ZINC000106962304	769027439	/nfs/dbraw/zinc/02/74/39/769027439.db2.gz	MHRPEBBOOJBCJS-MRXNPFEDSA-N	1	0	277.412	1.606	50	0		CDAARO
CC(C)(C)OC(=O)N[C@@H]1CCO[C@H]1C1CC[NH2+]CC1	ZINC000238853512	770736024	/nfs/dbraw/zinc/73/60/24/770736024.db2.gz	JRVKTJYZTOUCBA-NEPJUHHUSA-N	1	0	270.373	1.668	50	0		CDAARO
CC(C)(C)C[C@H]([NH3+])C1(O)CCC2(CC1)OCCO2	ZINC000958528933	771202722	/nfs/dbraw/zinc/20/27/22/771202722.db2.gz	YVQLLQWDJSUHHA-NSHDSACASA-N	1	0	257.374	1.798	50	0		CDAARO
Cn1nccc1C[NH+]1CCC(CNC(=O)C2CCC2)CC1	ZINC001001111174	772455122	/nfs/dbraw/zinc/45/51/22/772455122.db2.gz	WTTIDWNUVVMYSW-UHFFFAOYSA-N	1	0	290.411	1.548	50	0		CDAARO
Cc1nc([C@H]2CCCN2C[C@@H](O)Cn2cccn2)[nH]c1C	ZINC000952994896	772729600	/nfs/dbraw/zinc/72/96/00/772729600.db2.gz	VZYDQTXMAVRPQY-ZIAGYGMSSA-N	1	0	289.383	1.421	50	0		CDAARO
Cc1[nH]nc(C(=O)N(C)C[C@@H]2CCCC[N@@H+]2C)c1Cl	ZINC001506420222	909170041	/nfs/dbraw/zinc/17/00/41/909170041.db2.gz	YWCBJMOZHJGINX-JTQLQIEISA-N	1	0	284.791	1.928	50	0		CDAARO
C[C@H]1CCC(=O)N1c1cccc(NC(=O)CC[NH3+])c1	ZINC001506420348	909175138	/nfs/dbraw/zinc/17/51/38/909175138.db2.gz	DHHAJBUDTDIRJB-JTQLQIEISA-N	1	0	261.325	1.489	50	0		CDAARO
O=C(NCC1(C[NH+]2CCCC2)CC1)[C@@H]1CCOC1	ZINC000827778720	925964753	/nfs/dbraw/zinc/96/47/53/925964753.db2.gz	QQQCXKOXACCWPK-GFCCVEGCSA-N	1	0	252.358	1.015	50	0		CDAARO
O=C(NC[C@@H]1CCC[NH2+]C1)c1cccc2c1CCC2=O	ZINC000828177557	926058370	/nfs/dbraw/zinc/05/83/70/926058370.db2.gz	ULYALVPRUHIQJB-LLVKDONJSA-N	1	0	272.348	1.545	50	0		CDAARO
Nc1cc(C(=O)NCC[N@@H+]2CC[C@H](c3ccccc3)C2)[nH]n1	ZINC000828210104	926072469	/nfs/dbraw/zinc/07/24/69/926072469.db2.gz	PTAKDHBPYBFKRT-ZDUSSCGKSA-N	1	0	299.378	1.211	50	0		CDAARO
Cn1cnc(C[NH2+]C[C@](C)(CO)c2ccccc2)c1	ZINC000585083659	930864142	/nfs/dbraw/zinc/86/41/42/930864142.db2.gz	XADSVFKWBRLAKP-OAHLLOKOSA-N	1	0	259.353	1.460	50	0		CDAARO
Cc1nncn1CC[N@@H+](C)Cc1ccc2nsnc2c1	ZINC001506397350	975148152	/nfs/dbraw/zinc/14/81/52/975148152.db2.gz	SKYYSHVZJVGABE-UHFFFAOYSA-N	1	0	288.380	1.723	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(C(=O)/C=C/c2cnc(N)nc2)CC1	ZINC001506398875	975149129	/nfs/dbraw/zinc/14/91/29/975149129.db2.gz	YPROELPUGKSDNV-URWSZGRFSA-N	1	0	289.383	1.015	50	0		CDAARO
Cc1ccccc1CC1([NH2+][C@H](C)CN(C)CCO)CC1	ZINC001506398723	975149451	/nfs/dbraw/zinc/14/94/51/975149451.db2.gz	SBLCHFAIWZWSRD-OAHLLOKOSA-N	1	0	276.424	1.972	50	0		CDAARO
CC1(C)C[C@H]1C(=O)N1CCOC2(CC[NH2+]CC2)C1	ZINC001506402085	975150507	/nfs/dbraw/zinc/15/05/07/975150507.db2.gz	IJQLPDWXWRZGJL-NSHDSACASA-N	1	0	252.358	1.014	50	0		CDAARO
CSc1cccc(C[NH2+][C@H](C)CN(C)CCO)c1	ZINC001506411711	975154428	/nfs/dbraw/zinc/15/44/28/975154428.db2.gz	KGMBAWPLNRNGAH-GFCCVEGCSA-N	1	0	268.426	1.811	50	0		CDAARO
Cc1nncn1CC[NH+]1CCC(C(F)(F)F)CC1	ZINC001506426889	975160492	/nfs/dbraw/zinc/16/04/92/975160492.db2.gz	UBQVYMIUKNRZFU-UHFFFAOYSA-N	1	0	262.279	1.861	50	0		CDAARO
C[C@H](NC(=O)C[C@@H]1CCOC1)C(C)(C)C[NH+](C)C	ZINC000096449601	230375530	/nfs/dbraw/zinc/37/55/30/230375530.db2.gz	GZIIVSSPQRDQCC-RYUDHWBXSA-N	1	0	256.390	1.506	50	0		CDAARO
CSCC(=O)N(C)C[C@H]1CC[N@H+](CC(C)C)C1	ZINC000584902928	341986917	/nfs/dbraw/zinc/98/69/17/341986917.db2.gz	JGBJWMWMNUIUAH-GFCCVEGCSA-N	1	0	258.431	1.786	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)CCCOC	ZINC000106662021	349446222	/nfs/dbraw/zinc/44/62/22/349446222.db2.gz	ZJLBNLQXAAYJBP-UONOGXRCSA-N	1	0	268.401	1.888	50	0		CDAARO
CO[C@@H](C)CC(=O)NC[C@H]1CCC[N@@H+](C(C)C)C1	ZINC000107320120	398139413	/nfs/dbraw/zinc/13/94/13/398139413.db2.gz	QBYSCYXNMFQLFV-QWHCGFSZSA-N	1	0	256.390	1.648	50	0		CDAARO
COc1ccc(C[NH2+][C@H]2CCCC[C@@H]2C(N)=O)cc1F	ZINC000097375120	342002838	/nfs/dbraw/zinc/00/28/38/342002838.db2.gz	WQBBRKGGPPIIHS-AAEUAGOBSA-N	1	0	280.343	1.968	50	0		CDAARO
CSc1ncccc1C(=O)N1CCC(C[NH3+])CC1	ZINC000096024201	185066362	/nfs/dbraw/zinc/06/63/62/185066362.db2.gz	GKXZESLXAIOOFM-UHFFFAOYSA-N	1	0	265.382	1.614	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)NCc1ccc(F)cc1)C1CCOCC1	ZINC000095985405	185055041	/nfs/dbraw/zinc/05/50/41/185055041.db2.gz	OJXMRDWETHLVAC-GFCCVEGCSA-N	1	0	294.370	1.847	50	0		CDAARO
COc1ccc(OCC[N@H+](C)[C@H](C)C[S@@](C)=O)cc1	ZINC000096012899	185065202	/nfs/dbraw/zinc/06/52/02/185065202.db2.gz	NOGUJTHNANSQPL-BLVKFPJESA-N	1	0	285.409	1.773	50	0		CDAARO
COC(=O)c1cc(C[N@@H+]2CCC[C@@H]([C@H](C)O)C2)n(C)c1C	ZINC000242302207	361756057	/nfs/dbraw/zinc/75/60/57/361756057.db2.gz	YQMFSWGTFMJDKR-QWHCGFSZSA-N	1	0	294.395	1.713	50	0		CDAARO
C[C@@H](CNC(=O)OC(C)(C)C)[N@H+](C)CCn1cncn1	ZINC000242292584	361756260	/nfs/dbraw/zinc/75/62/60/361756260.db2.gz	YNLNNMQHZBOXHK-NSHDSACASA-N	1	0	283.376	1.123	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)c1ccc(F)c(SC)c1	ZINC000195554010	342625819	/nfs/dbraw/zinc/62/58/19/342625819.db2.gz	RVWNWKQMOXIGDM-MNOVXSKESA-N	1	0	284.356	1.264	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)C[C@H](C)c1ccc(F)cc1F	ZINC000195554030	342625845	/nfs/dbraw/zinc/62/58/45/342625845.db2.gz	VIWZOWWZOAMBLT-HERUPUMHSA-N	1	0	298.333	1.561	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1cc(F)c(C)cc1F	ZINC000195544655	342626657	/nfs/dbraw/zinc/62/66/57/342626657.db2.gz	ABXJEZYJCCFDJU-VIFPVBQESA-N	1	0	292.351	1.679	50	0		CDAARO
CCc1noc(CN(C)C(=O)C[C@@H]([NH3+])c2ccccc2)n1	ZINC000119082436	342144325	/nfs/dbraw/zinc/14/43/25/342144325.db2.gz	IVTKBBGIBNBXJS-GFCCVEGCSA-N	1	0	288.351	1.681	50	0		CDAARO
C[NH+]1CCC2(CC1)CN(c1cc(C3CC3)ncn1)CCO2	ZINC000641648778	365686973	/nfs/dbraw/zinc/68/69/73/365686973.db2.gz	QMRQGTZDHPCNGJ-UHFFFAOYSA-N	1	0	288.395	1.655	50	0		CDAARO
COc1ccc(CC[N@H+](C)C[C@@H]2COCCO2)cc1OC	ZINC000244673660	361855567	/nfs/dbraw/zinc/85/55/67/361855567.db2.gz	HTJJKIVRFGXQIG-CQSZACIVSA-N	1	0	295.379	1.594	50	0		CDAARO
O=C(CCN1CC[N@@H+]2CCCC[C@@H]2C1)Nc1nccs1	ZINC000244874653	361867978	/nfs/dbraw/zinc/86/79/78/361867978.db2.gz	XFANRMMNJAONHR-GFCCVEGCSA-N	1	0	294.424	1.642	50	0		CDAARO
CN1CCO[C@@H](CNc2ncnc3ccsc32)C1	ZINC000065554059	361915353	/nfs/dbraw/zinc/91/53/53/361915353.db2.gz	VOVUBZZEAKVMPL-VIFPVBQESA-N	1	0	264.354	1.434	50	0		CDAARO
CN1CCO[C@@H](CNc2ncnc3ccccc32)C1	ZINC000065593904	361918377	/nfs/dbraw/zinc/91/83/77/361918377.db2.gz	ZXRRHMDNTNBYDD-NSHDSACASA-N	1	0	258.325	1.372	50	0		CDAARO
CN(C)C(=O)[C@@H]1CC[C@@H](C[NH2+]C2Cc3ccccc3C2)O1	ZINC000097033466	185156505	/nfs/dbraw/zinc/15/65/05/185156505.db2.gz	UMSTUHBHFYQIIF-HOTGVXAUSA-N	1	0	288.391	1.379	50	0		CDAARO
c1c(-c2nc(-c3ccccc3)no2)nnn1[C@H]1CCC[NH2+]C1	ZINC000424342748	539071810	/nfs/dbraw/zinc/07/18/10/539071810.db2.gz	ZHLWTQPTMRVTPC-LBPRGKRZSA-N	1	0	296.334	1.920	50	0		CDAARO
CSC[C@H](C)NC(=O)N1C[C@@H]2C[N@@H+]3CCCC[C@@H]3[C@@H]2C1	ZINC000098013140	539095136	/nfs/dbraw/zinc/09/51/36/539095136.db2.gz	WWTWCMKWMPGOFA-IGQOVBAYSA-N	1	0	297.468	1.864	50	0		CDAARO
CCCn1cc(C[NH2+][C@@H]2CCN(C(C)=O)C[C@@H]2C)cn1	ZINC000084760614	342268815	/nfs/dbraw/zinc/26/88/15/342268815.db2.gz	RXGQZULKIGPIHH-SWLSCSKDSA-N	1	0	278.400	1.640	50	0		CDAARO
CC1(C)C[C@H]([NH2+]CC[C@@H]2CCOC2=O)C(C)(C)O1	ZINC000119831940	342270495	/nfs/dbraw/zinc/27/04/95/342270495.db2.gz	KVYGHHCBOMYYLC-MNOVXSKESA-N	1	0	255.358	1.875	50	0		CDAARO
C[NH+](C)Cc1ccccc1CNS(=O)(=O)N1CCCC1	ZINC000078722575	342339970	/nfs/dbraw/zinc/33/99/70/342339970.db2.gz	WPJSRVODUKESOT-UHFFFAOYSA-N	1	0	297.424	1.178	50	0		CDAARO
Cc1cc(N2CCC(O)(C(F)(F)F)CC2)nc(C)n1	ZINC000089637023	342391200	/nfs/dbraw/zinc/39/12/00/342391200.db2.gz	PWXCERJYFRNEGH-UHFFFAOYSA-N	1	0	275.274	1.987	50	0		CDAARO
COC(=O)[C@]1(C)CC[N@@H+]([C@@H]2Cc3ccccc3[C@@H]2O)C1	ZINC000095987308	342431820	/nfs/dbraw/zinc/43/18/20/342431820.db2.gz	PQPPUBZEKKLWJE-IJEWVQPXSA-N	1	0	275.348	1.530	50	0		CDAARO
CCOc1ccccc1CCC(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178550839	362246987	/nfs/dbraw/zinc/24/69/87/362246987.db2.gz	HGGPIHUXMRZLEQ-ZDUSSCGKSA-N	1	0	276.380	1.825	50	0		CDAARO
Cc1nn(CC(C)C)c(C)c1CC(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178559773	362246728	/nfs/dbraw/zinc/24/67/28/362246728.db2.gz	ZRDYPROLBUODCQ-AWEZNQCLSA-N	1	0	292.427	1.506	50	0		CDAARO
Cn1cnnc1C1CC[NH+](CCn2cc(Cl)cn2)CC1	ZINC000252481121	362385258	/nfs/dbraw/zinc/38/52/58/362385258.db2.gz	CHYSTXMRYQEXAF-UHFFFAOYSA-N	1	0	294.790	1.545	50	0		CDAARO
CC(C)c1cc(CN2C[C@H](O)[C@@H]([NH+]3CCCCC3)C2)no1	ZINC000252489926	362386431	/nfs/dbraw/zinc/38/64/31/362386431.db2.gz	KEZKVCJRDSLOJI-GJZGRUSLSA-N	1	0	293.411	1.829	50	0		CDAARO
Cc1nnc(CN2CCCN(c3cc[nH+]c(C)c3)CC2)o1	ZINC000252490405	362387408	/nfs/dbraw/zinc/38/74/08/362387408.db2.gz	KSSPCWDNAXTEPN-UHFFFAOYSA-N	1	0	287.367	1.794	50	0		CDAARO
Nc1nc(NCC2(O)CCCCC2)cc([C@H]2C[C@@H](O)C2)[nH+]1	ZINC000252570435	362393520	/nfs/dbraw/zinc/39/35/20/362393520.db2.gz	WTFYSRMDHPMCHK-PHIMTYICSA-N	1	0	292.383	1.404	50	0		CDAARO
C[C@@H](c1cccs1)[N@H+](C)CCc1c[nH]c(=O)n(C)c1=O	ZINC000253536569	362435572	/nfs/dbraw/zinc/43/55/72/362435572.db2.gz	WEKVGRJPRICMIX-JTQLQIEISA-N	1	0	293.392	1.783	50	0		CDAARO
COC(=O)N1CCC[C@H]([NH2+][C@H](C)CCn2cccn2)C1	ZINC000097049730	185514928	/nfs/dbraw/zinc/51/49/28/185514928.db2.gz	VFKWOTXCTXWHKI-OLZOCXBDSA-N	1	0	280.372	1.482	50	0		CDAARO
COC(=O)C1(C[NH2+]Cc2csc(C)n2)CCOCC1	ZINC000097108637	185534619	/nfs/dbraw/zinc/53/46/19/185534619.db2.gz	GFOSLVKNFHFKAV-UHFFFAOYSA-N	1	0	284.381	1.511	50	0		CDAARO
CC[C@@H]1COCCN1C(=O)N[C@H](C)C(C)(C)C[NH+](C)C	ZINC000085425487	179059706	/nfs/dbraw/zinc/05/97/06/179059706.db2.gz	CUXBSKDVLHMOAG-CHWSQXEVSA-N	1	0	285.432	1.783	50	0		CDAARO
O=C(c1ccoc1)N1CCC[N@H+](C[C@H]2CCOC2)CC1	ZINC000055059783	347836095	/nfs/dbraw/zinc/83/60/95/347836095.db2.gz	KHTYXHMIEWDCCQ-CYBMUJFWSA-N	1	0	278.352	1.464	50	0		CDAARO
CC[N@@H+]1C[C@@H](C)[C@@H](NS(=O)(=O)CCc2ccccc2)C1	ZINC000107058989	348423457	/nfs/dbraw/zinc/42/34/57/348423457.db2.gz	SHROLCZMRIKGRM-HIFRSBDPSA-N	1	0	296.436	1.489	50	0		CDAARO
CC1(C(=O)NCC[N@@H+]2CCC[C@@H](CO)C2)CCCCC1	ZINC000584884290	349342535	/nfs/dbraw/zinc/34/25/35/349342535.db2.gz	SFFXMEHGQMACRN-CQSZACIVSA-N	1	0	282.428	1.777	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@H](CN(C)C(=O)c2cncnc2)C1	ZINC000584886377	349344739	/nfs/dbraw/zinc/34/47/39/349344739.db2.gz	FOYNJVIRWRLWFF-CYBMUJFWSA-N	1	0	276.384	1.669	50	0		CDAARO
CN(C)C(=O)[C@H]1CN(C2CC(C)(C)[NH2+]C(C)(C)C2)CCO1	ZINC000584897872	349359730	/nfs/dbraw/zinc/35/97/30/349359730.db2.gz	WUCSYMCRQLHUBU-CYBMUJFWSA-N	1	0	297.443	1.085	50	0		CDAARO
COc1ccc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)o1	ZINC000091364717	180142199	/nfs/dbraw/zinc/14/21/99/180142199.db2.gz	RYSWMQIBBMTIIZ-ZJUUUORDSA-N	1	0	250.298	1.098	50	0		CDAARO
CCO[C@@H]1C[C@H](O)C12CC[NH+](C[C@H](O)CC)CC2	ZINC000110618676	350203880	/nfs/dbraw/zinc/20/38/80/350203880.db2.gz	OEOHHUKMKDUVPJ-FRRDWIJNSA-N	1	0	257.374	1.009	50	0		CDAARO
Cc1c[nH]c(CN2C[C@H]([NH3+])[C@@H](C(C)C)C2)c(C)c1=O	ZINC000091636172	180211664	/nfs/dbraw/zinc/21/16/64/180211664.db2.gz	MBKWSLFCCSFXAC-OLZOCXBDSA-N	1	0	263.385	1.407	50	0		CDAARO
CCOc1ccc(C[NH2+]C[C@@H]2CN(C)CCO2)cc1OC	ZINC000105472195	186059198	/nfs/dbraw/zinc/05/91/98/186059198.db2.gz	HAUIERFBXGNZTE-CQSZACIVSA-N	1	0	294.395	1.514	50	0		CDAARO
COCCN1C(=O)[C@H]2CC[C@@H]1C[N@@H+](Cc1ccsc1)C2	ZINC000091830986	180266171	/nfs/dbraw/zinc/26/61/71/180266171.db2.gz	VXAIRVJKKIBJLU-UONOGXRCSA-N	1	0	294.420	1.817	50	0		CDAARO
CC(C)([NH3+])CNS(=O)(=O)c1ccc2ccccc2c1	ZINC000129635074	187444313	/nfs/dbraw/zinc/44/43/13/187444313.db2.gz	AOSIGLPYOICWHE-UHFFFAOYSA-N	1	0	278.377	1.855	50	0		CDAARO
Cc1c([C@@H](C)NC(=O)C[NH3+])cnn1-c1ccc(F)cc1F	ZINC000091943913	180290171	/nfs/dbraw/zinc/29/01/71/180290171.db2.gz	PBBCBNQIOHPETF-MRVPVSSYSA-N	1	0	294.305	1.595	50	0		CDAARO
Cc1nc(CN2CC3(CC[NH2+]CC3)CCC2=O)cs1	ZINC000091966687	180293652	/nfs/dbraw/zinc/29/36/52/180293652.db2.gz	JMVZOJWNORZZDP-UHFFFAOYSA-N	1	0	279.409	1.944	50	0		CDAARO
CCC[C@]1(CO)CCC[N@H+](CCc2cnn(C)c2)C1	ZINC000091876870	180278734	/nfs/dbraw/zinc/27/87/34/180278734.db2.gz	YTZIYOMUBGYWTM-HNNXBMFYSA-N	1	0	265.401	1.837	50	0		CDAARO
C[NH2+][C@@H]1CCN(C(=O)OCc2ccccc2)C[C@@H]1F	ZINC000107272476	186164377	/nfs/dbraw/zinc/16/43/77/186164377.db2.gz	ABMWQTWKPOPMIO-QWHCGFSZSA-N	1	0	266.316	1.955	50	0		CDAARO
C[NH+](C)Cc1cccc(C(=O)NCC2(C)COC2)c1	ZINC000156428066	188261841	/nfs/dbraw/zinc/26/18/41/188261841.db2.gz	PRHQWTGJYSROMZ-UHFFFAOYSA-N	1	0	262.353	1.515	50	0		CDAARO
c1cnc(N2CCC([NH2+][C@@H]3CN4CCC3CC4)CC2)nc1	ZINC000036932518	363294572	/nfs/dbraw/zinc/29/45/72/363294572.db2.gz	RYALVFDRFOYKIJ-OAHLLOKOSA-N	1	0	287.411	1.129	50	0		CDAARO
CN1CC[C@@H]2CC[N@H+](C[C@H](O)COC(C)(C)C)[C@H]2C1	ZINC000253417076	283076698	/nfs/dbraw/zinc/07/66/98/283076698.db2.gz	LENXEFFBRGIKCU-RDBSUJKOSA-N	1	0	270.417	1.188	50	0		CDAARO
COc1cc(C[NH2+]C2CCCCC2)ccc1OCC(N)=O	ZINC000000349823	355906068	/nfs/dbraw/zinc/90/60/68/355906068.db2.gz	CEJKDAPPEOASFC-UHFFFAOYSA-N	1	0	292.379	1.982	50	0		CDAARO
NC(=[NH2+])NC(=[NH2+])Nc1ccccc1Br	ZINC000000406677	355909609	/nfs/dbraw/zinc/90/96/09/355909609.db2.gz	IMEMWVITMHDQIB-UHFFFAOYSA-N	1	0	256.107	1.279	50	0		CDAARO
O=S(=O)(c1ccccc1)N(C1CC1)C1CC[NH2+]CC1	ZINC000000154345	355891677	/nfs/dbraw/zinc/89/16/77/355891677.db2.gz	GADOCUCQRAEUHG-UHFFFAOYSA-N	1	0	280.393	1.592	50	0		CDAARO
CCOc1ccc(C(=O)NCCC[NH+](C)C)cc1	ZINC000002807150	355983770	/nfs/dbraw/zinc/98/37/70/355983770.db2.gz	ZTUNMDQDSJRSEJ-UHFFFAOYSA-N	1	0	250.342	1.767	50	0		CDAARO
C[C@@H]1CCCN(C(=O)/C=C\c2cccnc2)[C@H]1C[NH3+]	ZINC000255096224	355998723	/nfs/dbraw/zinc/99/87/23/355998723.db2.gz	XOEDMNSBBHARNA-XBWLEZLWSA-N	1	0	259.353	1.681	50	0		CDAARO
COc1ccccc1N1CCN(C2CC[NH2+]CC2)CC1	ZINC000004703411	356040399	/nfs/dbraw/zinc/04/03/99/356040399.db2.gz	JGLHKIWGTIKPEE-UHFFFAOYSA-N	1	0	275.396	1.569	50	0		CDAARO
C[NH+](C)CCOC(=O)c1ccc2c(c1)OCCO2	ZINC000003641324	356007610	/nfs/dbraw/zinc/00/76/10/356007610.db2.gz	JHEGJJVATNSAPK-UHFFFAOYSA-N	1	0	251.282	1.176	50	0		CDAARO
Nc1ccc(C(=O)N2CCN(c3ccccn3)CC2)cc1	ZINC000003884050	356011833	/nfs/dbraw/zinc/01/18/33/356011833.db2.gz	MMRVFMRIJLTGHP-UHFFFAOYSA-N	1	0	282.347	1.626	50	0		CDAARO
C[C@@H]1CCCN(S(=O)(=O)c2ccc(C[NH3+])cc2)C1	ZINC000011849280	356280790	/nfs/dbraw/zinc/28/07/90/356280790.db2.gz	MNZZDOSKBMCICP-LLVKDONJSA-N	1	0	268.382	1.566	50	0		CDAARO
CC(C)(O)[C@H]1CCC[N@H+](CCCCn2cncn2)C1	ZINC000032598109	356308024	/nfs/dbraw/zinc/30/80/24/356308024.db2.gz	DLAMLGGZQNDALU-ZDUSSCGKSA-N	1	0	266.389	1.541	50	0		CDAARO
Cc1cccc(CN2CCC[C@@](O)(C[NH2+]C(C)C)C2=O)c1	ZINC000012572231	356309637	/nfs/dbraw/zinc/30/96/37/356309637.db2.gz	QKKHKKSMUSJUIP-QGZVFWFLSA-N	1	0	290.407	1.847	50	0		CDAARO
CC(C)(C)CN1CCC[C@](O)(C[NH2+]CC2CC2)C1=O	ZINC000012582877	356310116	/nfs/dbraw/zinc/31/01/16/356310116.db2.gz	QDSMVWJWXKIYDF-HNNXBMFYSA-N	1	0	268.401	1.386	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1cc(-c2ccco2)n[nH]1	ZINC000032611211	356312540	/nfs/dbraw/zinc/31/25/40/356312540.db2.gz	KLVXQDAYLYSNQW-UHFFFAOYSA-N	1	0	276.340	1.741	50	0		CDAARO
Cc1cc(NCC(C)(C)C[NH+](C)C)n2ncnc2n1	ZINC000032717163	356347224	/nfs/dbraw/zinc/34/72/24/356347224.db2.gz	VMIRPKWSXFJBBQ-UHFFFAOYSA-N	1	0	262.361	1.432	50	0		CDAARO
C[NH+](C)CCNC(=O)c1cc2c(s1)CCCC2	ZINC000016579915	356442067	/nfs/dbraw/zinc/44/20/67/356442067.db2.gz	QKBVASPZSGFJSJ-UHFFFAOYSA-N	1	0	252.383	1.918	50	0		CDAARO
O=C([C@H]1CCC[NH2+]1)N1CCN(Cc2ccccc2)CC1	ZINC000019413364	356484693	/nfs/dbraw/zinc/48/46/93/356484693.db2.gz	HVHGAJURRVBUQI-OAHLLOKOSA-N	1	0	273.380	1.083	50	0		CDAARO
O=C([C@H]1CCCC[NH2+]1)N1CCN(Cc2ccccc2)CC1	ZINC000019413206	356485117	/nfs/dbraw/zinc/48/51/17/356485117.db2.gz	UOXKEPYIIWANER-MRXNPFEDSA-N	1	0	287.407	1.473	50	0		CDAARO
CCOc1ccccc1OCCCN1CC[NH2+]CC1	ZINC000019728657	356497473	/nfs/dbraw/zinc/49/74/73/356497473.db2.gz	KOZMEYMGOKZJCW-UHFFFAOYSA-N	1	0	264.369	1.759	50	0		CDAARO
CC[NH+]1CCN(CCC(=O)Nc2ccccc2C)CC1	ZINC000019850689	356509929	/nfs/dbraw/zinc/50/99/29/356509929.db2.gz	JUSRNBBFUNUDBE-UHFFFAOYSA-N	1	0	275.396	1.961	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@H](CNC(=O)c2cncnc2)C1	ZINC000273726186	192280629	/nfs/dbraw/zinc/28/06/29/192280629.db2.gz	NFDMLPZDBOPRSK-GFCCVEGCSA-N	1	0	262.357	1.327	50	0		CDAARO
Cc1cc(C)c(OC[C@@H](O)CN2CC[NH+](C)CC2)c(C)c1	ZINC000022029301	356597883	/nfs/dbraw/zinc/59/78/83/356597883.db2.gz	GFPXUMPZAWMVKJ-INIZCTEOSA-N	1	0	292.423	1.599	50	0		CDAARO
CC(C)(C)OC(=O)NCCC[C@H]([NH3+])[C@@H](O)C(F)(F)F	ZINC000034537888	363531051	/nfs/dbraw/zinc/53/10/51/363531051.db2.gz	UHEFDJGMLCIEND-JGVFFNPUSA-N	1	0	286.294	1.542	50	0		CDAARO
Cn1cc(CN2CC[N@H+](C3CCCC3)[C@@H](CCO)C2)cn1	ZINC000023360402	356641512	/nfs/dbraw/zinc/64/15/12/356641512.db2.gz	MKPHOEUPXWCFMJ-INIZCTEOSA-N	1	0	292.427	1.231	50	0		CDAARO
C[C@@H]1C[N@H+](C)C[C@@H]1NS(=O)(=O)Cc1cccc(F)c1	ZINC000078899065	538477027	/nfs/dbraw/zinc/47/70/27/538477027.db2.gz	SQRLRIPLTKSQCW-MFKMUULPSA-N	1	0	286.372	1.195	50	0		CDAARO
Fc1ccc(-c2nc(CN3CC[NH2+]CC3)no2)cc1	ZINC000034904589	356821727	/nfs/dbraw/zinc/82/17/27/356821727.db2.gz	IFNORVNMDHIXDR-UHFFFAOYSA-N	1	0	262.288	1.281	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2CCC[NH2+]C2)CC1	ZINC000036379801	356873357	/nfs/dbraw/zinc/87/33/57/356873357.db2.gz	CGBRVCPIVDANCZ-GFCCVEGCSA-N	1	0	297.399	1.065	50	0		CDAARO
O=C(c1ccc(-c2nc[nH]n2)cc1)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065374626	357532774	/nfs/dbraw/zinc/53/27/74/357532774.db2.gz	PDCAVKFHRDGCHP-KGLIPLIRSA-N	1	0	297.362	1.438	50	0		CDAARO
O=C1CC[C@@H](C[N@H+](Cc2ccncc2)C2CCOCC2)N1	ZINC000065534442	357548166	/nfs/dbraw/zinc/54/81/66/357548166.db2.gz	SKEZYJLJXACDHE-AWEZNQCLSA-N	1	0	289.379	1.341	50	0		CDAARO
[NH2+]=C1S[C@@H]2CS(=O)(=O)C[C@@H]2N1CCc1ccccc1	ZINC000011999732	283271152	/nfs/dbraw/zinc/27/11/52/283271152.db2.gz	SGQUNMIYQVOSKO-NWDGAFQWSA-N	1	0	296.417	1.378	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](NC(=O)c2cc3ccccc3[nH]c2=O)C1	ZINC000067676442	357618236	/nfs/dbraw/zinc/61/82/36/357618236.db2.gz	ZDRFDTICWSWDJN-GHMZBOCLSA-N	1	0	271.320	1.138	50	0		CDAARO
COCc1ncc(C[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)cn1	ZINC000067934282	357638475	/nfs/dbraw/zinc/63/84/75/357638475.db2.gz	SIPHQRQUYKDTEA-CYBMUJFWSA-N	1	0	287.367	1.726	50	0		CDAARO
[NH3+]CC[C@H]1CCCN(C(=O)c2ccc(-c3nc[nH]n3)cc2)C1	ZINC000067955149	357639563	/nfs/dbraw/zinc/63/95/63/357639563.db2.gz	ROHLRXCMSYQBOK-GFCCVEGCSA-N	1	0	299.378	1.673	50	0		CDAARO
Cn1ncc2c1CCC[C@H]2NC(=O)C[C@H]1CSCC[NH2+]1	ZINC000091135234	357708913	/nfs/dbraw/zinc/70/89/13/357708913.db2.gz	ZCEBYVVGTFDTTN-CMPLNLGQSA-N	1	0	294.424	1.009	50	0		CDAARO
c1cn(C[C@@H]2CCCO2)c(-c2cc3n(n2)CC[NH2+]C3)n1	ZINC000072459119	357836773	/nfs/dbraw/zinc/83/67/73/357836773.db2.gz	TVXFISJMCXUQFX-LBPRGKRZSA-N	1	0	273.340	1.029	50	0		CDAARO
c1cn([C@H]2CCSC2)c(-c2cc3n(n2)CC[NH2+]C3)n1	ZINC000072476528	357838180	/nfs/dbraw/zinc/83/81/80/357838180.db2.gz	OYRHLVIOQDGJPD-JTQLQIEISA-N	1	0	275.381	1.528	50	0		CDAARO
C[C@H]([NH2+]CCS(=O)(=O)c1ccccc1)[C@H]1CCCO1	ZINC000097108726	357984343	/nfs/dbraw/zinc/98/43/43/357984343.db2.gz	URJHRYJJCKRWBM-GXTWGEPZSA-N	1	0	283.393	1.617	50	0		CDAARO
COc1ccc2oc([C@H](C)[NH2+]CC(N)=O)c(C)c2c1	ZINC000097112138	357986819	/nfs/dbraw/zinc/98/68/19/357986819.db2.gz	HGFDFTHMGGZXSY-VIFPVBQESA-N	1	0	262.309	1.886	50	0		CDAARO
Cn1ccnc1-c1ccc(N2CCCC[C@H]([NH3+])C2)nn1	ZINC000082121610	358148043	/nfs/dbraw/zinc/14/80/43/358148043.db2.gz	CKZMCKHFGFXDET-NSHDSACASA-N	1	0	272.356	1.195	50	0		CDAARO
CCOc1ccc(N2C[C@H](C)[NH+](CCOC)[C@@H](C)C2)nn1	ZINC000097082678	358183513	/nfs/dbraw/zinc/18/35/13/358183513.db2.gz	FBPVBCOZQWZWRL-STQMWFEESA-N	1	0	294.399	1.421	50	0		CDAARO
CCCC(=O)NC[C@H](c1ccc2c(c1)OCO2)[NH+](C)C	ZINC000012195996	358552575	/nfs/dbraw/zinc/55/25/75/358552575.db2.gz	NPPZIRFIWYLREF-GFCCVEGCSA-N	1	0	278.352	1.934	50	0		CDAARO
Cc1cc(F)cc(S(=O)(=O)N[C@@H]2CCC[C@@H]2C[NH3+])c1	ZINC000195544569	358559752	/nfs/dbraw/zinc/55/97/52/358559752.db2.gz	BNIYWYFVJDFDOE-ZWNOBZJWSA-N	1	0	286.372	1.540	50	0		CDAARO
C[C@H](Cn1cncn1)Nc1cc(N2CCCCC2)ncn1	ZINC000195575126	358567000	/nfs/dbraw/zinc/56/70/00/358567000.db2.gz	BYEQGLZDWHARSX-GFCCVEGCSA-N	1	0	287.371	1.559	50	0		CDAARO
CC[C@H]([NH2+][C@H]1CCc2nc(COC)nn2C1)C1CCC1	ZINC000567336064	358662559	/nfs/dbraw/zinc/66/25/59/358662559.db2.gz	MELDKJCZXWNORX-STQMWFEESA-N	1	0	278.400	1.908	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)NCc1ccc(O)cc1	ZINC000095364599	358686280	/nfs/dbraw/zinc/68/62/80/358686280.db2.gz	DOJFTKBAJJZERH-CQSZACIVSA-N	1	0	262.353	1.883	50	0		CDAARO
CCCCn1ccnc1[C@@H]1CCC[N@H+](CC(=O)N(C)C)C1	ZINC000095367375	358686339	/nfs/dbraw/zinc/68/63/39/358686339.db2.gz	ZDXMBOLFNNDOIQ-CQSZACIVSA-N	1	0	292.427	1.951	50	0		CDAARO
CCCCn1ccnc1[C@H]1CCC[N@H+](CCC(N)=O)C1	ZINC000095376080	358689462	/nfs/dbraw/zinc/68/94/62/358689462.db2.gz	HGHVJBNSSSHUCA-ZDUSSCGKSA-N	1	0	278.400	1.738	50	0		CDAARO
NC(=O)CCN1C[C@H]2CC[C@H](C[N@H+]2Cc2ccccc2)C1	ZINC000095382120	358690306	/nfs/dbraw/zinc/69/03/06/358690306.db2.gz	JJBWUMOKCBUTCN-JKSUJKDBSA-N	1	0	287.407	1.458	50	0		CDAARO
Cc1cc(Cl)ccc1C[NH2+]C[C@@]1(O)CCOC1	ZINC000185308357	358779557	/nfs/dbraw/zinc/77/95/57/358779557.db2.gz	ILOCDYQAJASGEJ-ZDUSSCGKSA-N	1	0	255.745	1.889	50	0		CDAARO
COc1cc(C[N@H+](C)C[C@@H]2COCCO2)cc2c1OCO2	ZINC000097522340	358781648	/nfs/dbraw/zinc/78/16/48/358781648.db2.gz	PTODDMSBJRHPEX-GFCCVEGCSA-N	1	0	295.335	1.271	50	0		CDAARO
CC(C)c1cc(C(=O)N2C[C@H]3CC[C@@H]2C[N@H+](C)C3)n(C)n1	ZINC000097636616	358789695	/nfs/dbraw/zinc/78/96/95/358789695.db2.gz	GQQSZBFPUFQVRO-QWHCGFSZSA-N	1	0	290.411	1.710	50	0		CDAARO
c1cncc(OC2CC[NH+](C[C@@H]3CCOC3)CC2)c1	ZINC000215785803	358903333	/nfs/dbraw/zinc/90/33/33/358903333.db2.gz	NFTJJOQBIIHMFH-ZDUSSCGKSA-N	1	0	262.353	1.961	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)c1cccc(Cn2cccn2)c1	ZINC000216258564	358933462	/nfs/dbraw/zinc/93/34/62/358933462.db2.gz	WQFIVRAQQAGDSH-UHFFFAOYSA-N	1	0	298.390	1.757	50	0		CDAARO
O=C(NCC1CC1)[C@@H]1CCC[N@@H+]([C@H]2CCOC2)C1	ZINC000108101842	358955981	/nfs/dbraw/zinc/95/59/81/358955981.db2.gz	HWBVEDWMDFFTOQ-OLZOCXBDSA-N	1	0	252.358	1.014	50	0		CDAARO
CC[N@@H+]1CC[C@H](NC(=O)c2c(F)cccc2OC)C1	ZINC000219741049	359119749	/nfs/dbraw/zinc/11/97/49/359119749.db2.gz	HVJLSHAICMNFPB-JTQLQIEISA-N	1	0	266.316	1.658	50	0		CDAARO
CC(C)(C)OC(=O)N1C[C@@H]2CCC[N@@H+]2C[C@@H]1CO	ZINC000072233499	359059343	/nfs/dbraw/zinc/05/93/43/359059343.db2.gz	NDMVHLYKYURZNP-WDEREUQCSA-N	1	0	256.346	1.062	50	0		CDAARO
COC(=O)CC1([NH2+]Cc2nnnn2C2CC2)CCCCC1	ZINC000089400643	359127609	/nfs/dbraw/zinc/12/76/09/359127609.db2.gz	ZUEJCOMWGDRGRC-UHFFFAOYSA-N	1	0	293.371	1.364	50	0		CDAARO
CN1CC[NH+](C[C@@H]2CCCN(C(=O)c3cc[nH]c3)C2)CC1	ZINC000221299103	359229880	/nfs/dbraw/zinc/22/98/80/359229880.db2.gz	WPYWKHZBPADYHS-AWEZNQCLSA-N	1	0	290.411	1.114	50	0		CDAARO
Cc1nc(CN2CCC(CO)(C[NH+]3CCCC3)CC2)c[nH]1	ZINC000223180846	359406782	/nfs/dbraw/zinc/40/67/82/359406782.db2.gz	UQCDQHPQUQKLPD-UHFFFAOYSA-N	1	0	292.427	1.388	50	0		CDAARO
C[C@H](C(=O)NCC1(O)CC[NH+](C)CC1)c1ccc(O)cc1	ZINC000223620546	359440069	/nfs/dbraw/zinc/44/00/69/359440069.db2.gz	DEDIRSYPRHSEOF-LBPRGKRZSA-N	1	0	292.379	1.069	50	0		CDAARO
OC1CC(c2cc(NCC[NH+]3CCCCC3)ncn2)C1	ZINC000223646472	359442469	/nfs/dbraw/zinc/44/24/69/359442469.db2.gz	WAKRUQUQWFYZEK-UHFFFAOYSA-N	1	0	276.384	1.613	50	0		CDAARO
C[C@H]([NH2+]CCn1cccn1)C(=O)N1C[C@H](C)C[C@@H](C)C1	ZINC000106787685	299301953	/nfs/dbraw/zinc/30/19/53/299301953.db2.gz	HENGVQGUGQAPNI-MCIONIFRSA-N	1	0	278.400	1.366	50	0		CDAARO
C[C@H](C(N)=O)N1CC[NH+](Cc2cccc3[nH]ccc32)CC1	ZINC000093440431	359934023	/nfs/dbraw/zinc/93/40/23/359934023.db2.gz	GUYVBITURLWSQK-GFCCVEGCSA-N	1	0	286.379	1.159	50	0		CDAARO
CCOc1ccc(S(=O)(=O)N[C@@H]2C[N@H+](C)C[C@H]2C)cc1	ZINC000257366165	359944732	/nfs/dbraw/zinc/94/47/32/359944732.db2.gz	MBJHXTYYLQUTOM-BXUZGUMPSA-N	1	0	298.408	1.314	50	0		CDAARO
CN(C(=O)c1c(F)cc(F)cc1F)[C@@H]1CC[NH2+]C1	ZINC000086996244	360132557	/nfs/dbraw/zinc/13/25/57/360132557.db2.gz	ISBPNCPRVZLQPV-MRVPVSSYSA-N	1	0	258.243	1.538	50	0		CDAARO
Cc1nc(CN2CCC[C@H]([NH2+]C[C@H]3CCCCO3)C2)no1	ZINC000247964534	360276259	/nfs/dbraw/zinc/27/62/59/360276259.db2.gz	PYKGXQHVNLCPEC-UONOGXRCSA-N	1	0	294.399	1.501	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1C(=O)N1CCN([C@@H]2C=CCCC2)CC1	ZINC000248159827	360417520	/nfs/dbraw/zinc/41/75/20/360417520.db2.gz	RXWJXZNFHZUSMX-HUUCEWRRSA-N	1	0	277.412	1.334	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)c2cnc(-c3ccncc3)s2)C1	ZINC000178320973	189106507	/nfs/dbraw/zinc/10/65/07/189106507.db2.gz	HDPGZBDNZHYSCD-LLVKDONJSA-N	1	0	288.376	1.768	50	0		CDAARO
CN(Cc1cnccn1)C(=O)C(C)(C)[NH+]1CCCC1	ZINC000426500076	360677976	/nfs/dbraw/zinc/67/79/76/360677976.db2.gz	IWECUFRKZWOYBA-UHFFFAOYSA-N	1	0	262.357	1.309	50	0		CDAARO
Cc1scnc1CSc1nnc(C[NH3+])n1C	ZINC000426580943	360685258	/nfs/dbraw/zinc/68/52/58/360685258.db2.gz	IXRFUJGMVQDHBX-UHFFFAOYSA-N	1	0	255.372	1.331	50	0		CDAARO
C[NH+]1CCC(CCC(=O)NCc2ncc(Cl)cn2)CC1	ZINC000426651946	360691882	/nfs/dbraw/zinc/69/18/82/360691882.db2.gz	BZNNOHTUZXRBJE-UHFFFAOYSA-N	1	0	296.802	1.868	50	0		CDAARO
Cc1nc(CSc2nnc([C@H]3CCC[NH2+]C3)n2C)no1	ZINC000426362114	360660241	/nfs/dbraw/zinc/66/02/41/360660241.db2.gz	YOWQTDZFEKFEEI-VIFPVBQESA-N	1	0	294.384	1.266	50	0		CDAARO
O=C(NCC[C@@H]1CCC[NH2+]1)NCc1cccc(F)c1F	ZINC000426379586	360661168	/nfs/dbraw/zinc/66/11/68/360661168.db2.gz	APQKZDPKPWFBGE-NSHDSACASA-N	1	0	283.322	1.906	50	0		CDAARO
CC(C)(C)n1cc(C(=O)N2CC[C@H](C[NH3+])C2)cn1	ZINC000178517829	189123457	/nfs/dbraw/zinc/12/34/57/189123457.db2.gz	DSDOBFQKRUKZAX-SNVBAGLBSA-N	1	0	250.346	1.059	50	0		CDAARO
CN(C(=O)c1cccc(Oc2cnccn2)c1)[C@@H]1CC[NH2+]C1	ZINC000179083919	189168075	/nfs/dbraw/zinc/16/80/75/189168075.db2.gz	KXXUWSKTWJODHZ-CYBMUJFWSA-N	1	0	298.346	1.703	50	0		CDAARO
C[NH+]1CCC(C)(C(=O)N2CCC[C@H](c3ncon3)C2)CC1	ZINC000426535667	361004294	/nfs/dbraw/zinc/00/42/94/361004294.db2.gz	RIHLVEUPGOJJPN-LBPRGKRZSA-N	1	0	292.383	1.508	50	0		CDAARO
CCNC(=O)c1cc(OC)ccc1OCCC[NH3+]	ZINC000299778603	200868908	/nfs/dbraw/zinc/86/89/08/200868908.db2.gz	PGSJVGKWLKDVSP-UHFFFAOYSA-N	1	0	252.314	1.173	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)CC[C@H]1CC[C@H](C)O1	ZINC000262586011	361458795	/nfs/dbraw/zinc/45/87/95/361458795.db2.gz	OTMMATUDRJDRDH-RWMBFGLXSA-N	1	0	254.374	1.545	50	0		CDAARO
COc1ccc(S(=O)(=O)N2CCC[C@H]([NH3+])C2)cc1C	ZINC000036297011	361462385	/nfs/dbraw/zinc/46/23/85/361462385.db2.gz	JDMIWOSJVTZZRN-NSHDSACASA-N	1	0	284.381	1.115	50	0		CDAARO
CC(=O)Nc1ccc(C[N@@H+]2CCCC3(C2)OCCO3)cc1	ZINC000184722156	189393591	/nfs/dbraw/zinc/39/35/91/189393591.db2.gz	FWTUXNYBQTVVNK-UHFFFAOYSA-N	1	0	290.363	1.984	50	0		CDAARO
OC[C@H]1CCCN1c1cc(N[C@H]2CCCOC2)ncn1	ZINC000264501503	363952046	/nfs/dbraw/zinc/95/20/46/363952046.db2.gz	QHAVHPHDCDBJCV-NWDGAFQWSA-N	1	0	278.356	1.029	50	0		CDAARO
OC[C@H](Cc1ccc(O)cc1)[NH2+][C@@H]1CCSC1	ZINC000190503593	189566884	/nfs/dbraw/zinc/56/68/84/189566884.db2.gz	OQNDNUHTSOGSRP-NEPJUHHUSA-N	1	0	253.367	1.391	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)c2cnc3ccccc3n2)C1	ZINC000195123751	189672100	/nfs/dbraw/zinc/67/21/00/189672100.db2.gz	QWJQJAHEQSEDQP-LBPRGKRZSA-N	1	0	284.363	1.701	50	0		CDAARO
COc1ccc(CN2CCC([NH+]3CCOCC3)CC2)cn1	ZINC000215940134	189698388	/nfs/dbraw/zinc/69/83/88/189698388.db2.gz	VLCRBRMYJSVSEN-UHFFFAOYSA-N	1	0	291.395	1.387	50	0		CDAARO
Cc1nc(/C=C\C(=O)N2CC[NH2+]C[C@H]2C)cs1	ZINC000606441628	366877359	/nfs/dbraw/zinc/87/73/59/366877359.db2.gz	BXLMSQYLSJBVON-ZBJFTSOASA-N	1	0	251.355	1.285	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](Nc2nc(C(C)C)no2)C1	ZINC000089893675	366956370	/nfs/dbraw/zinc/95/63/70/366956370.db2.gz	DVLRCGOBLGQAJM-LLVKDONJSA-N	1	0	268.361	1.716	50	0		CDAARO
Cc1ccc(F)cc1C(=O)N[C@H]1CC[NH2+]C[C@H]1C	ZINC000094345418	367469452	/nfs/dbraw/zinc/46/94/52/367469452.db2.gz	ZBCSOGYAIKSGKV-MFKMUULPSA-N	1	0	250.317	1.862	50	0		CDAARO
C[C@@H](Oc1cccc(F)c1)C(=O)N1C[C@@H]2C[N@@H+](C)C[C@@H]2C1	ZINC000252478955	367553540	/nfs/dbraw/zinc/55/35/40/367553540.db2.gz	AYAUAKRUMILIJY-UPJWGTAASA-N	1	0	292.354	1.613	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+][C@H](C)[C@@H]2CN(C)CCO2)C1(C)C	ZINC000252486926	367576197	/nfs/dbraw/zinc/57/61/97/367576197.db2.gz	OMBYQXWKUWRLHY-ZOBORPQBSA-N	1	0	270.417	1.499	50	0		CDAARO
C[C@@H]1C[C@@H]1c1ccc(CN(CC(N)=O)C[C@H]2CCCO2)o1	ZINC000252498234	367648472	/nfs/dbraw/zinc/64/84/72/367648472.db2.gz	UHFAWLXFHUMFLW-BZPMIXESSA-N	1	0	292.379	1.869	50	0		CDAARO
Cn1cncc1C[NH2+][C@@H]1CCc2ccccc2OC1	ZINC000377143867	367923827	/nfs/dbraw/zinc/92/38/27/367923827.db2.gz	XRIKHHLQFMTPNL-CYBMUJFWSA-N	1	0	257.337	1.904	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]Cc2nncn2CC)CC1	ZINC000089139138	370114555	/nfs/dbraw/zinc/11/45/55/370114555.db2.gz	ZYAHHUDYAZRSDL-UHFFFAOYSA-N	1	0	281.360	1.009	50	0		CDAARO
O=C(C[N@@H+]1CCC2(CCCC2)C1)N1CCOCC1	ZINC000174271202	372567483	/nfs/dbraw/zinc/56/74/83/372567483.db2.gz	ZSMLXMWQNBIRHT-UHFFFAOYSA-N	1	0	252.358	1.111	50	0		CDAARO
CNC(=O)[C@@H]1C[C@H]([NH3+])CN1Cc1cccc2ccccc21	ZINC000299757208	372745912	/nfs/dbraw/zinc/74/59/12/372745912.db2.gz	JFCZLUOZPKJYQE-HOCLYGCPSA-N	1	0	283.375	1.487	50	0		CDAARO
O=C(C[C@H]1CC[NH2+]C1)N1CC(Oc2cccc(Cl)c2)C1	ZINC000299773187	372752163	/nfs/dbraw/zinc/75/21/63/372752163.db2.gz	CZBZVDMPCZRUJF-LLVKDONJSA-N	1	0	294.782	1.929	50	0		CDAARO
Cc1nccn1CCC(=O)N(C)C[C@H]1CC[N@H+](C)C1(C)C	ZINC000299773515	372753132	/nfs/dbraw/zinc/75/31/32/372753132.db2.gz	DPTBRFAQZWLLLY-CQSZACIVSA-N	1	0	292.427	1.770	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)Nc1cccc(F)c1C	ZINC000299783729	372758491	/nfs/dbraw/zinc/75/84/91/372758491.db2.gz	XVMSGHMUTFWVAG-KBPBESRZSA-N	1	0	295.358	1.975	50	0		CDAARO
Cn1cnc(C(=O)N2CCC[N@@H+](C3CCCCC3)CC2)c1	ZINC000299783992	372759475	/nfs/dbraw/zinc/75/94/75/372759475.db2.gz	YGSBEXRWWRITIQ-UHFFFAOYSA-N	1	0	290.411	1.901	50	0		CDAARO
O=C([C@H]1C[C@@H](c2ccccc2)[N@@H+]2CCC[C@H]12)N1CC(O)C1	ZINC000299799541	372771118	/nfs/dbraw/zinc/77/11/18/372771118.db2.gz	SGFUYGAMGSDUCP-XHSDSOJGSA-N	1	0	286.375	1.415	50	0		CDAARO
CSC[C@H](C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2[NH2+]1	ZINC000239359505	189902186	/nfs/dbraw/zinc/90/21/86/189902186.db2.gz	AEHVWHCDSNMYCY-YFKTTZPYSA-N	1	0	256.415	1.775	50	0		CDAARO
CCn1c(CN2CCC(F)(F)CC2)nnc1[C@H]1C[C@@H]([NH3+])C1	ZINC000244796142	189912349	/nfs/dbraw/zinc/91/23/49/189912349.db2.gz	RTVQOWATQHYLGW-PHIMTYICSA-N	1	0	299.369	1.734	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1CCC[C@H]([C@H](C)NC(=O)NC(C)(C)C)C1	ZINC000108090718	412810627	/nfs/dbraw/zinc/81/06/27/412810627.db2.gz	QTHAVYDBXVPANQ-MELADBBJSA-N	1	0	299.459	1.956	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@@H]1NC(=O)Cc1c(F)cccc1F	ZINC000095048569	373694766	/nfs/dbraw/zinc/69/47/66/373694766.db2.gz	GXCZDYPQUCEUOH-RNCFNFMXSA-N	1	0	268.307	1.764	50	0		CDAARO
CCC[C@@H]1C[C@@H](C(=O)NCC[N@H+]2CC=CCC2)CCO1	ZINC000253431740	373745804	/nfs/dbraw/zinc/74/58/04/373745804.db2.gz	SZEJOWWYBCMIGM-LSDHHAIUSA-N	1	0	280.412	1.960	50	0		CDAARO
Cc1cncc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)c1	ZINC000073989043	373934620	/nfs/dbraw/zinc/93/46/20/373934620.db2.gz	KCHBUNAISLFEEJ-KGLIPLIRSA-N	1	0	259.353	1.699	50	0		CDAARO
Cc1ccc(F)c(C[NH2+]CCCN2CCOCC2)c1	ZINC000116912016	374491492	/nfs/dbraw/zinc/49/14/92/374491492.db2.gz	IRZMKKQISPSQMW-UHFFFAOYSA-N	1	0	266.360	1.946	50	0		CDAARO
CN(CC(F)(F)F)C1CC[NH+](C[C@@H]2CCOC2)CC1	ZINC000095431994	374932658	/nfs/dbraw/zinc/93/26/58/374932658.db2.gz	KNGNWOAVIJGSGB-NSHDSACASA-N	1	0	280.334	1.981	50	0		CDAARO
CC1CC[NH+](C[C@@H](O)COc2cccc(C(N)=O)c2)CC1	ZINC000095439083	374939817	/nfs/dbraw/zinc/93/98/17/374939817.db2.gz	VFPBBPXVCJSXTO-CQSZACIVSA-N	1	0	292.379	1.257	50	0		CDAARO
CCCCSCCC(=O)NCCOCC[NH+](C)C	ZINC000095465026	374962049	/nfs/dbraw/zinc/96/20/49/374962049.db2.gz	VSMOJGKJZPOYCA-UHFFFAOYSA-N	1	0	276.446	1.604	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+][C@@H]2CCN(C)C2=O)C1(CC)CC	ZINC000095408399	374910321	/nfs/dbraw/zinc/91/03/21/374910321.db2.gz	PUUCDHAYXHDYSL-FRRDWIJNSA-N	1	0	268.401	1.791	50	0		CDAARO
COc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)nn1	ZINC000282627807	375096428	/nfs/dbraw/zinc/09/64/28/375096428.db2.gz	AQBSAJVZXLCSMP-OCCSQVGLSA-N	1	0	287.367	1.765	50	0		CDAARO
COc1cncc(N2CC[NH+]([C@H]3C=CCCC3)CC2)n1	ZINC000096406665	375097524	/nfs/dbraw/zinc/09/75/24/375097524.db2.gz	HNMMBHMPTLZZDP-ZDUSSCGKSA-N	1	0	274.368	1.716	50	0		CDAARO
COc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)nn1	ZINC000282627810	375097547	/nfs/dbraw/zinc/09/75/47/375097547.db2.gz	AQBSAJVZXLCSMP-TZMCWYRMSA-N	1	0	287.367	1.765	50	0		CDAARO
C[N@H+](CCO)C1(CNC(=O)C2=CCCC2)CCCCC1	ZINC000095973198	375046264	/nfs/dbraw/zinc/04/62/64/375046264.db2.gz	XHOHJPWNDOREGQ-UHFFFAOYSA-N	1	0	280.412	1.840	50	0		CDAARO
O=C(CC[NH2+][C@H]1CCCSC1)NCc1cccnc1	ZINC000097084510	375146516	/nfs/dbraw/zinc/14/65/16/375146516.db2.gz	LOHFIJMDOGKZMG-ZDUSSCGKSA-N	1	0	279.409	1.573	50	0		CDAARO
C[NH+](C)C1(CNC(=O)C[C@H]2CCOC2)CCCC1	ZINC000352161330	375823693	/nfs/dbraw/zinc/82/36/93/375823693.db2.gz	BCDGHTIAPKXAMI-GFCCVEGCSA-N	1	0	254.374	1.404	50	0		CDAARO
Cc1nn(C)c(C)c1C[NH2+][C@@H]([C@@H](CO)C1CC1)C1CC1	ZINC000449498945	375891239	/nfs/dbraw/zinc/89/12/39/375891239.db2.gz	BVDMEIBAEOZKKX-JKSUJKDBSA-N	1	0	277.412	1.924	50	0		CDAARO
CC(=O)N1CCC([NH2+][C@@H](C(C)C)[C@@H](CO)C(C)C)CC1	ZINC000449513613	375898486	/nfs/dbraw/zinc/89/84/86/375898486.db2.gz	TXVPNJBCEVWDGW-HOTGVXAUSA-N	1	0	284.444	1.876	50	0		CDAARO
Cc1cc(C(=O)N2CC[NH2+]C[C@@H]2C)c(F)cc1F	ZINC000126143472	376631534	/nfs/dbraw/zinc/63/15/34/376631534.db2.gz	DLHOBHGLVUOTKH-VIFPVBQESA-N	1	0	254.280	1.707	50	0		CDAARO
C[NH+]1CCC(NC(=O)c2[nH]nnc2-c2ccccc2)CC1	ZINC000188913872	377096040	/nfs/dbraw/zinc/09/60/40/377096040.db2.gz	GZAUTXZJHZJRLG-UHFFFAOYSA-N	1	0	285.351	1.296	50	0		CDAARO
Cc1cc(S(=O)(=O)NCCC[NH+](C)C)ccc1F	ZINC000041091225	379327716	/nfs/dbraw/zinc/32/77/16/379327716.db2.gz	AOCWFBKPFUNREX-UHFFFAOYSA-N	1	0	274.361	1.364	50	0		CDAARO
NC(=O)C[NH+]1CCC(COCc2ccccc2)CC1	ZINC000070644103	379433239	/nfs/dbraw/zinc/43/32/39/379433239.db2.gz	NSDMDCXYKPAEJG-UHFFFAOYSA-N	1	0	262.353	1.401	50	0		CDAARO
O=C1NC(=O)[C@@](CCc2ccccc2)(C2CC[NH2+]CC2)N1	ZINC000067804708	284863086	/nfs/dbraw/zinc/86/30/86/284863086.db2.gz	ZZQQBMLEXRCFJO-MRXNPFEDSA-N	1	0	287.363	1.197	50	0		CDAARO
C[N@H+](CCO)C1CCN(CC2=CCCCC2)CC1	ZINC000450371813	251251396	/nfs/dbraw/zinc/25/13/96/251251396.db2.gz	KLJJSCNDYSHHIL-UHFFFAOYSA-N	1	0	252.402	1.875	50	0		CDAARO
COc1ccc(NC(=O)N2C[C@@H]3CC[NH2+][C@@H]3C2)c(C)c1	ZINC000426433700	256860850	/nfs/dbraw/zinc/86/08/50/256860850.db2.gz	UJXRSMFYXNYLHT-SMDDNHRTSA-N	1	0	275.352	1.829	50	0		CDAARO
Cc1nc(C)c(C[NH+]2CCC(S(N)(=O)=O)CC2)s1	ZINC000095441996	256880606	/nfs/dbraw/zinc/88/06/06/256880606.db2.gz	QBQQEJQPWLVREH-UHFFFAOYSA-N	1	0	289.426	1.013	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+]C2CCN(C(N)=O)CC2)C12CCC2	ZINC000095423212	184978189	/nfs/dbraw/zinc/97/81/89/184978189.db2.gz	SWZGEPMRPCSIBZ-QWHCGFSZSA-N	1	0	281.400	1.467	50	0		CDAARO
CN(CC[NH+]1CCCC1)C(=O)[C@H](O)C1CCCCC1	ZINC000437856593	390405567	/nfs/dbraw/zinc/40/55/67/390405567.db2.gz	XJCVEZJZIUTSIW-CQSZACIVSA-N	1	0	268.401	1.482	50	0		CDAARO
CC[C@H](O)[C@@H]1CCCC[N@@H+]1C[C@H](O)CN1CCC(C)CC1	ZINC000096424713	390515707	/nfs/dbraw/zinc/51/57/07/390515707.db2.gz	VOJUROBBYILNPW-IKGGRYGDSA-N	1	0	298.471	1.705	50	0		CDAARO
CCc1ccc(CN2CCOC[C@@H](C[NH+](C)C)C2)nc1	ZINC000072156309	390625371	/nfs/dbraw/zinc/62/53/71/390625371.db2.gz	VGHUQYKTXZQCHA-HNNXBMFYSA-N	1	0	277.412	1.654	50	0		CDAARO
Cc1noc(C)c1NC(=O)N1CC[C@@H]2CC[C@H](C1)[N@@H+]2C	ZINC000072941851	390634144	/nfs/dbraw/zinc/63/41/44/390634144.db2.gz	BWSGPJIZIMMINF-NWDGAFQWSA-N	1	0	278.356	1.992	50	0		CDAARO
CN1CCc2ncnc(N3CCC[N@@H+]4CCC[C@@H]4C3)c2C1	ZINC000065539115	390942177	/nfs/dbraw/zinc/94/21/77/390942177.db2.gz	JTWBHWTXNXWCQU-CYBMUJFWSA-N	1	0	287.411	1.139	50	0		CDAARO
CCc1[nH+]c(N)nc(N2CCC[C@@H](O)CC2)c1C	ZINC000095366427	390910996	/nfs/dbraw/zinc/91/09/96/390910996.db2.gz	HBPLEEYECCKLCQ-SNVBAGLBSA-N	1	0	250.346	1.281	50	0		CDAARO
Cc1csc2c1ncnc2N1CCC[N@H+](CCO)CC1	ZINC000191141721	391460815	/nfs/dbraw/zinc/46/08/15/391460815.db2.gz	GBVLMHOIRSGCLL-UHFFFAOYSA-N	1	0	292.408	1.504	50	0		CDAARO
CSC[C@H](C)[N@H+]1CCC(=O)N(CC(C)C)CC1	ZINC000012218985	391417134	/nfs/dbraw/zinc/41/71/34/391417134.db2.gz	AXALMBQLVQQDHV-LBPRGKRZSA-N	1	0	258.431	1.928	50	0		CDAARO
O=C(NC[C@H](O)c1ccccc1F)[C@H]1CCCC[NH2+]1	ZINC000269099511	132111430	/nfs/dbraw/zinc/11/14/30/132111430.db2.gz	QLQQXJQCQMSLLA-OLZOCXBDSA-N	1	0	266.316	1.117	50	0		CDAARO
C[C@@H]1CCC[C@H](NC(=O)NC(=O)C[NH+]2CCCC2)[C@H]1C	ZINC000102445000	397605861	/nfs/dbraw/zinc/60/58/61/397605861.db2.gz	PGPHIJIVTGBTSX-AGIUHOORSA-N	1	0	281.400	1.733	50	0		CDAARO
C[NH2+]CCC(=O)N1CCc2c(cnn2-c2ccccc2)C1	ZINC000262525759	149072532	/nfs/dbraw/zinc/07/25/32/149072532.db2.gz	LHIBXSDFTIIVHJ-UHFFFAOYSA-N	1	0	284.363	1.367	50	0		CDAARO
COc1ccc(OC)c([C@@H](C[NH3+])N2CCCC2)c1	ZINC000032497116	286343505	/nfs/dbraw/zinc/34/35/05/286343505.db2.gz	CIOILIJGKPQPDM-CYBMUJFWSA-N	1	0	250.342	1.799	50	0		CDAARO
O=C(c1cn2ccccc2n1)N1CCC[C@]2(CC[NH2+]C2)C1	ZINC000367408540	159483090	/nfs/dbraw/zinc/48/30/90/159483090.db2.gz	VTRHLPAHILRVGB-MRXNPFEDSA-N	1	0	284.363	1.550	50	0		CDAARO
COc1ccc(C[NH+]2CCC(C(N)=O)CC2)cc1OC	ZINC000004715626	170004281	/nfs/dbraw/zinc/00/42/81/170004281.db2.gz	SHMNGPIOUXLIAU-UHFFFAOYSA-N	1	0	278.352	1.401	50	0		CDAARO
CCOc1cc(C[NH2+]CCO)c(Cl)cc1OC	ZINC000004840532	170027632	/nfs/dbraw/zinc/02/76/32/170027632.db2.gz	AUQHBHWWFZQAQM-UHFFFAOYSA-N	1	0	259.733	1.829	50	0		CDAARO
COC[C@H](C)[NH2+]Cc1cc(OC)c(OC)c(OC)c1	ZINC000004891748	170036939	/nfs/dbraw/zinc/03/69/39/170036939.db2.gz	CKPZKSIJNFEQTD-JTQLQIEISA-N	1	0	269.341	1.837	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)cc1OC	ZINC000004988956	170050050	/nfs/dbraw/zinc/05/00/50/170050050.db2.gz	AVVRUCRJLFLQQK-GFCCVEGCSA-N	1	0	278.352	1.401	50	0		CDAARO
Cn1nnnc1SCCC[NH2+]Cc1ccc(F)cc1	ZINC000004993801	170051774	/nfs/dbraw/zinc/05/17/74/170051774.db2.gz	VUUMDFPWPMWMJQ-UHFFFAOYSA-N	1	0	281.360	1.621	50	0		CDAARO
C[NH+](C)CCCNc1c(N)c(=O)oc2ccccc21	ZINC000018008829	170740251	/nfs/dbraw/zinc/74/02/51/170740251.db2.gz	KMNGZZDRRKDPKH-UHFFFAOYSA-N	1	0	261.325	1.739	50	0	biogenic	CDAARO
Cc1nc(C)c(C[N@H+](C)CCN2CCOCC2)s1	ZINC000020254685	171108119	/nfs/dbraw/zinc/10/81/19/171108119.db2.gz	XOHJBZINHMYKKE-UHFFFAOYSA-N	1	0	269.414	1.524	50	0		CDAARO
C[N@H+](CCc1cn[nH]c1)C[C@@H]1COc2ccccc2O1	ZINC000020450027	171207742	/nfs/dbraw/zinc/20/77/42/171207742.db2.gz	VDOFZMUNPHVDGL-CYBMUJFWSA-N	1	0	273.336	1.724	50	0		CDAARO
CC[NH+]1CCN([C@@H](C)C(=O)Nc2ccc(F)cc2)CC1	ZINC000022786864	171398673	/nfs/dbraw/zinc/39/86/73/171398673.db2.gz	VURVBIXCJLHINM-LBPRGKRZSA-N	1	0	279.359	1.790	50	0		CDAARO
CCSc1nc2c(cnn2CC[NH3+])c(NCC(C)C)n1	ZINC000026421764	171483440	/nfs/dbraw/zinc/48/34/40/171483440.db2.gz	KDVCHLVODCPKQI-UHFFFAOYSA-N	1	0	294.428	1.965	50	0		CDAARO
COc1ccccc1CN(C)C(=O)[C@@H]1CCCC[NH2+]1	ZINC000038059143	174069443	/nfs/dbraw/zinc/06/94/43/174069443.db2.gz	SECUNQHOBQNXFQ-ZDUSSCGKSA-N	1	0	262.353	1.796	50	0		CDAARO
CC[C@H]1CCCCN1C(=O)[C@@H](C)[NH+]1CCC(O)CC1	ZINC000043302522	175002419	/nfs/dbraw/zinc/00/24/19/175002419.db2.gz	OHODJYRRCHOAHZ-OLZOCXBDSA-N	1	0	268.401	1.623	50	0		CDAARO
CCOc1ccccc1C[N@H+](C[C@@H](O)CO)C1CC1	ZINC000055369322	175576873	/nfs/dbraw/zinc/57/68/73/175576873.db2.gz	PJQKORZHNDMRNC-CQSZACIVSA-N	1	0	265.353	1.403	50	0		CDAARO
O=C(c1ccc(CN[C@@H]2CCC[NH2+]C2)cc1)N1CCCC1	ZINC000071278753	176108100	/nfs/dbraw/zinc/10/81/00/176108100.db2.gz	WRWFNNINSCENTH-MRXNPFEDSA-N	1	0	287.407	1.764	50	0		CDAARO
[NH3+]CC(=O)N1CCC[C@H](Nc2ccc(F)cc2)C1	ZINC000072125479	176320572	/nfs/dbraw/zinc/32/05/72/176320572.db2.gz	WCSYTFRIMRFRLC-LBPRGKRZSA-N	1	0	251.305	1.187	50	0		CDAARO
CN1CC2(CC[NH+](CCCn3cccc3)CC2)OC1=O	ZINC000077471369	177272348	/nfs/dbraw/zinc/27/23/48/177272348.db2.gz	QPKSBDWUQQEVLL-UHFFFAOYSA-N	1	0	277.368	1.795	50	0		CDAARO
COc1ccc(NC(=O)CN2CCC([NH3+])CC2)c(OC)c1	ZINC000019688424	260114528	/nfs/dbraw/zinc/11/45/28/260114528.db2.gz	BBJVXAXXVXFCDH-UHFFFAOYSA-N	1	0	293.367	1.065	50	0		CDAARO
C[C@H](C(=O)Nc1cccc(F)c1)N1CC[NH2+]CC1	ZINC000019977568	260115361	/nfs/dbraw/zinc/11/53/61/260115361.db2.gz	CRGIBILRUDDOAP-SNVBAGLBSA-N	1	0	251.305	1.058	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)CCOc2ccc(F)cc2)C1	ZINC000178535328	261397676	/nfs/dbraw/zinc/39/76/76/261397676.db2.gz	MWBZQIVHFAYUHR-NSHDSACASA-N	1	0	266.316	1.402	50	0		CDAARO
C[NH+]1CCN(c2nc3ccccc3n3cnnc23)CC1	ZINC000004793594	273900911	/nfs/dbraw/zinc/90/09/11/273900911.db2.gz	UUBLPRADOSQTNR-UHFFFAOYSA-N	1	0	268.324	1.029	50	0		CDAARO
CC1(C)CC(Nc2ccc3nnnn3n2)CC(C)(C)[NH2+]1	ZINC000012815700	275809103	/nfs/dbraw/zinc/80/91/03/275809103.db2.gz	CIVALLGXNRKVLF-UHFFFAOYSA-N	1	0	275.360	1.240	50	0		CDAARO
CC1(C)NC(=[NH2+])NC(=N)N1c1ccccc1C(F)(F)F	ZINC000000071375	275875825	/nfs/dbraw/zinc/87/58/25/275875825.db2.gz	NQJSJMOZDIIQHJ-UHFFFAOYSA-N	1	0	285.273	1.891	50	0		CDAARO
CC1(C)Cc2nc(N3CCOCC3)ncc2[C@H]([NH3+])C1	ZINC000047218877	276151511	/nfs/dbraw/zinc/15/15/11/276151511.db2.gz	GCMJQJPFPCEJSY-LLVKDONJSA-N	1	0	262.357	1.285	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1N1CCC2(C[C@H](O)CO2)CC1	ZINC000095392085	276682761	/nfs/dbraw/zinc/68/27/61/276682761.db2.gz	NGDDMCGONKVUOI-NSHDSACASA-N	1	0	292.383	1.050	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+][C@H]1C[C@H](C)N(C2CC2)C1	ZINC000097081557	277048567	/nfs/dbraw/zinc/04/85/67/277048567.db2.gz	DSJQXTFZCMWRTL-QWRGUYRKSA-N	1	0	254.374	1.400	50	0		CDAARO
CNC(=O)NC(=O)[C@@H](C)[N@H+](C)Cc1ccccc1C	ZINC000007844903	277236148	/nfs/dbraw/zinc/23/61/48/277236148.db2.gz	LQFGHWKYOLTRTA-LLVKDONJSA-N	1	0	263.341	1.271	50	0		CDAARO
COC(=O)CC1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1	ZINC000089886835	277315207	/nfs/dbraw/zinc/31/52/07/277315207.db2.gz	MHOKJCRWCGYSAY-STQMWFEESA-N	1	0	255.358	1.565	50	0		CDAARO
CC[C@H](O)C[N@@H+]1CC[C@H](N(C)C(=O)OC(C)(C)C)C1	ZINC000096455389	288112991	/nfs/dbraw/zinc/11/29/91/288112991.db2.gz	NINIPMHHPVAVGG-RYUDHWBXSA-N	1	0	272.389	1.699	50	0		CDAARO
Cn1cnnc1C1CC[NH+](C[C@H]2CCOC2)CC1	ZINC000097515016	279392976	/nfs/dbraw/zinc/39/29/76/279392976.db2.gz	ZACORYPHHCQSOZ-LLVKDONJSA-N	1	0	250.346	1.031	50	0		CDAARO
Cc1cccc2nc(C(=O)N[C@H]3CC[C@H]3[NH3+])c(F)n21	ZINC000072129148	281316002	/nfs/dbraw/zinc/31/60/02/281316002.db2.gz	CQUSHAOMATUMOV-BDAKNGLRSA-N	1	0	262.288	1.001	50	0		CDAARO
CC1(C)C[C@H]([NH2+]CC2(CS(C)(=O)=O)CC2)C(C)(C)O1	ZINC000090183072	281356906	/nfs/dbraw/zinc/35/69/06/281356906.db2.gz	MMUNAMYKZLFTPU-NSHDSACASA-N	1	0	289.441	1.747	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1N1CCC2(C[C@@H](O)CO2)CC1	ZINC000095392086	281368402	/nfs/dbraw/zinc/36/84/02/281368402.db2.gz	NGDDMCGONKVUOI-LLVKDONJSA-N	1	0	292.383	1.050	50	0		CDAARO
COCCn1cnnc1CNC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000067974392	292739876	/nfs/dbraw/zinc/73/98/76/292739876.db2.gz	QBKWGLQTAFZNLG-UHFFFAOYSA-N	1	0	295.431	1.323	50	0		CDAARO
CC[C@H]([NH2+][C@@H]1CCc2nc(COC)nn2C1)C1CCC1	ZINC000567336062	293761280	/nfs/dbraw/zinc/76/12/80/293761280.db2.gz	MELDKJCZXWNORX-OLZOCXBDSA-N	1	0	278.400	1.908	50	0		CDAARO
CO[C@]1(C)C[C@@H](N(C)C(=O)[C@H]2CCC[NH2+]C2)C1(C)C	ZINC000246725648	294842097	/nfs/dbraw/zinc/84/20/97/294842097.db2.gz	OJRXYJZVMZASFW-YWPYICTPSA-N	1	0	268.401	1.648	50	0		CDAARO
O=C(C[NH+]1CCCCCCC1)NCC1(CO)CCCC1	ZINC000534584183	328311409	/nfs/dbraw/zinc/31/14/09/328311409.db2.gz	QFKUXHGIUOBRFF-UHFFFAOYSA-N	1	0	282.428	1.921	50	0		CDAARO
CCN(Cc1cnn(CC)c1)C(=O)NC[C@H](C)[NH+](C)C	ZINC000534584239	328311766	/nfs/dbraw/zinc/31/17/66/328311766.db2.gz	SMKOHKDPUUGQDQ-LBPRGKRZSA-N	1	0	281.404	1.385	50	0		CDAARO
CCC[C@@H](CNc1ncccc1C(N)=O)[NH+](C)C	ZINC000534582439	328312364	/nfs/dbraw/zinc/31/23/64/328312364.db2.gz	BCDLZHOXDHQNOG-JTQLQIEISA-N	1	0	250.346	1.323	50	0		CDAARO
Cc1ccc(CCC(=O)NC[C@@H]2CC[NH2+]C[C@H]2O)c(C)c1	ZINC000534582479	328312397	/nfs/dbraw/zinc/31/23/97/328312397.db2.gz	XFUDEGZHGKRTPX-JKSUJKDBSA-N	1	0	290.407	1.323	50	0		CDAARO
c1sc(-c2cnccn2)nc1C[NH2+][C@@H]1CCCOC1	ZINC000534581906	328312415	/nfs/dbraw/zinc/31/24/15/328312415.db2.gz	CCKVKUWJFDBVLO-SNVBAGLBSA-N	1	0	276.365	1.869	50	0		CDAARO
O=C(Cc1ccc(F)c(F)c1)N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000534587758	328316272	/nfs/dbraw/zinc/31/62/72/328316272.db2.gz	SXKRUWJAYQEOJE-HGSJOUDDSA-N	1	0	292.329	1.716	50	0		CDAARO
CNc1nc(C(=O)N[C@H](C)c2nc(C)c[nH]2)cs1	ZINC000534590117	328317740	/nfs/dbraw/zinc/31/77/40/328317740.db2.gz	PFZLWGZDXXAHOP-SSDOTTSWSA-N	1	0	265.342	1.129	50	0		CDAARO
O=C(NCCSCc1ccccc1)[C@H]1C=CC[NH2+]1	ZINC000534645424	328330652	/nfs/dbraw/zinc/33/06/52/328330652.db2.gz	QKVNMJDTZCRGGF-CYBMUJFWSA-N	1	0	262.378	1.564	50	0		CDAARO
OCC1CCN(CC[NH2+]C2CSCCSC2)CC1	ZINC000534646033	328332499	/nfs/dbraw/zinc/33/24/99/328332499.db2.gz	BOKFCEAQMCCYQD-UHFFFAOYSA-N	1	0	290.498	1.129	50	0		CDAARO
COCC1(CNC(=O)[C@H]2CCC[N@H+](C)C2)CCCC1	ZINC000534649171	328343736	/nfs/dbraw/zinc/34/37/36/328343736.db2.gz	FNZBIUMNYZSSGH-ZDUSSCGKSA-N	1	0	268.401	1.651	50	0		CDAARO
Cc1ccc(CC2([NH2+][C@@H](C)CN(C)CCO)CC2)cc1	ZINC000534659609	328342237	/nfs/dbraw/zinc/34/22/37/328342237.db2.gz	QIPPXIDOQKFTKS-HNNXBMFYSA-N	1	0	276.424	1.972	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCNC(=O)c2cnc(N)s2)C1	ZINC000534659548	328342304	/nfs/dbraw/zinc/34/23/04/328342304.db2.gz	QSAFEEKARZSSGR-SECBINFHSA-N	1	0	268.386	1.017	50	0		CDAARO
C[NH+](C)CCN1CC(=O)Nc2ccc(Cl)cc2C1=O	ZINC000534649230	328343927	/nfs/dbraw/zinc/34/39/27/328343927.db2.gz	AQEZVJVPDRTUIW-UHFFFAOYSA-N	1	0	281.743	1.296	50	0		CDAARO
CCCS(=O)(=O)N1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1	ZINC000019867995	326857785	/nfs/dbraw/zinc/85/77/85/326857785.db2.gz	ZVQNHYCDCXZQPZ-KGLIPLIRSA-N	1	0	288.457	1.923	50	0		CDAARO
COC[C@@H](O)CN1CCC([NH2+]Cc2cccc(C)c2)CC1	ZINC000089800813	327173588	/nfs/dbraw/zinc/17/35/88/327173588.db2.gz	QQWMSFRMJULHMO-KRWDZBQOSA-N	1	0	292.423	1.556	50	0		CDAARO
CCc1nnsc1C(=O)N1CCCC[C@H]1[C@H](C)[NH3+]	ZINC000087455706	330373056	/nfs/dbraw/zinc/37/30/56/330373056.db2.gz	TXMLJYFMWXJBQI-WPRPVWTQSA-N	1	0	268.386	1.442	50	0		CDAARO
FC(F)(F)[C@]1(c2nc(-c3ccncc3)no2)CC[NH2+]C1	ZINC000111240731	330381697	/nfs/dbraw/zinc/38/16/97/330381697.db2.gz	HHBHCPRLXOKQFR-LLVKDONJSA-N	1	0	284.241	1.925	50	0		CDAARO
COc1nc(N2CC([N@@H+]3CCCC[C@H]3C)C2)ncc1F	ZINC001772703417	1159437744	/nfs/dbraw/zinc/43/77/44/1159437744.db2.gz	MZSHECGKJLCJAQ-SNVBAGLBSA-N	1	0	280.347	1.687	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)NC[C@H]1CC[C@H](CO)CC1	ZINC000670441100	482985823	/nfs/dbraw/zinc/98/58/23/482985823.db2.gz	PERYUGFHAUCUSS-SHTZXODSSA-N	1	0	282.428	1.777	50	0		CDAARO
O=C1CN(Cc2cccc(OC(F)(F)F)c2)CCCN1	ZINC000670452408	483018803	/nfs/dbraw/zinc/01/88/03/483018803.db2.gz	HUQOYSSKQSRVGY-UHFFFAOYSA-N	1	0	288.269	1.907	50	0		CDAARO
CCc1noc(CC[NH2+][C@@H](C)CC(C)(C)OC)n1	ZINC000670452913	483022616	/nfs/dbraw/zinc/02/26/16/483022616.db2.gz	MQYUOZNHYJXZTO-JTQLQIEISA-N	1	0	255.362	1.968	50	0		CDAARO
O=c1c2c(Cl)cccc2ncn1C[C@@H]1CC[NH2+]C[C@H]1O	ZINC000670457247	483036860	/nfs/dbraw/zinc/03/68/60/483036860.db2.gz	JDEGUMPOBRAKRQ-JOYOIKCWSA-N	1	0	293.754	1.020	50	0		CDAARO
C[N@H+](Cc1cnc2ccccc2n1)[C@@H]1CCNC(=O)CC1	ZINC000670468965	483061056	/nfs/dbraw/zinc/06/10/56/483061056.db2.gz	PBKQRFWOSBKXEM-ZDUSSCGKSA-N	1	0	284.363	1.730	50	0		CDAARO
O=C(NCC[N@H+]1CCCC[C@H]1CO)c1ccc(Cl)cn1	ZINC000670473353	483083618	/nfs/dbraw/zinc/08/36/18/483083618.db2.gz	LNPUMFQWZNMHPZ-LBPRGKRZSA-N	1	0	297.786	1.312	50	0		CDAARO
COc1cc(C[NH2+]CC2(O)CCCC2)cc2c1OCCO2	ZINC000096479136	533870769	/nfs/dbraw/zinc/87/07/69/533870769.db2.gz	MGLROZZVVCBPCC-UHFFFAOYSA-N	1	0	293.363	1.861	50	0		CDAARO
C[C@@H](CNS(=O)(=O)CCCF)[N@@H+]1CCCC[C@@H]1C	ZINC000096456111	534066437	/nfs/dbraw/zinc/06/64/37/534066437.db2.gz	XWISNMFQUKEOSU-RYUDHWBXSA-N	1	0	280.409	1.528	50	0		CDAARO
C[NH+](C)C[C@H]1CCN(S(=O)(=O)CC2CCCC2)C1	ZINC000178340243	535965524	/nfs/dbraw/zinc/96/55/24/535965524.db2.gz	RCOHXIFJDPSONJ-CYBMUJFWSA-N	1	0	274.430	1.390	50	0		CDAARO
Cc1cccc(Cl)c1NC(=O)N[C@@H]1C[NH2+]C[C@H]1O	ZINC000426386894	534733228	/nfs/dbraw/zinc/73/32/28/534733228.db2.gz	LYSVBJPHSLHUEY-NXEZZACHSA-N	1	0	269.732	1.103	50	0		CDAARO
CCC[C@@H]1CN(C(=O)C2CC2)CC[N@@H+]1CCOC	ZINC000096487593	527776723	/nfs/dbraw/zinc/77/67/23/527776723.db2.gz	QHTYUQOHYOPLHZ-CYBMUJFWSA-N	1	0	254.374	1.356	50	0		CDAARO
CC[C@@H]([NH2+]Cc1cc(=O)n2ccsc2n1)[C@@H]1CCCO1	ZINC000182367842	535805400	/nfs/dbraw/zinc/80/54/00/535805400.db2.gz	BTFRYZFNYNMUND-NEPJUHHUSA-N	1	0	293.392	1.803	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1C(=O)N1CCN([C@H]2C=CCCC2)CC1	ZINC000178732492	536370080	/nfs/dbraw/zinc/37/00/80/536370080.db2.gz	RXWJXZNFHZUSMX-LSDHHAIUSA-N	1	0	277.412	1.334	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]Cc1cccnc1-n1cccn1	ZINC000097159353	567904842	/nfs/dbraw/zinc/90/48/42/567904842.db2.gz	ZVSVVPACOPFXOK-UHFFFAOYSA-N	1	0	282.351	1.897	50	0		CDAARO
Brc1cncc(SCC2=[NH+]CCN2)c1	ZINC000757210063	577036265	/nfs/dbraw/zinc/03/62/65/577036265.db2.gz	HWNODIXZPQBDLO-UHFFFAOYSA-N	1	0	272.171	1.938	50	0		CDAARO
O=C(Cc1cc[nH]n1)NC[C@@H](c1ccccc1)[NH+]1CCCC1	ZINC000120670393	620286526	/nfs/dbraw/zinc/28/65/26/620286526.db2.gz	SPVABUKEIRNZCV-INIZCTEOSA-N	1	0	298.390	1.906	50	0		CDAARO
CCc1[nH+]c(N)nc(N2CCC[C@@H](NC(C)=O)C2)c1C	ZINC001772711842	1159445058	/nfs/dbraw/zinc/44/50/58/1159445058.db2.gz	GHSWFQZUSGMERK-LLVKDONJSA-N	1	0	277.372	1.035	50	0		CDAARO
NS(=O)(=O)C[C@H]1CCCC[N@@H+]1CCCc1ccccc1	ZINC000585133644	1164216860	/nfs/dbraw/zinc/21/68/60/1164216860.db2.gz	OXSNASYYJZEHGW-OAHLLOKOSA-N	1	0	296.436	1.762	50	0		CDAARO
O[C@@H]1C[N@H+](Cc2cncs2)C[C@H]1Cc1ccccn1	ZINC001704341487	1177695153	/nfs/dbraw/zinc/69/51/53/1177695153.db2.gz	UKRBVJSKXMTLBH-BXUZGUMPSA-N	1	0	275.377	1.574	50	0		CDAARO
CSc1cccc(C[N@H+](C)CCCn2cnnn2)c1	ZINC001704351032	1177697219	/nfs/dbraw/zinc/69/72/19/1177697219.db2.gz	MOCGXUBAVHDJQY-UHFFFAOYSA-N	1	0	277.397	1.917	50	0		CDAARO
CC[N@H+](C)CCCN(C)Cc1ccc2nonc2c1	ZINC001704353168	1177698683	/nfs/dbraw/zinc/69/86/83/1177698683.db2.gz	BFIQMIWPLSWOMQ-UHFFFAOYSA-N	1	0	262.357	1.996	50	0		CDAARO
Fc1ccccc1N1CC[NH+](CCCn2cnnn2)CC1	ZINC001704352941	1177698835	/nfs/dbraw/zinc/69/88/35/1177698835.db2.gz	GSVPYLFKYBVOMN-UHFFFAOYSA-N	1	0	290.346	1.025	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(NC[C@@H](C)n2cncn2)c1C	ZINC000065455625	774037304	/nfs/dbraw/zinc/03/73/04/774037304.db2.gz	YJBPRTVORVUFIP-SECBINFHSA-N	1	0	275.360	1.424	50	0		CDAARO
O=c1cccc(CN2CCC([NH+]3CCSCC3)CC2)[nH]1	ZINC000020917434	774216925	/nfs/dbraw/zinc/21/69/25/774216925.db2.gz	DDFYNXZBSIMQOV-UHFFFAOYSA-N	1	0	293.436	1.800	50	0		CDAARO
COCC[C@@]1(CO)CCC[N@H+](Cc2cc(OC)ccn2)C1	ZINC000091644327	774261169	/nfs/dbraw/zinc/26/11/69/774261169.db2.gz	RRDVEKKGZYCPNO-INIZCTEOSA-N	1	0	294.395	1.701	50	0		CDAARO
CCCn1cnnc1CN(C)C[C@@H]1CC[N@H+](CC)C1	ZINC000252479930	774689434	/nfs/dbraw/zinc/68/94/34/774689434.db2.gz	BQCSQWPZNNDBLS-ZDUSSCGKSA-N	1	0	265.405	1.462	50	0		CDAARO
COc1ccc(/C(C)=C/C(=O)N2CC[NH2+]C[C@@H]2C)cc1	ZINC000125575470	775606254	/nfs/dbraw/zinc/60/62/54/775606254.db2.gz	MPAWJQFOGLVZLA-XSNHNAGMSA-N	1	0	274.364	1.919	50	0		CDAARO
CCNc1cc(C)[nH+]c(NCCNC(=O)C(C)C)n1	ZINC000082230270	777561626	/nfs/dbraw/zinc/56/16/26/777561626.db2.gz	NPIPZVZPWVDSHL-UHFFFAOYSA-N	1	0	265.361	1.401	50	0		CDAARO
C[C@H](NC(=O)C[NH+]1CCC(C(N)=O)CC1)C1=CCCCC1	ZINC000091695837	778878575	/nfs/dbraw/zinc/87/85/75/778878575.db2.gz	MRJGEUYATVKJMN-LBPRGKRZSA-N	1	0	293.411	1.189	50	0		CDAARO
COc1ccccc1OCCN1CCC[C@H]([NH2+]CCO)C1	ZINC000864097424	778919523	/nfs/dbraw/zinc/91/95/23/778919523.db2.gz	VHOAWWNQYAFFRA-AWEZNQCLSA-N	1	0	294.395	1.120	50	0		CDAARO
Cc1cccc(CN2CCO[C@H](CC[NH+](C)C)C2)n1	ZINC000012449532	779165136	/nfs/dbraw/zinc/16/51/36/779165136.db2.gz	CKMUVABIOHPQLY-OAHLLOKOSA-N	1	0	263.385	1.543	50	0		CDAARO
Cc1ccc(C[NH2+]CCN2CCCC[C@H]2CO)o1	ZINC000952963440	779585145	/nfs/dbraw/zinc/58/51/45/779585145.db2.gz	JZEVYCDYUOXKMV-ZDUSSCGKSA-N	1	0	252.358	1.524	50	0		CDAARO
[NH3+][C@@H](c1ccsc1C(F)(F)F)C1(O)CC[NH2+]CC1	ZINC000958528561	780105133	/nfs/dbraw/zinc/10/51/33/780105133.db2.gz	QSQRAYAXHJMYHX-QMMMGPOBSA-N	1	0	280.315	1.881	50	0		CDAARO
Cc1csc(CN2C[C@@H](C)O[C@@]3(CC[NH2+]C3)C2)n1	ZINC000952881815	910448271	/nfs/dbraw/zinc/44/82/71/910448271.db2.gz	MZRYPVMOLHSCBM-DGCLKSJQSA-N	1	0	267.398	1.404	50	0		CDAARO
Cc1nc(C)c(C(=O)NCCNc2cc[nH+]cc2C)o1	ZINC000825302620	925864030	/nfs/dbraw/zinc/86/40/30/925864030.db2.gz	PKBAXCUNVICRAT-UHFFFAOYSA-N	1	0	274.324	1.259	50	0		CDAARO
C[NH+](C)[C@@H]1CN(Cc2ccc(F)c(F)c2)CC[C@@H]1CO	ZINC000581798886	927199186	/nfs/dbraw/zinc/19/91/86/927199186.db2.gz	BESDJIKIHSFHPX-IUODEOHRSA-N	1	0	284.350	1.709	50	0		CDAARO
O=C(O[C@@H]1CCOC1)N1CCN(c2cc[nH+]cc2)CC1	ZINC000585135254	931028670	/nfs/dbraw/zinc/02/86/70/931028670.db2.gz	ZVTRUYIIQRFFAJ-CYBMUJFWSA-N	1	0	277.324	1.129	50	0		CDAARO
Cc1c[nH]c(C(=O)N2CCC[N@@H+](CC(C)C)CC2)n1	ZINC000221346069	931320091	/nfs/dbraw/zinc/32/00/91/931320091.db2.gz	NSKNBOCSFXVHGL-UHFFFAOYSA-N	1	0	264.373	1.522	50	0		CDAARO
Cc1ccc(=O)n(CC2C[NH+](C[C@H]3CCCCO3)C2)n1	ZINC000585603248	932835190	/nfs/dbraw/zinc/83/51/90/932835190.db2.gz	LWHDAQNZGXAISL-CQSZACIVSA-N	1	0	277.368	1.053	50	0		CDAARO
Cc1nc(N2C[C@H]3C[NH2+]C[C@@]3(CO)C2)ccc1Cl	ZINC001165283706	939540243	/nfs/dbraw/zinc/54/02/43/939540243.db2.gz	KAMZGNHCTSXCMH-MFKMUULPSA-N	1	0	267.760	1.062	50	0		CDAARO
Cc1c(NC(=O)[C@@H]2CCCC[NH2+]2)c(N2CCCC2)nn1C	ZINC001529198634	969011352	/nfs/dbraw/zinc/01/13/52/969011352.db2.gz	HSQNAGSEJXNZEF-LBPRGKRZSA-N	1	0	291.399	1.409	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]Cc1cn2c(n1)SCC2	ZINC001506404912	975151874	/nfs/dbraw/zinc/15/18/74/975151874.db2.gz	VYOWZGCUCFLLOJ-NSHDSACASA-N	1	0	291.424	1.926	50	0		CDAARO
Cc1noc(C)c1C[NH2+]C[C@@H]1COC2(CCOCC2)O1	ZINC000096494772	230383884	/nfs/dbraw/zinc/38/38/84/230383884.db2.gz	WVYUBVCPQGULBB-GFCCVEGCSA-N	1	0	282.340	1.303	50	0		CDAARO
O=C(NC[C@H]1CCC[NH2+]C1)c1ccncc1Cl	ZINC000082164550	177926353	/nfs/dbraw/zinc/92/63/53/177926353.db2.gz	DYPRVMNQHJPTMU-VIFPVBQESA-N	1	0	253.733	1.464	50	0		CDAARO
C[C@@H]1CCC[NH2+][C@@H]1CNC(=O)CC[C@@H]1CCOC1	ZINC000401255960	342484389	/nfs/dbraw/zinc/48/43/89/342484389.db2.gz	AOTSVQLDPUHNQO-JHJVBQTASA-N	1	0	254.374	1.307	50	0		CDAARO
CC[N@@H+]1CCN(C(=O)[C@]2(C)CCCCO2)CC1(C)C	ZINC000584903685	341987105	/nfs/dbraw/zinc/98/71/05/341987105.db2.gz	JPLACJYVNRISCH-HNNXBMFYSA-N	1	0	268.401	1.888	50	0		CDAARO
CCS(=O)(=O)C[C@H](C)[NH2+]C1CCN(C(C)C)CC1	ZINC000121067524	230394421	/nfs/dbraw/zinc/39/44/21/230394421.db2.gz	IQCDTMJKXVMABC-LBPRGKRZSA-N	1	0	276.446	1.272	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@H](C(=O)NCCn2cccc2)C1	ZINC000095529158	185004684	/nfs/dbraw/zinc/00/46/84/185004684.db2.gz	IQMYKLVQWOYBPY-AWEZNQCLSA-N	1	0	263.385	1.725	50	0		CDAARO
O=S(=O)(CC[NH2+][C@H]1CCCSC1)CC1CCC1	ZINC000097371175	342002164	/nfs/dbraw/zinc/00/21/64/342002164.db2.gz	YXUROMPGCVCFQD-LBPRGKRZSA-N	1	0	277.455	1.687	50	0		CDAARO
COC(=O)[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C(=O)OC	ZINC000095841982	185029864	/nfs/dbraw/zinc/02/98/64/185029864.db2.gz	JSRVVUSBZJFOJO-BETUJISGSA-N	1	0	277.320	1.081	50	0		CDAARO
COCCN(Cc1ccncc1)C(=O)C[C@H]1CC[NH2+]C1	ZINC000215767864	398204677	/nfs/dbraw/zinc/20/46/77/398204677.db2.gz	AQYBUZHGYSMZTA-CQSZACIVSA-N	1	0	277.368	1.056	50	0		CDAARO
CS(=O)(=O)C[C@@H]([NH2+]C[C@H]1CCCOC1)c1ccccc1	ZINC000095985962	185056137	/nfs/dbraw/zinc/05/61/37/185056137.db2.gz	XJSGQGLYBXNZDK-UKRRQHHQSA-N	1	0	297.420	1.789	50	0		CDAARO
C[C@@H](C1CCN(c2nc(CO)cs2)CC1)[NH+](C)C	ZINC000096148410	185106355	/nfs/dbraw/zinc/10/63/55/185106355.db2.gz	IKDQIGNCLWWNIP-JTQLQIEISA-N	1	0	269.414	1.802	50	0		CDAARO
C[C@H](Cc1ccc(F)cc1)NC(=O)[C@@]1(F)CC[NH2+]C1	ZINC000195543193	342626642	/nfs/dbraw/zinc/62/66/42/342626642.db2.gz	URGUCRVKWWWDBN-QMTHXVAHSA-N	1	0	268.307	1.575	50	0		CDAARO
Cc1ccc(NC(=O)N2C[C@@H]([NH+]3CCCC3)[C@@H](O)C2)s1	ZINC000095407151	539088086	/nfs/dbraw/zinc/08/80/86/539088086.db2.gz	VWXIDEQMGIQRPP-NEPJUHHUSA-N	1	0	295.408	1.729	50	0		CDAARO
CCc1nnc(NC(=O)CC[N@@H+]2CCC[C@H](OC)C2)s1	ZINC000244574813	361853805	/nfs/dbraw/zinc/85/38/05/361853805.db2.gz	CRWUYYCJRBZKTB-JTQLQIEISA-N	1	0	298.412	1.540	50	0		CDAARO
COc1ccc(S(=O)(=O)NCC[NH3+])c(Cl)c1Cl	ZINC000096889337	185123765	/nfs/dbraw/zinc/12/37/65/185123765.db2.gz	ODCZFEYVFFLDFP-UHFFFAOYSA-N	1	0	299.179	1.239	50	0		CDAARO
Cc1ccc2[nH]c(CN3CCN([C@H]4CC[NH2+]C4)CC3)nc2c1	ZINC000244691024	361857045	/nfs/dbraw/zinc/85/70/45/361857045.db2.gz	JBGYDEZQHZPJKU-AWEZNQCLSA-N	1	0	299.422	1.351	50	0		CDAARO
[NH3+][C@H]1C[C@@H](c2cc(N3CCC(CCO)CC3)ncn2)C1	ZINC000244900136	361869556	/nfs/dbraw/zinc/86/95/56/361869556.db2.gz	ZWQMJGYIILIKJV-BETUJISGSA-N	1	0	276.384	1.280	50	0		CDAARO
CC(C)[NH2+]Cc1cc(F)ccc1CS(C)(=O)=O	ZINC000097034633	185157177	/nfs/dbraw/zinc/15/71/77/185157177.db2.gz	NLGDAFNPQOGIGX-UHFFFAOYSA-N	1	0	259.346	1.868	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2CO)cc1	ZINC000097034942	185157285	/nfs/dbraw/zinc/15/72/85/185157285.db2.gz	PYKUSLZVULZWMW-ZIAGYGMSSA-N	1	0	263.337	1.724	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@H]1NC(=O)C[C@@H](O)c1cccc(F)c1	ZINC000585136911	342216104	/nfs/dbraw/zinc/21/61/04/342216104.db2.gz	YLIFJFXVUZISMR-JDOCFBBISA-N	1	0	294.370	1.752	50	0		CDAARO
CCCCNC(=O)[C@H](C)[NH2+][C@@H]1C[C@@H](OCC)[C@H]1SC	ZINC000585089104	362016009	/nfs/dbraw/zinc/01/60/09/362016009.db2.gz	MTDTVBDDGHUQEQ-LOWDOPEQSA-N	1	0	288.457	1.790	50	0		CDAARO
C[C@H](O)[C@@H]1CC[N@@H+]([C@@H]2CCN(c3ccccc3)C2=O)C1	ZINC000096002362	342431805	/nfs/dbraw/zinc/43/18/05/342431805.db2.gz	NYTFMPULJCINSJ-GZBFAFLISA-N	1	0	274.364	1.495	50	0		CDAARO
CN(C)S(=O)(=O)CCC[N@@H+]1CCC[C@@H]1c1ccccn1	ZINC000252482733	362384731	/nfs/dbraw/zinc/38/47/31/362384731.db2.gz	DMOCCPXKGGHSLM-CQSZACIVSA-N	1	0	297.424	1.500	50	0		CDAARO
C[N@H+](CC[C@H]1CCCCO1)CCn1cc[nH]c1=O	ZINC000252493442	362386589	/nfs/dbraw/zinc/38/65/89/362386589.db2.gz	NBZZVXGUHOJEBS-GFCCVEGCSA-N	1	0	253.346	1.067	50	0		CDAARO
C[C@@H]1CC[N@H+](CC2CCSCC2)CC[S@@]1=O	ZINC000602637831	344510670	/nfs/dbraw/zinc/51/06/70/344510670.db2.gz	ODMHPKDLGUOQKD-BZNIZROVSA-N	1	0	261.456	1.973	50	0		CDAARO
Cc1nc[nH]c1C(=O)NCC1CCN(c2cc[nH+]cc2)CC1	ZINC000635764350	362523469	/nfs/dbraw/zinc/52/34/69/362523469.db2.gz	HHSOOLWOIHXLGQ-UHFFFAOYSA-N	1	0	299.378	1.760	50	0		CDAARO
CNC(=O)N1c2ccc(C)cc2[C@H]2C[N@@H+](C)CC[C@H]21	ZINC000016036444	346002537	/nfs/dbraw/zinc/00/25/37/346002537.db2.gz	ZLLYQMRMDBRZGG-TZMCWYRMSA-N	1	0	259.353	1.942	50	0		CDAARO
CCOC(=O)[C@]12C[NH2+]C[C@@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000051943471	346372445	/nfs/dbraw/zinc/37/24/45/346372445.db2.gz	LWIRXZLYPPQKOS-YGRLFVJLSA-N	1	0	284.356	1.006	50	0		CDAARO
COC(=O)c1ccc(OC2CC[NH2+]CC2)cc1O	ZINC000098213665	185700755	/nfs/dbraw/zinc/70/07/55/185700755.db2.gz	KKLWFSDQARLJRQ-UHFFFAOYSA-N	1	0	251.282	1.310	50	0		CDAARO
COc1ccc(C[NH2+]CC2(C(N)=O)CCOCC2)cc1	ZINC000086250419	179256192	/nfs/dbraw/zinc/25/61/92/179256192.db2.gz	UYYIRXHBTRPQCF-UHFFFAOYSA-N	1	0	278.352	1.067	50	0		CDAARO
CC[NH+](CC)[C@H]1CC(=O)N(c2ccc(OC)cc2)C1=O	ZINC000138153517	348751140	/nfs/dbraw/zinc/75/11/40/348751140.db2.gz	GLIUXUYUAXQFRW-ZDUSSCGKSA-N	1	0	276.336	1.669	50	0		CDAARO
C[C@H](C(=O)N1C[C@@H](C)O[C@H](C)C1)N(C)CC[NH+]1CCCC1	ZINC000089898328	179879515	/nfs/dbraw/zinc/87/95/15/179879515.db2.gz	OPDMIPYESAZPME-RBSFLKMASA-N	1	0	297.443	1.038	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1Cn1cnc2cnccc2c1=O	ZINC000584895005	349355029	/nfs/dbraw/zinc/35/50/29/349355029.db2.gz	ZWYILHDIBMUWRU-LLVKDONJSA-N	1	0	258.325	1.276	50	0		CDAARO
O=C1CC[C@@H]([NH2+]Cc2ccccc2-n2ccnc2)CCN1	ZINC000584895293	349356070	/nfs/dbraw/zinc/35/60/70/349356070.db2.gz	LNDWFAKCFGTPEE-CQSZACIVSA-N	1	0	284.363	1.631	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@@H]1NC(=O)Cc1ccccc1F	ZINC000091496335	180171950	/nfs/dbraw/zinc/17/19/50/180171950.db2.gz	SCCIZZOGZJVCDA-GWCFXTLKSA-N	1	0	250.317	1.625	50	0		CDAARO
COC(=O)N1CCC(c2nccn2CC[NH+](C)C)CC1	ZINC000091563548	180192883	/nfs/dbraw/zinc/19/28/83/180192883.db2.gz	UCRYIURVCJVINW-UHFFFAOYSA-N	1	0	280.372	1.391	50	0		CDAARO
Cc1nc(CN2C[C@H](CO)[C@H](C[NH+]3CCCCC3)C2)co1	ZINC000092028958	180309182	/nfs/dbraw/zinc/30/91/82/180309182.db2.gz	ABCPOBBWSOTVJW-HUUCEWRRSA-N	1	0	293.411	1.509	50	0		CDAARO
O[C@@H](CN1CCOCC1)C[N@@H+]1CCC[C@@H]1c1ccsc1	ZINC000106748954	186134453	/nfs/dbraw/zinc/13/44/53/186134453.db2.gz	RUSNLNPJIHBXCX-LSDHHAIUSA-N	1	0	296.436	1.578	50	0		CDAARO
CC[C@@H]1CN(Cc2cc(C)no2)CC[N@@H+]1C[C@H](C)O	ZINC000106841072	186139433	/nfs/dbraw/zinc/13/94/33/186139433.db2.gz	ZVFBVLKKHKUFJP-QWHCGFSZSA-N	1	0	267.373	1.260	50	0		CDAARO
C[C@H](O)[C@H]1CCCC[N@@H+]1CC(=O)NC1CCC(C)CC1	ZINC000106846263	186140187	/nfs/dbraw/zinc/14/01/87/186140187.db2.gz	VLFZCQXTAJIYBG-OOJKYFRXSA-N	1	0	282.428	1.917	50	0		CDAARO
CC[C@@H]1CN(CCc2ccccn2)CC[N@@H+]1C[C@H](C)O	ZINC000106844385	186140346	/nfs/dbraw/zinc/14/03/46/186140346.db2.gz	UIFJEDQIUJIQGO-GOEBONIOSA-N	1	0	277.412	1.401	50	0		CDAARO
C[C@@H]1CN(C(=O)CO[C@H]2CCCC[C@H]2C)C[C@@H]1[NH+](C)C	ZINC000107141771	186160427	/nfs/dbraw/zinc/16/04/27/186160427.db2.gz	RBMNHFVUIRYNRT-KBXIAJHMSA-N	1	0	282.428	1.990	50	0		CDAARO
CC[N@@H+]1CC[C@H](N(C)C(=O)NCCOC)[C@@H](C)C1	ZINC000107158839	186161080	/nfs/dbraw/zinc/16/10/80/186161080.db2.gz	QIZKGDFRTXFGEZ-RYUDHWBXSA-N	1	0	257.378	1.005	50	0		CDAARO
C[C@H](NC(=O)CCc1ccncc1)[C@@H]1CCCC[NH2+]1	ZINC000583651208	366008722	/nfs/dbraw/zinc/00/87/22/366008722.db2.gz	GYXDMLQLCVANAD-JSGCOSHPSA-N	1	0	261.369	1.661	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N(C)C[C@H]2COCCO2)c1C	ZINC000065397735	363041831	/nfs/dbraw/zinc/04/18/31/363041831.db2.gz	LWBCBHDVVICRCV-LBPRGKRZSA-N	1	0	280.372	1.011	50	0		CDAARO
C[C@H](C[NH2+][C@@H]1CC(C)(C)OC1(C)C)CS(C)(=O)=O	ZINC000119688612	186844512	/nfs/dbraw/zinc/84/45/12/186844512.db2.gz	LAXFCYYZKNBCRH-GHMZBOCLSA-N	1	0	277.430	1.603	50	0		CDAARO
CNc1cc(C(=O)NC[C@]2([NH+](C)C)CCSC2)ccn1	ZINC000065500816	363289743	/nfs/dbraw/zinc/28/97/43/363289743.db2.gz	XLJQJGWQJNEBBR-CQSZACIVSA-N	1	0	294.424	1.290	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@H]1CCC[NH2+]C1	ZINC000036961614	363301866	/nfs/dbraw/zinc/30/18/66/363301866.db2.gz	DGLVGXOPNHDVGL-NSHDSACASA-N	1	0	272.345	1.164	50	0		CDAARO
C[NH+]1CCC(OC(=O)COc2ccc(F)cc2)CC1	ZINC000004454529	356030855	/nfs/dbraw/zinc/03/08/55/356030855.db2.gz	IMACDUMITYOUQH-UHFFFAOYSA-N	1	0	267.300	1.842	50	0		CDAARO
CC(C)CNC(=O)[C@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000012473969	356301378	/nfs/dbraw/zinc/30/13/78/356301378.db2.gz	VXJPQVZMRDVLRS-AWEZNQCLSA-N	1	0	281.444	1.565	50	0		CDAARO
Cc1cc(C(=O)NCC[NH+](C)C)c2ccccc2n1	ZINC000004516940	356381376	/nfs/dbraw/zinc/38/13/76/356381376.db2.gz	DSCHOULWZUUQAH-UHFFFAOYSA-N	1	0	257.337	1.835	50	0		CDAARO
O=C(NCC[NH2+]Cc1ccc(F)cc1)c1ccco1	ZINC000004498124	356369855	/nfs/dbraw/zinc/36/98/55/356369855.db2.gz	UPGYXGRCTXPCQE-UHFFFAOYSA-N	1	0	262.284	1.938	50	0		CDAARO
Fc1ccc(N2CCN([C@H]3CCC[NH2+]C3)CC2)cc1	ZINC000037246731	356461063	/nfs/dbraw/zinc/46/10/63/356461063.db2.gz	QTUSPEVNIWRLGQ-HNNXBMFYSA-N	1	0	263.360	1.700	50	0		CDAARO
C[NH+]1CCC(NC(=O)COc2ccccc2F)CC1	ZINC000016580028	356442095	/nfs/dbraw/zinc/44/20/95/356442095.db2.gz	RXOQKOBELVGQKL-UHFFFAOYSA-N	1	0	266.316	1.415	50	0		CDAARO
CCOc1cc(CN(C)CC[NH+](C)C)ccc1O	ZINC000019606499	356493428	/nfs/dbraw/zinc/49/34/28/356493428.db2.gz	VZAPXSMHBRWXON-UHFFFAOYSA-N	1	0	252.358	1.784	50	0		CDAARO
CCOc1cc(CN2CC[NH+](C)CC2)ccc1O	ZINC000019809180	356506760	/nfs/dbraw/zinc/50/67/60/356506760.db2.gz	DOMHNSQZXFIHQE-UHFFFAOYSA-N	1	0	250.342	1.538	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)c1cnccn1)c1ccsc1	ZINC000023133062	356629783	/nfs/dbraw/zinc/62/97/83/356629783.db2.gz	FZFZUFHYSUCALX-LBPRGKRZSA-N	1	0	276.365	1.571	50	0		CDAARO
CC(C)c1ccc(CN(C)Cc2nc(N)nc(N)n2)cc1	ZINC000024032003	356651529	/nfs/dbraw/zinc/65/15/29/356651529.db2.gz	YFNWCOCKXLFFPN-UHFFFAOYSA-N	1	0	286.383	1.791	50	0		CDAARO
CCNC(=O)CC[NH+]1CCN(c2ccccc2OC)CC1	ZINC000025910869	356685285	/nfs/dbraw/zinc/68/52/85/356685285.db2.gz	OSYIYRDYEABNBS-UHFFFAOYSA-N	1	0	291.395	1.343	50	0		CDAARO
C[C@@H]1CCCC[C@@H]1NC(=O)CN1CCC2(CC1)OCCO2	ZINC000026933589	356701498	/nfs/dbraw/zinc/70/14/98/356701498.db2.gz	MPKVAKHQQUZQHR-KGLIPLIRSA-N	1	0	296.411	1.520	50	0		CDAARO
CC[C@@H](CO)[NH2+]C[C@H](O)Cn1c(C)c(C)c2ccccc21	ZINC000000106236	356735029	/nfs/dbraw/zinc/73/50/29/356735029.db2.gz	CSEDJBHBLGSNMW-GJZGRUSLSA-N	1	0	290.407	1.980	50	0		CDAARO
OCC[NH2+]CCNCc1ccc(-c2ccccc2)o1	ZINC000032497127	356780637	/nfs/dbraw/zinc/78/06/37/356780637.db2.gz	XWMBGCUVHDFRMV-UHFFFAOYSA-N	1	0	260.337	1.618	50	0		CDAARO
O=C(NCCc1ccccn1)[C@@H]1CC12CC[NH2+]CC2	ZINC000070252123	356871175	/nfs/dbraw/zinc/87/11/75/356871175.db2.gz	DUWUHQVACUNAEP-ZDUSSCGKSA-N	1	0	259.353	1.130	50	0		CDAARO
Cc1ccc(CN2CC[N@@H+](C(C)C)[C@H](CCO)C2)o1	ZINC000039362738	356972484	/nfs/dbraw/zinc/97/24/84/356972484.db2.gz	DZRARZFQYOATNQ-CQSZACIVSA-N	1	0	266.385	1.865	50	0		CDAARO
CCOc1ccc(N2C(=O)C[C@@H]([NH2+]C(C)C)C2=O)cc1	ZINC000039432465	356973258	/nfs/dbraw/zinc/97/32/58/356973258.db2.gz	KYPPQCGLABCQRP-CYBMUJFWSA-N	1	0	276.336	1.715	50	0		CDAARO
CCOC(=O)c1ccc(NCC[NH+](C)C)c(N)c1	ZINC000041079838	357020908	/nfs/dbraw/zinc/02/09/08/357020908.db2.gz	OLRORXLMYOVOGL-UHFFFAOYSA-N	1	0	251.330	1.419	50	0		CDAARO
C[NH2+]CCCNC(=O)CC(=O)Nc1ccccc1C	ZINC000055357983	357331743	/nfs/dbraw/zinc/33/17/43/357331743.db2.gz	SVUJEXBXVWQHSM-UHFFFAOYSA-N	1	0	263.341	1.049	50	0		CDAARO
C[C@@H](CO)NC(=O)N[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C	ZINC000096503124	357517960	/nfs/dbraw/zinc/51/79/60/357517960.db2.gz	PMYTZFJRKYSLSV-IPYPFGDCSA-N	1	0	291.395	1.187	50	0		CDAARO
[NH3+]CCc1n[nH]c(=O)n1-c1ccccc1Oc1ccccc1	ZINC000065451631	357542580	/nfs/dbraw/zinc/54/25/80/357542580.db2.gz	OZNZCIXNWCVDHP-UHFFFAOYSA-N	1	0	296.330	1.854	50	0		CDAARO
C[C@H](Cn1cccn1)[NH2+]CCC(=O)NC1CCCCC1	ZINC000065501029	357546071	/nfs/dbraw/zinc/54/60/71/357546071.db2.gz	RDNOWPLVYGHUFE-CYBMUJFWSA-N	1	0	278.400	1.700	50	0		CDAARO
Cc1cnc(C)c(-c2cc(O)c3c(c2)C[NH2+]CCO3)n1	ZINC000067739895	357622706	/nfs/dbraw/zinc/62/27/06/357622706.db2.gz	AANDZEGOEHJUJF-UHFFFAOYSA-N	1	0	271.320	1.948	50	0		CDAARO
CCNc1cc(C)[nH+]c(NCCNC(=O)CC)n1	ZINC000067613841	357613605	/nfs/dbraw/zinc/61/36/05/357613605.db2.gz	IZISFORNBMMQML-UHFFFAOYSA-N	1	0	251.334	1.155	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCNC(=O)COc2cccnc2)C1	ZINC000067982159	357641789	/nfs/dbraw/zinc/64/17/89/357641789.db2.gz	BGBCJNLAOOXKBI-ZDUSSCGKSA-N	1	0	277.368	1.309	50	0		CDAARO
CC[C@H](C)OCC(=O)N(C)[C@@H]1CC[N@H+](CC)C[C@@H]1C	ZINC000095433840	357647807	/nfs/dbraw/zinc/64/78/07/357647807.db2.gz	PZEIRGNHXSZMQJ-MELADBBJSA-N	1	0	270.417	1.990	50	0		CDAARO
Cc1cc2nc(C(C)C)cc(N3CC[NH2+][C@H](C)C3)n2n1	ZINC000072447862	357836251	/nfs/dbraw/zinc/83/62/51/357836251.db2.gz	WIHXZCPRMBQSKM-GFCCVEGCSA-N	1	0	273.384	1.959	50	0		CDAARO
C[NH+](C)CC(=O)NCCc1nc(-c2ccccn2)cs1	ZINC000097101878	357972327	/nfs/dbraw/zinc/97/23/27/357972327.db2.gz	CAGMFRWIYZZBRE-UHFFFAOYSA-N	1	0	290.392	1.425	50	0		CDAARO
COc1c(C[N@@H+]2CCCSCC2)c(C)nn1C	ZINC000097113616	357982977	/nfs/dbraw/zinc/98/29/77/357982977.db2.gz	PECUDXKZUFRMIZ-UHFFFAOYSA-N	1	0	255.387	1.676	50	0		CDAARO
C[C@H]([NH2+]CC(=O)NC(=O)NC1CC1)[C@@H](C)c1ccccc1	ZINC000097110018	357985600	/nfs/dbraw/zinc/98/56/00/357985600.db2.gz	WGLKOWYAGKHJRB-NEPJUHHUSA-N	1	0	289.379	1.756	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1C(=O)/C=C\c1ccc2c(c1)CCO2	ZINC000098055870	358344412	/nfs/dbraw/zinc/34/44/12/358344412.db2.gz	DOFORYIRJBVTPP-AGLBCWCQSA-N	1	0	286.375	1.797	50	0		CDAARO
NC(=O)C[C@@]1(O)CCC[N@H+](Cc2ccccc2C2CC2)C1	ZINC000643746766	358547047	/nfs/dbraw/zinc/54/70/47/358547047.db2.gz	UNLSNDRDJPPETO-KRWDZBQOSA-N	1	0	288.391	1.766	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@H]1C(=O)NC[C@@H](O)C1CCCC1	ZINC000195530805	358559128	/nfs/dbraw/zinc/55/91/28/358559128.db2.gz	JINBCWRTWVCLPR-LSDHHAIUSA-N	1	0	282.428	1.917	50	0		CDAARO
O=C(CCC[NH+]1CCCCC1)NCCc1c[nH]cn1	ZINC000095360202	358684534	/nfs/dbraw/zinc/68/45/34/358684534.db2.gz	SYPWDSFMIZZUPV-UHFFFAOYSA-N	1	0	264.373	1.335	50	0		CDAARO
Cc1nnc(CCNc2cc(C(C)C)[nH+]c(N)n2)s1	ZINC000095391093	358691819	/nfs/dbraw/zinc/69/18/19/358691819.db2.gz	MDESGZKIZJRLBD-UHFFFAOYSA-N	1	0	278.385	1.997	50	0		CDAARO
C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1CCCS(N)(=O)=O	ZINC000247646499	358710277	/nfs/dbraw/zinc/71/02/77/358710277.db2.gz	UMPXEJBOHSSRQR-IJLUTSLNSA-N	1	0	260.403	1.318	50	0		CDAARO
Cc1nnc(CN2CCC[N@@H+](C3CCCC3)CC2)[nH]1	ZINC000244852985	358724764	/nfs/dbraw/zinc/72/47/64/358724764.db2.gz	VDCJNSWXYMGHLI-UHFFFAOYSA-N	1	0	263.389	1.563	50	0		CDAARO
CC(C)[N@@H+]1CCO[C@@H](CC(=O)NCCc2ccco2)C1	ZINC000097553394	358785065	/nfs/dbraw/zinc/78/50/65/358785065.db2.gz	QZERARKDLQPYCR-AWEZNQCLSA-N	1	0	280.368	1.438	50	0		CDAARO
Cc1nc(C)c(CC(=O)NCCCn2ccnc2)s1	ZINC000097604299	358787806	/nfs/dbraw/zinc/78/78/06/358787806.db2.gz	LYZRTFMYBVAKFZ-UHFFFAOYSA-N	1	0	278.381	1.705	50	0		CDAARO
Cn1c(C(=O)N2C[C@H]3C[NH2+]C[C@H]3C2)ccc1-c1ccccc1	ZINC000097635057	358788819	/nfs/dbraw/zinc/78/88/19/358788819.db2.gz	SNFSUTRQEQUJBK-GASCZTMLSA-N	1	0	295.386	1.984	50	0		CDAARO
COc1ccc(F)c(C[NH+]2CCC3(C[C@@H](O)CO3)CC2)c1	ZINC000097696209	358793901	/nfs/dbraw/zinc/79/39/01/358793901.db2.gz	GFWUVTKKLQOAFC-CYBMUJFWSA-N	1	0	295.354	1.950	50	0		CDAARO
[NH3+]C1CCN(C[C@@H](O)c2ccc(Cl)cc2)CC1	ZINC000011729523	283414828	/nfs/dbraw/zinc/41/48/28/283414828.db2.gz	HRBIZTJAMVKWIO-CYBMUJFWSA-N	1	0	254.761	1.797	50	0		CDAARO
O=C(O[C@H]1C[NH+]2CCC1CC2)[C@H]1COc2ccccc2O1	ZINC000000108980	359097795	/nfs/dbraw/zinc/09/77/95/359097795.db2.gz	MUWXMGFHWUUUDA-LSDHHAIUSA-N	1	0	289.331	1.464	50	0		CDAARO
CCc1ccc(C(=O)N(C)C[C@@H]2CC[N@H+](CCOC)C2)[nH]1	ZINC000220664115	359190048	/nfs/dbraw/zinc/19/00/48/359190048.db2.gz	XFLWQPYORNSHFR-ZDUSSCGKSA-N	1	0	293.411	1.617	50	0		CDAARO
[NH3+]CC(=O)N1CCC([C@@H](O)c2ccc(Cl)cc2)CC1	ZINC000269044631	283418637	/nfs/dbraw/zinc/41/86/37/283418637.db2.gz	CLIXJEYDGZJHJF-AWEZNQCLSA-N	1	0	282.771	1.571	50	0		CDAARO
Nc1nc(NCCc2cccnc2)cc(C2CC([NH3+])C2)n1	ZINC000223556455	359434354	/nfs/dbraw/zinc/43/43/54/359434354.db2.gz	FCZQXAYQKGXHGV-UHFFFAOYSA-N	1	0	284.367	1.313	50	0		CDAARO
COC[C@H](NC(=O)CC[NH+]1CCCC1)c1ccccn1	ZINC000223911893	359470795	/nfs/dbraw/zinc/47/07/95/359470795.db2.gz	KLQCMZSIGFJFLW-AWEZNQCLSA-N	1	0	277.368	1.371	50	0		CDAARO
CC[NH+]1CCC(CC(=O)N2CCC3(CC[C@H]3O)CC2)CC1	ZINC000257186172	359522451	/nfs/dbraw/zinc/52/24/51/359522451.db2.gz	KDSZEHPOXLKJLT-OAHLLOKOSA-N	1	0	294.439	1.872	50	0		CDAARO
Cc1cc(C[NH+]2CCC3(CC2)C[C@@](C)(O)CCO3)n(C)n1	ZINC000257191034	359537535	/nfs/dbraw/zinc/53/75/35/359537535.db2.gz	OTILITVQLYQOOM-HNNXBMFYSA-N	1	0	293.411	1.625	50	0		CDAARO
O[C@@H]1CCC[N@H+](Cc2ccc(-n3cccn3)cc2)C1	ZINC000032758420	359692841	/nfs/dbraw/zinc/69/28/41/359692841.db2.gz	MFXITEJIQLIENW-OAHLLOKOSA-N	1	0	257.337	1.829	50	0		CDAARO
NC(=O)c1ccccc1-c1cccc2c1O[C@H](C[NH3+])C2	ZINC000067712952	283488336	/nfs/dbraw/zinc/48/83/36/283488336.db2.gz	WEJQBZTUZREQEI-NSHDSACASA-N	1	0	268.316	1.715	50	0		CDAARO
CCOCC[N@H+](C)CCON1C(=O)c2ccccc2C1=O	ZINC000408524273	359932889	/nfs/dbraw/zinc/93/28/89/359932889.db2.gz	RRNSPQWDYOQSMO-UHFFFAOYSA-N	1	0	292.335	1.183	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1[C@@H]1CCN(C(=O)c2ccnn2C)C1	ZINC000409421159	360230373	/nfs/dbraw/zinc/23/03/73/360230373.db2.gz	SHGXJXQKDSIPCF-CYBMUJFWSA-N	1	0	299.378	1.890	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)NC[C@@H]1CC[N@@H+](CC(C)C)C1	ZINC000177283353	189041538	/nfs/dbraw/zinc/04/15/38/189041538.db2.gz	NXSOEYLWHASXLL-AWEZNQCLSA-N	1	0	292.427	1.663	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@@H]1CCCN1C(=O)C[C@H]1CCCO1	ZINC000248105783	360362720	/nfs/dbraw/zinc/36/27/20/360362720.db2.gz	FUIKKEACYSUBOZ-MCIONIFRSA-N	1	0	266.385	1.641	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)[C@@H]2COc3ccc(Cl)cc3C2)C1	ZINC000191350328	283565388	/nfs/dbraw/zinc/56/53/88/283565388.db2.gz	QPHJJVDCHBTVBD-WCQYABFASA-N	1	0	294.782	1.841	50	0		CDAARO
CC(C)C[N@@H+]1CCCC[C@@H]1CCNC(=O)Cn1ccnn1	ZINC000426508182	360677946	/nfs/dbraw/zinc/67/79/46/360677946.db2.gz	ZXPZYHGKFVVQHF-CQSZACIVSA-N	1	0	293.415	1.295	50	0		CDAARO
Cc1cnc(C)c(Sc2nnc(C[NH3+])n2CC(C)C)n1	ZINC000426545434	360682422	/nfs/dbraw/zinc/68/24/22/360682422.db2.gz	RAYPXYPLVHZLNL-UHFFFAOYSA-N	1	0	292.412	1.951	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@@H](C(=O)NCCc2cc[nH]n2)C1	ZINC000426613709	360690025	/nfs/dbraw/zinc/69/00/25/360690025.db2.gz	ZVTPMBVWVWCKOL-GFCCVEGCSA-N	1	0	264.373	1.189	50	0		CDAARO
CCc1ccc(C(=O)NCC[NH+]2CCC(CO)CC2)[nH]1	ZINC000426651206	360692437	/nfs/dbraw/zinc/69/24/37/360692437.db2.gz	FHONKJPZEHEUIK-UHFFFAOYSA-N	1	0	279.384	1.011	50	0		CDAARO
Cc1c(CNC(=O)N2CCC[C@H]([NH+](C)C)CC2)cnn1C	ZINC000426677328	360695927	/nfs/dbraw/zinc/69/59/27/360695927.db2.gz	ARBPJJSBJWQMQG-AWEZNQCLSA-N	1	0	293.415	1.354	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)COc2ccc(C)cc2)C1	ZINC000178970043	189158393	/nfs/dbraw/zinc/15/83/93/189158393.db2.gz	UQCVLLXVLQVEOW-CYBMUJFWSA-N	1	0	262.353	1.442	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2ccc(-n3cncn3)c(C)c2)C1	ZINC000179028671	189163036	/nfs/dbraw/zinc/16/30/36/189163036.db2.gz	BTNOMECOJGTQQG-ZDUSSCGKSA-N	1	0	299.378	1.257	50	0		CDAARO
CCOc1ccc(S(=O)(=O)NCC[C@@H](C)[NH3+])c(C)c1	ZINC000178911810	189154011	/nfs/dbraw/zinc/15/40/11/189154011.db2.gz	KVQRJWAVAZDCDJ-LLVKDONJSA-N	1	0	286.397	1.409	50	0		CDAARO
C[C@H](Oc1cccnc1)C(=O)N1C[C@@H](C)[NH2+][C@H](C)C1	ZINC000246662714	360906937	/nfs/dbraw/zinc/90/69/37/360906937.db2.gz	DNTJGVCUHDJLMT-UTUOFQBUSA-N	1	0	263.341	1.058	50	0		CDAARO
COCC[N@@H+](Cc1ccco1)C[C@H](O)COC(C)(C)C	ZINC000036096429	360911391	/nfs/dbraw/zinc/91/13/91/360911391.db2.gz	IVAUUXHMGKTMOR-ZDUSSCGKSA-N	1	0	285.384	1.904	50	0		CDAARO
CN(C)c1noc(C2CC[NH+](Cc3cccn3C)CC2)n1	ZINC000191907525	361386126	/nfs/dbraw/zinc/38/61/26/361386126.db2.gz	FPQKZLZAHNWATD-UHFFFAOYSA-N	1	0	289.383	1.854	50	0		CDAARO
C[C@H](NC(=O)N(CCO)CC[NH+](C)C)c1ccc(F)cc1	ZINC000426658284	361432863	/nfs/dbraw/zinc/43/28/63/361432863.db2.gz	HKHVJAUAJUHULO-LBPRGKRZSA-N	1	0	297.374	1.452	50	0		CDAARO
C[C@@H]1CN(C(=O)c2cc(F)c(F)c(F)c2)CC[NH2+]1	ZINC000088059199	364050807	/nfs/dbraw/zinc/05/08/07/364050807.db2.gz	JZSFDFYMBKVXBD-SSDOTTSWSA-N	1	0	258.243	1.538	50	0		CDAARO
Cc1ccc(COC[C@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1	ZINC000016579253	364850444	/nfs/dbraw/zinc/85/04/44/364850444.db2.gz	NAFHMESIBRXAPD-HLLBOEOZSA-N	1	0	293.407	1.982	50	0		CDAARO
CCCNC(=O)[C@H](C)[NH2+]Cc1ccc(-n2cccn2)cc1	ZINC000035046183	364813167	/nfs/dbraw/zinc/81/31/67/364813167.db2.gz	RNEYWVPADGISHX-ZDUSSCGKSA-N	1	0	286.379	1.877	50	0		CDAARO
CS(=O)(=O)c1cc(C[NH3+])cc(C(F)(F)F)c1	ZINC000164658295	364829471	/nfs/dbraw/zinc/82/94/71/364829471.db2.gz	MUIXPGZYRCQACO-UHFFFAOYSA-N	1	0	253.245	1.568	50	0		CDAARO
COCCO[C@@H]1CCC[N@H+](Cc2ccnc(N)c2)C1	ZINC000193455365	189643260	/nfs/dbraw/zinc/64/32/60/189643260.db2.gz	VZKFSJRWCDKXMI-CYBMUJFWSA-N	1	0	265.357	1.291	50	0		CDAARO
CC(C)CC1(C(=O)NCC2(O)CC[NH+](C)CC2)CCC1	ZINC000089821087	366940664	/nfs/dbraw/zinc/94/06/64/366940664.db2.gz	ZNRQUTNBBYCSCZ-UHFFFAOYSA-N	1	0	282.428	1.776	50	0		CDAARO
CC(C)C[N@@H+]1CCC[C@H]1CNC(=O)CCN1CCCC1=O	ZINC000089840183	366944606	/nfs/dbraw/zinc/94/46/06/366944606.db2.gz	IGAOHGGGTRJCSX-AWEZNQCLSA-N	1	0	295.427	1.236	50	0		CDAARO
CC(C)[N@H+](C)CC(=O)N[C@H](C)[C@H](O)c1cccc(F)c1	ZINC000089869446	366951338	/nfs/dbraw/zinc/95/13/38/366951338.db2.gz	MGNVQGPLAYMVJM-ABAIWWIYSA-N	1	0	282.359	1.704	50	0		CDAARO
CC1(C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)OCCO1	ZINC000089920644	366969578	/nfs/dbraw/zinc/96/95/78/366969578.db2.gz	YMUXLZNBGWONJL-ZIAGYGMSSA-N	1	0	269.385	1.765	50	0		CDAARO
CCC(C)(C)NC(=O)NCCCC[NH+]1CCN(C)CC1	ZINC000089942016	366974440	/nfs/dbraw/zinc/97/44/40/366974440.db2.gz	RVBCEMFPKLXAEG-UHFFFAOYSA-N	1	0	284.448	1.502	50	0		CDAARO
CCCN(C)S(=O)(=O)N(CC[NH+](C)C)C1CCCC1	ZINC000089955525	366981866	/nfs/dbraw/zinc/98/18/66/366981866.db2.gz	DKZCPQGQVQJCGI-UHFFFAOYSA-N	1	0	291.461	1.379	50	0		CDAARO
CCCc1noc([C@H](C)[NH2+][C@H]2CCN(C(C)=O)C[C@@H]2C)n1	ZINC000089960490	366984185	/nfs/dbraw/zinc/98/41/85/366984185.db2.gz	UXDFIYUWEUWTPH-GVXVVHGQSA-N	1	0	294.399	1.930	50	0		CDAARO
Cc1ccc(C)c(CC(=O)N[C@H]2CC[NH2+]C[C@@H]2C)c1	ZINC000094345412	367399692	/nfs/dbraw/zinc/39/96/92/367399692.db2.gz	IOJPQDWJWCMNEZ-ZFWWWQNUSA-N	1	0	260.381	1.960	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@@H]1NS(=O)(=O)c1ccccc1F	ZINC000094345701	367484605	/nfs/dbraw/zinc/48/46/05/367484605.db2.gz	KFFVUHRHKHUWJF-KOLCDFICSA-N	1	0	272.345	1.102	50	0		CDAARO
C[C@H](c1ccc(S(N)(=O)=O)cc1)[N@H+](C)[C@@H]1CCO[C@H]1C	ZINC000252477351	367545928	/nfs/dbraw/zinc/54/59/28/367545928.db2.gz	MNSWCOFXSXDSFR-UHIISALHSA-N	1	0	298.408	1.504	50	0		CDAARO
CCOC(=O)[C@H](C)N1CCC[C@H]1CC(=O)c1cnn(C)c1	ZINC000252517476	367741789	/nfs/dbraw/zinc/74/17/89/367741789.db2.gz	JOEJEAVXPYKDIJ-AAEUAGOBSA-N	1	0	293.367	1.409	50	0		CDAARO
CC(C)N(C)C(=O)CN(C)[C@@H](C)Cc1cnccn1	ZINC000299780749	372756723	/nfs/dbraw/zinc/75/67/23/372756723.db2.gz	BRRQRRBCWGXZGI-LBPRGKRZSA-N	1	0	264.373	1.206	50	0		CDAARO
Cc1ccc2nc(CNC(=O)C[C@H]3CC[NH2+]C3)cn2c1	ZINC000299787353	372762422	/nfs/dbraw/zinc/76/24/22/372762422.db2.gz	SXJUQPCSQFVOFG-GFCCVEGCSA-N	1	0	272.352	1.259	50	0		CDAARO
CNC(=O)[C@@H]1C[C@@H]([NH3+])CN1Cc1ccc2ccccc2c1	ZINC000299798300	372769733	/nfs/dbraw/zinc/76/97/33/372769733.db2.gz	RZWCJRSGTVOZSP-CVEARBPZSA-N	1	0	283.375	1.487	50	0		CDAARO
O=C(Nc1cccc2c1CCCC2)[C@@H]1C[NH2+]CCO1	ZINC000043707507	284354862	/nfs/dbraw/zinc/35/48/62/284354862.db2.gz	CVADLKMZDHYUTG-AWEZNQCLSA-N	1	0	260.337	1.492	50	0		CDAARO
CCn1nc(C)c(NC(=O)CN2CCC[C@@H]([NH3+])CC2)c1C	ZINC000244707795	189910126	/nfs/dbraw/zinc/91/01/26/189910126.db2.gz	KHRPQTPIPCWRGY-CYBMUJFWSA-N	1	0	293.415	1.272	50	0		CDAARO
C[C@H]([NH3+])C(=O)N(Cc1cccs1)C[C@H]1CCCO1	ZINC000037801386	373349700	/nfs/dbraw/zinc/34/97/00/373349700.db2.gz	HLFAVMHTEDFRFB-WDEREUQCSA-N	1	0	268.382	1.603	50	0		CDAARO
C[C@@H](C(=O)N1CCCC1)[N@@H+]1CCCC[C@H]1Cn1cncn1	ZINC000253378008	373679976	/nfs/dbraw/zinc/67/99/76/373679976.db2.gz	YYCUTIJGGFRPEX-KBPBESRZSA-N	1	0	291.399	1.144	50	0		CDAARO
Cc1noc([C@@H]2C[N@@H+](C3CCCCC3)C[C@H]2CO)n1	ZINC000253401358	373691202	/nfs/dbraw/zinc/69/12/02/373691202.db2.gz	FNYNTADNRPJSFS-WCQYABFASA-N	1	0	265.357	1.718	50	0		CDAARO
C[NH2+]C[C@H](C)CNS(=O)(=O)c1ccc(C)nc1Cl	ZINC000253415913	373725943	/nfs/dbraw/zinc/72/59/43/373725943.db2.gz	BXXFUSZHFFBNLS-QMMMGPOBSA-N	1	0	291.804	1.177	50	0		CDAARO
Cc1cccc(C(=O)N2CCO[C@H]3CC[N@@H+](C)C[C@H]32)c1O	ZINC000253425308	373731778	/nfs/dbraw/zinc/73/17/78/373731778.db2.gz	CHQWMCINHAMFCM-KGLIPLIRSA-N	1	0	290.363	1.246	50	0		CDAARO
C[NH+](C)CCNC(=O)c1cn(-c2cccc(Cl)c2)nn1	ZINC000067264170	374402856	/nfs/dbraw/zinc/40/28/56/374402856.db2.gz	MNEOBXNHIQNUPQ-UHFFFAOYSA-N	1	0	293.758	1.212	50	0		CDAARO
Cc1cc(S(=O)(=O)N[C@@H](C[NH3+])C2CC2)c(F)cc1F	ZINC000095432123	374932882	/nfs/dbraw/zinc/93/28/82/374932882.db2.gz	AAECPZGXGXQFMG-NSHDSACASA-N	1	0	290.335	1.289	50	0		CDAARO
CO[C@@H]1CC[C@@H]2OCC[N@H+](CCc3ccncc3)[C@@H]2C1	ZINC000095438013	374937506	/nfs/dbraw/zinc/93/75/06/374937506.db2.gz	BZQURKMTFLHUEX-OAGGEKHMSA-N	1	0	276.380	1.892	50	0		CDAARO
O[C@H](COc1ccccc1)C[N@@H+]1CCCSCC1	ZINC000095442037	374943043	/nfs/dbraw/zinc/94/30/43/374943043.db2.gz	DEOSBEGXFTULPH-ZDUSSCGKSA-N	1	0	267.394	1.865	50	0		CDAARO
c1nnc2c(N[C@H]3CC[N@@H+](C4CCCC4)C3)nccn12	ZINC000095404342	374908163	/nfs/dbraw/zinc/90/81/63/374908163.db2.gz	KYGWGHVMFQFRMP-NSHDSACASA-N	1	0	272.356	1.553	50	0		CDAARO
Cn1cc(C[NH2+]CC(=O)N2CCCC2)c(-c2cccnc2)n1	ZINC000097159893	375151018	/nfs/dbraw/zinc/15/10/18/375151018.db2.gz	CHFJQRSGFQDWFF-UHFFFAOYSA-N	1	0	299.378	1.194	50	0		CDAARO
CCC[NH+]1CCN(C(=O)Cn2nc(C)cc2C)CC1	ZINC000027982473	375168388	/nfs/dbraw/zinc/16/83/88/375168388.db2.gz	IHNWBWMPSHTIHP-UHFFFAOYSA-N	1	0	264.373	1.054	50	0		CDAARO
CC(C)OCCC[NH2+]C[C@H](O)COc1ccccc1	ZINC000003324728	375647079	/nfs/dbraw/zinc/64/70/79/375647079.db2.gz	PRTYRJYPGACTNO-AWEZNQCLSA-N	1	0	267.369	1.831	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CC[NH2+]CC2)cc1F	ZINC000606441059	375822607	/nfs/dbraw/zinc/82/26/07/375822607.db2.gz	BVKQOSAICIGSJZ-HYXAFXHYSA-N	1	0	264.300	1.279	50	0		CDAARO
CCNC(=O)NC(=O)[C@H](C)[N@@H+]1CC[C@@H]2CCCC[C@H]2C1	ZINC000239425985	376015576	/nfs/dbraw/zinc/01/55/76/376015576.db2.gz	VOMLNBIKGLAHPU-AVGNSLFASA-N	1	0	281.400	1.733	50	0		CDAARO
CC(C)[NH+]1CCC(N(C)C(=O)C[C@H]2CCCC(=O)N2)CC1	ZINC000377157396	376905942	/nfs/dbraw/zinc/90/59/42/376905942.db2.gz	GELUWJJCSGTVBF-CYBMUJFWSA-N	1	0	295.427	1.376	50	0		CDAARO
Cc1ncsc1CN1CCC[C@@H]1C[N@@H+]1CCC[C@H]1CO	ZINC000245312467	378068945	/nfs/dbraw/zinc/06/89/45/378068945.db2.gz	JKENYPXAEQBNHO-KGLIPLIRSA-N	1	0	295.452	1.873	50	0		CDAARO
CC(C)N1C[C@@H](C)[C@@H]([NH2+][C@H](C)CCS(C)(=O)=O)C1	ZINC000245338656	378070697	/nfs/dbraw/zinc/07/06/97/378070697.db2.gz	NOZLPZMXLCFMPC-UPJWGTAASA-N	1	0	276.446	1.128	50	0		CDAARO
[NH3+]Cc1ccccc1CS(=O)(=O)N1CCCCC1	ZINC000021520700	295279072	/nfs/dbraw/zinc/27/90/72/295279072.db2.gz	SHBHZZSQUUQNJX-UHFFFAOYSA-N	1	0	268.382	1.461	50	0		CDAARO
CCOc1ccc(/C=C\C(=O)N2CC[NH2+][C@@H](C)C2)cc1	ZINC000493195707	253396533	/nfs/dbraw/zinc/39/65/33/253396533.db2.gz	VOUOWMNEBQRSOA-XURPKSDJSA-N	1	0	274.364	1.919	50	0		CDAARO
C[C@@H]1CCCN(S(=O)(=O)c2ccccc2F)[C@H]1C[NH3+]	ZINC000251602266	296399420	/nfs/dbraw/zinc/39/94/20/296399420.db2.gz	BTLLAKFYSIOQLD-PWSUYJOCSA-N	1	0	286.372	1.574	50	0		CDAARO
CCc1cnc(N2CCCO[C@H](C[NH+]3CCCC3)C2)nc1	ZINC000095386048	184962574	/nfs/dbraw/zinc/96/25/74/184962574.db2.gz	KWBOAMPWOSZIHN-OAHLLOKOSA-N	1	0	290.411	1.730	50	0		CDAARO
Cc1cc(Cl)cc2c(=O)n(C[C@@H]3C[NH2+]CCO3)cnc12	ZINC000043103009	390430695	/nfs/dbraw/zinc/43/06/95/390430695.db2.gz	GCNBUGJSTOVGAX-NSHDSACASA-N	1	0	293.754	1.347	50	0		CDAARO
CCNC(=O)N[C@@H]1CC[N@H+](CCCOCC)C[C@@H]1C	ZINC000096407027	390508105	/nfs/dbraw/zinc/50/81/05/390508105.db2.gz	MIXBMOITUKGJIA-QWHCGFSZSA-N	1	0	271.405	1.443	50	0		CDAARO
CC[C@H]1CN(Cc2cnc(N(C)C)nc2)CC[N@@H+]1C(C)C	ZINC000072149014	390625344	/nfs/dbraw/zinc/62/53/44/390625344.db2.gz	VCJZOHALLVKWKA-HNNXBMFYSA-N	1	0	291.443	1.847	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(C[C@@H](C[NH3+])O2)CC1	ZINC000095630830	390911173	/nfs/dbraw/zinc/91/11/73/390911173.db2.gz	BXYHKGJGEWCZMB-JTQLQIEISA-N	1	0	256.346	1.504	50	0		CDAARO
[NH3+]C1(c2cccc(I)c2)COC1	ZINC000095630843	390911456	/nfs/dbraw/zinc/91/14/56/390911456.db2.gz	XDXWHQAWKOSKIJ-UHFFFAOYSA-N	1	0	275.089	1.475	50	0		CDAARO
COc1ccc(F)c(C[NH+]2CCC3(C[C@H](O)CO3)CC2)c1	ZINC000097696208	390918173	/nfs/dbraw/zinc/91/81/73/390918173.db2.gz	GFWUVTKKLQOAFC-ZDUSSCGKSA-N	1	0	295.354	1.950	50	0		CDAARO
CNc1nc(CN2CC[N@@H+]3CCC[C@@H]3C2)cs1	ZINC000244708316	391042870	/nfs/dbraw/zinc/04/28/70/391042870.db2.gz	KRLIBPIJUNTOFY-LLVKDONJSA-N	1	0	252.387	1.465	50	0		CDAARO
CC(C)[NH+]1CCC(N2C(=O)N3CCC[C@]3(C)C2=O)CC1	ZINC000240333290	391328414	/nfs/dbraw/zinc/32/84/14/391328414.db2.gz	FCTSQKPWPFFRRT-OAHLLOKOSA-N	1	0	279.384	1.676	50	0		CDAARO
CC(C)[NH2+]C[C@@]1(O)CCCN(CC(C)(C)C)C1=O	ZINC000015068283	391517257	/nfs/dbraw/zinc/51/72/57/391517257.db2.gz	DOLYOCDXRDUODF-AWEZNQCLSA-N	1	0	256.390	1.384	50	0		CDAARO
COC[C@H](O)CN1CC[NH+](C2CCC(C)CC2)CC1	ZINC000096406960	393179769	/nfs/dbraw/zinc/17/97/69/393179769.db2.gz	JNUQWRHAXXIFFT-YMAMQOFZSA-N	1	0	270.417	1.190	50	0		CDAARO
CC[C@H](O)CN1CC[NH+](C2CCC(C)CC2)CC1	ZINC000096406961	393179823	/nfs/dbraw/zinc/17/98/23/393179823.db2.gz	PCIZLQVSWUHAAN-NRXISQOPSA-N	1	0	254.418	1.954	50	0		CDAARO
CC(C)(O)C(C)(C)[NH2+]CC(=O)N1CCc2sccc2C1	ZINC000095459773	393147210	/nfs/dbraw/zinc/14/72/10/393147210.db2.gz	IDHQAFRMKUXPAF-UHFFFAOYSA-N	1	0	296.436	1.772	50	0		CDAARO
c1cn(-c2ccc(CN3C[C@@H]4CC[NH2+][C@@H]4C3)cc2)cn1	ZINC000097797309	285534267	/nfs/dbraw/zinc/53/42/67/285534267.db2.gz	OZSJQORVJMXZMN-GOEBONIOSA-N	1	0	268.364	1.666	50	0		CDAARO
C[C@@H]1CCC[C@@H](NC(=O)CCC(=O)NCC[NH+](C)C)[C@H]1C	ZINC000103140223	397889628	/nfs/dbraw/zinc/88/96/28/397889628.db2.gz	BVMNLTCKDVFEQL-HZSPNIEDSA-N	1	0	297.443	1.385	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)CCc2cc(F)ccc2F)C1	ZINC000095971822	147113717	/nfs/dbraw/zinc/11/37/17/147113717.db2.gz	RUQCZELYGRXEDC-NSHDSACASA-N	1	0	254.280	1.457	50	0		CDAARO
C[C@H]([NH3+])[C@H](C)C(=O)N1CCO[C@@H](c2cccs2)C1	ZINC000249018859	148916683	/nfs/dbraw/zinc/91/66/83/148916683.db2.gz	KNRHXPRXHHUKOF-GARJFASQSA-N	1	0	268.382	1.631	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+]C2CCN(C(N)=O)CC2)C12CCCC2	ZINC000095423474	286277662	/nfs/dbraw/zinc/27/76/62/286277662.db2.gz	MYZFJXVJBHFYIW-ZIAGYGMSSA-N	1	0	295.427	1.857	50	0		CDAARO
COCCNC(=O)C1CC[NH+](C[C@H]2CC=CCC2)CC1	ZINC000002828202	169835107	/nfs/dbraw/zinc/83/51/07/169835107.db2.gz	IAHKAEQTOHIIJO-AWEZNQCLSA-N	1	0	280.412	1.817	50	0		CDAARO
Cn1nnnc1SCC[NH2+]Cc1ccc(Cl)cc1	ZINC000004831838	170025492	/nfs/dbraw/zinc/02/54/92/170025492.db2.gz	BRUKTCLRAQJSAW-UHFFFAOYSA-N	1	0	283.788	1.745	50	0		CDAARO
C[C@@](C[NH3+])(NS(=O)(=O)c1ccccc1)c1ccccc1	ZINC000004854936	170031211	/nfs/dbraw/zinc/03/12/11/170031211.db2.gz	CVDKJMWPWHYCTA-HNNXBMFYSA-N	1	0	290.388	1.839	50	0		CDAARO
O=C(C[NH2+]C[C@H]1CCCO1)Nc1ccccc1F	ZINC000004894703	170037479	/nfs/dbraw/zinc/03/74/79/170037479.db2.gz	PVGBPVJYLSPPON-SNVBAGLBSA-N	1	0	252.289	1.533	50	0		CDAARO
COc1ccccc1CSc1nc(N)cc(N)[nH+]1	ZINC000007692713	170297592	/nfs/dbraw/zinc/29/75/92/170297592.db2.gz	JOZXOIWJFOIXIU-UHFFFAOYSA-N	1	0	262.338	1.942	50	0		CDAARO
CCOc1ccc(C[NH2+]CCOCCO)cc1OC	ZINC000008324697	170331561	/nfs/dbraw/zinc/33/15/61/170331561.db2.gz	JGOYGYVQLOPNCI-UHFFFAOYSA-N	1	0	269.341	1.192	50	0		CDAARO
O=C(C[N@@H+]1CCC[C@H]1c1ccccc1)NC(=O)NC1CC1	ZINC000010088866	170397528	/nfs/dbraw/zinc/39/75/28/170397528.db2.gz	IPNJACLNBCQBQQ-AWEZNQCLSA-N	1	0	287.363	1.812	50	0		CDAARO
CC[C@@H](C)[NH+]1CCC2(CC1)C(=O)N(C)C(=O)N2CCOC	ZINC000014740826	170644315	/nfs/dbraw/zinc/64/43/15/170644315.db2.gz	KXMJHDDDTGHTTO-GFCCVEGCSA-N	1	0	297.399	1.160	50	0		CDAARO
CCCC[NH2+][C@H]1CC(=O)N(c2ccc(OC)cc2)C1=O	ZINC000018106136	170742673	/nfs/dbraw/zinc/74/26/73/170742673.db2.gz	YOFIMPRZPGRQAZ-ZDUSSCGKSA-N	1	0	276.336	1.717	50	0		CDAARO
NC(=O)C1CC[NH+](Cn2cnc3ccccc32)CC1	ZINC000020421507	171187900	/nfs/dbraw/zinc/18/79/00/171187900.db2.gz	OMMSAEKYJGKWJI-UHFFFAOYSA-N	1	0	258.325	1.191	50	0		CDAARO
COc1ccc(S(=O)(=O)Nc2cccc(C[NH3+])c2)cc1	ZINC000020431895	171196540	/nfs/dbraw/zinc/19/65/40/171196540.db2.gz	CXDLOWMNDVRSDZ-UHFFFAOYSA-N	1	0	292.360	1.955	50	0		CDAARO
CS(=O)(=O)N1CCC([NH2+]Cc2ccccc2)CC1	ZINC000030656202	171620318	/nfs/dbraw/zinc/62/03/18/171620318.db2.gz	UYJLISVKTRBRPL-UHFFFAOYSA-N	1	0	268.382	1.200	50	0		CDAARO
COc1cc(C[NH2+]CCO)ccc1OCc1nc(C)no1	ZINC000035287258	172105026	/nfs/dbraw/zinc/10/50/26/172105026.db2.gz	DVNDUNBVEGAFDE-UHFFFAOYSA-N	1	0	293.323	1.048	50	0		CDAARO
Cc1ccc(Cl)cc1S(=O)(=O)N1CCC[C@H]([NH3+])C1	ZINC000036297052	172590250	/nfs/dbraw/zinc/59/02/50/172590250.db2.gz	QPNGJBIMROAXGM-NSHDSACASA-N	1	0	288.800	1.760	50	0		CDAARO
CCn1cc([C@@H]2OCCC[C@H]2C[NH2+][C@@H]2CCC[C@H]2O)cn1	ZINC000657489581	414390659	/nfs/dbraw/zinc/39/06/59/414390659.db2.gz	RCPWTPRYLBUBST-LCGIIJARSA-N	1	0	293.411	1.874	50	0		CDAARO
C[NH2+]CC(=O)NCCc1c(OC)ccc2ccccc21	ZINC000071422403	176160991	/nfs/dbraw/zinc/16/09/91/176160991.db2.gz	WKVCLMQRHYEGSV-UHFFFAOYSA-N	1	0	272.348	1.727	50	0		CDAARO
CCOc1ccccc1NC(=O)NC[C@H]1C[NH2+]CCOC1	ZINC000072134682	176322179	/nfs/dbraw/zinc/32/21/79/176322179.db2.gz	NEZQPEBYTUQFEH-GFCCVEGCSA-N	1	0	293.367	1.443	50	0		CDAARO
Cc1ccc(NC(=O)NC[C@@H]2C[NH2+]CCOC2)cc1	ZINC000072144582	176324316	/nfs/dbraw/zinc/32/43/16/176324316.db2.gz	BRQYJZYYGVCAPU-LBPRGKRZSA-N	1	0	263.341	1.353	50	0		CDAARO
Cn1cncc1CN1CCCC[C@H]1CC[NH+](C)C	ZINC000072163576	176330306	/nfs/dbraw/zinc/33/03/06/176330306.db2.gz	CCPWOIJBJCFJQB-ZDUSSCGKSA-N	1	0	250.390	1.726	50	0		CDAARO
CCOC(=O)[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1O	ZINC000072267128	176352374	/nfs/dbraw/zinc/35/23/74/176352374.db2.gz	MUPAPEDKCKNYLY-KGLIPLIRSA-N	1	0	263.337	1.433	50	0		CDAARO
C[C@@H]1CCCN(C(=O)[C@H]2CC23CCOCC3)[C@H]1C[NH3+]	ZINC000299739629	287336904	/nfs/dbraw/zinc/33/69/04/287336904.db2.gz	QSDXMSJZSSORFA-UPJWGTAASA-N	1	0	266.385	1.389	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)N(C)CC2CCOCC2)CC1	ZINC000179869309	260077844	/nfs/dbraw/zinc/07/78/44/260077844.db2.gz	MUGRBOXACDKVMQ-UHFFFAOYSA-N	1	0	282.428	1.992	50	0		CDAARO
CNC(=O)[C@H](CC(C)C)[NH2+][C@H]1CN(C(C)C)C[C@@H]1C	ZINC000095421152	277011948	/nfs/dbraw/zinc/01/19/48/277011948.db2.gz	DZSZXGKBDDXOQF-IHRRRGAJSA-N	1	0	269.433	1.465	50	0		CDAARO
C[C@H]([NH2+]CC(=O)N1CCCCCC1)C1CCOCC1	ZINC000096492011	278255076	/nfs/dbraw/zinc/25/50/76/278255076.db2.gz	INJRJHWLPQDKOK-ZDUSSCGKSA-N	1	0	268.401	1.794	50	0		CDAARO
Cc1cc(C)c(C[N@@H+]2CCN3C(=O)NC[C@H]3C2)cc1C	ZINC000091863786	279288787	/nfs/dbraw/zinc/28/87/87/279288787.db2.gz	IIFMHYQGXIUQGD-HNNXBMFYSA-N	1	0	273.380	1.821	50	0		CDAARO
O=C([C@H]1CCCC[NH2+]1)N1CCC[C@H](C(F)(F)F)C1	ZINC000037750002	280129504	/nfs/dbraw/zinc/12/95/04/280129504.db2.gz	GFZYGWFRPFUEFF-VHSXEESVSA-N	1	0	264.291	1.929	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)/C=C\c2cnc(C)s2)C1	ZINC000255129160	289357798	/nfs/dbraw/zinc/35/77/98/289357798.db2.gz	WXERZMJLYDLDHK-GZTOBOFZSA-N	1	0	265.382	1.675	50	0		CDAARO
CN(CC[NH+]1CCCC1)C(=O)[C@@]1(C)CCCCO1	ZINC000457533263	289650441	/nfs/dbraw/zinc/65/04/41/289650441.db2.gz	RGXUULIVDKTXLA-CQSZACIVSA-N	1	0	254.374	1.500	50	0		CDAARO
Cc1cnc(N)nc1N(C)CC[C@@H](C)[NH+]1CCCC1	ZINC000091424926	302347962	/nfs/dbraw/zinc/34/79/62/302347962.db2.gz	KOAWLUILMXZQDZ-GFCCVEGCSA-N	1	0	263.389	1.678	50	0		CDAARO
C[NH+](C)[C@H]1CN(Cc2ccc(Cl)s2)C[C@@H]1O	ZINC000578245160	317501093	/nfs/dbraw/zinc/50/10/93/317501093.db2.gz	FBFYJIRDAHRLOS-UWVGGRQHSA-N	1	0	260.790	1.508	50	0		CDAARO
C[NH+](C)CC[C@H](NS(=O)(=O)C1CC1)c1ccccc1	ZINC000534581467	328311850	/nfs/dbraw/zinc/31/18/50/328311850.db2.gz	NISWDQNHTPSHLX-AWEZNQCLSA-N	1	0	282.409	1.761	50	0		CDAARO
Cc1nc(CN2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)c(C)s1	ZINC000534646636	328330372	/nfs/dbraw/zinc/33/03/72/328330372.db2.gz	ZTHXNEQWLLCMJE-WVKUQDAKSA-N	1	0	263.410	1.942	50	0		CDAARO
O=C(NC[C@H]1CC[N@@H+](C2CCCC2)C1)C1(CO)CC1	ZINC000534640023	328335841	/nfs/dbraw/zinc/33/58/41/328335841.db2.gz	BWURPRBQIOQFAH-GFCCVEGCSA-N	1	0	266.385	1.140	50	0		CDAARO
CNC(=O)CCC(=O)N[C@H](CC[NH+](C)C)c1ccccc1	ZINC000534647956	328342972	/nfs/dbraw/zinc/34/29/72/328342972.db2.gz	BEKUGAAGCFFFRT-CQSZACIVSA-N	1	0	291.395	1.322	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@H]2C(=O)Nc3cccc(Cl)c3C(=O)N2C1	ZINC000534655077	328339441	/nfs/dbraw/zinc/33/94/41/328339441.db2.gz	YTVZTEHKUXWSTK-KCJUWKMLSA-N	1	0	293.754	1.437	50	0		CDAARO
COCCCNC(=O)c1cc(C2CC[NH2+]CC2)ccn1	ZINC000534648710	328343691	/nfs/dbraw/zinc/34/36/91/328343691.db2.gz	HSEPGANRTRKQLA-UHFFFAOYSA-N	1	0	277.368	1.315	50	0		CDAARO
O=C(c1ccc(C[NH2+][C@H]2CCOC2)cc1)N1CCCC1	ZINC000534665969	328345190	/nfs/dbraw/zinc/34/51/90/328345190.db2.gz	HROSKBLTYUDRKU-HNNXBMFYSA-N	1	0	274.364	1.801	50	0		CDAARO
C[NH2+]C[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000032104979	330381174	/nfs/dbraw/zinc/38/11/74/330381174.db2.gz	XVUQUTDOVKEXAH-SECBINFHSA-N	1	0	250.125	1.953	50	0		CDAARO
COCC[N@@H+]1CCC[C@@]2(CCN(c3ncccn3)C2)C1	ZINC000072142031	482451452	/nfs/dbraw/zinc/45/14/52/482451452.db2.gz	WYRRJGWQQNGEAP-OAHLLOKOSA-N	1	0	276.384	1.415	50	0		CDAARO
[NH3+][C@@H]1CCC[C@@H]1C(=O)N1CCN(c2ccccc2F)CC1	ZINC000085365306	482577967	/nfs/dbraw/zinc/57/79/67/482577967.db2.gz	DCBSSNIMRUJCSZ-GXTWGEPZSA-N	1	0	291.370	1.602	50	0		CDAARO
[NH3+][C@@H]1CCC[C@@H]1C(=O)N1CCOc2ccccc2C1	ZINC000085370635	482579174	/nfs/dbraw/zinc/57/91/74/482579174.db2.gz	KRQDRGKPVDOLFI-QWHCGFSZSA-N	1	0	260.337	1.535	50	0		CDAARO
O=C1C[C@H](C[NH+]2CCC(C(F)(F)F)CC2)CN1	ZINC000585094219	482828693	/nfs/dbraw/zinc/82/86/93/482828693.db2.gz	RRGYYEAPTJSCTG-QMMMGPOBSA-N	1	0	250.264	1.397	50	0		CDAARO
CCCOc1cccc(CNC(=O)N[C@H]2CC[NH2+]C2)c1	ZINC000670446695	482997552	/nfs/dbraw/zinc/99/75/52/482997552.db2.gz	XRZFKKNRPZIBOT-ZDUSSCGKSA-N	1	0	277.368	1.637	50	0		CDAARO
CC(C)CC(=O)N1CC[NH+](CC[C@@H]2CCOC2)CC1	ZINC000670469495	483064535	/nfs/dbraw/zinc/06/45/35/483064535.db2.gz	QAQKPWHFMGFKIU-CQSZACIVSA-N	1	0	268.401	1.603	50	0		CDAARO
Cc1c(C(=O)N2[C@@H]3CC[C@H]2C[N@H+](C)CC3)ccn1C	ZINC000670470667	483072259	/nfs/dbraw/zinc/07/22/59/483072259.db2.gz	FCYQWMIXQSUFBR-OLZOCXBDSA-N	1	0	261.369	1.642	50	0		CDAARO
CCCc1cc(C(=O)N[C@@H]2CCC[C@H]2[NH+](C)C)[nH]n1	ZINC000681788671	483114477	/nfs/dbraw/zinc/11/44/77/483114477.db2.gz	JEGZQFDXUCFMKB-DGCLKSJQSA-N	1	0	264.373	1.575	50	0		CDAARO
CCn1c(C)nnc1CN(C)[C@@H]1CC[N@H+](CCCOC)C1	ZINC000083836854	483202704	/nfs/dbraw/zinc/20/27/04/483202704.db2.gz	GUHVFPDBXURKOR-CQSZACIVSA-N	1	0	295.431	1.149	50	0		CDAARO
CN(CCOCC1CC1)C(=O)N[C@H]1CCC[N@H+](C)C1	ZINC000083877762	483216008	/nfs/dbraw/zinc/21/60/08/483216008.db2.gz	XVPIPPWJRUFQSQ-ZDUSSCGKSA-N	1	0	269.389	1.149	50	0		CDAARO
CCCN(CC)C(=O)Cn1ccc([C@@H]2CCC[NH2+]C2)n1	ZINC000426698224	527953460	/nfs/dbraw/zinc/95/34/60/527953460.db2.gz	KVXBDMAIMIENGP-CYBMUJFWSA-N	1	0	278.400	1.609	50	0		CDAARO
CC[N@H+](CCC(=O)NC)C[C@H](O)c1ccc(C)cc1	ZINC000096441672	528398554	/nfs/dbraw/zinc/39/85/54/528398554.db2.gz	KKZCRNRVHJPTPO-AWEZNQCLSA-N	1	0	264.369	1.486	50	0		CDAARO
CCS[C@@H]1CC[C@H]([N@H+](C)CCN2C(=O)CCC2=O)C1	ZINC000096441694	529221491	/nfs/dbraw/zinc/22/14/91/529221491.db2.gz	RMRVKXYHKGDTLJ-NWDGAFQWSA-N	1	0	284.425	1.741	50	0		CDAARO
CC(C)([NH3+])CN1CCC[C@@H](Oc2ncccc2F)C1	ZINC000261646220	535197882	/nfs/dbraw/zinc/19/78/82/535197882.db2.gz	AQZBBQWZQCZDNT-LLVKDONJSA-N	1	0	267.348	1.801	50	0		CDAARO
COc1ccc(C(=O)O[C@@H]2C[NH+]3CCC2CC3)cc1	ZINC000000487776	545531673	/nfs/dbraw/zinc/53/16/73/545531673.db2.gz	RTVDYLNYUUQEKN-CQSZACIVSA-N	1	0	261.321	1.946	50	0	biogenic	CDAARO
C/C=C/Cc1nnc(C(=O)N(C)C[C@@H]2CCC[N@@H+]2C)o1	ZINC000071774862	538427306	/nfs/dbraw/zinc/42/73/06/538427306.db2.gz	NXPWMQXFFQXPNC-ZWNMCFTASA-N	1	0	278.356	1.354	50	0		CDAARO
CNC(=O)NC(=O)C[NH2+][C@H](Cc1ccc(F)cc1)C(C)C	ZINC000097049021	567903855	/nfs/dbraw/zinc/90/38/55/567903855.db2.gz	PSCARMCWQYSGIS-CYBMUJFWSA-N	1	0	295.358	1.438	50	0		CDAARO
Nn1cn[n+](CC(=O)c2ccc(Cl)cc2Cl)c1	ZINC000000037825	567905355	/nfs/dbraw/zinc/90/53/55/567905355.db2.gz	LSSSZQFDFRPCBE-UHFFFAOYSA-N	1	0	272.115	1.074	50	0		CDAARO
CCCN1C[C@H]([NH2+]Cc2ccc(N(C)C)nc2)CC1=O	ZINC000952991380	614813394	/nfs/dbraw/zinc/81/33/94/614813394.db2.gz	OSJWNCDQKSPASS-CYBMUJFWSA-N	1	0	276.384	1.248	50	0		CDAARO
CC[C@@H](Cn1ccnc1)[NH2+]Cc1ccc(OC)nc1	ZINC000952975547	615497679	/nfs/dbraw/zinc/49/76/79/615497679.db2.gz	FKSHGLICJVCPRG-ZDUSSCGKSA-N	1	0	260.341	1.855	50	0		CDAARO
F[C@H](c1nc(-c2ccc3c(c2)CCO3)no1)C1C[NH2+]C1	ZINC000888096719	617759583	/nfs/dbraw/zinc/75/95/83/617759583.db2.gz	JYLHTQCHPHYPPY-LBPRGKRZSA-N	1	0	275.283	1.902	50	0		CDAARO
[NH3+]CC(=O)N1CCC2(CC1)OCCc1c3ccccc3[nH]c12	ZINC001704299831	1177679971	/nfs/dbraw/zinc/67/99/71/1177679971.db2.gz	KTIGCIUWMMCSAD-UHFFFAOYSA-N	1	0	299.374	1.517	50	0		CDAARO
CCc1cnc(NCCCN2CC[NH+](C)CC2)nc1	ZINC000095384589	782364435	/nfs/dbraw/zinc/36/44/35/782364435.db2.gz	ORTPJCURXBZNHT-UHFFFAOYSA-N	1	0	263.389	1.088	50	0		CDAARO
Cn1cc(C[NH2+][C@@H]2CCCN(Cc3ccccn3)C2)cn1	ZINC000023374409	781118094	/nfs/dbraw/zinc/11/80/94/781118094.db2.gz	SPPZNSYHPGCXON-MRXNPFEDSA-N	1	0	285.395	1.569	50	0		CDAARO
CSc1ncc(C[NH2+]CC(C)(C)N2CCOCC2)n1C	ZINC000952979656	781228056	/nfs/dbraw/zinc/22/80/56/781228056.db2.gz	QWJPATSYYNOJGB-UHFFFAOYSA-N	1	0	298.456	1.342	50	0		CDAARO
CCC1=NO[C@H](C[N@H+](C)CCn2ccnc2C)C1	ZINC000252481437	900765512	/nfs/dbraw/zinc/76/55/12/900765512.db2.gz	CMFCFUOFMSHOME-ZDUSSCGKSA-N	1	0	250.346	1.678	50	0		CDAARO
OC[C@@H]1CCC[N@H+](CCNc2ncccc2F)C1	ZINC000952870174	910421374	/nfs/dbraw/zinc/42/13/74/910421374.db2.gz	UGEBOSZQWGOFCQ-LLVKDONJSA-N	1	0	253.321	1.337	50	0		CDAARO
Cc1cc(NC(=O)[C@H]2C=CC[NH2+]2)cc2sc(N)nc21	ZINC000952972363	910512975	/nfs/dbraw/zinc/51/29/75/910512975.db2.gz	ZWSMSFCEZMEQNT-SECBINFHSA-N	1	0	274.349	1.653	50	0		CDAARO
Cc1cc(C)nc(NCC[N@@H+]2CCCC[C@@H]2CO)n1	ZINC000952977737	910525655	/nfs/dbraw/zinc/52/56/55/910525655.db2.gz	ISBFHESLMCYOSV-CYBMUJFWSA-N	1	0	264.373	1.352	50	0		CDAARO
Cc1nc(SCC[NH2+]Cc2cnc(C)nc2)n[nH]1	ZINC000952983575	910547028	/nfs/dbraw/zinc/54/70/28/910547028.db2.gz	VPOWQLZIUMCHHB-UHFFFAOYSA-N	1	0	264.358	1.093	50	0		CDAARO
CCN(CCOc1ccc(OC)cc1)C(=O)C[NH+](C)C	ZINC000055211763	936414142	/nfs/dbraw/zinc/41/41/42/936414142.db2.gz	QKCKDYQIYLYQLV-UHFFFAOYSA-N	1	0	280.368	1.484	50	0		CDAARO
CC(C)[C@@H](CNc1ncccc1C(N)=O)[NH+]1CCCC1	ZINC000820696271	925543586	/nfs/dbraw/zinc/54/35/86/925543586.db2.gz	FCWSNVPWLYFVAK-CYBMUJFWSA-N	1	0	276.384	1.713	50	0		CDAARO
CCC1(C[NH2+][C@@H](C)CNS(=O)(=O)C2CC2)CCC1	ZINC000822681482	925646141	/nfs/dbraw/zinc/64/61/41/925646141.db2.gz	MBIGKAXZLIONJU-NSHDSACASA-N	1	0	274.430	1.627	50	0		CDAARO
CCOc1ccnc(N2CCC[C@@H]([NH+](C)C)C2)n1	ZINC000823399298	925691163	/nfs/dbraw/zinc/69/11/63/925691163.db2.gz	LCOPCPVTJYIRBK-LLVKDONJSA-N	1	0	250.346	1.406	50	0		CDAARO
C[N@H+](CCc1ncc[nH]1)C[C@H]1COc2ccccc2O1	ZINC000823690354	925723297	/nfs/dbraw/zinc/72/32/97/925723297.db2.gz	WHXQHLNCGHIYSM-LBPRGKRZSA-N	1	0	273.336	1.724	50	0		CDAARO
COCCC[N@@H+]1CC[C@@H](CNC(=O)c2cncc(F)c2)C1	ZINC000824390219	925817321	/nfs/dbraw/zinc/81/73/21/925817321.db2.gz	VLKZVLBJZJCBBS-LBPRGKRZSA-N	1	0	295.358	1.309	50	0		CDAARO
COCC1(CNC(=O)[C@H](C)C[NH+]2CCCC2)CCC1	ZINC000824346704	925817920	/nfs/dbraw/zinc/81/79/20/925817920.db2.gz	BXCHJVUDAYYNCV-CYBMUJFWSA-N	1	0	268.401	1.651	50	0		CDAARO
COc1ncc(C[N@H+](C)CCCn2cccn2)cn1	ZINC000824852246	925839931	/nfs/dbraw/zinc/83/99/31/925839931.db2.gz	YYPPCXWEKOJPSH-UHFFFAOYSA-N	1	0	261.329	1.204	50	0		CDAARO
CC(C)(C[NH+]1CCCC1)C[NH+]1CCC(C(=O)[O-])CC1	ZINC000828481740	926128959	/nfs/dbraw/zinc/12/89/59/926128959.db2.gz	BZTIHWFAUIRXMN-UHFFFAOYSA-N	1	0	268.401	1.905	50	0		CDAARO
CCN1CCCn2ccnc2[C@@H]1C1CC[NH+](CCO)CC1	ZINC000581814675	927206356	/nfs/dbraw/zinc/20/63/56/927206356.db2.gz	WTQRAYNDLYINDR-HNNXBMFYSA-N	1	0	292.427	1.354	50	0		CDAARO
O=C(NC1(CO)CCSCC1)[C@@H]1CCC[C@H]2CCC[N@@H+]21	ZINC000585121959	930988075	/nfs/dbraw/zinc/98/80/75/930988075.db2.gz	HOOMOXFGRVBWMI-STQMWFEESA-N	1	0	298.452	1.378	50	0		CDAARO
Cc1cc(=O)c(C(=O)N[C@H]2C[C@@H]([NH+](C)C)C23CCC3)c[nH]1	ZINC000585127796	931011263	/nfs/dbraw/zinc/01/12/63/931011263.db2.gz	JNXCZDPKIRMKPX-UONOGXRCSA-N	1	0	289.379	1.286	50	0		CDAARO
CC(C)(C)c1ccc(=O)n(CC2CC[NH+](CCO)CC2)n1	ZINC000585499107	932836738	/nfs/dbraw/zinc/83/67/38/932836738.db2.gz	CKVZFKRNVGTNJG-UHFFFAOYSA-N	1	0	293.411	1.245	50	0		CDAARO
C[C@@H]1COC[C@H]1[NH2+]CCN(C)C(=O)OC(C)(C)C	ZINC000688049549	934529288	/nfs/dbraw/zinc/52/92/88/934529288.db2.gz	RBWOHHXEFWJESD-GHMZBOCLSA-N	1	0	258.362	1.478	50	0		CDAARO
COc1ccccc1[C@@H](O)C[NH2+][C@H]1CCC1(OC)OC	ZINC000864097175	934606673	/nfs/dbraw/zinc/60/66/73/934606673.db2.gz	POWLMUVYIKQHMG-JSGCOSHPSA-N	1	0	281.352	1.470	50	0		CDAARO
O=C(Nc1ccc(-n2cncn2)c(F)c1)[C@H]1CCC[NH2+]C1	ZINC000037771227	934816161	/nfs/dbraw/zinc/81/61/61/934816161.db2.gz	KXDXZSTXDJJBLO-JTQLQIEISA-N	1	0	289.314	1.345	50	0		CDAARO
C/C=C(\C)C(=O)N[C@@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000015064324	935533456	/nfs/dbraw/zinc/53/34/56/935533456.db2.gz	DPGQARWKGYRQOU-QJIMOZNHSA-N	1	0	279.428	1.627	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1ncc(F)c(N(C)C)n1	ZINC001529090281	968978414	/nfs/dbraw/zinc/97/84/14/968978414.db2.gz	FTLPZIOCJPAKFM-LLVKDONJSA-N	1	0	281.379	1.968	50	0		CDAARO
COc1ccc(C[C@H]([NH3+])C(=O)Nc2cnn(C)c2C)cc1	ZINC001529098344	968979553	/nfs/dbraw/zinc/97/95/53/968979553.db2.gz	AYHZJKIWTJTNIA-ZDUSSCGKSA-N	1	0	288.351	1.246	50	0		CDAARO
CC[N@@H+]1CCC[C@]2(CCC[NH+](CCC(=O)[O-])C2)C1	ZINC001529151343	968995593	/nfs/dbraw/zinc/99/55/93/968995593.db2.gz	BODNHLYSZBXAHW-AWEZNQCLSA-N	1	0	254.374	1.659	50	0		CDAARO
CCC[C@@H](CNc1cc(OC(C)C)nc(N)n1)[NH+](C)C	ZINC001529160169	968999138	/nfs/dbraw/zinc/99/91/38/968999138.db2.gz	YRCWOCKYMIPPFA-NSHDSACASA-N	1	0	281.404	1.988	50	0		CDAARO
CCn1ncc(NC(=O)[C@@H]2CCCN2CC)c1C	ZINC001529194583	969008778	/nfs/dbraw/zinc/00/87/78/969008778.db2.gz	AISWRDJWQNFAOK-LBPRGKRZSA-N	1	0	250.346	1.634	50	0		CDAARO
CCc1ccc(C[NH2+]CCN2CCC[C@H](CO)C2)o1	ZINC001506397124	975147849	/nfs/dbraw/zinc/14/78/49/975147849.db2.gz	NLHIREPPKRWDMI-ZDUSSCGKSA-N	1	0	266.385	1.636	50	0		CDAARO
C[C@H](Cn1cncn1)[NH2+]C1CSCCSC1	ZINC001506408448	975152544	/nfs/dbraw/zinc/15/25/44/975152544.db2.gz	SDNFMILYSGGJSS-SECBINFHSA-N	1	0	258.416	1.105	50	0		CDAARO
CC[N@@H+]1CCC[C@]2(CCCN(CCn3cnnc3C)C2)C1	ZINC001506412864	975154533	/nfs/dbraw/zinc/15/45/33/975154533.db2.gz	PDDDGCFFKONEOJ-INIZCTEOSA-N	1	0	291.443	1.784	50	0		CDAARO
COC[C@@H]([NH2+][C@@H]1CCN(CC(F)(F)F)C1)C1CC1	ZINC000096476821	230379798	/nfs/dbraw/zinc/37/97/98/230379798.db2.gz	CPRZCLYNHPUKMN-GHMZBOCLSA-N	1	0	266.307	1.638	50	0		CDAARO
[NH3+]CCOc1ccc(Cl)cc1C(=O)NCC(F)(F)F	ZINC000426399471	230417386	/nfs/dbraw/zinc/41/73/86/230417386.db2.gz	XTVKZKVQTYSTKD-UHFFFAOYSA-N	1	0	296.676	1.970	50	0		CDAARO
O=C(Cc1cccc(F)c1F)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000127625099	187321466	/nfs/dbraw/zinc/32/14/66/187321466.db2.gz	QGDKITWOKGUDOT-NEPJUHHUSA-N	1	0	280.318	1.860	50	0		CDAARO
CC(C)(C)c1ccc(OC[C@H](O)C[NH+]2CC(CO)C2)cc1	ZINC000095942195	185036316	/nfs/dbraw/zinc/03/63/16/185036316.db2.gz	PJGQELGCOFHWLW-OAHLLOKOSA-N	1	0	293.407	1.648	50	0		CDAARO
C[C@@H](CNC(=O)COCC1CC1)C[NH+]1CCCC1	ZINC000095953249	185040607	/nfs/dbraw/zinc/04/06/07/185040607.db2.gz	ZXFTYDZGWQZRCM-LBPRGKRZSA-N	1	0	254.374	1.261	50	0		CDAARO
C[C@H](c1cccnc1)[N@H+](C)CCC(=O)N1CCOCC1	ZINC000095977290	185051480	/nfs/dbraw/zinc/05/14/80/185051480.db2.gz	CBCASCFUKXKQHZ-CYBMUJFWSA-N	1	0	277.368	1.323	50	0		CDAARO
COc1cc(C[N@@H+]2CC[C@H](C(N)=O)C2)cc(OC)c1	ZINC000095982235	185054315	/nfs/dbraw/zinc/05/43/15/185054315.db2.gz	BRKUTIKRJXNVEC-NSHDSACASA-N	1	0	264.325	1.011	50	0		CDAARO
C[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1cc(C2CC2)on1	ZINC000242048176	361754851	/nfs/dbraw/zinc/75/48/51/361754851.db2.gz	VTLVMMTYWMZGIG-JQWIXIFHSA-N	1	0	275.352	1.861	50	0		CDAARO
C[C@@H](CC(=O)N1C[C@@H](C)OC[C@H]1C)[C@@H]1CCC[NH2+]C1	ZINC000251704645	361812946	/nfs/dbraw/zinc/81/29/46/361812946.db2.gz	OJDVBUFDOCBURR-REWJHTLYSA-N	1	0	268.401	1.648	50	0		CDAARO
COCC1(CNC(=O)[C@@H]2CCC[C@H]([NH3+])C2)CCC1	ZINC000386573179	342090052	/nfs/dbraw/zinc/09/00/52/342090052.db2.gz	XXVXCWUGVGUBID-NEPJUHHUSA-N	1	0	254.374	1.437	50	0		CDAARO
O=C(N[C@H]1CC[N@H+](CC2CC2)C1)N1CC[C@]2(CCOC2)C1	ZINC000089598165	539087500	/nfs/dbraw/zinc/08/75/00/539087500.db2.gz	FOSYVWHOJMLFFT-HOCLYGCPSA-N	1	0	293.411	1.293	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1ccc(-n2cccn2)c(F)c1	ZINC000125193533	187173880	/nfs/dbraw/zinc/17/38/80/187173880.db2.gz	SPSCJCDMLMVNSX-LLVKDONJSA-N	1	0	288.326	1.445	50	0		CDAARO
[NH3+][C@H](C(=O)N1CC[C@@H](Oc2cccnc2)C1)c1ccccc1	ZINC000195554351	342625958	/nfs/dbraw/zinc/62/59/58/342625958.db2.gz	KGKJWSXOONSLGA-CVEARBPZSA-N	1	0	297.358	1.761	50	0		CDAARO
COCC[NH2+]CC(=O)N1CC[C@H](C)CC[C@@H]1C(C)C	ZINC000195543553	342626651	/nfs/dbraw/zinc/62/66/51/342626651.db2.gz	YZJAPHCEABGTRI-ZIAGYGMSSA-N	1	0	270.417	1.896	50	0		CDAARO
[NH3+][C@H]1C[C@@H](c2cc(N3CCOCC3)nc(C3CC3)n2)C1	ZINC000244691585	361857174	/nfs/dbraw/zinc/85/71/74/361857174.db2.gz	JFJGWGHEQAPJGA-TXEJJXNPSA-N	1	0	274.368	1.395	50	0		CDAARO
CCN(CC[NH+](C)C)C(=O)c1csc2nc(C)cn12	ZINC000244763860	361862307	/nfs/dbraw/zinc/86/23/07/361862307.db2.gz	OWSNKEWSYQXUKV-UHFFFAOYSA-N	1	0	280.397	1.728	50	0		CDAARO
O[C@H]1C[C@@H](c2cc(NCCC[NH+]3CCCC3)ncn2)C1	ZINC000244795420	361865098	/nfs/dbraw/zinc/86/50/98/361865098.db2.gz	RGCPQIGSRAQENA-BETUJISGSA-N	1	0	276.384	1.613	50	0		CDAARO
Cc1cc[nH+]c(NC[C@@H]2CCN([C@@H]3CCOC3=O)C2)c1	ZINC000065463568	361906671	/nfs/dbraw/zinc/90/66/71/361906671.db2.gz	ODBBIHYUFPAAHP-QWHCGFSZSA-N	1	0	275.352	1.439	50	0		CDAARO
O=C(OCCOc1cccnc1)c1ccn2c[nH+]cc2c1	ZINC000097034311	185157168	/nfs/dbraw/zinc/15/71/68/185157168.db2.gz	PHDMGHNXTHEOPL-UHFFFAOYSA-N	1	0	283.287	1.965	50	0		CDAARO
Cc1ccc(F)cc1C(=O)NCC[NH+]1CCC(CO)CC1	ZINC000084177576	539060344	/nfs/dbraw/zinc/06/03/44/539060344.db2.gz	HKPBNNUHTICNIA-UHFFFAOYSA-N	1	0	294.370	1.568	50	0		CDAARO
C[C@H](C[NH+]1CCCCCC1)NC(=O)N(C)CC1(CO)CC1	ZINC000252494828	342382547	/nfs/dbraw/zinc/38/25/47/342382547.db2.gz	OGAVLWFMNNWKOL-CQSZACIVSA-N	1	0	297.443	1.665	50	0		CDAARO
CS[C@@H]1CC[C@H](NC(=O)N2CC[C@H](C[NH+](C)C)C2)C1	ZINC000252584470	342385501	/nfs/dbraw/zinc/38/55/01/342385501.db2.gz	APPWHWAFFFLMAS-FRRDWIJNSA-N	1	0	285.457	1.864	50	0		CDAARO
COc1cc(C)c(C(=O)N(C)[C@@H]2CC[NH2+]C2)cc1OC	ZINC000179104986	362252082	/nfs/dbraw/zinc/25/20/82/362252082.db2.gz	SAFZLCBRLFPQAU-LLVKDONJSA-N	1	0	278.352	1.446	50	0		CDAARO
CC[N@H+](C)C[C@H]1CCN(C(=O)NCc2cccn2C)C1	ZINC000084760836	362271130	/nfs/dbraw/zinc/27/11/30/362271130.db2.gz	RMVUNWDXZWORGR-CYBMUJFWSA-N	1	0	278.400	1.508	50	0		CDAARO
CCO[C@H]1C[C@H]([NH2+]C[C@H](O)COC)C12CCCCC2	ZINC000087301412	362299667	/nfs/dbraw/zinc/29/96/67/362299667.db2.gz	CMLARJRSBFUGMT-IHRRRGAJSA-N	1	0	271.401	1.711	50	0		CDAARO
Cc1cc(=O)n(CC[N@@H+]2C[C@@H]3CC(C)=CC[C@@H]3C2)c(=O)[nH]1	ZINC000253537413	362436772	/nfs/dbraw/zinc/43/67/72/362436772.db2.gz	WTVMLDHDFQLELR-KGLIPLIRSA-N	1	0	289.379	1.545	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)c2ccc(F)cc2F)CC1	ZINC000085468005	179073099	/nfs/dbraw/zinc/07/30/99/179073099.db2.gz	RYYNINLPXARHSQ-UHFFFAOYSA-N	1	0	298.333	1.805	50	0		CDAARO
O=C1NCCC[C@@H]1[NH2+]C1CCN(c2ccccc2F)CC1	ZINC000584887251	349345846	/nfs/dbraw/zinc/34/58/46/349345846.db2.gz	FFRISZXHZBWZHE-AWEZNQCLSA-N	1	0	291.370	1.663	50	0		CDAARO
CCCSCC(=O)N(C)C[C@]1(C)CC[N@H+](C)C1	ZINC000584890696	349349644	/nfs/dbraw/zinc/34/96/44/349349644.db2.gz	VHBWSOJYGGMVBO-CYBMUJFWSA-N	1	0	258.431	1.930	50	0		CDAARO
CCc1nn(C)c2c1ncn(C[C@H]1CCCC[N@@H+]1C)c2=O	ZINC000584893677	349353493	/nfs/dbraw/zinc/35/34/93/349353493.db2.gz	PHYGZVBUASFTQF-LLVKDONJSA-N	1	0	289.383	1.177	50	0		CDAARO
CCS(=O)(=O)NC[C@@H](C)[NH2+]Cc1cnc(C)c(C)c1	ZINC000584894019	349354274	/nfs/dbraw/zinc/35/42/74/349354274.db2.gz	WBLLICANMDDTJS-LLVKDONJSA-N	1	0	285.413	1.116	50	0		CDAARO
Cc1nc(N(C)Cc2noc3c2CCCC3)cc(N)[nH+]1	ZINC000091444515	180156915	/nfs/dbraw/zinc/15/69/15/180156915.db2.gz	KKZPADODENKWMZ-UHFFFAOYSA-N	1	0	273.340	1.870	50	0		CDAARO
COCCC[N@@H+]1CC[C@H](Cc2cccc(C(N)=O)c2)C1	ZINC000091440205	180157018	/nfs/dbraw/zinc/15/70/18/180157018.db2.gz	IRPPIMAGEKBTTA-CQSZACIVSA-N	1	0	276.380	1.686	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N1C[C@H]([NH3+])[C@@H](C2CC2)C1	ZINC000091391075	180144977	/nfs/dbraw/zinc/14/49/77/180144977.db2.gz	GZZOBLSPBGDSLC-OLZOCXBDSA-N	1	0	298.383	1.492	50	0		CDAARO
CC[C@@H]1CN(C(=O)c2ccc(=O)n(C)c2)CC[N@@H+]1C(C)C	ZINC000091426453	180151948	/nfs/dbraw/zinc/15/19/48/180151948.db2.gz	SKOPAUXXMJBFEW-CQSZACIVSA-N	1	0	291.395	1.330	50	0		CDAARO
O=C(N[C@H]1CC[N@H+](CC2CCCC2)C1)[C@H]1CCCOC1	ZINC000110631316	350225257	/nfs/dbraw/zinc/22/52/57/350225257.db2.gz	YZJRSFOBPNVZRI-GJZGRUSLSA-N	1	0	280.412	1.794	50	0		CDAARO
O=C(N[C@@H]1CC[N@H+](CC2CCCC2)C1)[C@H]1CCCOC1	ZINC000110631312	350224957	/nfs/dbraw/zinc/22/49/57/350224957.db2.gz	YZJRSFOBPNVZRI-LSDHHAIUSA-N	1	0	280.412	1.794	50	0		CDAARO
COc1c[nH]c(C[N@@H+]2CC[C@](C)(O)C(C)(C)C2)cc1=O	ZINC000091877253	180278584	/nfs/dbraw/zinc/27/85/84/180278584.db2.gz	HHHLRFFJFOJZSD-HNNXBMFYSA-N	1	0	280.368	1.366	50	0		CDAARO
COCC[C@]1(CO)CCC[N@H+](Cc2cncn2C2CC2)C1	ZINC000092078660	180318921	/nfs/dbraw/zinc/31/89/21/180318921.db2.gz	BTMVAPUZUUKXEB-MRXNPFEDSA-N	1	0	293.411	1.829	50	0		CDAARO
C[C@H](O)CN1CC[N@H+](CC2CCCCC2)C[C@@H]1C	ZINC000106840896	186140107	/nfs/dbraw/zinc/14/01/07/186140107.db2.gz	ULQKDBHHUDRPGK-KBPBESRZSA-N	1	0	254.418	1.954	50	0		CDAARO
O=S1(=O)CCC([NH2+][C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000291101239	197917067	/nfs/dbraw/zinc/91/70/67/197917067.db2.gz	JHYOZSGDJVFXGX-CQSZACIVSA-N	1	0	294.420	1.432	50	0		CDAARO
CC(C)[N@H+](C)CCNC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C	ZINC000107052993	186155860	/nfs/dbraw/zinc/15/58/60/186155860.db2.gz	NIAVPQOZAALCDC-UPJWGTAASA-N	1	0	283.416	1.439	50	0		CDAARO
CC(C)(C)OC(=O)NCCCCC[N@@H+]1CC[C@H](C(N)=O)C1	ZINC000583651345	366009590	/nfs/dbraw/zinc/00/95/90/366009590.db2.gz	LFWQHWHANVRHHV-LBPRGKRZSA-N	1	0	299.415	1.489	50	0		CDAARO
Cc1ncc(CNC(=O)NC[C@@H]2CCCC[N@@H+](C)C2)o1	ZINC000624193143	351474248	/nfs/dbraw/zinc/47/42/48/351474248.db2.gz	USQDSHPCHPHHQS-LBPRGKRZSA-N	1	0	280.372	1.514	50	0		CDAARO
O=C(NC1CCN(c2ccccn2)CC1)[C@H]1CCC[NH2+]C1	ZINC000037008425	363312595	/nfs/dbraw/zinc/31/25/95/363312595.db2.gz	XADFFCKNTJWSCY-ZDUSSCGKSA-N	1	0	288.395	1.166	50	0		CDAARO
[NH3+][C@@H]1CCOc2c(Br)cccc2[C@@H]1O	ZINC000062626554	363384741	/nfs/dbraw/zinc/38/47/41/363384741.db2.gz	VDUBMHPWJFWWTE-BDAKNGLRSA-N	1	0	258.115	1.592	50	0		CDAARO
O=C(OCC[NH+]1CCCCC1)[C@H]1COc2ccccc2O1	ZINC000000808182	355921780	/nfs/dbraw/zinc/92/17/80/355921780.db2.gz	KBNXWRKJSDESKZ-OAHLLOKOSA-N	1	0	291.347	1.856	50	0		CDAARO
Cc1ccc(OCC(=O)NCCC[NH+](C)C)cc1	ZINC000002948600	355988329	/nfs/dbraw/zinc/98/83/29/355988329.db2.gz	OICODGLNDHAYRL-UHFFFAOYSA-N	1	0	250.342	1.442	50	0		CDAARO
CCNC(=O)c1cccc(NC(=O)[C@H]2CCC[NH2+]2)c1	ZINC000035053850	355946497	/nfs/dbraw/zinc/94/64/97/355946497.db2.gz	KGKVWMGPJHKRBE-GFCCVEGCSA-N	1	0	261.325	1.127	50	0		CDAARO
CC[C@@H]([NH2+]Cc1cccnc1)C(=O)Nc1cc(C)on1	ZINC000097495045	356177094	/nfs/dbraw/zinc/17/70/94/356177094.db2.gz	LKQSBEKDGWNDFJ-GFCCVEGCSA-N	1	0	274.324	1.885	50	0		CDAARO
C[NH+]1CCC2(CC1)OCCN2C(=O)/C=C/c1ccccc1	ZINC000013718988	356354554	/nfs/dbraw/zinc/35/45/54/356354554.db2.gz	DIRJXHLTKYYYKH-BQYQJAHWSA-N	1	0	286.375	1.981	50	0		CDAARO
CCCC[C@H](CC)CNC(=O)CCC(=O)NCC[NH+](C)C	ZINC000013940042	356366988	/nfs/dbraw/zinc/36/69/88/356366988.db2.gz	BBOFKWITADDLGY-AWEZNQCLSA-N	1	0	299.459	1.777	50	0		CDAARO
COc1ccc(OC)c([C@@H]2CCCN2[C@@H](C)C(N)=O)c1	ZINC000014129531	356375800	/nfs/dbraw/zinc/37/58/00/356375800.db2.gz	NEAVOSNGZVYQJH-GWCFXTLKSA-N	1	0	278.352	1.715	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1ccc(NC(C)=O)cc1	ZINC000014022474	356370615	/nfs/dbraw/zinc/37/06/15/356370615.db2.gz	VIJBXOVJEVAACW-HNNXBMFYSA-N	1	0	289.379	1.859	50	0		CDAARO
O=C1NC(=O)C(=CNc2cc[nH+]cc2)c2ccccc21	ZINC000016721084	356445129	/nfs/dbraw/zinc/44/51/29/356445129.db2.gz	NQSGUWGRJODSET-UKTHLTGXSA-N	1	0	265.272	1.805	50	0		CDAARO
CC(C)CC(=O)N1CCC([NH+]2CCN(C)CC2)CC1	ZINC000019868109	356511748	/nfs/dbraw/zinc/51/17/48/356511748.db2.gz	PZYXHDRJEYUFHW-UHFFFAOYSA-N	1	0	267.417	1.271	50	0		CDAARO
Cc1ccc(OCCOCCN2CC[NH+](C)CC2)cc1C	ZINC000019792407	356503863	/nfs/dbraw/zinc/50/38/63/356503863.db2.gz	HAJFEEWJAPETTL-UHFFFAOYSA-N	1	0	292.423	1.946	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COc2ccc(OC)cc2)CC1	ZINC000019790751	356504376	/nfs/dbraw/zinc/50/43/76/356504376.db2.gz	IEXYZOVSQTYJSL-AWEZNQCLSA-N	1	0	294.395	1.072	50	0		CDAARO
COc1ccc([C@H](C[NH3+])N2CCOCC2)cc1OC	ZINC000019795691	356504805	/nfs/dbraw/zinc/50/48/05/356504805.db2.gz	DPDHBGJASQWDBQ-LBPRGKRZSA-N	1	0	266.341	1.036	50	0		CDAARO
C[NH+]1CCN(CCCOc2ccccc2C=O)CC1	ZINC000019798111	356505077	/nfs/dbraw/zinc/50/50/77/356505077.db2.gz	JGLHGBUSDDCFKB-UHFFFAOYSA-N	1	0	262.353	1.515	50	0		CDAARO
O=C(COc1ccc(Cl)cc1Cl)N1CC[NH2+]CC1	ZINC000019795592	356505463	/nfs/dbraw/zinc/50/54/63/356505463.db2.gz	YEGXJZKXGWYYGG-UHFFFAOYSA-N	1	0	289.162	1.804	50	0		CDAARO
COc1cccc(NC(=O)CCN2CC[NH+](C)CC2)c1	ZINC000019913777	356516352	/nfs/dbraw/zinc/51/63/52/356516352.db2.gz	LXBFYKGXABGQGK-UHFFFAOYSA-N	1	0	277.368	1.271	50	0		CDAARO
COCCOCC1([NH3+])CCN(C(=O)OC(C)(C)C)CC1	ZINC000725255342	538451582	/nfs/dbraw/zinc/45/15/82/538451582.db2.gz	NZCTVRMTFOYLOB-UHFFFAOYSA-N	1	0	288.388	1.378	50	0		CDAARO
Cc1ccc(C(=O)N2CC[C@@H]([NH+]3CC=CC3)C2)c(O)c1	ZINC000104220047	538452874	/nfs/dbraw/zinc/45/28/74/538452874.db2.gz	JVDORYSSHYOBNS-CYBMUJFWSA-N	1	0	272.348	1.787	50	0		CDAARO
C[N@@H+]1CCC[C@H]1c1ccc(C(=O)N2CCOCC2)s1	ZINC000023541887	356645298	/nfs/dbraw/zinc/64/52/98/356645298.db2.gz	BXNBHHKLWIRUBG-NSHDSACASA-N	1	0	280.393	1.987	50	0		CDAARO
CCOC(=O)c1sc2[nH]c(C[NH2+]C)nc(=O)c2c1C	ZINC000023641230	356647272	/nfs/dbraw/zinc/64/72/72/356647272.db2.gz	XDFJILWIBKEROZ-UHFFFAOYSA-N	1	0	281.337	1.189	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2cccc(C(C)=O)c2)CC1	ZINC000023253958	356637246	/nfs/dbraw/zinc/63/72/46/356637246.db2.gz	VNCWFEZVQWNGFS-UHFFFAOYSA-N	1	0	289.379	1.465	50	0		CDAARO
Fc1cccc(-c2ccc(N3CC[NH2+]CC3)nn2)c1	ZINC000032918547	356790242	/nfs/dbraw/zinc/79/02/42/356790242.db2.gz	DLYLOSHICJUKHJ-UHFFFAOYSA-N	1	0	258.300	1.692	50	0		CDAARO
OCCN1CC[NH+]([C@@H]2CCc3ccccc3C2)CC1	ZINC000023282390	356816739	/nfs/dbraw/zinc/81/67/39/356816739.db2.gz	GYGVGXZFOWNKHR-MRXNPFEDSA-N	1	0	260.381	1.154	50	0		CDAARO
CC(C)(C[NH3+])S(=O)(=O)c1ccc(Br)cc1	ZINC000047845015	357167149	/nfs/dbraw/zinc/16/71/49/357167149.db2.gz	UXUZHVXQPDLFOQ-UHFFFAOYSA-N	1	0	292.198	1.960	50	0		CDAARO
C[C@H](CC(=O)N(C)c1ccccc1)[NH2+]Cc1ccnn1C	ZINC000095420189	357335745	/nfs/dbraw/zinc/33/57/45/357335745.db2.gz	MVILBONRASZRFR-CYBMUJFWSA-N	1	0	286.379	1.951	50	0		CDAARO
C[C@H](Oc1cccnc1)C(=O)N1CCC[C@@H](C)[C@@H]1C[NH3+]	ZINC000247314655	357431719	/nfs/dbraw/zinc/43/17/19/357431719.db2.gz	RPDRENXZEZLVCM-DYEKYZERSA-N	1	0	277.368	1.435	50	0		CDAARO
[NH3+]C[C@H](NS(=O)(=O)c1cc(F)c(F)cc1F)C1CC1	ZINC000095432129	357515559	/nfs/dbraw/zinc/51/55/59/357515559.db2.gz	OJPMPNLEUYBORW-JTQLQIEISA-N	1	0	294.298	1.120	50	0		CDAARO
C[N@H+]1CC=C(CNC(=O)COCc2ccccc2)CC1	ZINC000065372071	357531669	/nfs/dbraw/zinc/53/16/69/357531669.db2.gz	ZWQCOEYPTGYYKK-UHFFFAOYSA-N	1	0	274.364	1.581	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CNC(=O)Cn2ncc3ccccc32)C1	ZINC000067821738	357629590	/nfs/dbraw/zinc/62/95/90/357629590.db2.gz	NPHJDRSSFDZNCO-ZDUSSCGKSA-N	1	0	286.379	1.494	50	0		CDAARO
COc1ccc(CC(=O)N(C)[C@H]2CC[NH2+]C2)c(Cl)c1	ZINC000299740263	357700249	/nfs/dbraw/zinc/70/02/49/357700249.db2.gz	XRFWEQXNWPDKCZ-NSHDSACASA-N	1	0	282.771	1.711	50	0		CDAARO
NC(=O)C[N@@H+]1CC[C@@]2(C1)CCCN(C1CCCCC1)C2=O	ZINC000091951640	283289438	/nfs/dbraw/zinc/28/94/38/283289438.db2.gz	XVYSCYNAWPXXRN-MRXNPFEDSA-N	1	0	293.411	1.119	50	0		CDAARO
C[C@H]1CN(C(=O)[C@@H]2CSc3ccccc32)CC[NH2+]1	ZINC000092239666	357943954	/nfs/dbraw/zinc/94/39/54/357943954.db2.gz	OWPSIYPOLGRTBT-CMPLNLGQSA-N	1	0	262.378	1.696	50	0		CDAARO
C[C@H](CCO)[NH2+]C1CCN(c2nccs2)CC1	ZINC000097081043	357944938	/nfs/dbraw/zinc/94/49/38/357944938.db2.gz	NUJPRHQEERMGSR-SNVBAGLBSA-N	1	0	255.387	1.472	50	0		CDAARO
Cc1cccc(CNC(=O)C[NH2+][C@H](C)[C@@H]2CCCO2)c1	ZINC000097111606	357986534	/nfs/dbraw/zinc/98/65/34/357986534.db2.gz	KNJMKIZRXGPGRE-HIFRSBDPSA-N	1	0	276.380	1.768	50	0		CDAARO
C[N@@H+]1CC[C@H]2CN(C(=O)c3ccn(C(F)F)n3)C[C@H]21	ZINC000077437290	358018641	/nfs/dbraw/zinc/01/86/41/358018641.db2.gz	BQLZDVFIEXXKSY-WCBMZHEXSA-N	1	0	270.283	1.054	50	0		CDAARO
COCCCNC(=O)[C@H](C)N1CCC[C@@H]([NH+]2CCCC2)C1	ZINC000195530711	358559402	/nfs/dbraw/zinc/55/94/02/358559402.db2.gz	IKSFADJZHWLGNH-LSDHHAIUSA-N	1	0	297.443	1.088	50	0		CDAARO
Cc1nc2ccsc2c(N2C[C@H]3C[NH2+]C[C@H]3C2)n1	ZINC000092022519	358537030	/nfs/dbraw/zinc/53/70/30/358537030.db2.gz	IOQNWWQLFCYJRY-AOOOYVTPSA-N	1	0	260.366	1.655	50	0		CDAARO
C[NH2+]CCCNC(=O)c1coc(Br)c1	ZINC000121166090	358658909	/nfs/dbraw/zinc/65/89/09/358658909.db2.gz	LTVSPVYDBUNWRT-UHFFFAOYSA-N	1	0	261.119	1.381	50	0		CDAARO
O=C1C2CN3CC1(Cc1ccccc1)C[N@H+](C2)CC3	ZINC000095347205	358682733	/nfs/dbraw/zinc/68/27/33/358682733.db2.gz	SYTTZHPHENTYSR-UHFFFAOYSA-N	1	0	256.349	1.046	50	0	biogenic	CDAARO
C[N@@H+]1CCCC[C@H]1CCC(=O)NCCCn1cccn1	ZINC000095363688	358685943	/nfs/dbraw/zinc/68/59/43/358685943.db2.gz	SDDKHGXDOGMLFL-AWEZNQCLSA-N	1	0	278.400	1.654	50	0		CDAARO
CCc1cnc(NCCC[N@@H+]2CCC[C@@H](O)C2)nc1	ZINC000095371589	358687451	/nfs/dbraw/zinc/68/74/51/358687451.db2.gz	UJNSCMDZIVLWCE-CYBMUJFWSA-N	1	0	264.373	1.298	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CCn1ncc(N2CCCC2)cc1=O	ZINC000095387818	358691363	/nfs/dbraw/zinc/69/13/63/358691363.db2.gz	FQVMPFYWBTYTDM-AWEZNQCLSA-N	1	0	290.411	1.718	50	0		CDAARO
Nc1cc(N2CCOCC2)c(Br)c[nH+]1	ZINC000096134480	358708418	/nfs/dbraw/zinc/70/84/18/358708418.db2.gz	PZAGEEYPQDIYJM-UHFFFAOYSA-N	1	0	258.119	1.263	50	0		CDAARO
O[C@H]1C[C@H]2C[N@@H+](Cc3nc4ccccc4[nH]3)C[C@H]2C[C@@H]1O	ZINC000097553182	358785167	/nfs/dbraw/zinc/78/51/67/358785167.db2.gz	MBXHWUUCJVCXHW-JLUCKKNBSA-N	1	0	287.363	1.127	50	0		CDAARO
CC[NH+]1CCC(C(=O)NCc2cc(C)nn2C)CC1	ZINC000097575050	358785782	/nfs/dbraw/zinc/78/57/82/358785782.db2.gz	GJVSPPLERVUJEN-UHFFFAOYSA-N	1	0	264.373	1.077	50	0		CDAARO
COC[C@@H]1CCC[N@@H+]1Cc1cccc(OCC(N)=O)c1	ZINC000215603587	358895353	/nfs/dbraw/zinc/89/53/53/358895353.db2.gz	LIRPDWWEDXDLBM-ZDUSSCGKSA-N	1	0	278.352	1.162	50	0		CDAARO
COCCNC(=O)N(C)[C@@H](C)C1CC[NH+](C)CC1	ZINC000095467191	358928835	/nfs/dbraw/zinc/92/88/35/358928835.db2.gz	UOQMYBRSQLQDQR-NSHDSACASA-N	1	0	257.378	1.005	50	0		CDAARO
C[NH+](C)CCCOc1cccc(CN2CC(O)C2)c1	ZINC000216179820	358930293	/nfs/dbraw/zinc/93/02/93/358930293.db2.gz	QUGNOYMHYKGBOX-UHFFFAOYSA-N	1	0	264.369	1.194	50	0		CDAARO
CN1CCN(C(=O)C[NH+]2CCCC2)C[C@@H]1c1ccccc1	ZINC000216340840	358938562	/nfs/dbraw/zinc/93/85/62/358938562.db2.gz	NRXKZCOEMJLECG-MRXNPFEDSA-N	1	0	287.407	1.598	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2cc(Cl)c[nH]2)CC1	ZINC000089414357	359282873	/nfs/dbraw/zinc/28/28/73/359282873.db2.gz	UNISMWAKLSUHAT-UHFFFAOYSA-N	1	0	299.802	1.756	50	0		CDAARO
Nc1nc(NCCc2cscn2)cc([C@H]2C[C@@H]([NH3+])C2)n1	ZINC000222304694	359332843	/nfs/dbraw/zinc/33/28/43/359332843.db2.gz	XLMHKTWDHRHVEN-KYZUINATSA-N	1	0	290.396	1.375	50	0		CDAARO
CC(C)NC(=O)CC[NH+]1CCN(c2ccc(F)cc2)CC1	ZINC000035818961	359967626	/nfs/dbraw/zinc/96/76/26/359967626.db2.gz	AMSBVYHTAGMTDH-UHFFFAOYSA-N	1	0	293.386	1.862	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@@H]1CCCN1C(=O)[C@H]1CCOC1	ZINC000248161207	360417130	/nfs/dbraw/zinc/41/71/30/360417130.db2.gz	XQGCZQWMZBCQCW-XQQFMLRXSA-N	1	0	252.358	1.108	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2scnc2C)CC1	ZINC000089565467	360459846	/nfs/dbraw/zinc/45/98/46/360459846.db2.gz	UWSCIAKSYPIHGO-UHFFFAOYSA-N	1	0	297.424	1.540	50	0		CDAARO
COc1cccc(OCCSc2nnc(C[NH3+])n2C)c1	ZINC000426435463	360532124	/nfs/dbraw/zinc/53/21/24/360532124.db2.gz	XEDODELQFHIIGY-UHFFFAOYSA-N	1	0	294.380	1.454	50	0		CDAARO
CCCCCCNC(=O)N1C[C@@H]2CC[C@H]1C[NH2+]C2	ZINC000426574770	360684243	/nfs/dbraw/zinc/68/42/43/360684243.db2.gz	CYWWMWADQQCIGI-OLZOCXBDSA-N	1	0	253.390	1.960	50	0		CDAARO
CCOc1ccc(/C=C/C(=O)N2CC[C@H](C[NH3+])C2)cc1	ZINC000178555493	189126756	/nfs/dbraw/zinc/12/67/56/189126756.db2.gz	YKOHHEYTEIWHCJ-LHRNQBEKSA-N	1	0	274.364	1.906	50	0		CDAARO
CCn1nc(C)c(C(=O)N2CC[C@@H](C[NH3+])C2)c1Cl	ZINC000178591894	189129399	/nfs/dbraw/zinc/12/93/99/189129399.db2.gz	KLBDQSLFJSBZGH-VIFPVBQESA-N	1	0	270.764	1.286	50	0		CDAARO
O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)[C@@H]1CCCO1	ZINC000036090446	360895908	/nfs/dbraw/zinc/89/59/08/360895908.db2.gz	QAERRSINMWMGRW-OCCSQVGLSA-N	1	0	278.352	1.712	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H](O)C[N@@H+]1C[C@H]1C(C)=CCC[C@H]1C	ZINC000249056468	360958170	/nfs/dbraw/zinc/95/81/70/360958170.db2.gz	GVMYSEUEEJARIT-MQYQWHSLSA-N	1	0	267.369	1.587	50	0		CDAARO
O=C(N[C@H]1C[NH2+]CC[C@H]1O)c1[nH]c2ccccc2c1Cl	ZINC000426552353	361012196	/nfs/dbraw/zinc/01/21/96/361012196.db2.gz	PWDROBGDMKOQFL-WDEREUQCSA-N	1	0	293.754	1.274	50	0		CDAARO
CN(C)C(=O)[C@@H]1CCCN1C(=O)C[C@@H]([NH3+])c1ccccc1	ZINC000036136329	361076426	/nfs/dbraw/zinc/07/64/26/361076426.db2.gz	GBUTWXZOOVFZJS-KGLIPLIRSA-N	1	0	289.379	1.156	50	0		CDAARO
O[C@@H](C[N@@H+]1CCC[C@H]1Cn1cncn1)c1ccc(F)cc1	ZINC000247804004	361185131	/nfs/dbraw/zinc/18/51/31/361185131.db2.gz	XRHPDPBYXRTUDV-GJZGRUSLSA-N	1	0	290.342	1.615	50	0		CDAARO
O=S(=O)(c1cccnc1)N1CCC[N@@H+](C2CCC2)CC1	ZINC000828392566	781938714	/nfs/dbraw/zinc/93/87/14/781938714.db2.gz	SOKBVTCFKSTNSQ-UHFFFAOYSA-N	1	0	295.408	1.331	50	0		CDAARO
C[C@@H](C(=O)NCc1ccc(-c2ncon2)cc1)[NH+](C)C	ZINC000426641336	361330209	/nfs/dbraw/zinc/33/02/09/361330209.db2.gz	GLLHQWUSTVVZPK-JTQLQIEISA-N	1	0	274.324	1.303	50	0		CDAARO
O=C(C[C@H]1CC[NH2+]C1)NCCCn1cc(Cl)cn1	ZINC000299792553	361602151	/nfs/dbraw/zinc/60/21/51/361602151.db2.gz	FRMDYHFKGMBQQW-SNVBAGLBSA-N	1	0	270.764	1.042	50	0		CDAARO
C[C@@H]1CCc2[nH]c(=O)c(C(=O)NCCC[NH+](C)C)cc2C1	ZINC000049551697	364071565	/nfs/dbraw/zinc/07/15/65/364071565.db2.gz	VGONBCZAZAMBDB-LLVKDONJSA-N	1	0	291.395	1.181	50	0		CDAARO
CN1C[C@@H](C[NH+]2CCN(c3ccccc3)CC2)CC1=O	ZINC000618255937	364035772	/nfs/dbraw/zinc/03/57/72/364035772.db2.gz	LDIYOFZTYBDJBL-AWEZNQCLSA-N	1	0	273.380	1.287	50	0		CDAARO
C[NH+](C)CCNc1c(=O)c(=O)c1NCCC1=CCCCC1	ZINC000101699752	364039896	/nfs/dbraw/zinc/03/98/96/364039896.db2.gz	SEEMLZYHPQPVFC-UHFFFAOYSA-N	1	0	291.395	1.559	50	0		CDAARO
C[NH+](C)[C@@H]1CCN(Cc2cnc(N3CCCC3)s2)C1	ZINC000215059933	189691312	/nfs/dbraw/zinc/69/13/12/189691312.db2.gz	RQLCTSANFNPGLM-GFCCVEGCSA-N	1	0	280.441	1.879	50	0		CDAARO
CC[N@@H+]1CCCN(CC(=O)NC2CCCCC2)CC1	ZINC000089977261	366993750	/nfs/dbraw/zinc/99/37/50/366993750.db2.gz	AISZIJRVCJZTBK-UHFFFAOYSA-N	1	0	267.417	1.463	50	0		CDAARO
C[C@@H](CC(=O)N(C)C)[NH2+]C[C@@H](O)c1c(F)cccc1F	ZINC000090078230	367011699	/nfs/dbraw/zinc/01/16/99/367011699.db2.gz	ZIANQVNWJLCQEV-JOYOIKCWSA-N	1	0	286.322	1.455	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@@H]1CC[NH2+]C[C@H]1C	ZINC000094345633	367491272	/nfs/dbraw/zinc/49/12/72/367491272.db2.gz	ROVYWRQYKMMRLT-ZYHUDNBSSA-N	1	0	286.372	1.410	50	0		CDAARO
CC(C)[C@@H](CNC(=O)N(C)[C@@H](C)CO)[NH+]1CCCCCC1	ZINC000252491497	367634863	/nfs/dbraw/zinc/63/48/63/367634863.db2.gz	LNLUBYBJPAUGBM-LSDHHAIUSA-N	1	0	299.459	1.909	50	0		CDAARO
CCc1noc(CN(C)C(=O)[C@@H]2C[C@@H]3CCCC[C@H]3[NH2+]2)n1	ZINC000252512215	367682970	/nfs/dbraw/zinc/68/29/70/367682970.db2.gz	OCVGDLWYOLZNKY-TUAOUCFPSA-N	1	0	292.383	1.511	50	0		CDAARO
CN(C[C@@H]1CCC[N@@H+]1C)S(=O)(=O)CC1CCCC1	ZINC000420769794	244370719	/nfs/dbraw/zinc/37/07/19/244370719.db2.gz	PSCLLVHSVNXSSN-ZDUSSCGKSA-N	1	0	274.430	1.532	50	0		CDAARO
C[C@@H](C(=O)N(C)C1CCCCC1)[N@@H+]1CC[C@@H](O)C1	ZINC000175307471	372658626	/nfs/dbraw/zinc/65/86/26/372658626.db2.gz	IXTMVQZSFCICEK-WCQYABFASA-N	1	0	254.374	1.233	50	0		CDAARO
NC(=O)c1ccc(-c2ccc3c(c2)C[C@H](C[NH3+])O3)nc1	ZINC000299758121	372747235	/nfs/dbraw/zinc/74/72/35/372747235.db2.gz	COMNQQIVNOGNNV-GFCCVEGCSA-N	1	0	269.304	1.110	50	0		CDAARO
Cc1occc1C(=O)NCc1c(C)ncc2c1CC[NH2+]C2	ZINC000299787753	372762471	/nfs/dbraw/zinc/76/24/71/372762471.db2.gz	YAZWRJSEWUJBMO-UHFFFAOYSA-N	1	0	285.347	1.867	50	0		CDAARO
Cc1nc2ccccn2c1CN(C)C(=O)C[C@@H]1CC[NH2+]C1	ZINC000299789537	372764006	/nfs/dbraw/zinc/76/40/06/372764006.db2.gz	WWWGQYHCGBNGAY-ZDUSSCGKSA-N	1	0	286.379	1.601	50	0		CDAARO
O=C(NC[C@@H]1CCC2(CC[NH2+]CC2)O1)c1ccco1	ZINC000299802812	372773548	/nfs/dbraw/zinc/77/35/48/372773548.db2.gz	WTILBKCJTLUREL-NSHDSACASA-N	1	0	264.325	1.311	50	0		CDAARO
[NH3+][C@@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CCCC[C@@H]21	ZINC000037815409	373419545	/nfs/dbraw/zinc/41/95/45/373419545.db2.gz	CWKNNFWJPOEPCW-HRCADAONSA-N	1	0	288.391	1.726	50	0		CDAARO
Cc1cccc(N2CCC[C@@H]2C[N@@H+]2CCC[C@H]2CO)n1	ZINC000253370990	373679045	/nfs/dbraw/zinc/67/90/45/373679045.db2.gz	ZCNNQUNJOGHLHP-CABCVRRESA-N	1	0	275.396	1.816	50	0		CDAARO
CCN1CCc2ccc(NC(=O)[C@H]3C[C@H](OC)C[NH2+]3)cc21	ZINC000253432407	373745314	/nfs/dbraw/zinc/74/53/14/373745314.db2.gz	YVTXBUIPHXFVGX-UONOGXRCSA-N	1	0	289.379	1.384	50	0		CDAARO
COc1ccc(Cl)cc1CN(C)C(=O)[C@H]1C[C@H](O)C[NH2+]1	ZINC000277711150	374805807	/nfs/dbraw/zinc/80/58/07/374805807.db2.gz	IRYDWOKEBBARMR-NWDGAFQWSA-N	1	0	298.770	1.030	50	0		CDAARO
CC[C@H](CO)[NH+]1CCN(Cc2c(F)cccc2F)CC1	ZINC000093740398	374782716	/nfs/dbraw/zinc/78/27/16/374782716.db2.gz	GFQQHRNTKSQJCK-GFCCVEGCSA-N	1	0	284.350	1.853	50	0		CDAARO
CC(C)[N@@H+]1CCN(Cc2ccccc2)[C@@H](CCO)C1	ZINC000019794453	374792258	/nfs/dbraw/zinc/79/22/58/374792258.db2.gz	HDOCWVLLUKBVGB-INIZCTEOSA-N	1	0	262.397	1.964	50	0		CDAARO
Cc1cc(C)c2[nH]c(CNC[C@@H]3CCC[NH2+]3)cc(=O)c2c1	ZINC000095379675	374895498	/nfs/dbraw/zinc/89/54/98/374895498.db2.gz	JGXUZSLHSNUQET-ZDUSSCGKSA-N	1	0	285.391	1.987	50	0		CDAARO
Cc1cc(S(=O)(=O)N[C@H](C[NH3+])C2CC2)c(F)cc1F	ZINC000095432124	374932181	/nfs/dbraw/zinc/93/21/81/374932181.db2.gz	AAECPZGXGXQFMG-LLVKDONJSA-N	1	0	290.335	1.289	50	0		CDAARO
CCCC[C@H]([NH3+])C(=O)N1CC[C@H](Oc2cccnc2)C1	ZINC000095466799	374962242	/nfs/dbraw/zinc/96/22/42/374962242.db2.gz	DMHWQAQTDLBLIY-KBPBESRZSA-N	1	0	277.368	1.579	50	0		CDAARO
COc1cccc([C@H](C)[NH2+]CC(=O)NC(C)C)c1	ZINC000096286620	375073245	/nfs/dbraw/zinc/07/32/45/375073245.db2.gz	MSINFEMHRLURQS-NSHDSACASA-N	1	0	250.342	1.870	50	0		CDAARO
CCSc1ccc(NC(=O)NCC[NH+](C)C)cn1	ZINC000095999596	375049885	/nfs/dbraw/zinc/04/98/85/375049885.db2.gz	CCVRWLORAWHMPB-UHFFFAOYSA-N	1	0	268.386	1.877	50	0		CDAARO
CCCCC(=O)N1CCN(c2cc(N(C)C)cn[nH+]2)CC1	ZINC000096098670	375055957	/nfs/dbraw/zinc/05/59/57/375055957.db2.gz	YUYSOVGJWNFKDW-UHFFFAOYSA-N	1	0	291.399	1.381	50	0		CDAARO
COC[C@H](Nc1ccc(N2CC[NH+](C)CC2)nc1)C1CC1	ZINC000097037928	375138786	/nfs/dbraw/zinc/13/87/86/375138786.db2.gz	DNGBJXUTLYNCSM-HNNXBMFYSA-N	1	0	290.411	1.670	50	0		CDAARO
Cc1ccc(O)c(C[NH+]2CCC(O)(C(F)(F)F)CC2)n1	ZINC000097058669	375142506	/nfs/dbraw/zinc/14/25/06/375142506.db2.gz	ZIOWOQGPAJKSEA-UHFFFAOYSA-N	1	0	290.285	1.985	50	0		CDAARO
CCCC[C@H](C(N)=O)[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(C)=O	ZINC000299754278	375211393	/nfs/dbraw/zinc/21/13/93/375211393.db2.gz	DZJJBYHRPXAQOC-RBSFLKMASA-N	1	0	295.427	1.506	50	0		CDAARO
CCn1cc(C(=O)N[C@H](C)C[NH+]2CCC(C)CC2)cn1	ZINC000002782463	375327219	/nfs/dbraw/zinc/32/72/19/375327219.db2.gz	GPGBWRDNYXKGAU-CYBMUJFWSA-N	1	0	278.400	1.753	50	0		CDAARO
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC([NH3+])CC1	ZINC000020521589	296230315	/nfs/dbraw/zinc/23/03/15/296230315.db2.gz	HHVXPNQOTFFNGK-NSHDSACASA-N	1	0	282.409	1.574	50	0		CDAARO
CN(C)c1ncc(C[N@@H+]2CC[C@@](O)(C3CC3)C2)s1	ZINC000426535992	247039033	/nfs/dbraw/zinc/03/90/33/247039033.db2.gz	DBLXTFQWLFAKTQ-ZDUSSCGKSA-N	1	0	267.398	1.556	50	0		CDAARO
CCc1cccc(C)c1NC(=O)C[NH2+]C(C)(C)CO	ZINC000003342433	375656058	/nfs/dbraw/zinc/65/60/58/375656058.db2.gz	YOCJFGNOCCJCNR-UHFFFAOYSA-N	1	0	264.369	1.856	50	0		CDAARO
O=C(C[NH+]1CCCC1)NCCCOC1CCCCC1	ZINC000132188597	375826530	/nfs/dbraw/zinc/82/65/30/375826530.db2.gz	IHCWKWLBPZBXBA-UHFFFAOYSA-N	1	0	268.401	1.938	50	0		CDAARO
CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CCN2C(=O)NC(=O)[C@H]2C1	ZINC000239762573	376016690	/nfs/dbraw/zinc/01/66/90/376016690.db2.gz	CMEJHLVQROTNKY-YNEHKIRRSA-N	1	0	277.368	1.215	50	0		CDAARO
OC1CCN([C@@H]2CC[N@H+](CC3CCCC3)C[C@H]2O)CC1	ZINC000012710406	376973034	/nfs/dbraw/zinc/97/30/34/376973034.db2.gz	AKODJGBLUQQEFM-HZPDHXFCSA-N	1	0	282.428	1.069	50	0		CDAARO
OC[C@@H]1C[C@@H](O)CN1Cc1c(Cl)cccc1Cl	ZINC000248400198	377350630	/nfs/dbraw/zinc/35/06/30/377350630.db2.gz	XDNDKBSSAVWBQN-DTWKUNHWSA-N	1	0	276.163	1.921	50	0		CDAARO
O=C1NC2(CC[NH2+]CC2)C(=O)N1C/C=C/c1ccccc1	ZINC000077484963	377572926	/nfs/dbraw/zinc/57/29/26/377572926.db2.gz	NWQXXJGJYZYTMO-QPJJXVBHSA-N	1	0	285.347	1.374	50	0		CDAARO
CC[C@H](C)[NH2+]C[C@H](O)COCCOc1ccc(F)cc1	ZINC000041690315	184553141	/nfs/dbraw/zinc/55/31/41/184553141.db2.gz	DMADYEFBULAUGA-JSGCOSHPSA-N	1	0	285.359	1.970	50	0		CDAARO
O[C@@H](C[NH+]1CCN(Cc2ccc(F)cc2)CC1)C1CC1	ZINC000085436859	285302371	/nfs/dbraw/zinc/30/23/71/285302371.db2.gz	RSFNQDKSLZYCNO-INIZCTEOSA-N	1	0	278.371	1.714	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2CC[NH2+]C[C@H]2C)ccc1F	ZINC000094345014	184785487	/nfs/dbraw/zinc/78/54/87/184785487.db2.gz	VRECQTRJNSHGGO-MFKMUULPSA-N	1	0	250.317	1.862	50	0		CDAARO
CN(CCC[NH3+])C(=O)c1sccc1Br	ZINC000095427930	184979855	/nfs/dbraw/zinc/97/98/55/184979855.db2.gz	OKRDCDFJIIDPMQ-UHFFFAOYSA-N	1	0	277.187	1.931	50	0		CDAARO
CN1CCN(c2ccc(-c3ccccc3)nn2)CC1	ZINC000013777200	390249651	/nfs/dbraw/zinc/24/96/51/390249651.db2.gz	JGGDRYMPCVSLML-UHFFFAOYSA-N	1	0	254.337	1.895	50	0		CDAARO
CN(CC[NH+]1CCCC1)C(=O)[C@]1(C)CCCCO1	ZINC000457533261	390406504	/nfs/dbraw/zinc/40/65/04/390406504.db2.gz	RGXUULIVDKTXLA-AWEZNQCLSA-N	1	0	254.374	1.500	50	0		CDAARO
CCSCC[N@@H+]1CCCC[C@@H]1CNS(C)(=O)=O	ZINC000096424144	390516315	/nfs/dbraw/zinc/51/63/15/390516315.db2.gz	DDEQDZSQBBGADL-LLVKDONJSA-N	1	0	280.459	1.143	50	0		CDAARO
COC[C@@H](O)C[N@H+](C)C[C@H](O)c1ccc(Cl)cc1	ZINC000096424645	390516572	/nfs/dbraw/zinc/51/65/72/390516572.db2.gz	FFIDXSZSAZAVAS-STQMWFEESA-N	1	0	273.760	1.313	50	0		CDAARO
COCCC[N@@H+]1CC[C@H](CNc2nnc(C)o2)C1	ZINC000095383003	390910952	/nfs/dbraw/zinc/91/09/52/390910952.db2.gz	UUBZJEDYDRUHTO-LLVKDONJSA-N	1	0	254.334	1.148	50	0		CDAARO
C[N@H+](C[C@H](O)Cn1cccn1)[C@H]1CCc2ccccc21	ZINC000248061235	390912895	/nfs/dbraw/zinc/91/28/95/390912895.db2.gz	YYTDSSQQHHKWDB-HOCLYGCPSA-N	1	0	271.364	1.863	50	0		CDAARO
C[C@@H]([NH3+])C(=O)N1[C@H](C)CO[C@@H](c2ccccc2)[C@H]1C	ZINC000246467023	390925863	/nfs/dbraw/zinc/92/58/63/390925863.db2.gz	COFJXYQBTCAEFS-HKUMRIAESA-N	1	0	262.353	1.711	50	0		CDAARO
Cc1noc(C)c1[C@@H](C)C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188370908	390957417	/nfs/dbraw/zinc/95/74/17/390957417.db2.gz	QKBAAJJKLMWHHC-RKDXNWHRSA-N	1	0	251.330	1.215	50	0		CDAARO
CC[C@H]1CCCCN1C(=O)[C@H](C)[N@@H+]1C[C@@H](C)[C@H](C(N)=O)C1	ZINC000408048183	391163768	/nfs/dbraw/zinc/16/37/68/391163768.db2.gz	LQVIFGSXPVRSBB-ZOBORPQBSA-N	1	0	295.427	1.219	50	0		CDAARO
COc1ccc2c(c1)C=C(CN1CC[C@H]3C[NH2+]C[C@H]31)CO2	ZINC000426399103	391858556	/nfs/dbraw/zinc/85/85/56/391858556.db2.gz	WQVZIESZCGPKNA-XJKSGUPXSA-N	1	0	286.375	1.765	50	0		CDAARO
Cc1c(NC(=O)[C@@H]([NH3+])Cc2c[nH]c3ccccc23)cnn1C	ZINC000438886896	391976149	/nfs/dbraw/zinc/97/61/49/391976149.db2.gz	YGMOFQPNNKPBIY-ZDUSSCGKSA-N	1	0	297.362	1.718	50	0		CDAARO
CC[C@H](C(=O)N(C)Cc1noc(C2CC2)n1)[NH+]1CCCC1	ZINC000243892353	131083456	/nfs/dbraw/zinc/08/34/56/131083456.db2.gz	AGRLOMJJPMWGPL-GFCCVEGCSA-N	1	0	292.383	1.780	50	0		CDAARO
CC[C@H](CNC(=O)Nc1cn[nH]c1)[NH+]1CCCC1	ZINC000089943420	392521869	/nfs/dbraw/zinc/52/18/69/392521869.db2.gz	BDGODYMGVCVVCH-LLVKDONJSA-N	1	0	251.334	1.406	50	0		CDAARO
C[N@H+](CCO)CCOCCOc1ccccc1Cl	ZINC000002975051	397719409	/nfs/dbraw/zinc/71/94/09/397719409.db2.gz	FUIIRAARUOOMII-UHFFFAOYSA-N	1	0	273.760	1.660	50	0		CDAARO
COC[C@H]([NH3+])C(=O)N[C@H](C)[C@@H]1Oc2ccccc2[C@H]1C	ZINC000262241325	149038383	/nfs/dbraw/zinc/03/83/83/149038383.db2.gz	HTDWWWVNLRPXHL-KOXOONSLSA-N	1	0	278.352	1.030	50	0		CDAARO
COCC(C)(C)[NH2+][C@H]1CCN(c2ccccc2OC)C1=O	ZINC000192569022	292203388	/nfs/dbraw/zinc/20/33/88/292203388.db2.gz	LSVNQFWUDINUSB-LBPRGKRZSA-N	1	0	292.379	1.815	50	0		CDAARO
CSCC(=O)N1CCCN(c2cc[nH+]cc2C)CC1	ZINC000082126296	286659526	/nfs/dbraw/zinc/65/95/26/286659526.db2.gz	AYZXHWHYKGTNFH-UHFFFAOYSA-N	1	0	279.409	1.792	50	0		CDAARO
Cn1cc(CC(=O)NCC[NH+](C)C)c2ccccc21	ZINC000004901699	170038520	/nfs/dbraw/zinc/03/85/20/170038520.db2.gz	QZXJFNUULSIYNQ-UHFFFAOYSA-N	1	0	259.353	1.399	50	0		CDAARO
COC(=O)[C@@H]1[C@@H](C(=O)OC)C2(CCCCC2)[N@H+]2CCC[C@@H]12	ZINC000006657987	170222824	/nfs/dbraw/zinc/22/28/24/170222824.db2.gz	YLAUEXHRCZFZSL-AVGNSLFASA-N	1	0	295.379	1.746	50	0		CDAARO
CCCCCNC(=O)CSc1nc(N)cc(N)[nH+]1	ZINC000007692856	170297566	/nfs/dbraw/zinc/29/75/66/170297566.db2.gz	YYLUWENAVFOWFE-UHFFFAOYSA-N	1	0	269.374	1.040	50	0		CDAARO
Cc1ccc(OCC[NH+]2CCC(C(N)=O)CC2)cc1	ZINC000008317238	170330470	/nfs/dbraw/zinc/33/04/70/170330470.db2.gz	DCQYGPBXOJDNQE-UHFFFAOYSA-N	1	0	262.353	1.571	50	0		CDAARO
O[C@H](COc1ccc2ccccc2c1)CN1CC[NH2+]CC1	ZINC000019668808	170834831	/nfs/dbraw/zinc/83/48/31/170834831.db2.gz	DQJKVORHJXYXNI-INIZCTEOSA-N	1	0	286.375	1.485	50	0		CDAARO
Cc1nnc(CN(C)C(=O)CC[N@H+]2CCC[C@@H](C)C2)o1	ZINC000020862033	171276373	/nfs/dbraw/zinc/27/63/73/171276373.db2.gz	JHHICFDDYBTDCX-LLVKDONJSA-N	1	0	280.372	1.458	50	0		CDAARO
CC(C)[NH+](CCNC(=O)c1cnn(C)c1)C(C)C	ZINC000022623258	171394875	/nfs/dbraw/zinc/39/48/75/171394875.db2.gz	XTESVINXWUHURO-UHFFFAOYSA-N	1	0	252.362	1.269	50	0		CDAARO
Cc1c(C(=O)N[C@@H]2CC[NH2+]C2)cnn1-c1ccccc1C	ZINC000126250767	413554926	/nfs/dbraw/zinc/55/49/26/413554926.db2.gz	OYWPARVOGYNFNA-CYBMUJFWSA-N	1	0	284.363	1.581	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2ccsc2)CC1	ZINC000038582789	174148579	/nfs/dbraw/zinc/14/85/79/174148579.db2.gz	OGAYAEBLSWHMSV-UHFFFAOYSA-N	1	0	282.409	1.836	50	0		CDAARO
C[NH+](C)CCn1c2sc3c(c2c(N)nc1=O)CCCC3	ZINC000040268952	174218555	/nfs/dbraw/zinc/21/85/55/174218555.db2.gz	DDNAYSVIBGICED-UHFFFAOYSA-N	1	0	292.408	1.481	50	0		CDAARO
O=S(=O)(CC[NH2+]Cc1cccnc1)N1CCCCCC1	ZINC000040451277	174265856	/nfs/dbraw/zinc/26/58/56/174265856.db2.gz	FTJSUXPWDNHOFP-UHFFFAOYSA-N	1	0	297.424	1.377	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1c(C)[nH]c(C=O)c1C	ZINC000040456550	174267387	/nfs/dbraw/zinc/26/73/87/174267387.db2.gz	BRZYBFNUINXZMJ-UHFFFAOYSA-N	1	0	265.357	1.516	50	0		CDAARO
[NH3+]CC[C@H]1CCCN(C(=O)c2c(O)cccc2O)C1	ZINC000071755506	176260915	/nfs/dbraw/zinc/26/09/15/176260915.db2.gz	RJFKEWAIEGWVHV-SNVBAGLBSA-N	1	0	264.325	1.299	50	0		CDAARO
Cc1cc(NCC[NH+]2CCCCC2)n2nccc2n1	ZINC000072146607	176324996	/nfs/dbraw/zinc/32/49/96/176324996.db2.gz	XAUKCZLQVZNLCF-UHFFFAOYSA-N	1	0	259.357	1.936	50	0		CDAARO
c1cncc(N2CCN(C[C@@H]3CCC[NH2+]C3)CC2)c1	ZINC000077301855	177250803	/nfs/dbraw/zinc/25/08/03/177250803.db2.gz	LEBOALCMFFTLIR-CQSZACIVSA-N	1	0	260.385	1.203	50	0		CDAARO
C[C@@H]1CCC[C@@H]([NH+]2CCN(S(C)(=O)=O)CC2)C1	ZINC000019841816	287399223	/nfs/dbraw/zinc/39/92/23/287399223.db2.gz	FINFRFMKIIFPAO-VXGBXAGGSA-N	1	0	260.403	1.142	50	0		CDAARO
COCC(=O)N1c2ccc(C)cc2[C@@H]2C[N@@H+](C)CC[C@@H]21	ZINC000004027772	274016891	/nfs/dbraw/zinc/01/68/91/274016891.db2.gz	IENAECMLGVKZKZ-ZFWWWQNUSA-N	1	0	274.364	1.776	50	0	biogenic	CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)[C@H]1SCCc2ccccc21	ZINC000125184971	274376007	/nfs/dbraw/zinc/37/60/07/274376007.db2.gz	INPAUQBVDAUMPN-RISCZKNCSA-N	1	0	276.405	1.837	50	0		CDAARO
OCC[N@@H+]1CCCN(c2ccnc3cc(F)ccc32)CC1	ZINC000095960776	275046893	/nfs/dbraw/zinc/04/68/93/275046893.db2.gz	VQOYDYGDLCQHGG-UHFFFAOYSA-N	1	0	289.354	1.878	50	0		CDAARO
CCC[N@@H+]1CC[C@@H](CNc2nccc(N(C)C)n2)C1	ZINC000091457816	276013779	/nfs/dbraw/zinc/01/37/79/276013779.db2.gz	NRFJTLYVDDRDAA-LBPRGKRZSA-N	1	0	263.389	1.686	50	0		CDAARO
C[N@@H+]1CCO[C@H]2CCN(c3ccncc3Cl)C[C@@H]21	ZINC000285130105	277129891	/nfs/dbraw/zinc/12/98/91/277129891.db2.gz	SANOBTUFOWEENW-STQMWFEESA-N	1	0	267.760	1.644	50	0		CDAARO
CN1CCc2ncnc(N3CC[N@@H+]4CCCC[C@H]4C3)c2C1	ZINC000247961192	277190054	/nfs/dbraw/zinc/19/00/54/277190054.db2.gz	DTDKFVBPKPIUCS-ZDUSSCGKSA-N	1	0	287.411	1.139	50	0		CDAARO
CO[C@@]1(C)C[C@@H](O)C12CC[NH+](CC1CCOCC1)CC2	ZINC000091974142	277320343	/nfs/dbraw/zinc/32/03/43/277320343.db2.gz	QNIAPTWRCOYCNW-CABCVRRESA-N	1	0	283.412	1.665	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)[C@@H]1SCCc2ccccc21	ZINC000125185235	278837226	/nfs/dbraw/zinc/83/72/26/278837226.db2.gz	INPAUQBVDAUMPN-BXUZGUMPSA-N	1	0	276.405	1.837	50	0		CDAARO
Cc1nc(CN(CC[NH+](C)C)C[C@H]2CCCO2)co1	ZINC000216205529	279082507	/nfs/dbraw/zinc/08/25/07/279082507.db2.gz	YPDUYMPJJXZUKY-CQSZACIVSA-N	1	0	267.373	1.526	50	0		CDAARO
C[C@H](CNC(=O)NC1Cc2ccccc2C1)[N@H+](C)C1CC1	ZINC000186613063	279334576	/nfs/dbraw/zinc/33/45/76/279334576.db2.gz	NEQQNEHLBVEWHR-GFCCVEGCSA-N	1	0	287.407	1.936	50	0		CDAARO
C[C@@H]1COCC[C@@H]1[NH2+]Cc1ccc(S(C)(=O)=O)cc1	ZINC000191752780	288362568	/nfs/dbraw/zinc/36/25/68/288362568.db2.gz	MDAWBTPEJDIOLW-RISCZKNCSA-N	1	0	283.393	1.605	50	0		CDAARO
CC(C)N1CCC[C@@H](N2CC[NH+](C3CCCC3)CC2)C1=O	ZINC000095407274	289062417	/nfs/dbraw/zinc/06/24/17/289062417.db2.gz	RWJVCLLLQVDWRG-MRXNPFEDSA-N	1	0	293.455	1.946	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(S(=O)(=O)N2CCCCCC2)C1	ZINC000109840237	289297056	/nfs/dbraw/zinc/29/70/56/289297056.db2.gz	AGLUMLOHMQEDNA-CYBMUJFWSA-N	1	0	289.445	1.133	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCCC[C@H]2CC[NH3+])cc1	ZINC000020182097	301665692	/nfs/dbraw/zinc/66/56/92/301665692.db2.gz	MQIWDYXSVKGMOG-ZDUSSCGKSA-N	1	0	282.409	1.887	50	0		CDAARO
[NH3+]C[C@H]1CCC[N@H+](Cc2ccc(CC(=O)[O-])cc2)C1	ZINC000534588949	328317021	/nfs/dbraw/zinc/31/70/21/328317021.db2.gz	OIXOHUBOVBKYEC-CQSZACIVSA-N	1	0	262.353	1.484	50	0		CDAARO
CC1(C(=O)NC[C@@H]2CC[N@@H+](C3CCCCC3)C2)COC1	ZINC000534635500	328333421	/nfs/dbraw/zinc/33/34/21/328333421.db2.gz	GWZJIZCYQCRASB-ZDUSSCGKSA-N	1	0	280.412	1.794	50	0		CDAARO
O=C(CN1C[C@H]2CC[C@@H](C1)[NH2+]C2)NC1CCCCCC1	ZINC000534659629	328342106	/nfs/dbraw/zinc/34/21/06/328342106.db2.gz	WAYGTNFNCLSDBH-ZFWWWQNUSA-N	1	0	279.428	1.509	50	0		CDAARO
COCCC(=O)NC[C@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534664753	328344854	/nfs/dbraw/zinc/34/48/54/328344854.db2.gz	LDYNAZJVZKUHCT-GFCCVEGCSA-N	1	0	254.374	1.404	50	0		CDAARO
CNC(=O)c1cccnc1NCC1([NH+](C)C)CCCC1	ZINC000534668538	328346549	/nfs/dbraw/zinc/34/65/49/328346549.db2.gz	BHXHKAIIRZBENO-UHFFFAOYSA-N	1	0	276.384	1.728	50	0		CDAARO
O=C(NCC1(c2ccccc2)CCOCC1)[C@@H]1C=CC[NH2+]1	ZINC000534672346	328348038	/nfs/dbraw/zinc/34/80/38/328348038.db2.gz	FONLFGJMEINLJR-HNNXBMFYSA-N	1	0	286.375	1.379	50	0		CDAARO
CCCCc1nc(C)cc(NCC[NH2+][C@@H]2CCCOC2)n1	ZINC000534674659	328349832	/nfs/dbraw/zinc/34/98/32/328349832.db2.gz	AQJGGLFKCUGGBQ-CQSZACIVSA-N	1	0	292.427	1.730	50	0		CDAARO
Cc1nn[nH]c1C(=O)NC[C@@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534676065	328356249	/nfs/dbraw/zinc/35/62/49/328356249.db2.gz	VPYJCJCDFKTNMX-NSHDSACASA-N	1	0	277.372	1.107	50	0		CDAARO
Cc1ncc(Cl)c(C(=O)N2C[C@H]([NH+](C)C)[C@@H](C)C2)n1	ZINC000084290501	323207304	/nfs/dbraw/zinc/20/73/04/323207304.db2.gz	VSTPFKOBNNCBHT-KWQFWETISA-N	1	0	282.775	1.461	50	0		CDAARO
CCO[C@H](CC[NH+](C)C)CNC(=O)NCc1ccco1	ZINC000084800653	482507154	/nfs/dbraw/zinc/50/71/54/482507154.db2.gz	LCXSLSMVGLBODH-CYBMUJFWSA-N	1	0	283.372	1.436	50	0		CDAARO
CC1(C)[C@H]2CC[C@]1(C)[C@@H]([NH2+]CCCNS(C)(=O)=O)C2	ZINC000092721149	482635016	/nfs/dbraw/zinc/63/50/16/482635016.db2.gz	JWXYTCGVDSQFMG-SGMGOOAPSA-N	1	0	288.457	1.730	50	0		CDAARO
Cc1nccn1C[C@@H](C)[NH2+]Cc1cnc2cnccn12	ZINC000670426612	482953421	/nfs/dbraw/zinc/95/34/21/482953421.db2.gz	IGDMEWXWKIGXBD-LLVKDONJSA-N	1	0	270.340	1.413	50	0		CDAARO
C[C@@H](CCCC(C)(C)O)CC[N@@H+]1CCCNC(=O)C1	ZINC000670435511	482971913	/nfs/dbraw/zinc/97/19/13/482971913.db2.gz	UEFIFWMVDMNRMX-ZDUSSCGKSA-N	1	0	270.417	1.776	50	0		CDAARO
O[C@H]1CN(c2cnc3ccccc3n2)C[C@@H]1[NH+]1CCCC1	ZINC000670436327	482975611	/nfs/dbraw/zinc/97/56/11/482975611.db2.gz	VBSFSKNEHQMXJG-GJZGRUSLSA-N	1	0	284.363	1.275	50	0		CDAARO
CC1(C)C[C@H](O)CC[N@H+](CCCn2cccn2)C1	ZINC000670438496	482981991	/nfs/dbraw/zinc/98/19/91/482981991.db2.gz	VFUWMVVYGIRQQV-CYBMUJFWSA-N	1	0	251.374	1.756	50	0		CDAARO
O=C1C[N@H+](C2CCN(c3ccccc3F)CC2)CCCN1	ZINC000670446176	482995980	/nfs/dbraw/zinc/99/59/80/482995980.db2.gz	GXKWRHVXCJWZHW-UHFFFAOYSA-N	1	0	291.370	1.616	50	0		CDAARO
CCCc1ncncc1C(=O)NCCNc1cc[nH+]cc1C	ZINC000670448683	483003739	/nfs/dbraw/zinc/00/37/39/483003739.db2.gz	RAECZSQMALOWNP-UHFFFAOYSA-N	1	0	299.378	1.396	50	0		CDAARO
CN(C)C(=O)c1cncc(NCC(C)(C)[NH+]2CCCC2)n1	ZINC000670453846	483023595	/nfs/dbraw/zinc/02/35/95/483023595.db2.gz	QVIVZXBGUAGZKM-UHFFFAOYSA-N	1	0	291.399	1.465	50	0		CDAARO
Cc1cc(CNC(=O)[C@H](C)C[NH+]2CCOCC2)cnc1C	ZINC000670456087	483032575	/nfs/dbraw/zinc/03/25/75/483032575.db2.gz	ZOISPLOVRAJCSQ-CYBMUJFWSA-N	1	0	291.395	1.283	50	0		CDAARO
Cc1ccoc1C(=O)N1CC[C@@H](N2CC[NH+](C)CC2)C1	ZINC000670456428	483034615	/nfs/dbraw/zinc/03/46/15/483034615.db2.gz	BXVMEMJZOWVODB-CYBMUJFWSA-N	1	0	277.368	1.050	50	0		CDAARO
CN1C[C@@H](C[N@H+](C)CC(=O)NCC2CCCCC2)CC1=O	ZINC000670457711	483038614	/nfs/dbraw/zinc/03/86/14/483038614.db2.gz	QPNSZHJLAPCVJN-CQSZACIVSA-N	1	0	295.427	1.093	50	0		CDAARO
CC[N@@H+]1CC[C@@H](CNc2ncc(F)c(OC)n2)C1	ZINC000670458894	483040611	/nfs/dbraw/zinc/04/06/11/483040611.db2.gz	RBTAYVOFFPIDFD-VIFPVBQESA-N	1	0	254.309	1.378	50	0		CDAARO
c1[nH]nc2c1CC[C@H]([NH2+]C1CSCCSC1)C2	ZINC000670465138	483055331	/nfs/dbraw/zinc/05/53/31/483055331.db2.gz	LRTIFSDAGRXQEG-JTQLQIEISA-N	1	0	269.439	1.705	50	0		CDAARO
O=c1c2ccc(Cl)cc2ncn1C[C@@H]1CC[NH2+]C[C@H]1O	ZINC000670466683	483057106	/nfs/dbraw/zinc/05/71/06/483057106.db2.gz	HWBLTCXMXOGXNP-TVQRCGJNSA-N	1	0	293.754	1.020	50	0		CDAARO
CNC(=O)C[C@@H]1CC[N@H+](CC(=O)NC2CCCCCC2)C1	ZINC000670474329	483085275	/nfs/dbraw/zinc/08/52/75/483085275.db2.gz	HKIBIPXSJFFXIZ-ZDUSSCGKSA-N	1	0	295.427	1.283	50	0		CDAARO
Cc1cc([C@@H]2CCC[N@@H+](CCc3cnn(C)c3)C2)[nH]n1	ZINC000084111236	483248161	/nfs/dbraw/zinc/24/81/61/483248161.db2.gz	ZUZSBHMUKAZTSG-CQSZACIVSA-N	1	0	273.384	1.874	50	0		CDAARO
COc1ccc(F)c(F)c1CN1C[C@@H]2[NH2+]CCO[C@H]2C1	ZINC000426740496	533906646	/nfs/dbraw/zinc/90/66/46/533906646.db2.gz	NDUDNWYAHKMZAT-AAEUAGOBSA-N	1	0	284.306	1.146	50	0		CDAARO
CC[C@@H](C(=O)NCc1ccc(O)cc1)[N@H+](C)CC	ZINC000822555771	1161928583	/nfs/dbraw/zinc/92/85/83/1161928583.db2.gz	KACKJRWZKRWFDU-ZDUSSCGKSA-N	1	0	250.342	1.739	50	0		CDAARO
CC(C)Nc1ncccc1C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188453540	527768536	/nfs/dbraw/zinc/76/85/36/527768536.db2.gz	QCJKBDVNCKEQKA-LLVKDONJSA-N	1	0	262.357	1.336	50	0		CDAARO
NC(=O)CC[NH2+]Cc1cccc(-c2cccnc2)c1	ZINC000097037618	567903370	/nfs/dbraw/zinc/90/33/70/567903370.db2.gz	WHDGKROSPLKHLM-UHFFFAOYSA-N	1	0	255.321	1.714	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]CCN1CCN(c2ccccc2)CC1	ZINC000097159244	567904988	/nfs/dbraw/zinc/90/49/88/567904988.db2.gz	NMQLHBXIAKETQA-UHFFFAOYSA-N	1	0	299.422	1.630	50	0		CDAARO
CC(C)C[N@@H+]1CCN(C(=O)c2cc[nH]c2)C[C@H]1CCO	ZINC000952967189	614096215	/nfs/dbraw/zinc/09/62/15/614096215.db2.gz	KVJOYBSLCBHBBR-CQSZACIVSA-N	1	0	279.384	1.180	50	0		CDAARO
CCN1CCC[C@H]1C[NH2+]C1CSCCSC1	ZINC000952989979	615146565	/nfs/dbraw/zinc/14/65/65/615146565.db2.gz	QFOBDWVNQGPBOX-LBPRGKRZSA-N	1	0	260.472	1.909	50	0		CDAARO
CC[C@@H](C(=O)NCCc1ccc(O)cc1)[N@H+](C)CC	ZINC000822555067	1161928756	/nfs/dbraw/zinc/92/87/56/1161928756.db2.gz	FRRPOAZJWIKXPW-AWEZNQCLSA-N	1	0	264.369	1.781	50	0		CDAARO
CCn1ncnc1C[N@H+]1C[C@H]2[C@@H](C1)CCC[C@]2(O)CC	ZINC001704299961	1177679921	/nfs/dbraw/zinc/67/99/21/1177679921.db2.gz	SQEWNFWDHVLIIZ-VNHYZAJKSA-N	1	0	278.400	1.671	50	0		CDAARO
CCc1cc(C[N@@H+]2C[C@H](O)[C@H](Cc3cc(C)n[nH]3)C2)on1	ZINC001704342781	1177695788	/nfs/dbraw/zinc/69/57/88/1177695788.db2.gz	DPRTVFMYJFXGMA-ABAIWWIYSA-N	1	0	290.367	1.304	50	0		CDAARO
CCC1=NO[C@@H](C[N@H+](CC)CCn2cccn2)C1	ZINC001704354357	1177699646	/nfs/dbraw/zinc/69/96/46/1177699646.db2.gz	AEFCUWXTBBVJCT-CYBMUJFWSA-N	1	0	250.346	1.760	50	0		CDAARO
Cc1cc(N(C)CCC[C@H]2CCCO2)nc(N)[nH+]1	ZINC000032561087	912827942	/nfs/dbraw/zinc/82/79/42/912827942.db2.gz	PYBSAURLXYROQA-NSHDSACASA-N	1	0	250.346	1.763	50	0		CDAARO
C[C@@H](CNC(=O)Nc1ccc(F)cn1)C[NH+](C)C	ZINC000585086510	902249967	/nfs/dbraw/zinc/24/99/67/902249967.db2.gz	VZUBXPLHJHBHSY-VIFPVBQESA-N	1	0	254.309	1.540	50	0		CDAARO
CCc1ncc2c(n1)CN(C(=O)[C@H]([NH3+])c1ccccc1)C2	ZINC000067757754	908574463	/nfs/dbraw/zinc/57/44/63/908574463.db2.gz	HECPBKXUWLWZON-OAHLLOKOSA-N	1	0	282.347	1.581	50	0		CDAARO
Cc1nc(C2(O)CC[NH+](C)CC2)n(C(C)(C)C)n1	ZINC000952869846	910419600	/nfs/dbraw/zinc/41/96/00/910419600.db2.gz	NFRGVYKYCCDKQQ-UHFFFAOYSA-N	1	0	252.362	1.255	50	0		CDAARO
COc1ccc(F)c(C[N@H+](C)[C@H](C)CC(N)=O)c1	ZINC000952864684	910459405	/nfs/dbraw/zinc/45/94/05/910459405.db2.gz	LACWZNRKEPBZIU-SECBINFHSA-N	1	0	254.305	1.530	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1CCCNCc1nccs1	ZINC000952965147	910482006	/nfs/dbraw/zinc/48/20/06/910482006.db2.gz	QLXNIPRKLFLVQZ-GFCCVEGCSA-N	1	0	269.414	1.470	50	0		CDAARO
Cc1ccc(C[NH2+]CCSc2n[nH]c(C)n2)o1	ZINC000952970623	910503387	/nfs/dbraw/zinc/50/33/87/910503387.db2.gz	LKPOWXFCOCFXQX-UHFFFAOYSA-N	1	0	252.343	1.896	50	0		CDAARO
CCCc1cc(NC[C@]2(O)CCC[NH2+]CC2)nc(C)n1	ZINC000072133354	936652873	/nfs/dbraw/zinc/65/28/73/936652873.db2.gz	LOTGIDXRCKBOOO-HNNXBMFYSA-N	1	0	278.400	1.654	50	0		CDAARO
Cc1nccn1CC[C@@H](C)[NH2+]Cc1nncn1C(C)C	ZINC000821182127	925566446	/nfs/dbraw/zinc/56/64/46/925566446.db2.gz	YTDMRVFJRIUCDR-GFCCVEGCSA-N	1	0	276.388	1.932	50	0		CDAARO
CCCc1ccc(C[NH+]2CCC3(CC2)NC(=N)NC3=O)o1	ZINC000823010924	925661349	/nfs/dbraw/zinc/66/13/49/925661349.db2.gz	VVJIYOZOSUQSII-UHFFFAOYSA-N	1	0	290.367	1.221	50	0		CDAARO
COc1ccnc(C[NH+]2CCC(c3nnc[nH]3)CC2)c1	ZINC000824835791	925837132	/nfs/dbraw/zinc/83/71/32/925837132.db2.gz	UPVPLOSURLLHCO-UHFFFAOYSA-N	1	0	273.340	1.588	50	0		CDAARO
Cc1nnc([C@@H](C)[NH2+]C2CCN(C(=O)C3CC3)CC2)[nH]1	ZINC000827911262	925989312	/nfs/dbraw/zinc/98/93/12/925989312.db2.gz	QRJQWPXBVLBTTC-SECBINFHSA-N	1	0	277.372	1.165	50	0		CDAARO
Cc1nccn1C[C@@H](C)[NH2+]Cc1cccc(CO)c1	ZINC000828827574	926194151	/nfs/dbraw/zinc/19/41/51/926194151.db2.gz	GJTVCIWCBGZKFV-GFCCVEGCSA-N	1	0	259.353	1.862	50	0		CDAARO
C[C@@H]1[C@H](C)NC(=O)[C@H](C)N1CCO[C@H]1CCCCO1	ZINC000585116152	930967169	/nfs/dbraw/zinc/96/71/69/930967169.db2.gz	JEKDMRYBXRSVPJ-RNJOBUHISA-N	1	0	270.373	1.127	50	0		CDAARO
C[C@H](C[NH+](C)C)[C@H]1CCCCN1Cc1cnn(C)c1	ZINC000585117013	930972148	/nfs/dbraw/zinc/97/21/48/930972148.db2.gz	OXKWCWHYPNZXAG-UKRRQHHQSA-N	1	0	264.417	1.972	50	0		CDAARO
CNC(=O)c1nn(C)c2c1C[C@@H]([NH2+]CCC(C)C)CC2	ZINC000020452119	935731808	/nfs/dbraw/zinc/73/18/08/935731808.db2.gz	VXBTWFUFGALIFY-NSHDSACASA-N	1	0	278.400	1.273	50	0		CDAARO
CC[N@H+](CCN1CCOCC1)C[C@H]1CCCOC1	ZINC001207471832	940203840	/nfs/dbraw/zinc/20/38/40/940203840.db2.gz	UWOVMDZVJAYMOS-CQSZACIVSA-N	1	0	256.390	1.067	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CN(C)Cc2cccnc2C)C1	ZINC001529100435	968981853	/nfs/dbraw/zinc/98/18/53/968981853.db2.gz	SIRJRKSNJPBDNE-OAHLLOKOSA-N	1	0	277.412	1.790	50	0		CDAARO
Cc1ccn2c(nnc2NC(=O)c2ccc(CC[NH3+])cc2)n1	ZINC001529167832	968999813	/nfs/dbraw/zinc/99/98/13/968999813.db2.gz	RBQOSDAKDBGFNT-UHFFFAOYSA-N	1	0	296.334	1.186	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3c(C)n[nH]c3C)C[C@@H]2O)[nH]n1	ZINC001529168236	969002814	/nfs/dbraw/zinc/00/28/14/969002814.db2.gz	YHGGKPNSTPDPDU-DOMZBBRYSA-N	1	0	289.383	1.093	50	0		CDAARO
Fc1cnccc1N1CCN([C@@H]2C[NH+]3CCC2CC3)CC1	ZINC001506408481	975153101	/nfs/dbraw/zinc/15/31/01/975153101.db2.gz	YIZMLFALKVTVHV-MRXNPFEDSA-N	1	0	290.386	1.437	50	0		CDAARO
Cc1nncn1CC[NH+]1CCN(c2ncccc2C)CC1	ZINC001506415941	975156158	/nfs/dbraw/zinc/15/61/58/975156158.db2.gz	RPSPFTCLYFFNKM-UHFFFAOYSA-N	1	0	286.383	1.112	50	0		CDAARO
Cc1ccoc1C(=O)Nc1nnc(CC[NH+](C)C)s1	ZINC001506423256	975159846	/nfs/dbraw/zinc/15/98/46/975159846.db2.gz	ULYIIUYEPRAURO-UHFFFAOYSA-N	1	0	280.353	1.796	50	0		CDAARO
Cc1cc(=O)c(C(=O)NCC[C@H](C)[NH+]2CCCC2)c[nH]1	ZINC001506425644	975160620	/nfs/dbraw/zinc/16/06/20/975160620.db2.gz	BZNMRGAENIUNLM-LBPRGKRZSA-N	1	0	277.368	1.288	50	0		CDAARO
CC1=C(C(=O)N2CCC[C@@H]([NH+](C)C)CC2)OCCO1	ZINC001506431402	975161870	/nfs/dbraw/zinc/16/18/70/975161870.db2.gz	NMKMCFZHSKWEDE-GFCCVEGCSA-N	1	0	268.357	1.207	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(C(=O)c2ccc3c(c2)COCO3)C1	ZINC000096444525	230374101	/nfs/dbraw/zinc/37/41/01/230374101.db2.gz	OYFARGRLXZNQSJ-CQSZACIVSA-N	1	0	290.363	1.719	50	0		CDAARO
O=S(=O)(CC[NH+]1CCCC1)Oc1ccccc1	ZINC000001786800	230367145	/nfs/dbraw/zinc/36/71/45/230367145.db2.gz	WKPRJVRICWRKLE-UHFFFAOYSA-N	1	0	255.339	1.491	50	0		CDAARO
O=C1OC2(CN1Cc1nccn1C1CC1)CC[NH2+]CC2	ZINC000095513286	185001974	/nfs/dbraw/zinc/00/19/74/185001974.db2.gz	UYUDCMVHJIJHCP-UHFFFAOYSA-N	1	0	276.340	1.292	50	0		CDAARO
CCC[C@@H]1CN(C(=O)c2ccc(N)nc2)C[C@H]1[NH+](C)C	ZINC000095519651	185002526	/nfs/dbraw/zinc/00/25/26/185002526.db2.gz	YRWDYJVVWQIHQN-CHWSQXEVSA-N	1	0	276.384	1.466	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](c2nc(-c3cccnn3)no2)C1	ZINC000095516939	185002557	/nfs/dbraw/zinc/00/25/57/185002557.db2.gz	JZWZXUMGQBDPHY-LLVKDONJSA-N	1	0	289.339	1.352	50	0		CDAARO
COc1cccn(CC[C@H]2CCCC[N@@H+]2C)c1=O	ZINC000095520873	185002841	/nfs/dbraw/zinc/00/28/41/185002841.db2.gz	RJFUKRNYCZSDKA-GFCCVEGCSA-N	1	0	250.342	1.731	50	0		CDAARO
Cc1cc(F)ccc1C(=O)N1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1	ZINC000186928416	230395784	/nfs/dbraw/zinc/39/57/84/230395784.db2.gz	JWVBMWDVCFRWJD-GDLCADMTSA-N	1	0	262.328	1.943	50	0		CDAARO
CN(C(=O)Nc1ccc(F)nc1)[C@@H]1CC[N@H+](C)C1	ZINC000095527267	185003506	/nfs/dbraw/zinc/00/35/06/185003506.db2.gz	GBRNMCUHLQKLDB-SNVBAGLBSA-N	1	0	252.293	1.389	50	0		CDAARO
CC(C)Cn1nccc1NC(=O)N[C@@H]1CC[NH2+]C1	ZINC000097553221	342005694	/nfs/dbraw/zinc/00/56/94/342005694.db2.gz	ACILTLZZIRBAPP-SNVBAGLBSA-N	1	0	251.334	1.023	50	0		CDAARO
C[C@H](CNC(=O)COCC1CC1)C[NH+]1CCCC1	ZINC000095953250	185040901	/nfs/dbraw/zinc/04/09/01/185040901.db2.gz	ZXFTYDZGWQZRCM-GFCCVEGCSA-N	1	0	254.374	1.261	50	0		CDAARO
COC(=O)CNC(=O)[C@H](C)[N@@H+]1CC[C@H](C)C[C@@H](C)C1	ZINC000127713229	187328645	/nfs/dbraw/zinc/32/86/45/187328645.db2.gz	QGCGQDCTDKFIJT-TUAOUCFPSA-N	1	0	270.373	1.032	50	0		CDAARO
NC(=O)c1cc([C@@H]2CCC[N@H+](CCc3ccccn3)C2)n[nH]1	ZINC000095961708	185044986	/nfs/dbraw/zinc/04/49/86/185044986.db2.gz	XLXIQTGUMOEGPF-GFCCVEGCSA-N	1	0	299.378	1.326	50	0		CDAARO
NC(=O)CC[NH2+]Cc1ccc(Cl)c2cccnc12	ZINC000095991089	185058309	/nfs/dbraw/zinc/05/83/09/185058309.db2.gz	XIVCKEQNSBHYNL-UHFFFAOYSA-N	1	0	263.728	1.853	50	0		CDAARO
O=C(C[C@@H]1CCCO1)N1CCC[C@H]1C1CC[NH2+]CC1	ZINC000087212161	539087008	/nfs/dbraw/zinc/08/70/08/539087008.db2.gz	ILRKOBGDQHCLNE-KBPBESRZSA-N	1	0	266.385	1.546	50	0		CDAARO
COc1cccc(OCCOCCN2CCOCC2)c1	ZINC000016663432	342088938	/nfs/dbraw/zinc/08/89/38/342088938.db2.gz	COTXWACSTDXONG-UHFFFAOYSA-N	1	0	281.352	1.423	50	0		CDAARO
CC(C)[NH2+]C[C@H](O)COc1cc2c(cn1)CCCC2	ZINC000003683845	342089170	/nfs/dbraw/zinc/08/91/70/342089170.db2.gz	OPVJJXUSUVCARF-AWEZNQCLSA-N	1	0	264.369	1.698	50	0		CDAARO
C[C@@H]1C[N@H+](C)CC[C@@H]1N(C)C(=O)Nc1cccn(C)c1=O	ZINC000089937323	539087648	/nfs/dbraw/zinc/08/76/48/539087648.db2.gz	ATXFIQXNONHXKE-YPMHNXCESA-N	1	0	292.383	1.189	50	0		CDAARO
[NH3+][C@@H](C(=O)N1CCOC[C@H]1C1CC1)c1ccccc1	ZINC000195554888	342626201	/nfs/dbraw/zinc/62/62/01/342626201.db2.gz	DZLINGUKWWFQNQ-UONOGXRCSA-N	1	0	260.337	1.324	50	0		CDAARO
CCc1nn(C)cc1C[NH2+][C@@H]1CCCC[C@@H]1C(N)=O	ZINC000195562084	342628592	/nfs/dbraw/zinc/62/85/92/342628592.db2.gz	AOCJHKJULSZKFI-WCQYABFASA-N	1	0	264.373	1.116	50	0		CDAARO
C[C@H](CNC(=O)N1[C@H](C)CCC[C@@H]1C)N1CC[NH+](C)CC1	ZINC000092323883	539087902	/nfs/dbraw/zinc/08/79/02/539087902.db2.gz	OLAJWULWJPWSRV-QLFBSQMISA-N	1	0	296.459	1.595	50	0		CDAARO
C[C@H]1CC[C@H](C)N(C(=O)c2csc(CC[NH3+])n2)C1	ZINC000090957671	290628655	/nfs/dbraw/zinc/62/86/55/290628655.db2.gz	YAKONPXDDHMXPC-UWVGGRQHSA-N	1	0	267.398	1.905	50	0		CDAARO
O=C1NC(=O)[C@H](C2CC[NH+](Cc3ccccc3)CC2)N1	ZINC000096886868	185122515	/nfs/dbraw/zinc/12/25/15/185122515.db2.gz	KEQFPGGVSIYEGT-ZDUSSCGKSA-N	1	0	273.336	1.107	50	0		CDAARO
CCN(CCn1cccn1)C[C@@H](C)[NH+]1CCCC1	ZINC000244724065	361860119	/nfs/dbraw/zinc/86/01/19/361860119.db2.gz	MMXMDEGHALFZHC-CQSZACIVSA-N	1	0	250.390	1.689	50	0		CDAARO
CC(=O)N1CCC(Nc2cc([C@H]3C[C@@H]([NH3+])C3)ncn2)CC1	ZINC000244882849	361868015	/nfs/dbraw/zinc/86/80/15/361868015.db2.gz	YAHQBNNYGQIBBQ-TXEJJXNPSA-N	1	0	289.383	1.104	50	0		CDAARO
[NH3+]Cc1ccc(C(=O)NCCCn2ccccc2=O)cc1	ZINC000244900002	361869715	/nfs/dbraw/zinc/86/97/15/361869715.db2.gz	ZUDVJJWYGZFCNE-UHFFFAOYSA-N	1	0	285.347	1.127	50	0		CDAARO
c1ccc(C[N@H+]2C[C@@H]3C[C@H]2CN3CC2OCCO2)cc1	ZINC000585136436	342216066	/nfs/dbraw/zinc/21/60/66/342216066.db2.gz	GADGPZPOARRONU-GJZGRUSLSA-N	1	0	274.364	1.318	50	0		CDAARO
Cc1noc(-c2ccccc2C(=O)N2CC[C@H](C[NH3+])C2)n1	ZINC000178563190	362247243	/nfs/dbraw/zinc/24/72/43/362247243.db2.gz	CRYKCEVZWMHFML-LLVKDONJSA-N	1	0	286.335	1.466	50	0		CDAARO
CN(CC(=O)Nc1ccccc1F)C1CC[NH+](C)CC1	ZINC000002632786	529839199	/nfs/dbraw/zinc/83/91/99/529839199.db2.gz	RAIJLTYEZGWTTL-UHFFFAOYSA-N	1	0	279.359	1.790	50	0		CDAARO
CCOCC[N@@H+]1CCNC(=O)C[C@@H]1c1ccccc1	ZINC000084801346	362275324	/nfs/dbraw/zinc/27/53/24/362275324.db2.gz	HQFIPUVSICFVMJ-CQSZACIVSA-N	1	0	262.353	1.586	50	0		CDAARO
C[NH2+]CC1CCN(C(=O)c2ccncc2F)CC1	ZINC000086316775	362291363	/nfs/dbraw/zinc/29/13/63/362291363.db2.gz	OYRBQUGUORPVEU-UHFFFAOYSA-N	1	0	251.305	1.292	50	0		CDAARO
CCO[C@@H]1C[C@](CO)([NH2+]Cc2cncs2)C1(C)C	ZINC000186594200	362330102	/nfs/dbraw/zinc/33/01/02/362330102.db2.gz	KDAAZVNHBSMXNC-DGCLKSJQSA-N	1	0	270.398	1.799	50	0		CDAARO
C[NH+](C)[C@@H]1CCN(C(=O)CC2Cc3ccccc3C2)C1	ZINC000252485237	362385601	/nfs/dbraw/zinc/38/56/01/362385601.db2.gz	GPIHHNCRPFJACM-MRXNPFEDSA-N	1	0	272.392	1.954	50	0		CDAARO
Cc1nccn1CC1CC[NH+](CCn2cc[nH]c2=O)CC1	ZINC000252508651	362389871	/nfs/dbraw/zinc/38/98/71/362389871.db2.gz	XQIFNMNCQWSCHA-UHFFFAOYSA-N	1	0	289.383	1.094	50	0		CDAARO
C[N@H+](CC(=O)NC(=O)NC(C)(C)C)C1CCCCC1	ZINC000007786370	282350548	/nfs/dbraw/zinc/35/05/48/282350548.db2.gz	RGAWMSLEKUHYPC-UHFFFAOYSA-N	1	0	269.389	1.875	50	0		CDAARO
C[N@H+](CC(=O)[O-])Cc1ccccc1C[NH+]1CCCC1	ZINC000067672962	282360302	/nfs/dbraw/zinc/36/03/02/282360302.db2.gz	MXCWIKKWFKVCMZ-UHFFFAOYSA-N	1	0	262.353	1.799	50	0		CDAARO
Cc1ccc(F)cc1C[NH2+]C[C@H]1CN(C)CCN1C	ZINC000129073084	362502482	/nfs/dbraw/zinc/50/24/82/362502482.db2.gz	UKVHAJAPDKIUSB-HNNXBMFYSA-N	1	0	265.376	1.470	50	0		CDAARO
C[C@@H](CCNC(=O)N1CCC[C@H](O)C1)[NH+]1CCCCC1	ZINC000097108163	185535087	/nfs/dbraw/zinc/53/50/87/185535087.db2.gz	XKZYTXHJPVWKCQ-KBPBESRZSA-N	1	0	283.416	1.417	50	0		CDAARO
CCOc1cccc(CCNC(=O)[C@@H]2CCC[NH2+]2)c1	ZINC000097234143	185569944	/nfs/dbraw/zinc/56/99/44/185569944.db2.gz	DBXQETFVKXPCKO-AWEZNQCLSA-N	1	0	262.353	1.496	50	0		CDAARO
Cc1cccc(CN2CCN([C@@H]3CC[NH2+]C3)C2=O)c1	ZINC000085347892	179029038	/nfs/dbraw/zinc/02/90/38/179029038.db2.gz	IJDGDURGAGKYCZ-CQSZACIVSA-N	1	0	259.353	1.595	50	0		CDAARO
COCCC[N@@H+]1CC[C@H](N(Cc2ncc(C)o2)C(C)=O)C1	ZINC000089702322	347608010	/nfs/dbraw/zinc/60/80/10/347608010.db2.gz	XOTBSKKVECPJQO-AWEZNQCLSA-N	1	0	295.383	1.442	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)c2c(F)cc(F)cc2F)C1	ZINC000086997907	179377561	/nfs/dbraw/zinc/37/75/61/179377561.db2.gz	JTBJUEFHABWCOJ-ZETCQYMHSA-N	1	0	258.243	1.525	50	0		CDAARO
CN(CCC(F)(F)F)C(=O)[C@@H]([NH3+])Cc1ccccc1	ZINC000088420073	179597113	/nfs/dbraw/zinc/59/71/13/179597113.db2.gz	JRNYUIUQUKNRBD-NSHDSACASA-N	1	0	274.286	1.967	50	0		CDAARO
CO[C@H]1c2ccccc2C(=O)N1CC[NH+]1CCCC1	ZINC000027103961	348746536	/nfs/dbraw/zinc/74/65/36/348746536.db2.gz	RWZMTCXOCBZGSH-HNNXBMFYSA-N	1	0	260.337	1.883	50	0		CDAARO
CC(C)[NH+](CCn1cnc2cccnc2c1=O)C(C)C	ZINC000584896752	349358197	/nfs/dbraw/zinc/35/81/97/349358197.db2.gz	LSBRJIOYNMWZNZ-UHFFFAOYSA-N	1	0	274.368	1.910	50	0		CDAARO
CC[C@@H](C[NH+](C)C)NC(=O)N1CC(c2ccccn2)C1	ZINC000584886356	349344293	/nfs/dbraw/zinc/34/42/93/349344293.db2.gz	ZTAXLXAVKAJWPU-ZDUSSCGKSA-N	1	0	276.384	1.531	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H]1CN(C(=O)CCc1cn[nH]c1)C2	ZINC000584897179	349358976	/nfs/dbraw/zinc/35/89/76/349358976.db2.gz	DDNGZBXKZRAWEI-KBPBESRZSA-N	1	0	276.384	1.285	50	0		CDAARO
CC1(C)CN(C(=O)C2(Cn3ccnc3)CC2)CCO1	ZINC000584898396	349359602	/nfs/dbraw/zinc/35/96/02/349359602.db2.gz	XYJXPMATKWZTDB-UHFFFAOYSA-N	1	0	263.341	1.301	50	0		CDAARO
COCC1(CNC(=O)[C@@H]2CCC[C@H]([NH3+])C2)CCCC1	ZINC000584899438	349361459	/nfs/dbraw/zinc/36/14/59/349361459.db2.gz	MAZBQZMATZHCAV-OLZOCXBDSA-N	1	0	268.401	1.827	50	0		CDAARO
C[C@H]([NH2+]C[C@H]1CN2CCN1CC2)c1ccc2c(c1)OCO2	ZINC000090649280	180017820	/nfs/dbraw/zinc/01/78/20/180017820.db2.gz	LIRPGXFIBQLNJG-JSGCOSHPSA-N	1	0	289.379	1.066	50	0		CDAARO
COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@@]1(O)CCOC1	ZINC000090849774	180046059	/nfs/dbraw/zinc/04/60/59/180046059.db2.gz	AQLJOPHKDKBOMC-DOMZBBRYSA-N	1	0	265.353	1.806	50	0		CDAARO
O=C(C[C@@H]1C[NH2+]CCO1)NCc1nc2ccccc2s1	ZINC000091310453	180132217	/nfs/dbraw/zinc/13/22/17/180132217.db2.gz	NVTLKPUZFVFLBW-SNVBAGLBSA-N	1	0	291.376	1.291	50	0		CDAARO
c1cnc(NC2CC[NH+](Cc3ccncc3)CC2)nc1	ZINC000091444795	180157068	/nfs/dbraw/zinc/15/70/68/180157068.db2.gz	RULJPGPIHLPSTK-UHFFFAOYSA-N	1	0	269.352	1.948	50	0		CDAARO
C[C@@H]1C[N@H+](CCc2nccn2C)CC[C@@]1(O)C1CCC1	ZINC000091848947	180271005	/nfs/dbraw/zinc/27/10/05/180271005.db2.gz	UXJJKVRSZZLVOW-CJNGLKHVSA-N	1	0	277.412	1.836	50	0		CDAARO
COCCC[N@@H+]1CC[C@@H](CNc2ccncn2)C1	ZINC000091933472	180288485	/nfs/dbraw/zinc/28/84/85/180288485.db2.gz	GDRWIFJULDUEAW-LBPRGKRZSA-N	1	0	250.346	1.247	50	0		CDAARO
COCC[C@@]1(CO)CCC[N@H+](Cc2cncn2C2CC2)C1	ZINC000092078662	180318301	/nfs/dbraw/zinc/31/83/01/180318301.db2.gz	BTMVAPUZUUKXEB-INIZCTEOSA-N	1	0	293.411	1.829	50	0		CDAARO
COCC[C@]1(O)CC[N@H+](Cc2c(C)n[nH]c2C)C[C@H]1C	ZINC000092096968	180323611	/nfs/dbraw/zinc/32/36/11/180323611.db2.gz	JAVAXBHMOMKBNH-IAQYHMDHSA-N	1	0	281.400	1.636	50	0		CDAARO
c1nc2ncnc(N3CCC[N@@H+]4CCC[C@H]4C3)c2[nH]1	ZINC000106851221	186141495	/nfs/dbraw/zinc/14/14/95/186141495.db2.gz	ONUKQHRMEQUBJY-JTQLQIEISA-N	1	0	258.329	1.027	50	0		CDAARO
Cc1ccc(C[NH2+][C@H]2CCN(S(C)(=O)=O)C[C@H]2C)o1	ZINC000106918454	186151175	/nfs/dbraw/zinc/15/11/75/186151175.db2.gz	KCDZAEOZUCHGSA-MFKMUULPSA-N	1	0	286.397	1.348	50	0		CDAARO
CCC[NH+]1CCC(CC(=O)N[C@@H]2CCCCNC2=O)CC1	ZINC000065388054	362960498	/nfs/dbraw/zinc/96/04/98/362960498.db2.gz	GENOEUGOWPVOLN-CQSZACIVSA-N	1	0	295.427	1.283	50	0		CDAARO
O=C(NCC1CC[NH2+]CC1)c1cccc(Cl)n1	ZINC000120568001	186909193	/nfs/dbraw/zinc/90/91/93/186909193.db2.gz	OGDNNBZEXFNPOJ-UHFFFAOYSA-N	1	0	253.733	1.464	50	0		CDAARO
Cc1ccc2oc(N3C[C@H](O)[C@@H]([NH+](C)C)C3)nc2c1	ZINC000292365565	198260720	/nfs/dbraw/zinc/26/07/20/198260720.db2.gz	PAOVCYZUKPZXBA-RYUDHWBXSA-N	1	0	261.325	1.247	50	0		CDAARO
CC/C=C\CCC[N@@H+]1C[C@@H]2C[NH+](C)C[C@]2(C(=O)[O-])C1	ZINC000065434234	363270104	/nfs/dbraw/zinc/27/01/04/363270104.db2.gz	WXUGNZXMFWPUGN-CWHGNCJQSA-N	1	0	266.385	1.681	50	0		CDAARO
CCc1cc(N2C[C@H](O)[C@@H](OC(C)C)C2)nc(N(C)C)[nH+]1	ZINC000065458485	363281007	/nfs/dbraw/zinc/28/10/07/363281007.db2.gz	IZNQFTHPURYCQY-STQMWFEESA-N	1	0	294.399	1.080	50	0		CDAARO
CC(C)c1ccc([C@H](C)NC(=O)[C@H]2C[C@H](O)C[NH2+]2)cc1	ZINC000037027824	363315132	/nfs/dbraw/zinc/31/51/32/363315132.db2.gz	CLARUPUMSWGCBT-TUKIKUTGSA-N	1	0	276.380	1.710	50	0		CDAARO
O=C(Nc1ccc(-c2cc[nH]n2)cc1)[C@@H]1CCC[NH2+]1	ZINC000037045320	363319480	/nfs/dbraw/zinc/31/94/80/363319480.db2.gz	YQLXKOCPSYCFKJ-ZDUSSCGKSA-N	1	0	256.309	1.767	50	0		CDAARO
CN(Cc1nncn1C)Cc1cccc2[nH]ccc21	ZINC000276890619	366203951	/nfs/dbraw/zinc/20/39/51/366203951.db2.gz	GHEHCWWMRQLQHZ-UHFFFAOYSA-N	1	0	255.325	1.928	50	0		CDAARO
O=C(COc1ccc(F)cc1)O[C@H]1C[NH+]2CCC1CC2	ZINC000000203547	355896671	/nfs/dbraw/zinc/89/66/71/355896671.db2.gz	XHPLXOQGCDRAHV-AWEZNQCLSA-N	1	0	279.311	1.842	50	0		CDAARO
COc1ccc(-c2nnn(C3CC[NH2+]CC3)n2)cc1OC	ZINC000004343343	356028330	/nfs/dbraw/zinc/02/83/30/356028330.db2.gz	RCJOSCIHXIXEGO-UHFFFAOYSA-N	1	0	289.339	1.282	50	0		CDAARO
COC(=O)c1ccc(N2CC[NH+](C)CC2)c(NC(C)=O)c1	ZINC000006700849	356082188	/nfs/dbraw/zinc/08/21/88/356082188.db2.gz	QQDWXRDMFSARMK-UHFFFAOYSA-N	1	0	291.351	1.183	50	0		CDAARO
CN1CCC([N@@H+]2CCC[C@H](NC(=O)C3=CCCC3)C2)CC1	ZINC000011879570	356281550	/nfs/dbraw/zinc/28/15/50/356281550.db2.gz	KYFBWJBHQPPZPO-HNNXBMFYSA-N	1	0	291.439	1.772	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@@H]([NH3+])c1ccc2c(c1)OCO2	ZINC000012357113	356294873	/nfs/dbraw/zinc/29/48/73/356294873.db2.gz	SPSZUBZMVYTJJF-SNVBAGLBSA-N	1	0	280.324	1.940	50	0		CDAARO
Cc1ccccc1O[C@H](C)C(=O)NCCC[NH+](C)C	ZINC000012862349	356327535	/nfs/dbraw/zinc/32/75/35/356327535.db2.gz	QUIZOTMEFXDADP-CYBMUJFWSA-N	1	0	264.369	1.830	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)c1ccc(Cl)c(F)c1	ZINC000195554069	363461719	/nfs/dbraw/zinc/46/17/19/363461719.db2.gz	ZWSXYRZJTSTVLH-MNOVXSKESA-N	1	0	272.707	1.196	50	0		CDAARO
CCC[NH+]1CCN(C(=O)Cc2ccccc2F)CC1	ZINC000013324186	356343186	/nfs/dbraw/zinc/34/31/86/356343186.db2.gz	GSKZNLCGFAKVRA-UHFFFAOYSA-N	1	0	264.344	1.922	50	0		CDAARO
O=C(NCC[N@@H+]1CCc2ccccc2C1)c1ccc(=O)[nH]c1	ZINC000032787376	356369051	/nfs/dbraw/zinc/36/90/51/356369051.db2.gz	MMPLOMGJHIVSNZ-UHFFFAOYSA-N	1	0	297.358	1.163	50	0		CDAARO
C[C@H]1C[NH+](CCCNC(=O)c2ccoc2)C[C@H](C)O1	ZINC000032826846	356383311	/nfs/dbraw/zinc/38/33/11/356383311.db2.gz	MIGLSIKEJZRGGO-RYUDHWBXSA-N	1	0	266.341	1.509	50	0		CDAARO
Cc1ccc(C)c(NC(=O)NCCN2CCOCC2)c1	ZINC000032862295	356398012	/nfs/dbraw/zinc/39/80/12/356398012.db2.gz	BALLBZLIGDIHNP-UHFFFAOYSA-N	1	0	277.368	1.757	50	0		CDAARO
C[NH+](C)C1(CNc2ccc3nnnn3n2)CCCCC1	ZINC000032871795	356404813	/nfs/dbraw/zinc/40/48/13/356404813.db2.gz	CSLANADSFQIZME-UHFFFAOYSA-N	1	0	275.360	1.196	50	0		CDAARO
CC(C)(C)CN1CCC[C@@](O)(C[NH2+]C2CCC2)C1=O	ZINC000015073781	356404890	/nfs/dbraw/zinc/40/48/90/356404890.db2.gz	FSEHGXFNIAPKFP-OAHLLOKOSA-N	1	0	268.401	1.528	50	0		CDAARO
COc1ccc(/C(C)=C\C(=O)N2CC[NH2+]C[C@@H]2C)cc1	ZINC000255439679	356406838	/nfs/dbraw/zinc/40/68/38/356406838.db2.gz	MPAWJQFOGLVZLA-UKVQZPPCSA-N	1	0	274.364	1.919	50	0		CDAARO
Cc1nc2c(C)cccn2c1CN1CCC([NH3+])CC1	ZINC000019237591	356477913	/nfs/dbraw/zinc/47/79/13/356477913.db2.gz	YYAYFKAAHKSQMO-UHFFFAOYSA-N	1	0	258.369	1.874	50	0		CDAARO
COc1ccc(CCN2C[C@@H](C[NH3+])CC2=O)cc1OC	ZINC000019669406	356495162	/nfs/dbraw/zinc/49/51/62/356495162.db2.gz	JBSFMBYYPGBGEM-GFCCVEGCSA-N	1	0	278.352	1.054	50	0		CDAARO
Cc1c(C)n(C[C@H](O)CN2CC[NH2+]CC2)c2ccccc12	ZINC000019735429	356497766	/nfs/dbraw/zinc/49/77/66/356497766.db2.gz	WYHXAZHFQHMALD-OAHLLOKOSA-N	1	0	287.407	1.524	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc(F)cc2Cl)C[C@@H]1CCO	ZINC000019745419	356498891	/nfs/dbraw/zinc/49/88/91/356498891.db2.gz	SFKPLDOPQHOBPL-ZDUSSCGKSA-N	1	0	286.778	1.978	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COc2ccc(OC)cc2)CC1	ZINC000019790750	356504179	/nfs/dbraw/zinc/50/41/79/356504179.db2.gz	IEXYZOVSQTYJSL-CQSZACIVSA-N	1	0	294.395	1.072	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@@H](CNC(=O)c2cncnc2)C1	ZINC000273726191	192280369	/nfs/dbraw/zinc/28/03/69/192280369.db2.gz	NFDMLPZDBOPRSK-LBPRGKRZSA-N	1	0	262.357	1.327	50	0		CDAARO
CC(=O)c1ccc(N2C(=O)C[C@H]([NH2+]CC3CC3)C2=O)cc1	ZINC000095630534	538449307	/nfs/dbraw/zinc/44/93/07/538449307.db2.gz	KIWCQZOUIROYBM-AWEZNQCLSA-N	1	0	286.331	1.521	50	0		CDAARO
CC(=O)N1CCN(c2cc(N3CCCC3)[nH+]c(C)n2)CC1	ZINC000021793603	356587062	/nfs/dbraw/zinc/58/70/62/356587062.db2.gz	YDRGTECLNNIPFK-UHFFFAOYSA-N	1	0	289.383	1.054	50	0		CDAARO
C[N@@H+]1CCN(Cc2c(F)cccc2Cl)C[C@@H]1CCO	ZINC000023361168	356641668	/nfs/dbraw/zinc/64/16/68/356641668.db2.gz	GBHHQVIOMSAFEW-NSHDSACASA-N	1	0	286.778	1.978	50	0		CDAARO
COc1ccc2c(c1)C[C@@H]([NH2+]CC(=O)NC(C)C)CC2	ZINC000067919907	356760838	/nfs/dbraw/zinc/76/08/38/356760838.db2.gz	IKNINQVCHDITRV-AWEZNQCLSA-N	1	0	276.380	1.667	50	0		CDAARO
COc1ccc(C(=O)N(C)C2CC[NH+](C)CC2)cc1	ZINC000033019492	356793663	/nfs/dbraw/zinc/79/36/63/356793663.db2.gz	GJPUAFVJSXMABL-UHFFFAOYSA-N	1	0	262.353	1.861	50	0		CDAARO
CN(C(=O)Cc1ccc(F)cc1)C1CC[NH+](C)CC1	ZINC000033019522	356793903	/nfs/dbraw/zinc/79/39/03/356793903.db2.gz	LZCAFGTWDXFEFP-UHFFFAOYSA-N	1	0	264.344	1.921	50	0		CDAARO
CCOC(=O)[C@H]1CCCCN1C1CC[NH+](C)CC1	ZINC000000291706	356813142	/nfs/dbraw/zinc/81/31/42/356813142.db2.gz	OCOMZDWEJWQZBX-CYBMUJFWSA-N	1	0	254.374	1.498	50	0		CDAARO
O=S(=O)(c1ccc2ccccc2c1)N1CCNCC1	ZINC000034781218	356820324	/nfs/dbraw/zinc/82/03/24/356820324.db2.gz	OJWPAXRMRPPQBG-UHFFFAOYSA-N	1	0	276.361	1.434	50	0		CDAARO
COc1ccccc1C[NH2+]CC1(O)CCOCC1	ZINC000112717056	357111123	/nfs/dbraw/zinc/11/11/23/357111123.db2.gz	WIVNGDFWLMATRC-UHFFFAOYSA-N	1	0	251.326	1.326	50	0		CDAARO
COCCN(Cc1cccs1)C(=O)C[C@@H]1CC[NH2+]C1	ZINC000089744177	357508172	/nfs/dbraw/zinc/50/81/72/357508172.db2.gz	NNAIQQVSZFCJHA-LBPRGKRZSA-N	1	0	282.409	1.723	50	0		CDAARO
CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)NC[C@@H]1CCCCO1	ZINC000096436227	357472364	/nfs/dbraw/zinc/47/23/64/357472364.db2.gz	CEJJGMRBYNDVFF-LSDHHAIUSA-N	1	0	298.427	1.465	50	0		CDAARO
C[NH2+]CCOc1ccc(I)cc1	ZINC000016293874	357489889	/nfs/dbraw/zinc/48/98/89/357489889.db2.gz	LWMXTHRQBOIJAW-UHFFFAOYSA-N	1	0	277.105	1.889	50	0		CDAARO
C[C@H](NC(=O)CC[NH2+]CCc1c[nH]cn1)c1ccccc1	ZINC000065409564	357539374	/nfs/dbraw/zinc/53/93/74/357539374.db2.gz	CLNVXBKOJFSYAF-ZDUSSCGKSA-N	1	0	286.379	1.809	50	0		CDAARO
CSc1ncccc1C(=O)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065407904	357539399	/nfs/dbraw/zinc/53/93/99/357539399.db2.gz	VYDQOJHVHSMNEQ-MNOVXSKESA-N	1	0	277.393	1.770	50	0		CDAARO
C[C@@H](CCc1ccccc1)[NH2+]CCN(C)S(C)(=O)=O	ZINC000065465335	357542968	/nfs/dbraw/zinc/54/29/68/357542968.db2.gz	BBSKLCWWAHUFOH-ZDUSSCGKSA-N	1	0	284.425	1.489	50	0		CDAARO
Cc1cccc(-c2n[nH]cc2C(=O)N[C@@H]2CC[C@@H]([NH3+])C2)c1	ZINC000067787466	357628084	/nfs/dbraw/zinc/62/80/84/357628084.db2.gz	LRNLQPORKPRXLR-CHWSQXEVSA-N	1	0	284.363	1.995	50	0		CDAARO
C[NH+]1CCC(CNS(=O)(=O)c2cccs2)CC1	ZINC000022999705	357581912	/nfs/dbraw/zinc/58/19/12/357581912.db2.gz	VMOYCEQFUFLBOY-UHFFFAOYSA-N	1	0	274.411	1.368	50	0		CDAARO
O=C(NCc1cccs1)[C@@H]1CC12CC[NH2+]CC2	ZINC000070252269	357715708	/nfs/dbraw/zinc/71/57/08/357715708.db2.gz	RNABDQUSTABCOM-NSHDSACASA-N	1	0	250.367	1.754	50	0		CDAARO
Cc1cc(CNC[C@]2(O)CCC[NH2+]C2)c(C(F)(F)F)o1	ZINC000072423589	357834089	/nfs/dbraw/zinc/83/40/89/357834089.db2.gz	QJJWFJCMAXOYTD-LBPRGKRZSA-N	1	0	292.301	1.811	50	0		CDAARO
C[C@H](CCc1cccc(F)c1)[N@@H+]1CC[C@H](C(N)=O)C1	ZINC000097084220	357944472	/nfs/dbraw/zinc/94/44/72/357944472.db2.gz	QHXUXTKZJPFEHB-YPMHNXCESA-N	1	0	264.344	1.954	50	0		CDAARO
Cc1nnc(CN[C@@H](CC(N)=O)C2CCCCC2)o1	ZINC000097111054	357986850	/nfs/dbraw/zinc/98/68/50/357986850.db2.gz	ZRCARERSWNQIRZ-NSHDSACASA-N	1	0	266.345	1.292	50	0		CDAARO
C[C@H]1OCCN(CCC[N@@H+]2CCO[C@@H](C)[C@@H]2C)[C@@H]1C	ZINC000247345898	358007559	/nfs/dbraw/zinc/00/75/59/358007559.db2.gz	XVCHFYDJCOZHCD-NMWPEEMBSA-N	1	0	270.417	1.595	50	0		CDAARO
CNC(=O)C[N@H+](C[C@@H]1CCCO1)C1CCC(C)CC1	ZINC000096441480	283313842	/nfs/dbraw/zinc/31/38/42/283313842.db2.gz	JDZMCMFCUGVCEO-RUXDESIVSA-N	1	0	268.401	1.792	50	0		CDAARO
CC(=O)c1ccc(Cl)c(S(=O)(=O)NCCC[NH3+])c1	ZINC000097229269	358043391	/nfs/dbraw/zinc/04/33/91/358043391.db2.gz	CBRJWKKMOLQEMX-UHFFFAOYSA-N	1	0	290.772	1.170	50	0		CDAARO
O=C(NCC[NH2+][C@H]1CCCc2sccc21)c1ccn[nH]1	ZINC000097236318	358049051	/nfs/dbraw/zinc/04/90/51/358049051.db2.gz	CJYXWJIYIUEBFX-NSHDSACASA-N	1	0	290.392	1.868	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C\C(=O)N1CC[N@@H+](C)C[C@@H]1C	ZINC000098055856	358344394	/nfs/dbraw/zinc/34/43/94/358344394.db2.gz	AWTWCPHJYBPIHE-OMMCCPJFSA-N	1	0	296.802	1.558	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N(C)Cc1cn(C)nc1C(F)(F)F	ZINC000195554692	358557381	/nfs/dbraw/zinc/55/73/81/358557381.db2.gz	HXWUXXZBYJFKTF-QMMMGPOBSA-N	1	0	278.278	1.135	50	0		CDAARO
CCc1nc(N)nc(NCC23CCC[NH+]2CCC3)c1C	ZINC000095371898	358687805	/nfs/dbraw/zinc/68/78/05/358687805.db2.gz	QKXBOTGVKKJRHP-UHFFFAOYSA-N	1	0	275.400	1.970	50	0		CDAARO
Cc1ccc(C)c(CN2C(=O)N[C@@]3(CC[NH2+]C3)C2=O)c1	ZINC000098212704	358816658	/nfs/dbraw/zinc/81/66/58/358816658.db2.gz	WQJYILVFHJHNBW-OAHLLOKOSA-N	1	0	273.336	1.087	50	0		CDAARO
COCc1cc(CN(C)C(=O)[C@H]2CCCCC[N@@H+]2C)[nH]n1	ZINC000097393926	358771923	/nfs/dbraw/zinc/77/19/23/358771923.db2.gz	JYCXFHJOZPYPLB-CQSZACIVSA-N	1	0	294.399	1.389	50	0		CDAARO
O[C@H]1CN(Cc2c(F)cccc2F)C[C@@H]1[NH+]1CCCC1	ZINC000097696123	358793917	/nfs/dbraw/zinc/79/39/17/358793917.db2.gz	VLRXPITVTWRQHW-GJZGRUSLSA-N	1	0	282.334	1.606	50	0		CDAARO
O=C(NCc1ccc2c(c1)CCCC2)[C@H]1C[NH2+]CCO1	ZINC000097758064	358797732	/nfs/dbraw/zinc/79/77/32/358797732.db2.gz	HRJJYSUOFIBMRI-OAHLLOKOSA-N	1	0	274.364	1.170	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)NCC(C)(C)C[NH+](C)C	ZINC000097797718	358799811	/nfs/dbraw/zinc/79/98/11/358799811.db2.gz	OTXYUMBZQABOEB-UHFFFAOYSA-N	1	0	266.389	1.273	50	0		CDAARO
O[C@@]1(C[NH2+][C@@H]2CCN(Cc3ccccc3)C2)CCSC1	ZINC000088738923	366491491	/nfs/dbraw/zinc/49/14/91/366491491.db2.gz	VKTZYAJZIOAOCW-HZPDHXFCSA-N	1	0	292.448	1.719	50	0		CDAARO
Cn1c2ccccc2cc(C[N@@H+]2CC[C@@H](O)C2)c1=O	ZINC000215778453	358903540	/nfs/dbraw/zinc/90/35/40/358903540.db2.gz	AZMKBKJKMLEQDC-CYBMUJFWSA-N	1	0	258.321	1.105	50	0		CDAARO
C[C@H]1CNC(=O)CC[N@@H+]1Cc1ccc(-c2cc[nH]n2)s1	ZINC000215927247	358910505	/nfs/dbraw/zinc/91/05/05/358910505.db2.gz	UCFAMGCBHFZRCQ-JTQLQIEISA-N	1	0	290.392	1.849	50	0		CDAARO
C/C=C/CN1CC[N@H+](Cc2ccccc2)C[C@@H](O)C1	ZINC000216918220	358970309	/nfs/dbraw/zinc/97/03/09/358970309.db2.gz	WDSROIIQWISPAJ-KZSQQDEKSA-N	1	0	260.381	1.741	50	0		CDAARO
Cc1nc(N)ncc1C(=O)N1CC[C@H]([NH+]2CCCCC2)C1	ZINC000216186531	358929774	/nfs/dbraw/zinc/92/97/74/358929774.db2.gz	JVVYUWGFVDTDRE-LBPRGKRZSA-N	1	0	289.383	1.068	50	0		CDAARO
CCCOc1ccc(CCNC(=O)[C@H]2C[NH2+]CCO2)cc1	ZINC000216426921	358945088	/nfs/dbraw/zinc/94/50/88/358945088.db2.gz	XUXHBKLXJWKPKL-OAHLLOKOSA-N	1	0	292.379	1.123	50	0		CDAARO
c1n[nH]cc1CCN1CCC([NH+]2CCCCC2)CC1	ZINC000218816359	359066926	/nfs/dbraw/zinc/06/69/26/359066926.db2.gz	GMJYYOBNKMJSCL-UHFFFAOYSA-N	1	0	262.401	1.903	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)[C@H]3OCCc4ccccc43)C[C@@H]12	ZINC000248561996	359052847	/nfs/dbraw/zinc/05/28/47/359052847.db2.gz	BAHQJLDGROLBCA-MIGQKNRLSA-N	1	0	286.375	1.496	50	0		CDAARO
C[C@@H](CO)CCNc1cc(C2CC([NH3+])C2)ncn1	ZINC000223498530	359430763	/nfs/dbraw/zinc/43/07/63/359430763.db2.gz	QOSKXBHCMYWLRZ-KPPDAEKUSA-N	1	0	250.346	1.112	50	0		CDAARO
CN(Cc1cccnc1)C1CN(C(=O)C2CCCC2)C1	ZINC000257185666	359509709	/nfs/dbraw/zinc/50/97/09/359509709.db2.gz	XICHFTVLIGTIRD-UHFFFAOYSA-N	1	0	273.380	1.914	50	0		CDAARO
c1ccc([C@@H]2CCC[N@H+]2CCN2CCOCC2)nc1	ZINC000571902468	359671651	/nfs/dbraw/zinc/67/16/51/359671651.db2.gz	MWGVWMNKLCQMTQ-HNNXBMFYSA-N	1	0	261.369	1.551	50	0		CDAARO
CC(=O)NC1CCC([NH2+][C@@H]2Cc3ccccc3[C@H]2O)CC1	ZINC000187214651	359837920	/nfs/dbraw/zinc/83/79/20/359837920.db2.gz	DWBNMOFOBQCEQQ-GMGZGELVSA-N	1	0	288.391	1.682	50	0		CDAARO
COCCC[NH2+]C1(CC(=O)OC(C)(C)C)CCOCC1	ZINC000408524350	359933202	/nfs/dbraw/zinc/93/32/02/359933202.db2.gz	SQWCIEFOHQPQCY-UHFFFAOYSA-N	1	0	287.400	1.894	50	0		CDAARO
NNc1[nH+]cnc2nc(N3CCCCC3)sc21	ZINC000033268011	283533645	/nfs/dbraw/zinc/53/36/45/283533645.db2.gz	UMLQSBQDMDBBSV-UHFFFAOYSA-N	1	0	250.331	1.362	50	0		CDAARO
CCn1ccc(C(=O)N2CC[C@@H](n3c(C)c[nH+]c3C)C2)n1	ZINC000409420114	360223343	/nfs/dbraw/zinc/22/33/43/360223343.db2.gz	FLCLUBRIJHAVSP-CYBMUJFWSA-N	1	0	287.367	1.804	50	0		CDAARO
CC(=O)N1CC([N@@H+](CC(C)C)C2CCN(C)CC2)C1	ZINC000409419648	360227160	/nfs/dbraw/zinc/22/71/60/360227160.db2.gz	PIONNYDAEWRZRL-UHFFFAOYSA-N	1	0	267.417	1.269	50	0		CDAARO
[NH3+]C[C@H]1CN(C(=O)c2c(F)cccc2Cl)CCO1	ZINC000011887394	360400803	/nfs/dbraw/zinc/40/08/03/360400803.db2.gz	IQAAJVJITLDURQ-QMMMGPOBSA-N	1	0	272.707	1.279	50	0		CDAARO
Cn1c(CC[NH3+])nnc1SCc1cncs1	ZINC000426477814	360565381	/nfs/dbraw/zinc/56/53/81/360565381.db2.gz	ADMQITAHXQSDGJ-UHFFFAOYSA-N	1	0	255.372	1.065	50	0		CDAARO
COc1cc(F)ccc1CN1CCO[C@H](CC[NH3+])C1	ZINC000426502873	360677854	/nfs/dbraw/zinc/67/78/54/360677854.db2.gz	IXNASXWVZBPNBV-CYBMUJFWSA-N	1	0	268.332	1.384	50	0		CDAARO
C[C@@H](CCC(=O)N(C)CCc1cnn(C)c1)[NH+]1CCCC1	ZINC000426612243	360688585	/nfs/dbraw/zinc/68/85/85/360688585.db2.gz	DTUVBKOVKAFSHK-AWEZNQCLSA-N	1	0	292.427	1.686	50	0		CDAARO
Cc1ccc(C(=O)NCCc2ncc[nH]2)cc1OCC[NH3+]	ZINC000426653043	360693339	/nfs/dbraw/zinc/69/33/39/360693339.db2.gz	XPIFSMGYDXTWIS-UHFFFAOYSA-N	1	0	288.351	1.028	50	0		CDAARO
C[C@H](CCC(=O)N(C)Cc1cnn(C)c1)[NH+]1CCCC1	ZINC000426393087	360664157	/nfs/dbraw/zinc/66/41/57/360664157.db2.gz	UXXMKPFOYRGEJQ-CYBMUJFWSA-N	1	0	278.400	1.643	50	0		CDAARO
CCC1CC[NH+](CCNC(=O)N(C)Cc2ncc[nH]2)CC1	ZINC000426485741	360675424	/nfs/dbraw/zinc/67/54/24/360675424.db2.gz	MRCVWQBULFKTJG-UHFFFAOYSA-N	1	0	293.415	1.673	50	0		CDAARO
CC(C)[NH+]1CCN(C(=O)Cc2nc3ccccc3[nH]2)CC1	ZINC000426486139	360675658	/nfs/dbraw/zinc/67/56/58/360675658.db2.gz	ZBRAFNFPMMFIKJ-UHFFFAOYSA-N	1	0	286.379	1.658	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)Cc2ccccc2Br)C1	ZINC000178566908	189127487	/nfs/dbraw/zinc/12/74/87/189127487.db2.gz	XNXQZDXMRZFBPL-SNVBAGLBSA-N	1	0	297.196	1.799	50	0		CDAARO
Cc1cccc(C)c1OCC(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178586714	189128773	/nfs/dbraw/zinc/12/87/73/189128773.db2.gz	QOOKIPMRPKRHRX-ZDUSSCGKSA-N	1	0	262.353	1.489	50	0		CDAARO
Cc1ccc2[nH]c(CNC(=O)N3CC[C@H](C[NH3+])C3)nc2c1	ZINC000426727049	360699427	/nfs/dbraw/zinc/69/94/27/360699427.db2.gz	ZABNMEUSWPOMRL-LLVKDONJSA-N	1	0	287.367	1.362	50	0		CDAARO
CC[C@@H]1C[N@H+](C[C@H]2CCC=CO2)C[C@]2(CCOC2)O1	ZINC000370210039	360975485	/nfs/dbraw/zinc/97/54/85/360975485.db2.gz	MZDBLLRGRBFFPK-KFWWJZLASA-N	1	0	267.369	1.949	50	0		CDAARO
CO[C@@H]1C[NH2+][C@@H](C(=O)NC/C=C/c2ccccc2)C1	ZINC000189258643	361729193	/nfs/dbraw/zinc/72/91/93/361729193.db2.gz	ZDPJYFUCYOPUAH-VTDTZARESA-N	1	0	260.337	1.193	50	0		CDAARO
C[NH+](C)CCN(Cc1ccco1)C(=O)[C@@H]1CCCOC1	ZINC000088230009	364561205	/nfs/dbraw/zinc/56/12/05/364561205.db2.gz	IXOMVIKUISAPRO-CYBMUJFWSA-N	1	0	280.368	1.596	50	0		CDAARO
CC(C)C[C@H]1NC(=O)N(CCCn2ccnc2)C1=O	ZINC000015955483	364621472	/nfs/dbraw/zinc/62/14/72/364621472.db2.gz	JYEBAOFOKIQBJQ-LLVKDONJSA-N	1	0	264.329	1.240	50	0		CDAARO
COCc1cc(C(=O)N[C@@H](C)C2=CC[N@H+](C)CC2)no1	ZINC000272679959	365348393	/nfs/dbraw/zinc/34/83/93/365348393.db2.gz	KPLOEUDHVUSXQS-JTQLQIEISA-N	1	0	279.340	1.201	50	0		CDAARO
O=C1[C@H]([NH2+][C@@H]2CCC[C@H]3OCC[C@@H]32)CCN1C1CC1	ZINC000089598044	366880422	/nfs/dbraw/zinc/88/04/22/366880422.db2.gz	NSQUBYSQBRZJRW-AAVRWANBSA-N	1	0	264.369	1.297	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCCN1C(=O)c1cccc2c1OCO2	ZINC000122110682	366896161	/nfs/dbraw/zinc/89/61/61/366896161.db2.gz	QYJJZFYSRICRRD-JQWIXIFHSA-N	1	0	276.336	1.757	50	0		CDAARO
CN(CC(=O)NCC[NH2+]C(C)(C)C)c1ccccc1	ZINC000089661590	366904762	/nfs/dbraw/zinc/90/47/62/366904762.db2.gz	RULPIJPUQQZWNK-UHFFFAOYSA-N	1	0	263.385	1.627	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1CC(=O)NCc1ccccc1F	ZINC000089939093	366972863	/nfs/dbraw/zinc/97/28/63/366972863.db2.gz	RDWSYWSDMDXUJV-GFCCVEGCSA-N	1	0	279.359	1.078	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1Cc1csc(-c2ncccn2)n1	ZINC000089939309	366974017	/nfs/dbraw/zinc/97/40/17/366974017.db2.gz	ZNRJGDVYAAEWIG-NSHDSACASA-N	1	0	289.408	1.736	50	0		CDAARO
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1[NH2+]Cc1ncc[nH]1	ZINC000089948772	366976191	/nfs/dbraw/zinc/97/61/91/366976191.db2.gz	PTEMDDUWTYWSGN-STQMWFEESA-N	1	0	278.400	1.782	50	0		CDAARO
CNC(=O)NCC1([NH+]2CCSCC2)CCCCC1	ZINC000070057231	368702197	/nfs/dbraw/zinc/70/21/97/368702197.db2.gz	GLLRRMOCIYDOOZ-UHFFFAOYSA-N	1	0	271.430	1.667	50	0		CDAARO
CSc1ccccc1NC(=O)C[NH2+]C[C@@H](C)O	ZINC000003338900	369403261	/nfs/dbraw/zinc/40/32/61/369403261.db2.gz	KRUNWPAEWBIMNU-SECBINFHSA-N	1	0	254.355	1.317	50	0		CDAARO
Cc1nc(C)c(CCNC(=O)[C@@H]2CCC[NH2+][C@@H]2C)s1	ZINC000377565618	371583946	/nfs/dbraw/zinc/58/39/46/371583946.db2.gz	QQFZCBCMLLCBGL-BXKDBHETSA-N	1	0	281.425	1.807	50	0		CDAARO
O=C(Cc1ccsc1)N[C@H]1COC[C@@H]1[NH+]1CCCC1	ZINC000299782681	372759085	/nfs/dbraw/zinc/75/90/85/372759085.db2.gz	GFPAFGADNFMPKA-STQMWFEESA-N	1	0	280.393	1.270	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N1CC(Oc2ccc(F)cc2)C1	ZINC000299789846	372764296	/nfs/dbraw/zinc/76/42/96/372764296.db2.gz	AEHNQWGQWZDAHK-ZDUSSCGKSA-N	1	0	298.383	1.496	50	0		CDAARO
CCN(Cc1ccc(Cl)s1)C(=O)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000037800015	373339826	/nfs/dbraw/zinc/33/98/26/373339826.db2.gz	FDYUEXSHPWNZFT-PSASIEDQSA-N	1	0	288.800	1.473	50	0		CDAARO
CCN(Cc1ccc(OC)c(F)c1)C(=O)C[C@@H](C)[NH3+]	ZINC000037800696	373343080	/nfs/dbraw/zinc/34/30/80/373343080.db2.gz	ZUZRMROTDGDEQS-SNVBAGLBSA-N	1	0	268.332	1.920	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)Cc2c(F)cccc2F)C1	ZINC000095045480	373692834	/nfs/dbraw/zinc/69/28/34/373692834.db2.gz	VJTCIWOEUFOCAD-SECBINFHSA-N	1	0	254.280	1.315	50	0		CDAARO
C[C@H](O)c1ncc(C[NH2+][C@@H](CO)Cc2ccccc2)s1	ZINC000253427599	373734472	/nfs/dbraw/zinc/73/44/72/373734472.db2.gz	GGKGJNKEMWJMGD-WCQYABFASA-N	1	0	292.404	1.890	50	0		CDAARO
O=S(=O)(c1ccccc1)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000103986760	374158965	/nfs/dbraw/zinc/15/89/65/374158965.db2.gz	CCFPTESXTWVKDO-LBPRGKRZSA-N	1	0	266.366	1.155	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@H]1CCC[C@H]([NH3+])C1	ZINC000111668878	374198599	/nfs/dbraw/zinc/19/85/99/374198599.db2.gz	COFVBRSMGXOXRA-QWRGUYRKSA-N	1	0	267.398	1.927	50	0		CDAARO
C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccnn1C	ZINC000248949546	374278771	/nfs/dbraw/zinc/27/87/71/374278771.db2.gz	ZRCQNMKPCRFHNE-DZGCQCFKSA-N	1	0	298.390	1.670	50	0		CDAARO
CCc1noc(CC[NH2+][C@H](C)CC(C)(C)OC)n1	ZINC000670452916	483021893	/nfs/dbraw/zinc/02/18/93/483021893.db2.gz	MQYUOZNHYJXZTO-SNVBAGLBSA-N	1	0	255.362	1.968	50	0		CDAARO
C([NH2+]C(C1CC1)C1CC1)[C@@H]([C@H]1CCOC1)N1CCOCC1	ZINC000095420024	374921539	/nfs/dbraw/zinc/92/15/39/374921539.db2.gz	JTLKXOXAKRTJTO-HOTGVXAUSA-N	1	0	294.439	1.502	50	0		CDAARO
CCCCN(C)C(=O)c1ccnc(OCC[NH+](C)C)c1	ZINC000095453087	374952222	/nfs/dbraw/zinc/95/22/22/374952222.db2.gz	NQWWAKXMZBJKSZ-UHFFFAOYSA-N	1	0	279.384	1.894	50	0		CDAARO
CC(=O)N1CCC(Nc2ccc(C)[nH+]c2N(C)C)CC1	ZINC000095988526	375048507	/nfs/dbraw/zinc/04/85/07/375048507.db2.gz	RBXLILVEEQCBND-UHFFFAOYSA-N	1	0	276.384	1.879	50	0		CDAARO
COc1ccc2c(c1)C[C@@H]([NH2+]CC(C)(C)C(N)=O)CC2	ZINC000097084673	375146989	/nfs/dbraw/zinc/14/69/89/375146989.db2.gz	WXMXAVIFEQWYPW-ZDUSSCGKSA-N	1	0	276.380	1.654	50	0		CDAARO
Cc1ccc(CC(=O)N2CCC[C@H]([C@H](C)[NH3+])C2)cn1	ZINC000299738820	375199593	/nfs/dbraw/zinc/19/95/93/375199593.db2.gz	GWEGYSOPVGKASS-JSGCOSHPSA-N	1	0	261.369	1.518	50	0		CDAARO
CC(C)c1nn(C)c(N(C)C)c1C[NH2+][C@H]1CCCN(C)C1	ZINC000058428412	375757130	/nfs/dbraw/zinc/75/71/30/375757130.db2.gz	XXIRMLPUZRMQTM-ZDUSSCGKSA-N	1	0	293.459	1.793	50	0		CDAARO
CS[C@H](C)C(=O)N1CCC(C[NH+]2CCN(C)CC2)CC1	ZINC000057066502	375811139	/nfs/dbraw/zinc/81/11/39/375811139.db2.gz	CDMOLSIZRGOBNP-CYBMUJFWSA-N	1	0	299.484	1.224	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]C1)N1CCC(Cc2cccnc2)CC1	ZINC000335566450	375822902	/nfs/dbraw/zinc/82/29/02/375822902.db2.gz	AVDWMCUWWGJKPC-MRXNPFEDSA-N	1	0	287.407	1.862	50	0		CDAARO
C[C@@H]1CCCN(C(=O)/C=C\c2cncc(F)c2)[C@H]1C[NH3+]	ZINC000606441565	375823294	/nfs/dbraw/zinc/82/32/94/375823294.db2.gz	ZFISHVYAGOMTPU-VRLOJBFMSA-N	1	0	277.343	1.820	50	0		CDAARO
C[NH+](C)CCCNC(=O)C(=O)Nc1ccc2cc[nH]c2c1	ZINC000032073953	375876549	/nfs/dbraw/zinc/87/65/49/375876549.db2.gz	BZKQCJBXGSKVKL-UHFFFAOYSA-N	1	0	288.351	1.174	50	0		CDAARO
O=C(c1ccncc1)c1ccc(N2CC[NH2+]CC2)cc1	ZINC000004245561	375937853	/nfs/dbraw/zinc/93/78/53/375937853.db2.gz	NAFDVQJXEURGEX-UHFFFAOYSA-N	1	0	267.332	1.722	50	0		CDAARO
COC(=O)[C@@H]1[C@@H]2CCC[N@@H+]2C2(CCCCC2)[C@H]1C(=O)OC	ZINC000239433776	376017601	/nfs/dbraw/zinc/01/76/01/376017601.db2.gz	YLAUEXHRCZFZSL-YNEHKIRRSA-N	1	0	295.379	1.746	50	0		CDAARO
C[C@H](C[NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)[S@](C)=O	ZINC000242100107	376021425	/nfs/dbraw/zinc/02/14/25/376021425.db2.gz	WEIYYPXDJDGTLF-WUILDGTKSA-N	1	0	271.426	1.691	50	0		CDAARO
Cc1nc(CC[NH3+])cc(N(Cc2nccn2C)C2CC2)n1	ZINC000067740582	377235676	/nfs/dbraw/zinc/23/56/76/377235676.db2.gz	BJKSFXRMLMRAEU-UHFFFAOYSA-N	1	0	286.383	1.189	50	0		CDAARO
Cc1cc(C)nc(N2CCOC3(CC[NH+](C)CC3)C2)n1	ZINC000645385502	377240605	/nfs/dbraw/zinc/24/06/05/377240605.db2.gz	XFNIHUMRZOYHIC-UHFFFAOYSA-N	1	0	276.384	1.394	50	0		CDAARO
CN(CC(F)(F)F)C(=O)C[N@H+](CCO)C1CCCCC1	ZINC000089340123	377833388	/nfs/dbraw/zinc/83/33/88/377833388.db2.gz	SPJUMKXOKTYAIC-UHFFFAOYSA-N	1	0	296.333	1.634	50	0		CDAARO
COC(=O)CC1(NCc2ccco2)CC[NH+](C)CC1	ZINC000089375167	377846612	/nfs/dbraw/zinc/84/66/12/377846612.db2.gz	GPLZNOXIIIJPTL-UHFFFAOYSA-N	1	0	266.341	1.397	50	0		CDAARO
COc1ccccc1OC[C@@H](O)C[NH2+]CC(C)C	ZINC000016650641	378200632	/nfs/dbraw/zinc/20/06/32/378200632.db2.gz	ATVFDNXXPBKULZ-LBPRGKRZSA-N	1	0	253.342	1.681	50	0		CDAARO
COC1CCN(C(=O)C2CC[NH+](C(C)C)CC2)CC1	ZINC000344336212	379499704	/nfs/dbraw/zinc/49/97/04/379499704.db2.gz	MPWYSQZGCQUCMG-UHFFFAOYSA-N	1	0	268.401	1.744	50	0		CDAARO
Cc1nn(C)c(C)c1C[NH2+][C@@H]([C@H](CO)C1CC1)C1CC1	ZINC000449498944	250880149	/nfs/dbraw/zinc/88/01/49/250880149.db2.gz	BVDMEIBAEOZKKX-HZPDHXFCSA-N	1	0	277.412	1.924	50	0		CDAARO
CCN(CCC[NH+]1CCCC1)C(=O)[C@@H]1CCCN1C(C)=O	ZINC000239654302	284893494	/nfs/dbraw/zinc/89/34/94/284893494.db2.gz	BNKBLUPZIMKSAR-HNNXBMFYSA-N	1	0	295.427	1.332	50	0		CDAARO
O=C(N[C@@H]1CCSc2ccc(F)cc21)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000037018186	390204244	/nfs/dbraw/zinc/20/42/44/390204244.db2.gz	ZBODSPGPEBUNET-WCQGTBRESA-N	1	0	296.367	1.202	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)c2cnc(-c3ccccc3)nc2)C1	ZINC000178589254	390793999	/nfs/dbraw/zinc/79/39/99/390793999.db2.gz	ANMRQONBMGSGLJ-LBPRGKRZSA-N	1	0	282.347	1.564	50	0		CDAARO
Cc1ccccc1[C@@H]1C[C@@H]1C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188443250	390957987	/nfs/dbraw/zinc/95/79/87/390957987.db2.gz	GAPDQLJWCSOKMW-SNPRPXQTSA-N	1	0	258.365	1.919	50	0		CDAARO
FC(F)(F)c1nnc(N2CCC[NH2+]CC2)s1	ZINC000096034519	390912076	/nfs/dbraw/zinc/91/20/76/390912076.db2.gz	SOEBDXCZEZDYPC-UHFFFAOYSA-N	1	0	252.265	1.357	50	0		CDAARO
COC(=O)CC(C)(C)CC(=O)N1[C@H](C)C[N@@H+](C)C[C@@H]1C	ZINC000096492980	533297504	/nfs/dbraw/zinc/29/75/04/533297504.db2.gz	AQKBDOJZJXOIAK-TXEJJXNPSA-N	1	0	284.400	1.517	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@@H](c2ccccc2)C[C@]12NC(=O)NC2=O	ZINC000245380735	391345722	/nfs/dbraw/zinc/34/57/22/391345722.db2.gz	JIVUQMZFYBMAHJ-HCKVZZMMSA-N	1	0	273.336	1.278	50	0		CDAARO
Cc1cc2c(cc1C)O[C@H](C(=O)N(C)[C@H]1CC[NH2+]C1)C2	ZINC000179125552	292004555	/nfs/dbraw/zinc/00/45/55/292004555.db2.gz	DAWQPENOCVVXBI-ZFWWWQNUSA-N	1	0	274.364	1.427	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC000269172518	132124825	/nfs/dbraw/zinc/12/48/25/132124825.db2.gz	JUTKEDZZCQGLRF-TUKIKUTGSA-N	1	0	276.355	1.997	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)C2(c3ccccc3F)CC2)C1	ZINC000269188335	132127502	/nfs/dbraw/zinc/12/75/02/132127502.db2.gz	UVHKUNGUJMVYAN-LBPRGKRZSA-N	1	0	276.355	1.925	50	0		CDAARO
C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NS(=O)(=O)CCCF	ZINC000195539362	393279952	/nfs/dbraw/zinc/27/99/52/393279952.db2.gz	OBEDVIDFJCQIIR-UPJWGTAASA-N	1	0	294.436	1.632	50	0		CDAARO
[NH3+][C@H]1CC[C@@H](C(=O)N2CCN(c3ccc(O)cc3)CC2)C1	ZINC000091546290	135072293	/nfs/dbraw/zinc/07/22/93/135072293.db2.gz	LOVTUSVNAOKKRV-OLZOCXBDSA-N	1	0	289.379	1.168	50	0		CDAARO
C[NH+](C)CCn1nnnc1SCCc1ccccc1	ZINC000096430138	397864595	/nfs/dbraw/zinc/86/45/95/397864595.db2.gz	QIJAGEGIHBOSLB-UHFFFAOYSA-N	1	0	277.397	1.570	50	0		CDAARO
Cc1c(NC(=O)C[C@H]([NH3+])c2ccccc2)cnn1C	ZINC000178815287	148090368	/nfs/dbraw/zinc/09/03/68/148090368.db2.gz	MPBPJAQMTWFCJM-LBPRGKRZSA-N	1	0	258.325	1.757	50	0		CDAARO
C[C@H]1C[C@@H](C[NH3+])CN1C(=O)c1cccc2cn[nH]c21	ZINC000262070635	149008956	/nfs/dbraw/zinc/00/89/56/149008956.db2.gz	WUXBFPXEJRFMIB-UWVGGRQHSA-N	1	0	258.325	1.372	50	0		CDAARO
COc1ccc([N+]2=C3CCCCN3C[C@@]2(C)O)cc1	ZINC000013152690	286325105	/nfs/dbraw/zinc/32/51/05/286325105.db2.gz	LLSHJOHYVPCTPY-OAHLLOKOSA-N	1	0	261.345	1.819	50	0		CDAARO
COCCCNC(=O)[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1C	ZINC000034938544	292362443	/nfs/dbraw/zinc/36/24/43/292362443.db2.gz	RIQBSKGFCAYSLS-RWMBFGLXSA-N	1	0	256.390	1.696	50	0		CDAARO
CC(=O)c1ccc2c(c1)CC[N@@H+](CCOCCO)CC2	ZINC000374326120	160274213	/nfs/dbraw/zinc/27/42/13/160274213.db2.gz	FBFCSIUVFMLGHX-UHFFFAOYSA-N	1	0	277.364	1.299	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)c1cccc2c1OCO2	ZINC000122111179	286923306	/nfs/dbraw/zinc/92/33/06/286923306.db2.gz	QYJJZFYSRICRRD-ZYHUDNBSSA-N	1	0	276.336	1.757	50	0		CDAARO
CC[NH+](CC)CCN1C(=O)[C@@H]2CC=C(Cl)C[C@H]2C1=O	ZINC000004772174	170014670	/nfs/dbraw/zinc/01/46/70/170014670.db2.gz	ZHKYUMGEZLEDND-VXGBXAGGSA-N	1	0	284.787	1.846	50	0		CDAARO
COC[C@@H](C)[NH2+]Cc1cc2c(c(OC)c1)OCO2	ZINC000004997035	170052134	/nfs/dbraw/zinc/05/21/34/170052134.db2.gz	UMVNCRDEPAFGAI-SECBINFHSA-N	1	0	253.298	1.548	50	0		CDAARO
O=C1NCCCC[C@H]1[NH2+][C@@H]1CCc2ccccc2C1	ZINC000008556084	170340229	/nfs/dbraw/zinc/34/02/29/170340229.db2.gz	IIXXQBNVBPXGSJ-HUUCEWRRSA-N	1	0	258.365	1.802	50	0		CDAARO
[NH3+]CCc1nc(COc2ccccc2Cl)no1	ZINC000019786260	170865115	/nfs/dbraw/zinc/86/51/15/170865115.db2.gz	DBMOLCBTYWAVGG-UHFFFAOYSA-N	1	0	253.689	1.803	50	0		CDAARO
CC(C)C[N@@H+]1CCN(Cc2ccc(CO)o2)C[C@@H]1CCO	ZINC000020910376	171278866	/nfs/dbraw/zinc/27/88/66/171278866.db2.gz	YPRFIFCEQQMYLW-AWEZNQCLSA-N	1	0	296.411	1.297	50	0		CDAARO
C[NH+](C)CCNC(=O)COc1ccc2ccccc2c1	ZINC000022184653	171372020	/nfs/dbraw/zinc/37/20/20/171372020.db2.gz	JFQLBXNCFQPURN-UHFFFAOYSA-N	1	0	272.348	1.896	50	0		CDAARO
CCOC(=O)[C@@H](C[NH3+])c1cc(OC)cc(OC)c1	ZINC000035287633	172106021	/nfs/dbraw/zinc/10/60/21/172106021.db2.gz	ZDONKCSFWYYZKE-LBPRGKRZSA-N	1	0	253.298	1.309	50	0		CDAARO
C[C@@H]1CSC[C@H]1[NH2+][C@H]1CCCN(c2ccn(C)n2)C1=O	ZINC000285118288	196199861	/nfs/dbraw/zinc/19/98/61/196199861.db2.gz	NBAXENSERLTGBO-GRYCIOLGSA-N	1	0	294.424	1.257	50	0		CDAARO
COc1ccccc1[C@@H]1C[C@@H]1C(=O)N1CC[NH2+]CC1	ZINC000038478361	174142081	/nfs/dbraw/zinc/14/20/81/174142081.db2.gz	GHTGTRWTBIXSFW-STQMWFEESA-N	1	0	260.337	1.231	50	0		CDAARO
Fc1cccc(-c2noc(CN3CC[NH2+]CC3)n2)c1	ZINC000045795883	175384065	/nfs/dbraw/zinc/38/40/65/175384065.db2.gz	IWNUVWQZZBAWNM-UHFFFAOYSA-N	1	0	262.288	1.281	50	0		CDAARO
[NH3+]CC(=O)N1CCC[C@@H](CCc2ccccc2F)C1	ZINC000071662917	176242656	/nfs/dbraw/zinc/24/26/56/176242656.db2.gz	DGKQCAMFWOMLOW-LBPRGKRZSA-N	1	0	264.344	1.956	50	0		CDAARO
O=C1N(Cc2ccccc2F)CCC[C@@]12CC[NH2+]C2	ZINC000072128132	176321208	/nfs/dbraw/zinc/32/12/08/176321208.db2.gz	NOUPDKOEUMINCV-HNNXBMFYSA-N	1	0	262.328	1.928	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)CCc2nc3ccccc3[nH]2)CC1	ZINC000072171138	176332814	/nfs/dbraw/zinc/33/28/14/176332814.db2.gz	LYZXTVMAUVKFRK-LBPRGKRZSA-N	1	0	286.379	1.835	50	0		CDAARO
COc1cc(C)ccc1OCC[N@@H+]1CCOC[C@@H](CO)C1	ZINC000077341125	177254682	/nfs/dbraw/zinc/25/46/82/177254682.db2.gz	XLJGUSVHFWOQHP-CQSZACIVSA-N	1	0	295.379	1.323	50	0		CDAARO
Cc1cc(C[NH2+][C@@H](C2CC2)[C@]2(CO)CCCO2)ccn1	ZINC000527539137	270697523	/nfs/dbraw/zinc/69/75/23/270697523.db2.gz	JFVBYYMACZUXCD-JKSUJKDBSA-N	1	0	276.380	1.800	50	0		CDAARO
CCN1C(=O)C[C@H]([NH+]2CCC(c3ccncc3)CC2)C1=O	ZINC000019890231	273649236	/nfs/dbraw/zinc/64/92/36/273649236.db2.gz	ATCFRWLXYNXCBB-AWEZNQCLSA-N	1	0	287.363	1.408	50	0		CDAARO
CCc1cc(N2CC[NH2+]CC2)n2nc(C)c(C)c2n1	ZINC000072480807	273768202	/nfs/dbraw/zinc/76/82/02/273768202.db2.gz	XXOFHZLKLRYCEN-UHFFFAOYSA-N	1	0	259.357	1.318	50	0		CDAARO
CC(C)c1n[nH]c2c1CN(C(=O)CC[NH+]1CCCC1)CC2	ZINC000243901223	275759212	/nfs/dbraw/zinc/75/92/12/275759212.db2.gz	AZZAVEFCTNNZRR-UHFFFAOYSA-N	1	0	290.411	1.904	50	0		CDAARO
CCN1c2cc(Cl)ccc2C(=O)NC12CC[NH2+]CC2	ZINC000067172755	276254408	/nfs/dbraw/zinc/25/44/08/276254408.db2.gz	BDIDRLKQXHIZRA-UHFFFAOYSA-N	1	0	279.771	1.989	50	0		CDAARO
CN(C)S(=O)(=O)C[C@@H](CCc1ccccc1)[NH+](C)C	ZINC000045069189	276851012	/nfs/dbraw/zinc/85/10/12/276851012.db2.gz	VIBIFBZVAWKQPI-CQSZACIVSA-N	1	0	284.425	1.441	50	0		CDAARO
CN1CCC([NH2+][C@@H]2CC(=O)N(C3CCCCCC3)C2)CC1	ZINC000012704195	277031270	/nfs/dbraw/zinc/03/12/70/277031270.db2.gz	OGMSHHZXRPJFSN-OAHLLOKOSA-N	1	0	293.455	1.994	50	0		CDAARO
CN1CC[C@@H]([N@@H+]2CCN(C)c3ccccc3C2)C1=O	ZINC000083881718	277135488	/nfs/dbraw/zinc/13/54/88/277135488.db2.gz	WXTZYJZNJFCSQW-CQSZACIVSA-N	1	0	259.353	1.169	50	0		CDAARO
COc1cccc(CNN(C)C)c1OCCC[NH+](C)C	ZINC000067603376	277454734	/nfs/dbraw/zinc/45/47/34/277454734.db2.gz	OSXRQMLLSONWBX-UHFFFAOYSA-N	1	0	281.400	1.592	50	0		CDAARO
COCc1nc2n(n1)CCC[C@H]2[NH2+]C1CCSCC1	ZINC000089420438	277615142	/nfs/dbraw/zinc/61/51/42/277615142.db2.gz	RKPHJWIBOZWZJO-LLVKDONJSA-N	1	0	282.413	1.745	50	0		CDAARO
COc1cccc2c1CC[N@H+](CC1OCCO1)CC2	ZINC000193708771	278027364	/nfs/dbraw/zinc/02/73/64/278027364.db2.gz	NFOKHQNCEPRBFY-UHFFFAOYSA-N	1	0	263.337	1.469	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C(=O)N[C@H]2COc3ccccc32)C1	ZINC000253149981	278570240	/nfs/dbraw/zinc/57/02/40/278570240.db2.gz	DKYQLPWUCFUVGM-WXHSDQCUSA-N	1	0	260.337	1.624	50	0		CDAARO
CC[NH+](CC)CCN1c2ccccc2[C@H](NC(C)=O)C1=O	ZINC000019877162	279104897	/nfs/dbraw/zinc/10/48/97/279104897.db2.gz	YXWTVIXRNPWMIS-HNNXBMFYSA-N	1	0	289.379	1.552	50	0		CDAARO
Cc1cc(F)ccc1C[NH2+]C[C@@H]1CN(C)CCO1	ZINC000105470862	280531286	/nfs/dbraw/zinc/53/12/86/280531286.db2.gz	ZEOXQFBITNPGOP-CQSZACIVSA-N	1	0	252.333	1.554	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C[C@H]1COc2ccccc2O1	ZINC000036864718	281768953	/nfs/dbraw/zinc/76/89/53/281768953.db2.gz	RQUUKTVSUDOJHA-LBPRGKRZSA-N	1	0	273.336	1.956	50	0		CDAARO
C[C@@H]1CN(C(=O)/C=C\c2ccc3c(c2)CCO3)C[C@H](C)[NH2+]1	ZINC000255145249	289358789	/nfs/dbraw/zinc/35/87/89/289358789.db2.gz	DEKQJCJFGBWWME-RWBPYIHSSA-N	1	0	286.375	1.844	50	0		CDAARO
Cc1cc(CC(=O)N2CC[NH+](CC3CC3)CC2)on1	ZINC000553021386	290090054	/nfs/dbraw/zinc/09/00/54/290090054.db2.gz	MIBCDJGYHVNOBX-UHFFFAOYSA-N	1	0	263.341	1.080	50	0		CDAARO
C[C@H](c1ccccc1)N1C(=[NH2+])S[C@@H]2CS(=O)(=O)C[C@@H]21	ZINC000227121254	290254615	/nfs/dbraw/zinc/25/46/15/290254615.db2.gz	VPTURGDGEBLVCX-ADEWGFFLSA-N	1	0	296.417	1.897	50	0		CDAARO
COc1ccc([C@@H]([NH2+]C2CCOCC2)[C@H]2C[C@@H](O)C2)cn1	ZINC000244718831	295215966	/nfs/dbraw/zinc/21/59/66/295215966.db2.gz	LRPHSNSGOSGIRH-IVMMDQJWSA-N	1	0	292.379	1.671	50	0		CDAARO
CC[N@H+](C)[C@H](C)CCNC(=O)N(C)Cc1ncc[nH]1	ZINC000534586262	328315602	/nfs/dbraw/zinc/31/56/02/328315602.db2.gz	JSTSCBCDPIRKPK-LLVKDONJSA-N	1	0	267.377	1.281	50	0		CDAARO
CNc1nc(C(=O)N[C@@H](C)c2nc(C)c[nH]2)cs1	ZINC000534590118	328317743	/nfs/dbraw/zinc/31/77/43/328317743.db2.gz	PFZLWGZDXXAHOP-ZETCQYMHSA-N	1	0	265.342	1.129	50	0		CDAARO
c1cnc(NC[C@@H]2CC[N@@H+](C3CCCCC3)C2)cn1	ZINC000534590244	328317851	/nfs/dbraw/zinc/31/78/51/328317851.db2.gz	ATFTUVWXQZHMKE-ZDUSSCGKSA-N	1	0	260.385	1.965	50	0		CDAARO
O=C(NCc1cccnc1)c1cc(C2CC[NH2+]CC2)ccn1	ZINC000534656706	328340106	/nfs/dbraw/zinc/34/01/06/328340106.db2.gz	KHEAFNKZPSLYHZ-UHFFFAOYSA-N	1	0	296.374	1.874	50	0		CDAARO
CCc1nc(CC[NH2+][C@H](C)Cn2cncn2)cs1	ZINC000534666174	328345446	/nfs/dbraw/zinc/34/54/46/328345446.db2.gz	FAJAMIOICCPCTF-SNVBAGLBSA-N	1	0	265.386	1.518	50	0		CDAARO
CCC[C@@H](CNc1cncc(N(C)C)n1)[NH+](C)C	ZINC000534667046	328345796	/nfs/dbraw/zinc/34/57/96/328345796.db2.gz	UDNDJLQNHIVVHO-NSHDSACASA-N	1	0	251.378	1.685	50	0		CDAARO
O=C(Nc1ccn(CC(F)F)n1)[C@H](C1CC1)[NH+]1CCCC1	ZINC000097376278	323208138	/nfs/dbraw/zinc/20/81/38/323208138.db2.gz	VRAIZWQBHZKQGE-ZDUSSCGKSA-N	1	0	298.337	1.961	50	0		CDAARO
CC1(C)CCCC[C@@H]1[NH2+]CCCN1C(=O)CNC1=O	ZINC000119984360	323208623	/nfs/dbraw/zinc/20/86/23/323208623.db2.gz	CEQZUVWTCGZTGX-NSHDSACASA-N	1	0	267.373	1.487	50	0		CDAARO
O=C(Nc1ccn(Cc2ccccc2)n1)[C@@H]1CCC[NH2+]C1	ZINC000195187567	323562969	/nfs/dbraw/zinc/56/29/69/323562969.db2.gz	MBAAKVSNRWBMNH-CQSZACIVSA-N	1	0	284.363	1.870	50	0		CDAARO
CC(C)[C@@H](CCO)[NH2+]CC(=O)N1C[C@H](C)C[C@@H](C)C1	ZINC000195563992	336056092	/nfs/dbraw/zinc/05/60/92/336056092.db2.gz	IXQGBRHOVLBGMG-MGPQQGTHSA-N	1	0	270.417	1.488	50	0		CDAARO
Cc1ccc(NC(=O)N2C[C@@H]3C[NH2+]C[C@@]3(CO)C2)cc1	ZINC001772711034	1159445457	/nfs/dbraw/zinc/44/54/57/1159445457.db2.gz	VVYLQHTXASLBOH-WFASDCNBSA-N	1	0	275.352	1.041	50	0		CDAARO
CSC[C@H](C)CNC(=O)N(C)[C@@H]1CC[N@H+](C)C[C@@H]1C	ZINC000108099888	482449674	/nfs/dbraw/zinc/44/96/74/482449674.db2.gz	KHKSNNYKWADIFF-FRRDWIJNSA-N	1	0	287.473	1.967	50	0		CDAARO
CC(C)OCC(=O)N1C[C@H]2CCC[C@@H](C1)[N@H+](C)C2	ZINC000670445455	482993277	/nfs/dbraw/zinc/99/32/77/482993277.db2.gz	MUGBFMNSJBAIRB-STQMWFEESA-N	1	0	254.374	1.354	50	0		CDAARO
CC[N@H+](C)[C@@H](C)C(=O)N(C)Cc1cc(C)cc(C)n1	ZINC000670444966	482994114	/nfs/dbraw/zinc/99/41/14/482994114.db2.gz	FSSBEHHTOARGJY-ZDUSSCGKSA-N	1	0	263.385	1.997	50	0		CDAARO
C[N@H+](CCn1cnnc1)Cc1ccc2c(c1)OCO2	ZINC000670458266	483039822	/nfs/dbraw/zinc/03/98/22/483039822.db2.gz	MHSFMMMZPBBATA-UHFFFAOYSA-N	1	0	260.297	1.139	50	0		CDAARO
O=c1c2cc(Cl)ccc2ncn1C[C@@H]1CC[NH2+]C[C@H]1O	ZINC000670468723	483062213	/nfs/dbraw/zinc/06/22/13/483062213.db2.gz	NTYXZODYIPSVDA-TVQRCGJNSA-N	1	0	293.754	1.020	50	0		CDAARO
C[NH+](C)CCc1nnc(NC(=O)[C@@H]2CC=CCC2)s1	ZINC001506427424	1160723227	/nfs/dbraw/zinc/72/32/27/1160723227.db2.gz	LGPFNBZXRAUJQA-SNVBAGLBSA-N	1	0	280.397	1.937	50	0		CDAARO
C[NH+](C)CC[C@H]1CN(C(=O)c2ccc(F)cc2F)CCO1	ZINC000012093921	517902248	/nfs/dbraw/zinc/90/22/48/517902248.db2.gz	PUWJPPDNRQJJIQ-LBPRGKRZSA-N	1	0	298.333	1.758	50	0		CDAARO
C[N@@H+]1CC[C@H](NC(=O)C(F)F)[C@H]1c1ccccc1	ZINC000248823177	523983642	/nfs/dbraw/zinc/98/36/42/523983642.db2.gz	YTLVKVDVNPNSIH-WDEREUQCSA-N	1	0	254.280	1.813	50	0		CDAARO
CC[C@@H]1CN(C(=O)NCC[N@H+](C)C(C)C)CCS1	ZINC000096439889	529366891	/nfs/dbraw/zinc/36/68/91/529366891.db2.gz	OHLZLADTCIOJDT-GFCCVEGCSA-N	1	0	273.446	1.864	50	0		CDAARO
CC1(C)C[C@@H](c2nccn2CCn2cnnc2)CCO1	ZINC000072421086	567901923	/nfs/dbraw/zinc/90/19/23/567901923.db2.gz	ZAYYCNXFKGHAJV-LBPRGKRZSA-N	1	0	275.356	1.847	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN(c2cccc(N)[nH+]2)CC1	ZINC000071788752	567902154	/nfs/dbraw/zinc/90/21/54/567902154.db2.gz	AZMGCCTVXYWFDJ-UHFFFAOYSA-N	1	0	278.356	1.721	50	0		CDAARO
CC(C)[NH+](CC(=O)N[C@@H](C)C(=O)N1CCCCC1)C(C)C	ZINC000097048563	567903515	/nfs/dbraw/zinc/90/35/15/567903515.db2.gz	XLBIGLKDKZXMFS-AWEZNQCLSA-N	1	0	297.443	1.622	50	0		CDAARO
O=C(N1CCOCC1)C12CC(C1)C[N@@H+]2Cc1ccccc1	ZINC000097124363	567904700	/nfs/dbraw/zinc/90/47/00/567904700.db2.gz	SYRWTAOWZVSWHC-UHFFFAOYSA-N	1	0	286.375	1.510	50	0		CDAARO
COc1cc(F)ccc1C[N@H+](C)[C@@H](C)CC(N)=O	ZINC000952982806	617197716	/nfs/dbraw/zinc/19/77/16/617197716.db2.gz	MPIJKGQMYVLYGH-VIFPVBQESA-N	1	0	254.305	1.530	50	0		CDAARO
COc1ccc(F)c(C[NH2+]CCN2CCC[C@H](CO)C2)c1	ZINC000952972888	617264369	/nfs/dbraw/zinc/26/43/69/617264369.db2.gz	HCUBPNPNLLRIDR-ZDUSSCGKSA-N	1	0	296.386	1.628	50	0		CDAARO
CCN(C[C@@H]1CC[N@H+](CC)C1)C(=O)CCn1ccnc1C	ZINC000952981557	615203841	/nfs/dbraw/zinc/20/38/41/615203841.db2.gz	ISCWNFGIRWFMAZ-OAHLLOKOSA-N	1	0	292.427	1.772	50	0		CDAARO
CC(C)(C)c1cc(CNc2nnc(C(C)(C)[NH3+])o2)[nH]n1	ZINC001772703481	1159439106	/nfs/dbraw/zinc/43/91/06/1159439106.db2.gz	XMQVZQNQUUYRBJ-UHFFFAOYSA-N	1	0	278.360	1.896	50	0		CDAARO
CCc1cnc(N)nc1NC[C@H]1CC2(CO1)CC[NH2+]CC2	ZINC001772705437	1159439984	/nfs/dbraw/zinc/43/99/84/1159439984.db2.gz	YWVPNKPXSZJBGY-GFCCVEGCSA-N	1	0	291.399	1.192	50	0		CDAARO
Cc1ccc(NC(=O)N2C[C@H]3C[NH2+]C[C@]3(CO)C2)cc1	ZINC001772711031	1159445166	/nfs/dbraw/zinc/44/51/66/1159445166.db2.gz	VVYLQHTXASLBOH-IUODEOHRSA-N	1	0	275.352	1.041	50	0		CDAARO
Cc1nccc(N2CCN(C)C3(CC[NH+](C)CC3)C2)n1	ZINC001704304243	1177681761	/nfs/dbraw/zinc/68/17/61/1177681761.db2.gz	PPKNWYLCCMLTNJ-UHFFFAOYSA-N	1	0	275.400	1.001	50	0		CDAARO
CCCCCOCC(=O)N1CCC([NH+]2CCOCC2)CC1	ZINC000585123949	1164210361	/nfs/dbraw/zinc/21/03/61/1164210361.db2.gz	SFKDXNVWKSOQDG-UHFFFAOYSA-N	1	0	298.427	1.516	50	0		CDAARO
Cc1cc2c(c(-c3cc(C(N)=O)ccn3)c1)O[C@H](C[NH3+])C2	ZINC000067640975	784325887	/nfs/dbraw/zinc/32/58/87/784325887.db2.gz	JCBDXQRAWQLXGE-LBPRGKRZSA-N	1	0	283.331	1.418	50	0		CDAARO
O=C1COC[C@@H]2C[NH2+]CC[C@@H]2N1Cc1ccccc1	ZINC000306591081	786936743	/nfs/dbraw/zinc/93/67/43/786936743.db2.gz	VIDQLCPBPXTUGA-KBPBESRZSA-N	1	0	260.337	1.024	50	0		CDAARO
CC(C)OC(=O)CC[NH2+]Cc1ccccc1-n1cncn1	ZINC000952849887	910405595	/nfs/dbraw/zinc/40/55/95/910405595.db2.gz	SOJCLXRFGKWDBG-UHFFFAOYSA-N	1	0	288.351	1.699	50	0		CDAARO
Cc1ccnc(C[C@@H]2CC[C@H](C[N@@H+]3CCCOCC3)O2)n1	ZINC000952854554	910409889	/nfs/dbraw/zinc/40/98/89/910409889.db2.gz	DSHMCENPJJYJPA-LSDHHAIUSA-N	1	0	291.395	1.597	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)N[C@@H]1c2ccccc2C[C@@H]1O	ZINC000952868054	910461987	/nfs/dbraw/zinc/46/19/87/910461987.db2.gz	ASZSRIRFZYJAIM-DOTOQJQBSA-N	1	0	288.391	1.637	50	0		CDAARO
CO[C@H]1CN(C(=O)c2cccc3nc(C)[nH]c32)CC[C@H]1[NH3+]	ZINC000071761312	936648361	/nfs/dbraw/zinc/64/83/61/936648361.db2.gz	HZCFNMMFOFJTTR-YPMHNXCESA-N	1	0	288.351	1.060	50	0		CDAARO
C[C@H](CS(C)(=O)=O)[NH2+]Cc1ccc2nsnc2c1	ZINC000821381928	925580414	/nfs/dbraw/zinc/58/04/14/925580414.db2.gz	NEZNREPDUZJRQT-MRVPVSSYSA-N	1	0	285.394	1.214	50	0		CDAARO
CC[N@@H+]1CC[C@H](CN(C)S(=O)(=O)CC2CCCC2)C1	ZINC000823104883	925672406	/nfs/dbraw/zinc/67/24/06/925672406.db2.gz	AMRPGXFNRSPXAO-CQSZACIVSA-N	1	0	288.457	1.780	50	0		CDAARO
COc1ncc(C[N@@H+]2CC[C@H](O)CC(C)(C)C2)cn1	ZINC000824852230	925840459	/nfs/dbraw/zinc/84/04/59/925840459.db2.gz	XOXYGXOZQHPUOC-LBPRGKRZSA-N	1	0	265.357	1.468	50	0		CDAARO
Cc1nc(C(C)(C)[NH3+])n(-c2ccc3c(c2)OCO3)n1	ZINC000825290820	925863132	/nfs/dbraw/zinc/86/31/32/925863132.db2.gz	OOZLYMDHKOUSMQ-UHFFFAOYSA-N	1	0	260.297	1.498	50	0		CDAARO
CC(C)(C)n1nc(-c2ccco2)nc1[C@@H]1C[C@@H](O)C[NH2+]1	ZINC000828901680	926202947	/nfs/dbraw/zinc/20/29/47/926202947.db2.gz	LRIGIFBXOXVZJV-ZJUUUORDSA-N	1	0	276.340	1.688	50	0		CDAARO
CCNC(=O)N1CC([N@@H+](Cc2ccncc2)CC2CC2)C1	ZINC000581776472	927193865	/nfs/dbraw/zinc/19/38/65/927193865.db2.gz	TVKWCSNSBFNARF-UHFFFAOYSA-N	1	0	288.395	1.707	50	0		CDAARO
CC(C)NC(=O)[C@@]1(CCO)CC[N@H+](Cc2ccccc2)C1	ZINC000581811536	927201810	/nfs/dbraw/zinc/20/18/10/927201810.db2.gz	MBDWHNAEMGZMQA-QGZVFWFLSA-N	1	0	290.407	1.786	50	0		CDAARO
O=C(NCc1nccs1)[C@@H]1CCC[C@H]2CCC[N@@H+]21	ZINC000585121983	930989146	/nfs/dbraw/zinc/98/91/46/930989146.db2.gz	ITLGEJIXZWZLIZ-QWRGUYRKSA-N	1	0	265.382	1.776	50	0		CDAARO
CCOc1cccc(CNC(=O)[C@]2(C)C[C@@H](O)C[N@@H+]2C)c1	ZINC000585121922	930989425	/nfs/dbraw/zinc/98/94/25/930989425.db2.gz	GHQFWKTVQWXFEP-CJNGLKHVSA-N	1	0	292.379	1.157	50	0		CDAARO
Cc1nccn1CCC[N@@H+](C)C[C@@H]1CCCCN1C	ZINC000243956735	937589095	/nfs/dbraw/zinc/58/90/95/937589095.db2.gz	CCZLXCAKDBMDIK-HNNXBMFYSA-N	1	0	264.417	1.998	50	0		CDAARO
Cc1ccc(C[N@H+]2C[C@@H](Cc3cnccn3)[C@H](O)C2)cc1	ZINC001529195719	969012214	/nfs/dbraw/zinc/01/22/14/969012214.db2.gz	ODAXZSUCUFUVRI-NVXWUHKLSA-N	1	0	283.375	1.820	50	0		CDAARO
O=C(c1cccnc1)N1CCC([NH+]2CCSCC2)CC1	ZINC001506398266	975147610	/nfs/dbraw/zinc/14/76/10/975147610.db2.gz	XYNRPUFJDNJSCB-UHFFFAOYSA-N	1	0	291.420	1.735	50	0		CDAARO
CN(C)[C@@H]1CCCC[N@H+](CCCn2ccnc2)C1	ZINC001506397929	975147671	/nfs/dbraw/zinc/14/76/71/975147671.db2.gz	ZCIXHXBETBGZMY-CQSZACIVSA-N	1	0	250.390	1.689	50	0		CDAARO
Cc1cnc(CN2CC[N@H+](CC3CC3)[C@@H](CCO)C2)cn1	ZINC001506400128	975149093	/nfs/dbraw/zinc/14/90/93/975149093.db2.gz	IFNPUEXEJVIQHM-INIZCTEOSA-N	1	0	290.411	1.064	50	0		CDAARO
CC(=O)NC(C)(C)C[C@H](C)[NH2+]Cc1nc(C)cc(C)n1	ZINC001506408291	975153469	/nfs/dbraw/zinc/15/34/69/975153469.db2.gz	WTZNLTLHUDIWEQ-LBPRGKRZSA-N	1	0	278.400	1.876	50	0		CDAARO
CC(C)c1ccc(N(C)C[C@@H]2CCC[N@H+](CCO)C2)nn1	ZINC001506428449	975161756	/nfs/dbraw/zinc/16/17/56/975161756.db2.gz	QMORLYQKIGEVLC-AWEZNQCLSA-N	1	0	292.427	1.741	50	0		CDAARO
COc1cc(C(=O)NC2CC[NH+](C)CC2)ccc1F	ZINC000124310691	187132258	/nfs/dbraw/zinc/13/22/58/187132258.db2.gz	HOUNSUFOPLLQPL-UHFFFAOYSA-N	1	0	266.316	1.658	50	0		CDAARO
OCC[NH2+]C/C=C/c1c(F)c(F)c(F)c(F)c1F	ZINC000002845403	230367522	/nfs/dbraw/zinc/36/75/22/230367522.db2.gz	BTIJTTWXCDSNPE-OWOJBTEDSA-N	1	0	267.197	1.977	50	0		CDAARO
O=C(C[NH+]1CCC(c2ccccc2)CC1)N1C[C@@H](O)CO1	ZINC000095510634	185001449	/nfs/dbraw/zinc/00/14/49/185001449.db2.gz	SISPQSUALABUCB-OAHLLOKOSA-N	1	0	290.363	1.001	50	0		CDAARO
CC(C)(C)[C@@H](C[NH+]1CCCC1)NC(=O)c1cncnc1	ZINC000584893860	341999255	/nfs/dbraw/zinc/99/92/55/341999255.db2.gz	NOKUIRRVGMYESS-CYBMUJFWSA-N	1	0	276.384	1.717	50	0		CDAARO
FC(F)(F)CN1CC[C@H]([NH2+][C@@H]2CCN3CCCC[C@H]23)C1	ZINC000107524939	398151609	/nfs/dbraw/zinc/15/16/09/398151609.db2.gz	PYYKMKAJZAWCMR-YNEHKIRRSA-N	1	0	291.361	1.839	50	0		CDAARO
C[C@H](C(=O)NCc1ccccc1F)N1CC[N@H+](C)C[C@H]1C	ZINC000107580620	398155134	/nfs/dbraw/zinc/15/51/34/398155134.db2.gz	HZQYFSLSFFMKDW-CHWSQXEVSA-N	1	0	293.386	1.466	50	0		CDAARO
COC(=O)C1(C[NH2+]Cc2cccnc2)CCOCC1	ZINC000097372946	342002652	/nfs/dbraw/zinc/00/26/52/342002652.db2.gz	UITPNTLBYDVUMZ-UHFFFAOYSA-N	1	0	264.325	1.141	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1ccc(Cn2ccnc2)cc1	ZINC000124594990	187145027	/nfs/dbraw/zinc/14/50/27/187145027.db2.gz	DQEMJJVUSSPVBP-CYBMUJFWSA-N	1	0	284.363	1.365	50	0		CDAARO
CSC[C@@H]1CCN(C(=O)[C@@H]([NH3+])Cc2ccccc2)C1	ZINC000095971147	185048462	/nfs/dbraw/zinc/04/84/62/185048462.db2.gz	JGFZARNUHWSIMM-KGLIPLIRSA-N	1	0	278.421	1.768	50	0		CDAARO
C[NH+](C)C(C)(C)CNC(=O)NCC[C@@H]1CCCCO1	ZINC000096003448	185061870	/nfs/dbraw/zinc/06/18/70/185061870.db2.gz	PDZVPFVEKDVVIE-LBPRGKRZSA-N	1	0	271.405	1.585	50	0		CDAARO
C[C@@H]1C[NH+](CCCNc2cnccc2C(N)=O)C[C@@H](C)O1	ZINC000096006363	185063313	/nfs/dbraw/zinc/06/33/13/185063313.db2.gz	ONZODLAPJLLZAU-VXGBXAGGSA-N	1	0	292.383	1.092	50	0		CDAARO
CO[C@H](C(=O)N1CC[C@H](C[NH+]2CCCCC2)C1)C1CC1	ZINC000241644487	361752901	/nfs/dbraw/zinc/75/29/01/361752901.db2.gz	PRDTZXWALOFUGJ-HIFRSBDPSA-N	1	0	280.412	1.746	50	0		CDAARO
CN(CC1(O)CCCC1)C(=O)C1CC[NH+](C2CC2)CC1	ZINC000242324423	361756151	/nfs/dbraw/zinc/75/61/51/361756151.db2.gz	ZBEAYWMRKPAMDR-UHFFFAOYSA-N	1	0	280.412	1.624	50	0		CDAARO
COc1ccccc1/C=C/C[NH+](C[C@H](C)O)C[C@H](C)O	ZINC000012383468	342050853	/nfs/dbraw/zinc/05/08/53/342050853.db2.gz	OJFZEASPESTSEJ-AJKRIUKHSA-N	1	0	279.380	1.772	50	0		CDAARO
Cc1cc(C(=O)N2CC[NH2+]C[C@H]2C)ccc1-n1cncn1	ZINC000124890149	187159586	/nfs/dbraw/zinc/15/95/86/187159586.db2.gz	VHMBVUXTHYDDQC-GFCCVEGCSA-N	1	0	285.351	1.010	50	0		CDAARO
CC(=O)N1CCC([NH+]2CCN(c3ccccn3)CC2)CC1	ZINC000005092892	342089101	/nfs/dbraw/zinc/08/91/01/342089101.db2.gz	OBZVEWUXHHRHQI-UHFFFAOYSA-N	1	0	288.395	1.215	50	0		CDAARO
CC(C)c1nc(C(=O)N2CC[NH2+]C[C@@H]2C)cs1	ZINC000095427895	539087968	/nfs/dbraw/zinc/08/79/68/539087968.db2.gz	MJBMBTDSWYQLIX-VIFPVBQESA-N	1	0	253.371	1.700	50	0		CDAARO
Cc1nnc(CN(C)CC[N@H+]2CCCC[C@H]2C)[nH]1	ZINC000244795435	361864286	/nfs/dbraw/zinc/86/42/86/361864286.db2.gz	RGJGZXJDOBZZGS-LLVKDONJSA-N	1	0	251.378	1.419	50	0		CDAARO
O=C(CC[NH+]1CCSCC1)NCc1ccccc1F	ZINC000244811537	361865079	/nfs/dbraw/zinc/86/50/79/361865079.db2.gz	SGLZIGXHNPVJJP-UHFFFAOYSA-N	1	0	282.384	1.881	50	0		CDAARO
[NH3+][C@H]1[C@@H]2CC[C@H]1CN(CCn1cc(Cl)cn1)C2	ZINC000244882811	361867846	/nfs/dbraw/zinc/86/78/46/361867846.db2.gz	XZLCREKDRFTCOX-IAZYJMLFSA-N	1	0	254.765	1.206	50	0		CDAARO
CC(C)OC[C@H](O)C[N@H+](C)CCOc1ccc(F)cc1	ZINC000096968026	185143822	/nfs/dbraw/zinc/14/38/22/185143822.db2.gz	DISIOCNQIDSOSX-CQSZACIVSA-N	1	0	285.359	1.922	50	0		CDAARO
CC[N@H+](C1CN(C(=O)c2ccccn2)C1)C1CCOCC1	ZINC000257179849	361988472	/nfs/dbraw/zinc/98/84/72/361988472.db2.gz	JQDLUXBAKFCQSJ-UHFFFAOYSA-N	1	0	289.379	1.407	50	0		CDAARO
CN(C[C@H]1CCC[N@H+](C)C1)c1nccc2nc[nH]c21	ZINC000585135088	342215917	/nfs/dbraw/zinc/21/59/17/342215917.db2.gz	WXKOJZVMIQLPKC-NSHDSACASA-N	1	0	259.357	1.736	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)CCCOc1ccc(F)cc1F	ZINC000125614338	187193240	/nfs/dbraw/zinc/19/32/40/187193240.db2.gz	FFBGQCALGMTZRV-NSHDSACASA-N	1	0	298.333	1.944	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1cccc(-n2ccnc2)c1	ZINC000126109908	187217728	/nfs/dbraw/zinc/21/77/28/187217728.db2.gz	RBXUDEZZDNLDDJ-LBPRGKRZSA-N	1	0	270.336	1.306	50	0		CDAARO
Cc1noc([C@H]2C[N@@H+](CC3CCSCC3)CCN2C)n1	ZINC000585117807	362046175	/nfs/dbraw/zinc/04/61/75/362046175.db2.gz	XIWRJIKHCRIGKH-CYBMUJFWSA-N	1	0	296.440	1.810	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@H](NC(=O)CCc2ccncc2)C1(C)C	ZINC000585130212	362062703	/nfs/dbraw/zinc/06/27/03/362062703.db2.gz	KMZVAQPUIPNDNE-UONOGXRCSA-N	1	0	275.396	1.859	50	0		CDAARO
O=C1C[C@H]([C@@H]2CCCC[N@@H+]2CCO[C@H]2CCCCO2)CN1	ZINC000252569060	342385199	/nfs/dbraw/zinc/38/51/99/342385199.db2.gz	VVZZJYWKSVYZCZ-DZKIICNBSA-N	1	0	296.411	1.520	50	0		CDAARO
CCc1nc2c(s1)[C@@H]([NH2+][C@H]1CCCNC1=O)CCC2	ZINC000095967545	342431880	/nfs/dbraw/zinc/43/18/80/342431880.db2.gz	QSNUHXOQZRKHBP-ONGXEEELSA-N	1	0	279.409	1.951	50	0		CDAARO
C[N@H+](C1CCCC1)C(C)(C)C(=O)NC[C@@H]1CCC[C@@H]1O	ZINC000096488966	529821520	/nfs/dbraw/zinc/82/15/20/529821520.db2.gz	YBZLJOQCGSUENH-JSGCOSHPSA-N	1	0	282.428	1.917	50	0		CDAARO
C[C@@H]1CN(C(=O)CCc2cscn2)C[C@H](C)[NH2+]1	ZINC000179152136	362252312	/nfs/dbraw/zinc/25/23/12/362252312.db2.gz	ZPOWYLHMXAWQJX-AOOOYVTPSA-N	1	0	253.371	1.285	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccc3nccn3c2)C[C@@H](C)[NH2+]1	ZINC000179152419	362253904	/nfs/dbraw/zinc/25/39/04/362253904.db2.gz	RGJNPNFPNSKBBT-GHMZBOCLSA-N	1	0	258.325	1.157	50	0		CDAARO
COC[C@@H](O)C[N@@H+]1CCSC2(CCCCC2)C1	ZINC000083897900	362255053	/nfs/dbraw/zinc/25/50/53/362255053.db2.gz	AEYDTRFKLCEWMM-LBPRGKRZSA-N	1	0	259.415	1.745	50	0		CDAARO
COC(=O)[C@H](N[C@H]1CCc2ccccc2C1)[C@H](C)O	ZINC000249158661	362400700	/nfs/dbraw/zinc/40/07/00/362400700.db2.gz	ZIPAEWXPHPZZNY-LEWSCRJBSA-N	1	0	263.337	1.056	50	0		CDAARO
CCC[C@H](C)[N@@H+]1CCN(CCC(=O)OC)C[C@H]1C	ZINC000249214861	362476716	/nfs/dbraw/zinc/47/67/16/362476716.db2.gz	DPBHWENEIQLIHP-QWHCGFSZSA-N	1	0	256.390	1.744	50	0		CDAARO
COc1ccc(N2C[C@H](C[NH3+])OC2=O)cc1Cl	ZINC000019669115	362628383	/nfs/dbraw/zinc/62/83/83/362628383.db2.gz	MEGBCHTUNNTZTF-QMMMGPOBSA-N	1	0	256.689	1.633	50	0		CDAARO
C[NH2+][C@H](C)c1nc2cc(Cl)ccc2c(=O)n1C	ZINC000000250235	346184137	/nfs/dbraw/zinc/18/41/37/346184137.db2.gz	FCQJNMKDJXOVSW-SSDOTTSWSA-N	1	0	251.717	1.867	50	0		CDAARO
COc1ccnc(N2CC[NH+](C[C@@H]3CCCO3)CC2)c1	ZINC000104719984	346549997	/nfs/dbraw/zinc/54/99/97/346549997.db2.gz	LEJDIVVJKCPEIB-AWEZNQCLSA-N	1	0	277.368	1.391	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2occc2C)CC1	ZINC000089701962	179848378	/nfs/dbraw/zinc/84/83/78/179848378.db2.gz	DNTKIEPRZZDGDU-UHFFFAOYSA-N	1	0	280.368	1.676	50	0		CDAARO
CCCc1ncncc1C(=O)N1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+]	ZINC000584888822	349347422	/nfs/dbraw/zinc/34/74/22/349347422.db2.gz	MNHREGJNTPLLHP-GNXNZQSNSA-N	1	0	274.368	1.238	50	0		CDAARO
CC1(C)CC(CC(=O)N2CCCNC(=O)C2)CC(C)(C)[NH2+]1	ZINC000584897435	349358774	/nfs/dbraw/zinc/35/87/74/349358774.db2.gz	DNSYRECQLGZLBZ-UHFFFAOYSA-N	1	0	295.427	1.282	50	0		CDAARO
CC(C)C[N@@H+]1CCN(C(=O)CC2CCC2)C[C@H]1CCO	ZINC000584893662	349353415	/nfs/dbraw/zinc/35/34/15/349353415.db2.gz	HFBQOBAGUGUGMC-OAHLLOKOSA-N	1	0	282.428	1.728	50	0		CDAARO
O=C(N1CCC(CC[NH+]2CCCC2)CC1)C1(CO)CC1	ZINC000584894333	349354160	/nfs/dbraw/zinc/35/41/60/349354160.db2.gz	XHZQXLCAPGIBAH-UHFFFAOYSA-N	1	0	280.412	1.483	50	0		CDAARO
Cc1ccsc1C(=O)N1C[C@H](O)[C@@H]([NH+]2CCCC2)C1	ZINC000584897273	349358923	/nfs/dbraw/zinc/35/89/23/349358923.db2.gz	ZEQQUARECGGGTI-RYUDHWBXSA-N	1	0	280.393	1.338	50	0		CDAARO
COCc1cc(CNC(=O)[C@H]2CCCCC[N@@H+]2C)[nH]n1	ZINC000091289090	180122282	/nfs/dbraw/zinc/12/22/82/180122282.db2.gz	PAPALQOJCYFDGF-CYBMUJFWSA-N	1	0	280.372	1.047	50	0		CDAARO
COCC[C@]1(O)CC[N@H+](Cc2ncccc2C)C[C@H]1C	ZINC000091829725	180265620	/nfs/dbraw/zinc/26/56/20/180265620.db2.gz	NJYYHNHLARRSNM-GDBMZVCRSA-N	1	0	278.396	1.999	50	0		CDAARO
O=C(CO)N1C[C@H]2CC[C@H](C[N@H+]2Cc2ccccc2)C1	ZINC000091965794	180294279	/nfs/dbraw/zinc/29/42/79/180294279.db2.gz	CEUQIUWBTXZVGM-HUUCEWRRSA-N	1	0	274.364	1.102	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N1C[C@H]([NH3+])[C@@H](C2CC2)C1	ZINC000091896496	180282595	/nfs/dbraw/zinc/28/25/95/180282595.db2.gz	PXIGCVQCXMKNGO-OLZOCXBDSA-N	1	0	298.383	1.492	50	0		CDAARO
Cc1nc2ccsc2c(NC[C@H]2C[NH2+]CCOC2)n1	ZINC000092098484	180324733	/nfs/dbraw/zinc/32/47/33/180324733.db2.gz	BPTIKMCUXAYSHP-SNVBAGLBSA-N	1	0	278.381	1.648	50	0		CDAARO
NC(=O)N1CCC([NH2+]Cc2cc(F)ccc2F)CC1	ZINC000107929028	186198014	/nfs/dbraw/zinc/19/80/14/186198014.db2.gz	KSTOUBFFUUDICC-UHFFFAOYSA-N	1	0	269.295	1.598	50	0		CDAARO
C[C@H](CCSc1ccccc1)[N@@H+]1CCO[C@@H](C(N)=O)C1	ZINC000108121022	186205008	/nfs/dbraw/zinc/20/50/08/186205008.db2.gz	NVDOKMLTOGMXNN-TZMCWYRMSA-N	1	0	294.420	1.743	50	0		CDAARO
Cn1cncc1C[NH2+][C@@H]1CCN(c2ccccc2)C1=O	ZINC000109352039	186249936	/nfs/dbraw/zinc/24/99/36/186249936.db2.gz	JAJSBJFJRYNTJS-CQSZACIVSA-N	1	0	270.336	1.315	50	0		CDAARO
C[C@@H]1COCC[C@H]1CNC(=O)NC[C@@H]1CCCC[N@H+](C)C1	ZINC000624048508	351394778	/nfs/dbraw/zinc/39/47/78/351394778.db2.gz	NMKPLCHOVHEICF-ILXRZTDVSA-N	1	0	297.443	1.690	50	0		CDAARO
C[C@@H]1O[C@H](C(Cl)(Cl)Cl)N(CC[NH+](C)C)C1=O	ZINC000096026577	351474425	/nfs/dbraw/zinc/47/44/25/351474425.db2.gz	BCBYNSIATNYIDO-POYBYMJQSA-N	1	0	289.590	1.492	50	0		CDAARO
Cc1cc(S(=O)(=O)N2CC[C@@H]([NH3+])C2)c(Cl)cc1F	ZINC000122720136	187047699	/nfs/dbraw/zinc/04/76/99/187047699.db2.gz	ROQRMWVZKZTQFJ-MRVPVSSYSA-N	1	0	292.763	1.509	50	0		CDAARO
C[NH+](C)CCc1c[nH]c2ccc(C[C@H]3COC(=O)N3)cc12	ZINC000000015515	355879609	/nfs/dbraw/zinc/87/96/09/355879609.db2.gz	ULSDMUVEXKOYBU-ZDUSSCGKSA-N	1	0	287.363	1.923	50	0	fda	CDAARO
COc1ccc([C@H]2CC(=O)N(CCC[NH+](C)C)C2)cc1	ZINC000000211532	355896617	/nfs/dbraw/zinc/89/66/17/355896617.db2.gz	LGKBMODMSHIDTB-AWEZNQCLSA-N	1	0	276.380	1.963	50	0		CDAARO
COc1ccc(C[NH2+]C[C@H]2CCCO2)c(OC)c1	ZINC000000268563	355900304	/nfs/dbraw/zinc/90/03/04/355900304.db2.gz	UMUVEGLNWVUCTM-CYBMUJFWSA-N	1	0	251.326	1.972	50	0		CDAARO
CC[NH+](CC)CCCNS(=O)(=O)Cc1ccccc1	ZINC000002463135	355970525	/nfs/dbraw/zinc/97/05/25/355970525.db2.gz	AWRGKRHGPLPUFX-UHFFFAOYSA-N	1	0	284.425	1.838	50	0		CDAARO
C[C@@H]([NH2+][C@@H](C)C(=O)NCc1cccs1)[C@H]1CCCO1	ZINC000097374218	356094632	/nfs/dbraw/zinc/09/46/32/356094632.db2.gz	ZJBZFEDVJDBBQK-NTZNESFSSA-N	1	0	282.409	1.910	50	0		CDAARO
COc1cc(C[NH2+]C(C)C)ccc1OCC(N)=O	ZINC000010435769	356258656	/nfs/dbraw/zinc/25/86/56/356258656.db2.gz	BAAQDDYEFKNLCM-UHFFFAOYSA-N	1	0	252.314	1.057	50	0		CDAARO
Cc1nnc(=O)[nH]c1NC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000012201264	356291251	/nfs/dbraw/zinc/29/12/51/356291251.db2.gz	PBNQZRTUZJGGKT-UHFFFAOYSA-N	1	0	265.361	1.194	50	0		CDAARO
C[C@@H](Oc1ccc(F)cc1F)C(=O)NC1CC[NH+](C)CC1	ZINC000012380616	356296263	/nfs/dbraw/zinc/29/62/63/356296263.db2.gz	YWOKQPKOROPBFV-SNVBAGLBSA-N	1	0	298.333	1.943	50	0		CDAARO
C[C@H]1CCC[N@H+](CC(=O)Nc2cccc3nonc32)C1	ZINC000032578579	356305195	/nfs/dbraw/zinc/30/51/95/356305195.db2.gz	VQJJRYZBFHRQTN-JTQLQIEISA-N	1	0	274.324	1.893	50	0		CDAARO
COc1cc(C[NH2+]C2CCC(O)CC2)cc2c1OCCO2	ZINC000032735842	356357538	/nfs/dbraw/zinc/35/75/38/356357538.db2.gz	HIMZWARSSYPHOA-UHFFFAOYSA-N	1	0	293.363	1.860	50	0		CDAARO
C[NH+](C)Cc1ccccc1CNc1ccc2nnnn2n1	ZINC000014198165	356379019	/nfs/dbraw/zinc/37/90/19/356379019.db2.gz	DRLNUPADGHEAIL-UHFFFAOYSA-N	1	0	283.339	1.193	50	0		CDAARO
Cc1ccc(O[C@@H](C)C(=O)NC2CC[NH+](C)CC2)cc1	ZINC000016580042	356442032	/nfs/dbraw/zinc/44/20/32/356442032.db2.gz	JTXCTXMYYBFHQX-ZDUSSCGKSA-N	1	0	276.380	1.973	50	0		CDAARO
CCOc1ccc(C[NH2+][C@H]2CCS(=O)(=O)C2)cc1	ZINC000016807777	356447628	/nfs/dbraw/zinc/44/76/28/356447628.db2.gz	YPGBEPGWCKYQNL-LBPRGKRZSA-N	1	0	269.366	1.362	50	0		CDAARO
O=C(c1ccccc1OC(F)F)N1CC[NH2+]CC1	ZINC000019803367	356506002	/nfs/dbraw/zinc/50/60/02/356506002.db2.gz	GAYUATPZDHVOEB-UHFFFAOYSA-N	1	0	256.252	1.333	50	0		CDAARO
Cn1cccc1C[NH2+]CCc1ccc(S(N)(=O)=O)cc1	ZINC000020069307	356523651	/nfs/dbraw/zinc/52/36/51/356523651.db2.gz	LIGIAEHYPCRDOG-UHFFFAOYSA-N	1	0	293.392	1.005	50	0		CDAARO
CO[C@H]1C=CC2=CC[N@@H+]3CCC4=C(CC(=O)OC4)[C@]23C1	ZINC000056871237	363559277	/nfs/dbraw/zinc/55/92/77/363559277.db2.gz	PXWINCSLFXUWBZ-BBRMVZONSA-N	1	0	273.332	1.589	50	0	biogenic,in-vitro	CDAARO
CN(C(=O)[C@H]1Cc2ccccc2O1)C1CC[NH+](C)CC1	ZINC000032780620	356668123	/nfs/dbraw/zinc/66/81/23/356668123.db2.gz	IOCFKPPIFVYCJU-OAHLLOKOSA-N	1	0	274.364	1.543	50	0		CDAARO
C[C@H](c1ccc(-n2cncn2)cc1)[N@H+](C)CC(=O)N1CCC1	ZINC000025926577	356685649	/nfs/dbraw/zinc/68/56/49/356685649.db2.gz	BBYPTTCNPPQHOP-CYBMUJFWSA-N	1	0	299.378	1.492	50	0		CDAARO
C[NH+](C)[C@H](CNc1ccc2nnnn2n1)c1ccsc1	ZINC000026720517	356697744	/nfs/dbraw/zinc/69/77/44/356697744.db2.gz	IUIJYVGXRQWQGK-SNVBAGLBSA-N	1	0	289.368	1.296	50	0		CDAARO
NC(=O)[C@@H]([NH2+]CCOc1ccccc1)c1ccccc1	ZINC000028375356	356720512	/nfs/dbraw/zinc/72/05/12/356720512.db2.gz	JGTSFNUKUBJPCO-HNNXBMFYSA-N	1	0	270.332	1.882	50	0		CDAARO
O=C(C[NH+]1CCCC1)NCCc1ccc2c(c1)OCCO2	ZINC000029121093	356730803	/nfs/dbraw/zinc/73/08/03/356730803.db2.gz	LGUSBYQGHNRFGS-UHFFFAOYSA-N	1	0	290.363	1.212	50	0		CDAARO
COc1ccc(OC)c(C[N@@H+]2CCC[C@@H](O)C2)c1	ZINC000002490720	356735023	/nfs/dbraw/zinc/73/50/23/356735023.db2.gz	JAITZLCJEAIXBU-GFCCVEGCSA-N	1	0	251.326	1.661	50	0		CDAARO
C[NH+]1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000014252159	357208090	/nfs/dbraw/zinc/20/80/90/357208090.db2.gz	KFOBTAODXTXODG-UHFFFAOYSA-N	1	0	254.355	1.059	50	0		CDAARO
COC[C@H](Cc1ccccc1)[NH2+]C[C@H]1CCS(=O)(=O)C1	ZINC000095419618	357334104	/nfs/dbraw/zinc/33/41/04/357334104.db2.gz	HBUPBNBOXGQNEM-CABCVRRESA-N	1	0	297.420	1.268	50	0		CDAARO
CC1(C)CNC(=O)c2[nH]c(CCC[NH+]3CCCC3)nc2C1	ZINC000065492474	357544822	/nfs/dbraw/zinc/54/48/22/357544822.db2.gz	LQJIMMCNOGFQFQ-UHFFFAOYSA-N	1	0	290.411	1.750	50	0		CDAARO
CC[C@H]1CN(C(=O)c2ccc3c(c2)OCO3)CC[NH2+]1	ZINC000067513755	357611216	/nfs/dbraw/zinc/61/12/16/357611216.db2.gz	RGMMHPBBTCHREQ-NSHDSACASA-N	1	0	262.309	1.239	50	0		CDAARO
CCNC(=O)NC[C@@H]1CC[N@@H+](C2Cc3ccccc3C2)C1	ZINC000067713027	357620363	/nfs/dbraw/zinc/62/03/63/357620363.db2.gz	NCKSJFCKOOQPLW-ZDUSSCGKSA-N	1	0	287.407	1.795	50	0		CDAARO
CCCc1nnc(C(=O)N2[C@@H]3CC[C@H]2C[N@H+](C)CC3)o1	ZINC000071753173	357777452	/nfs/dbraw/zinc/77/74/52/357777452.db2.gz	XULXBGWUWCEYKR-MNOVXSKESA-N	1	0	278.356	1.331	50	0		CDAARO
O[C@]1(CNCc2coc(-c3ccccc3)n2)CC[NH2+]C1	ZINC000072426235	357835052	/nfs/dbraw/zinc/83/50/52/357835052.db2.gz	KUGYOZXVEXPTSF-OAHLLOKOSA-N	1	0	273.336	1.156	50	0		CDAARO
CCn1cc(C[N@@H+]2CCOCC3(CCOCC3)C2)cn1	ZINC000097108688	357983753	/nfs/dbraw/zinc/98/37/53/357983753.db2.gz	YCPCUKSEZALXEL-UHFFFAOYSA-N	1	0	279.384	1.532	50	0		CDAARO
C[C@H]([NH2+]CC(=O)N1CCNC1=O)c1ccc(Cl)s1	ZINC000097111500	357987155	/nfs/dbraw/zinc/98/71/55/357987155.db2.gz	YGRNQRITAPQMBO-ZETCQYMHSA-N	1	0	287.772	1.604	50	0		CDAARO
Cc1cc(C)cc(OC[C@H](O)CN2CC[NH+](C)CC2)c1	ZINC000019790707	358142387	/nfs/dbraw/zinc/14/23/87/358142387.db2.gz	JDCFXZAFTPTPMD-OAHLLOKOSA-N	1	0	278.396	1.291	50	0		CDAARO
Cc1cn2cc(C(=O)NCC3CC[NH2+]CC3)ccc2n1	ZINC000082083754	358146214	/nfs/dbraw/zinc/14/62/14/358146214.db2.gz	WAQYMIUKYBLULG-UHFFFAOYSA-N	1	0	272.352	1.372	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2F)C[C@H]1O	ZINC000082125262	358147629	/nfs/dbraw/zinc/14/76/29/358147629.db2.gz	AHTCGPUJPCGEGM-VXGBXAGGSA-N	1	0	292.276	1.738	50	0		CDAARO
CN(CCc1ccccn1)C(=O)[C@@H]([NH3+])c1ccccc1	ZINC000019844224	358163739	/nfs/dbraw/zinc/16/37/39/358163739.db2.gz	IOZFXTIKDODFKD-HNNXBMFYSA-N	1	0	269.348	1.783	50	0		CDAARO
COCCNC(=O)C1CC[NH+](Cc2ccccc2)CC1	ZINC000020100551	358323899	/nfs/dbraw/zinc/32/38/99/358323899.db2.gz	KQOHJTTWXGFPLO-UHFFFAOYSA-N	1	0	276.380	1.661	50	0		CDAARO
COc1ccccc1/C=C\C(=O)N1CC[N@H+](C)C[C@H]1C	ZINC000098055863	358344302	/nfs/dbraw/zinc/34/43/02/358344302.db2.gz	VXWNCDJFTYBMHI-LJTDUEICSA-N	1	0	274.364	1.871	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCC[NH3+])cc1C(F)(F)F	ZINC000195544432	358559833	/nfs/dbraw/zinc/55/98/33/358559833.db2.gz	CVRJVRONKSTUHN-UHFFFAOYSA-N	1	0	282.287	1.251	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]C[C@@H]1C[C@@H](O)CN1Cc1ccccc1	ZINC000195549078	358560481	/nfs/dbraw/zinc/56/04/81/358560481.db2.gz	PFCSRQKJBGGIGP-LLLHUVSDSA-N	1	0	290.407	1.389	50	0		CDAARO
CCc1n[nH]c(=O)c(C[NH2+][C@@H]2CCSC2)c1CC	ZINC000194662196	358528156	/nfs/dbraw/zinc/52/81/56/358528156.db2.gz	AMFBPJNCMAUYCK-SECBINFHSA-N	1	0	267.398	1.490	50	0		CDAARO
O=C1[O+]=NN(c2ccccc2)C1I	ZINC000095836461	358703241	/nfs/dbraw/zinc/70/32/41/358703241.db2.gz	XMMFDMXGNNSLGS-UHFFFAOYSA-O	1	0	289.052	1.262	50	0		CDAARO
CC(C)Nc1cc(N2C[C@H]([NH3+])[C@@H](C3CC3)C2)ncn1	ZINC000095384219	358690359	/nfs/dbraw/zinc/69/03/59/358690359.db2.gz	LBKBVVAUXCMBMX-NEPJUHHUSA-N	1	0	261.373	1.470	50	0		CDAARO
C[NH+](C)CC(=O)N1CC[C@@H](Cc2ccc(CO)cc2)C1	ZINC000095389175	358691862	/nfs/dbraw/zinc/69/18/62/358691862.db2.gz	IWRVQWPDJIAFPF-HNNXBMFYSA-N	1	0	276.380	1.132	50	0		CDAARO
CCc1[nH]nc(C(=O)N2CC([N@@H+]3CCCC[C@@H]3C)C2)c1C	ZINC000097272547	358764360	/nfs/dbraw/zinc/76/43/60/358764360.db2.gz	IGDVXNPZVKPWGK-NSHDSACASA-N	1	0	290.411	1.979	50	0		CDAARO
CCN(Cc1ccncc1)C(=O)[C@H]1CCC[NH2+]CC1	ZINC000096137807	358709629	/nfs/dbraw/zinc/70/96/29/358709629.db2.gz	PGAJWXYFBSLDKQ-AWEZNQCLSA-N	1	0	261.369	1.820	50	0		CDAARO
CSc1ccccc1CN1CCN([C@@H]2CC[NH2+]C2)CC1	ZINC000097499508	358780807	/nfs/dbraw/zinc/78/08/07/358780807.db2.gz	KRTLIGSTNGNTBP-OAHLLOKOSA-N	1	0	291.464	1.888	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)NC(C)(C)c1nnc(N)s1	ZINC000097570797	358785949	/nfs/dbraw/zinc/78/59/49/358785949.db2.gz	XRNXWMYSXVSOOC-SECBINFHSA-N	1	0	297.428	1.346	50	0		CDAARO
COc1ccc(Cn2ncnc2CC2CC[NH2+]CC2)cc1	ZINC000097600897	358786340	/nfs/dbraw/zinc/78/63/40/358786340.db2.gz	WNRSUWNDCVGXBN-UHFFFAOYSA-N	1	0	286.379	1.877	50	0		CDAARO
CSc1ccccc1CN1C[C@H]([NH+](C)C)C[C@H]1CO	ZINC000215163816	358877103	/nfs/dbraw/zinc/87/71/03/358877103.db2.gz	QUBNXIOPOFXZNE-KGLIPLIRSA-N	1	0	280.437	1.905	50	0		CDAARO
Cc1nc2ccc(C(=O)N[C@@H]3CC[NH2+]C3)cc2s1	ZINC000102546781	358882463	/nfs/dbraw/zinc/88/24/63/358882463.db2.gz	LFLOJUHJVBMTQB-SNVBAGLBSA-N	1	0	261.350	1.696	50	0		CDAARO
Nc1nccc(C2CC[NH+](Cc3cccnc3)CC2)n1	ZINC000215689844	358899518	/nfs/dbraw/zinc/89/95/18/358899518.db2.gz	AZZYUZGGULNUAH-UHFFFAOYSA-N	1	0	269.352	1.833	50	0		CDAARO
COc1ccc(C[N@H+](C)[C@@H]2CCCC[C@@H]2O)cn1	ZINC000215748994	358901319	/nfs/dbraw/zinc/90/13/19/358901319.db2.gz	DHPWSCHPGCNQHL-OLZOCXBDSA-N	1	0	250.342	1.826	50	0		CDAARO
COc1ccc(S(=O)(=O)N(C)C2CC[NH+](C)CC2)cc1	ZINC000000111168	359105419	/nfs/dbraw/zinc/10/54/19/359105419.db2.gz	LNGQSIFKSWPQHF-UHFFFAOYSA-N	1	0	298.408	1.410	50	0		CDAARO
[NH3+]CC(=O)N[C@@H]1CCCc2nc(-c3ccccc3)ncc21	ZINC000092062463	283421263	/nfs/dbraw/zinc/42/12/63/283421263.db2.gz	YCJHVTIUJLKUSI-CYBMUJFWSA-N	1	0	282.347	1.596	50	0		CDAARO
CC[C@@H](C(=O)N(C)Cc1cc[nH]n1)[NH+]1CCCC1	ZINC000221171577	359214162	/nfs/dbraw/zinc/21/41/62/359214162.db2.gz	QJCMOCOSJQYORY-LBPRGKRZSA-N	1	0	250.346	1.243	50	0		CDAARO
C[NH+](C)[C@H]1[C@@H]2OCC[C@@H]2[C@@H]1NC(=O)CCc1ccsc1	ZINC000223827196	359459666	/nfs/dbraw/zinc/45/96/66/359459666.db2.gz	PDQDSLASMUSZOG-FAAHXZRKSA-N	1	0	294.420	1.514	50	0		CDAARO
CCC(=O)NC[C@@H](c1ccsc1)N1CC[NH+](C)CC1	ZINC000024012770	359542104	/nfs/dbraw/zinc/54/21/04/359542104.db2.gz	GTXFBXWBYUBPCX-ZDUSSCGKSA-N	1	0	281.425	1.563	50	0		CDAARO
CC[NH+](CC)CCNC(=O)C1=Cc2ccccc2OC1	ZINC000002021529	360117711	/nfs/dbraw/zinc/11/77/11/360117711.db2.gz	PCKKPXBYYXGBBP-UHFFFAOYSA-N	1	0	274.364	1.920	50	0		CDAARO
Cc1nnc2n1CC[C@H]([N@H+](C)Cc1ccccn1)CC2	ZINC000409421244	360230647	/nfs/dbraw/zinc/23/06/47/360230647.db2.gz	HALPEDAVZVBFFH-CQSZACIVSA-N	1	0	271.368	1.818	50	0		CDAARO
CC(C)C(=O)NCCC[NH+]1CCN(c2ccccc2)CC1	ZINC000011853344	360358727	/nfs/dbraw/zinc/35/87/27/360358727.db2.gz	OINKNPINEWELGS-UHFFFAOYSA-N	1	0	289.423	1.971	50	0		CDAARO
Clc1ccccc1-n1cc(CN2CC[NH2+]CC2)nn1	ZINC000232313869	360565095	/nfs/dbraw/zinc/56/50/95/360565095.db2.gz	UZOOIMPMKAPUCU-UHFFFAOYSA-N	1	0	277.759	1.326	50	0		CDAARO
COCCN(Cc1sccc1C)C(=O)[C@@H](C)[NH+](C)C	ZINC000426358219	360658689	/nfs/dbraw/zinc/65/86/89/360658689.db2.gz	GFZMZPUWOBCNBS-GFCCVEGCSA-N	1	0	284.425	1.982	50	0		CDAARO
Cc1ncsc1CSc1nnc(C[NH3+])n1C	ZINC000426380763	360661270	/nfs/dbraw/zinc/66/12/70/360661270.db2.gz	YJELQYNKELAWSW-UHFFFAOYSA-N	1	0	255.372	1.331	50	0		CDAARO
COc1ccc(C(=O)N2CC=C(C)CC2)cc1OCC[NH3+]	ZINC000426479048	360673919	/nfs/dbraw/zinc/67/39/19/360673919.db2.gz	UCWIOSUUXPLOEJ-UHFFFAOYSA-N	1	0	290.363	1.825	50	0		CDAARO
C[C@@H](C(=O)N(C)Cc1cnc2ccccc2n1)[NH+](C)C	ZINC000426486006	360675288	/nfs/dbraw/zinc/67/52/88/360675288.db2.gz	FKVXJGBVQNFHJV-NSHDSACASA-N	1	0	272.352	1.538	50	0		CDAARO
Cc1c[nH]c(CNC(=O)[C@H](C)C[NH+]2CCCC2)c(C)c1=O	ZINC000426689152	360696358	/nfs/dbraw/zinc/69/63/58/360696358.db2.gz	IUDPLQJNHQHQGK-GFCCVEGCSA-N	1	0	291.395	1.340	50	0		CDAARO
Cc1c[nH+]ccc1NCCNc1cc([C@H]2CCOC2)ncn1	ZINC000426712558	360698662	/nfs/dbraw/zinc/69/86/62/360698662.db2.gz	BVCAFQWVNMYQLF-ZDUSSCGKSA-N	1	0	299.378	1.052	50	0		CDAARO
[NH3+][C@@H]1CCCC[C@H]1NC(=O)c1ccc2c(c1)NC(=O)CO2	ZINC000128134921	360799517	/nfs/dbraw/zinc/79/95/17/360799517.db2.gz	WRBAZESBBFHUJX-GHMZBOCLSA-N	1	0	289.335	1.017	50	0		CDAARO
COc1ccc2ncn(Cc3nc(C)c[nH]3)c(=O)c2c1	ZINC000032507912	360953461	/nfs/dbraw/zinc/95/34/61/360953461.db2.gz	WCESQAPKQGGUEU-UHFFFAOYSA-N	1	0	270.292	1.485	50	0		CDAARO
O=C(C[C@H]1CCOC1)NC1CC[NH+](Cc2ccco2)CC1	ZINC000426537703	360999532	/nfs/dbraw/zinc/99/95/32/360999532.db2.gz	NPWKMSUZIXFUQV-CYBMUJFWSA-N	1	0	292.379	1.787	50	0		CDAARO
CC(=O)NC[C@@H]1CN(Cc2cc(F)ccc2C)CCO1	ZINC000180164404	189240783	/nfs/dbraw/zinc/24/07/83/189240783.db2.gz	DWBMFJVUHHDUMU-OAHLLOKOSA-N	1	0	280.343	1.471	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)NC[C@H](O)c1ccccc1Cl	ZINC000299739396	200851600	/nfs/dbraw/zinc/85/16/00/200851600.db2.gz	NYVBJFREQOCWFU-AWEZNQCLSA-N	1	0	296.798	1.879	50	0		CDAARO
CCn1cc(C(=O)NCC2(C)CC[NH2+]CC2)cn1	ZINC000183312123	189354597	/nfs/dbraw/zinc/35/45/97/189354597.db2.gz	VGNHINHPYGEKCD-UHFFFAOYSA-N	1	0	250.346	1.023	50	0		CDAARO
[NH3+][C@@H]1CCCN(S(=O)(=O)c2cc(F)cc(F)c2)C1	ZINC000036297291	361462250	/nfs/dbraw/zinc/46/22/50/361462250.db2.gz	GSBDZIQHVSWWEA-SNVBAGLBSA-N	1	0	276.308	1.077	50	0		CDAARO
Cc1ccsc1C(=O)N1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1	ZINC000185205325	189406777	/nfs/dbraw/zinc/40/67/77/189406777.db2.gz	BRUODXIXBZCYDY-HBNTYKKESA-N	1	0	250.367	1.866	50	0		CDAARO
OCC[NH2+]CCCOc1ccccc1Br	ZINC000002898359	364656173	/nfs/dbraw/zinc/65/61/73/364656173.db2.gz	AYADDMHTDWTPDV-UHFFFAOYSA-N	1	0	274.158	1.800	50	0		CDAARO
CNS(=O)(=O)CC[NH2+]Cc1ccc(C)c(Cl)c1	ZINC000195450932	189676099	/nfs/dbraw/zinc/67/60/99/189676099.db2.gz	FKQVTXWCSZDMLP-UHFFFAOYSA-N	1	0	276.789	1.287	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	ZINC000088834046	367319913	/nfs/dbraw/zinc/31/99/13/367319913.db2.gz	FKWBPMRPVHPMAB-VIFPVBQESA-N	1	0	252.280	1.787	50	0		CDAARO
CCC(CC)[C@H](O)CNC(=O)C[N@@H+]1CCC[C@H]1C	ZINC000252510587	367662692	/nfs/dbraw/zinc/66/26/92/367662692.db2.gz	ALHFOLYQTHYDHP-DGCLKSJQSA-N	1	0	256.390	1.384	50	0		CDAARO
CN1CCN(C)[C@H](CNC(=O)c2sccc2Cl)C1	ZINC000286191871	368722345	/nfs/dbraw/zinc/72/23/45/368722345.db2.gz	XNSAZNOHYWIPCW-SECBINFHSA-N	1	0	287.816	1.377	50	0		CDAARO
Cc1nonc1OCCNc1cc(C[NH+](C)C)nc(C)n1	ZINC000063856167	370550758	/nfs/dbraw/zinc/55/07/58/370550758.db2.gz	LIEYQPFEECOPSU-UHFFFAOYSA-N	1	0	292.343	1.029	50	0		CDAARO
CCN(C)C(=O)[C@H](C)[N@H+](C)CCCc1nccn1C	ZINC000299777462	372754742	/nfs/dbraw/zinc/75/47/42/372754742.db2.gz	NJBQKHHDQGWJQX-LBPRGKRZSA-N	1	0	266.389	1.151	50	0		CDAARO
COc1ccc(NC(=O)N2CCC[C@@H]([NH3+])C2)c(C)c1	ZINC000299802815	372773341	/nfs/dbraw/zinc/77/33/41/372773341.db2.gz	QKEDCCVWDNGXOD-LLVKDONJSA-N	1	0	263.341	1.959	50	0		CDAARO
CNC(=S)NC[C@@H](c1ccccc1OC)[NH+]1CCCC1	ZINC000015348415	372814962	/nfs/dbraw/zinc/81/49/62/372814962.db2.gz	LLCSLTLUMQPSFR-ZDUSSCGKSA-N	1	0	293.436	1.926	50	0		CDAARO
Cc1noc(C)c1C[N@H+]1C[C@@H](c2ccncc2)[C@H](CO)C1	ZINC000253397481	373686021	/nfs/dbraw/zinc/68/60/21/373686021.db2.gz	BLPYJEFXOSOJFF-HOCLYGCPSA-N	1	0	287.363	1.894	50	0		CDAARO
COC[C@@H]1C[N@H+](Cc2ccco2)C[C@H]1C(=O)N(C)C	ZINC000253400643	373687979	/nfs/dbraw/zinc/68/79/79/373687979.db2.gz	FBNWDJJEYSBYJG-WCQYABFASA-N	1	0	266.341	1.062	50	0		CDAARO
COc1ncnc(N)c1CN1CC(C)(C)C1(C)C	ZINC000093507972	374762024	/nfs/dbraw/zinc/76/20/24/374762024.db2.gz	OYUZXRGIZYHCNO-UHFFFAOYSA-N	1	0	250.346	1.688	50	0		CDAARO
Cc1nnc(CNC(=O)c2cccc([C@H]3CCC[NH2+]C3)c2)[nH]1	ZINC000095385133	374897630	/nfs/dbraw/zinc/89/76/30/374897630.db2.gz	CFIQLWPMXFBUJK-AWEZNQCLSA-N	1	0	299.378	1.510	50	0		CDAARO
CCn1nccc1C[N@@H+]1CCC[C@@H]1Cn1ccnc1	ZINC000188414242	375778323	/nfs/dbraw/zinc/77/83/23/375778323.db2.gz	DCTCVFFQUOVSLC-CYBMUJFWSA-N	1	0	259.357	1.764	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)CO[C@H]2CCC[C@H]2C)CC1	ZINC000245228853	376024393	/nfs/dbraw/zinc/02/43/93/376024393.db2.gz	HOQJEEHSQKXMCX-ILXRZTDVSA-N	1	0	270.417	1.190	50	0		CDAARO
Cc1ccc2cccc(C(=O)N3CC[NH2+]C[C@@H]3C)c2n1	ZINC000125399699	376305688	/nfs/dbraw/zinc/30/56/88/376305688.db2.gz	AUDMZRDGJXLBJI-LBPRGKRZSA-N	1	0	269.348	1.977	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](CNC(=O)c2cccc(=O)[nH]2)C1	ZINC000067459903	377087779	/nfs/dbraw/zinc/08/77/79/377087779.db2.gz	UFHZHEIJOZKHRN-GFCCVEGCSA-N	1	0	277.368	1.083	50	0		CDAARO
c1cc(CNc2ncnc3c2CC[NH2+]C3)cc2nsnc12	ZINC000067648885	377193763	/nfs/dbraw/zinc/19/37/63/377193763.db2.gz	XEBXRDWEINNCKC-UHFFFAOYSA-N	1	0	298.375	1.739	50	0		CDAARO
Cc1n[nH]c(C)c1CCCN[C@H]1CC[NH2+]C1(C)C	ZINC000067756357	377234829	/nfs/dbraw/zinc/23/48/29/377234829.db2.gz	OKIKBJTWSHRQDW-ZDUSSCGKSA-N	1	0	250.390	1.689	50	0		CDAARO
O=C1CC[C@@]2(CN1Cc1ccccc1)[NH2+]CCc1nc[nH]c12	ZINC000067840397	377252692	/nfs/dbraw/zinc/25/26/92/377252692.db2.gz	OACJTHOLJKIQCI-KRWDZBQOSA-N	1	0	296.374	1.573	50	0		CDAARO
O=C1[C@H]2CC=C(Cl)C[C@@H]2C(=O)N1CC[n+]1ccccc1	ZINC000018191391	285006453	/nfs/dbraw/zinc/00/64/53/285006453.db2.gz	MKYMTEZDKHZESB-STQMWFEESA-N	1	0	291.758	1.492	50	0		CDAARO
Cc1ccc(CS(=O)(=O)N(C)C[C@H]2CC[N@H+](C)C2)cc1	ZINC000288180708	197020280	/nfs/dbraw/zinc/02/02/80/197020280.db2.gz	ARYDTZFPLXQHLQ-HNNXBMFYSA-N	1	0	296.436	1.708	50	0		CDAARO
Cc1nc2c(cccc2C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)o1	ZINC000281377085	195216138	/nfs/dbraw/zinc/21/61/38/195216138.db2.gz	ZINKYSOFOCNOEI-TXEJJXNPSA-N	1	0	285.347	1.770	50	0		CDAARO
O[C@@H](Cn1cccn1)C[N@@H+]1CCC[C@@H]1Cc1ccccc1	ZINC000106107433	285307889	/nfs/dbraw/zinc/30/78/89/285307889.db2.gz	SVAPIBULUZOITC-IAGOWNOFSA-N	1	0	285.391	1.951	50	0		CDAARO
CO[C@]1(C)C[C@H](N(C)C(=O)[C@@H]2CC[C@H]([NH3+])C2)C1(C)C	ZINC000262628372	256849010	/nfs/dbraw/zinc/84/90/10/256849010.db2.gz	JPXDPODOXGTKQA-OXJKWZBOSA-N	1	0	268.401	1.776	50	0		CDAARO
Cc1cc(CNC(=O)CCC[NH+]2CCCCC2)n(C)n1	ZINC000095372596	184956979	/nfs/dbraw/zinc/95/69/79/184956979.db2.gz	LYWKOSNYUFZOCK-UHFFFAOYSA-N	1	0	278.400	1.611	50	0		CDAARO
CO[C@H](CC(C)C)CN1CCN(C)[C@H](c2nc(C)no2)C1	ZINC000419274310	390418359	/nfs/dbraw/zinc/41/83/59/390418359.db2.gz	XURINCBOYAIBJJ-KGLIPLIRSA-N	1	0	296.415	1.728	50	0		CDAARO
C[C@@]1(C[NH3+])CCN(C(=O)c2ccnc(C3CC3)n2)C1	ZINC000262043687	390504341	/nfs/dbraw/zinc/50/43/41/390504341.db2.gz	QIRFVFMBWBIKMC-AWEZNQCLSA-N	1	0	260.341	1.165	50	0		CDAARO
CN1CC[N@H+](C)CC12CCN(c1ncc(Cl)cn1)CC2	ZINC000067947210	390577042	/nfs/dbraw/zinc/57/70/42/390577042.db2.gz	BYMJSLZXJGQESU-UHFFFAOYSA-N	1	0	295.818	1.346	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)NCCCc2ccc(O)cc2)C1	ZINC000417741181	391005934	/nfs/dbraw/zinc/00/59/34/391005934.db2.gz	IUDYTDZRVIRYOW-GFCCVEGCSA-N	1	0	263.341	1.067	50	0		CDAARO
Cc1cc(C[NH2+][C@H](C2CC2)[C@]2(CO)CCCO2)ccn1	ZINC000527539134	391035418	/nfs/dbraw/zinc/03/54/18/391035418.db2.gz	JFVBYYMACZUXCD-HZPDHXFCSA-N	1	0	276.380	1.800	50	0		CDAARO
COCCOc1cccc(C(=O)NCC2([NH+](C)C)CC2)c1	ZINC000416304780	391264304	/nfs/dbraw/zinc/26/43/04/391264304.db2.gz	VPXFKTMRLLWKTM-UHFFFAOYSA-N	1	0	292.379	1.536	50	0		CDAARO
CC[C@@H]1CN(C)c2ccccc2C[N@@H+]1CCOCCO	ZINC000088562625	391422917	/nfs/dbraw/zinc/42/29/17/391422917.db2.gz	HUWVZCFQEYCYTO-OAHLLOKOSA-N	1	0	278.396	1.726	50	0		CDAARO
CO[C@]1(C)C[C@H](N(C)C(=O)[C@@H]2CCC[NH2+]C2)C1(C)C	ZINC000121653816	391561052	/nfs/dbraw/zinc/56/10/52/391561052.db2.gz	OJRXYJZVMZASFW-TYNCELHUSA-N	1	0	268.401	1.648	50	0		CDAARO
COc1cccnc1N1CCC[C@H](C[NH+]2CCOCC2)C1	ZINC000528004013	391945843	/nfs/dbraw/zinc/94/58/43/391945843.db2.gz	UPQFXJRHBKBLTK-CQSZACIVSA-N	1	0	291.395	1.639	50	0		CDAARO
[NH3+][C@@H]1CC[C@H]2CN(C(=O)CCc3cscn3)C[C@H]12	ZINC000248564816	131116387	/nfs/dbraw/zinc/11/63/87/131116387.db2.gz	BLVIOZXPUQQPNT-ZMLRMANQSA-N	1	0	265.382	1.271	50	0		CDAARO
CN(C)C(=O)C[N@H+](C[C@@H]1CCCO1)[C@@H]1CCSC1	ZINC000089952492	392531132	/nfs/dbraw/zinc/53/11/32/392531132.db2.gz	FAHFQLNBRUAZLC-NEPJUHHUSA-N	1	0	272.414	1.061	50	0		CDAARO
Oc1cccc(CN2CC[NH+](C[C@H]3CCOC3)CC2)c1	ZINC000096452009	393186962	/nfs/dbraw/zinc/18/69/62/393186962.db2.gz	BPZHIFATNJZWGK-OAHLLOKOSA-N	1	0	276.380	1.546	50	0		CDAARO
COc1c2c(cc3c1[C@@H](C[C@H](C)O)[N@H+](C)CC3)OCO2	ZINC000002139780	393275263	/nfs/dbraw/zinc/27/52/63/393275263.db2.gz	QLEBYGRJDONRLS-GXSJLCMTSA-N	1	0	279.336	1.724	50	0	biogenic	CDAARO
C[C@@H]1CN(C)CC[N@@H+]1CC1CCN(C(=O)C2CC2)CC1	ZINC000085468044	397610937	/nfs/dbraw/zinc/61/09/37/397610937.db2.gz	VUJKFPMRXMESHV-CYBMUJFWSA-N	1	0	279.428	1.271	50	0		CDAARO
CC(=O)Nc1ccc(NC(=O)NCC[NH+]2CC=CC2)cc1	ZINC000101488394	397798417	/nfs/dbraw/zinc/79/84/17/397798417.db2.gz	FNJSSCLZXDBUPF-UHFFFAOYSA-N	1	0	288.351	1.638	50	0		CDAARO
CCO[C@@H]1C[C@H](N(C)C(=O)[C@H]2CC[C@H]([NH3+])C2)C1(C)C	ZINC000299738619	286329211	/nfs/dbraw/zinc/32/92/11/286329211.db2.gz	CVWOUGYGGJKVLG-ZDEQEGDKSA-N	1	0	268.401	1.776	50	0		CDAARO
COC(=O)Cc1ccc(OC)c(CSC(N)=[NH2+])c1	ZINC000004598926	169988246	/nfs/dbraw/zinc/98/82/46/169988246.db2.gz	DQVWCSYNLNEQBR-UHFFFAOYSA-N	1	0	268.338	1.537	50	0		CDAARO
COCC[NH2+]Cc1cc(OC)c(OC)c(OC)c1	ZINC000004700472	170001584	/nfs/dbraw/zinc/00/15/84/170001584.db2.gz	GPCQTLTUOPFLJB-UHFFFAOYSA-N	1	0	255.314	1.448	50	0		CDAARO
CC[NH+](CC)CCNC(=O)C(=O)Nc1cccc(OC)c1	ZINC000005184141	170074618	/nfs/dbraw/zinc/07/46/18/170074618.db2.gz	LGHBUAYIYDWFLE-UHFFFAOYSA-N	1	0	293.367	1.092	50	0		CDAARO
O=C1CCCN1C[C@@H](O)C[NH2+]Cc1ccccc1Cl	ZINC000005764224	170138317	/nfs/dbraw/zinc/13/83/17/170138317.db2.gz	UHFGQXLGAWTHMF-LBPRGKRZSA-N	1	0	282.771	1.413	50	0		CDAARO
Cc1ccc(C[N@H+](C)CC(=O)N2CCNC2=O)c(C)c1	ZINC000007920899	170308280	/nfs/dbraw/zinc/30/82/80/170308280.db2.gz	JXPUCBKJBXIVSV-UHFFFAOYSA-N	1	0	275.352	1.287	50	0		CDAARO
C[NH+](C)CCNC(=O)CCSc1ccccc1	ZINC000010111505	170397669	/nfs/dbraw/zinc/39/76/69/170397669.db2.gz	DGYDRXKLENGWES-UHFFFAOYSA-N	1	0	252.383	1.847	50	0		CDAARO
Cc1c(C)n(C[C@H](O)C[NH2+]CCO)c2ccc(F)cc12	ZINC000012421995	170487384	/nfs/dbraw/zinc/48/73/84/170487384.db2.gz	YZECOJDXJZVJMZ-CYBMUJFWSA-N	1	0	280.343	1.340	50	0		CDAARO
Cc1cc(C)c(S(=O)(=O)NC2CC[NH2+]CC2)c(C)c1	ZINC000020272027	171126711	/nfs/dbraw/zinc/12/67/11/171126711.db2.gz	OVAMHDHDDWNJHS-UHFFFAOYSA-N	1	0	282.409	1.642	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC2CC[NH2+]CC2)c(C)c1	ZINC000020272018	171126854	/nfs/dbraw/zinc/12/68/54/171126854.db2.gz	DRPKTCQAXXHBFI-UHFFFAOYSA-N	1	0	268.382	1.334	50	0		CDAARO
Cc1ccc2c(CN3CC[NH2+]CC3)cc(=O)oc2c1C	ZINC000020348995	171154623	/nfs/dbraw/zinc/15/46/23/171154623.db2.gz	YLCCTGNGYKGLOV-UHFFFAOYSA-N	1	0	272.348	1.815	50	0	biogenic	CDAARO
CC(C)C[N@@H+]1CCN(Cc2ccc(O)cc2)C[C@@H]1CCO	ZINC000020601279	171266598	/nfs/dbraw/zinc/26/65/98/171266598.db2.gz	DOZRUEVBXGCLAF-INIZCTEOSA-N	1	0	292.423	1.917	50	0		CDAARO
Cc1cc(Cl)ccc1OCCOCCNCC[NH3+]	ZINC000022079123	171352653	/nfs/dbraw/zinc/35/26/53/171352653.db2.gz	JMXDJUARNAXMRF-UHFFFAOYSA-N	1	0	272.776	1.592	50	0		CDAARO
CCc1cc(NC[C@H]2CCC[N@H+]2CC)n2ncnc2n1	ZINC000022321822	171384642	/nfs/dbraw/zinc/38/46/42/171384642.db2.gz	RPYCARHQMJEKQR-GFCCVEGCSA-N	1	0	274.372	1.583	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2ccc(F)cc2)CC1	ZINC000022459737	171388170	/nfs/dbraw/zinc/38/81/70/171388170.db2.gz	DJFLIKTWGORILL-UHFFFAOYSA-N	1	0	265.332	1.402	50	0		CDAARO
CC(C)[C@@H]([NH2+]CC(=O)NC(N)=O)c1ccc(F)cc1	ZINC000032764814	171748701	/nfs/dbraw/zinc/74/87/01/171748701.db2.gz	BMHUQSZHYHBHOX-GFCCVEGCSA-N	1	0	267.304	1.307	50	0		CDAARO
O=C([C@H]1C[C@H](O)C[NH2+]1)N1CCC(Cc2ccccc2)CC1	ZINC000036963186	172831837	/nfs/dbraw/zinc/83/18/37/172831837.db2.gz	LRCUBBGXTFLPIY-JKSUJKDBSA-N	1	0	288.391	1.191	50	0		CDAARO
COc1cc(C[NH2+]C(C)(C)CO)cc2c1OCCO2	ZINC000037526570	173250694	/nfs/dbraw/zinc/25/06/94/173250694.db2.gz	GWWWETGIGGUQNV-UHFFFAOYSA-N	1	0	267.325	1.327	50	0		CDAARO
[NH3+][C@H](CF)[C@H](O)c1ccc(I)cc1	ZINC000040442732	174262878	/nfs/dbraw/zinc/26/28/78/174262878.db2.gz	RDKFSDYKXXYXJM-RKDXNWHRSA-N	1	0	295.095	1.621	50	0		CDAARO
CC(C)NC(=O)[C@@H]1C[C@H]([NH3+])CN1Cc1cc(C(C)C)no1	ZINC000067819837	175795072	/nfs/dbraw/zinc/79/50/72/175795072.db2.gz	MQHWXMGYJWLBFP-FZMZJTMJSA-N	1	0	294.399	1.224	50	0		CDAARO
CC(C)NC(=O)CN[C@@H](C)C[NH+]1CCCCCC1	ZINC000071278578	176108377	/nfs/dbraw/zinc/10/83/77/176108377.db2.gz	GTRDBUHRUKDCON-ZDUSSCGKSA-N	1	0	255.406	1.365	50	0		CDAARO
NC(=[NH2+])NCCCOc1ccc(Br)cc1	ZINC000071611483	176231886	/nfs/dbraw/zinc/23/18/86/176231886.db2.gz	SEWAIQVLPFHQLL-UHFFFAOYSA-N	1	0	272.146	1.701	50	0		CDAARO
CC(C)C[C@@H]([NH3+])C(=O)NCc1[nH]nc2c1CCCCC2	ZINC000071748593	176259717	/nfs/dbraw/zinc/25/97/17/176259717.db2.gz	XQEYZSKVVADWSZ-GFCCVEGCSA-N	1	0	278.400	1.668	50	0		CDAARO
CCCc1nc(C(=O)NC[C@@]2(O)CCC[NH2+]CC2)cs1	ZINC000072148544	176325759	/nfs/dbraw/zinc/32/57/59/176325759.db2.gz	FAQGIECMPCTHAK-CQSZACIVSA-N	1	0	297.424	1.330	50	0		CDAARO
CN(C(=O)NC[C@H]1C[NH2+]CCOC1)c1ccccc1	ZINC000072162347	176329965	/nfs/dbraw/zinc/32/99/65/176329965.db2.gz	CWKQPGUERURDHF-GFCCVEGCSA-N	1	0	263.341	1.068	50	0		CDAARO
[NH3+][C@H](CO)c1cccc(I)c1	ZINC000072199354	176340415	/nfs/dbraw/zinc/34/04/15/176340415.db2.gz	DVVISPFLNUQZPZ-MRVPVSSYSA-N	1	0	263.078	1.283	50	0		CDAARO
Clc1ccc(-c2nnn(C[C@@H]3CC[NH2+]C3)n2)cc1	ZINC000072343401	176371578	/nfs/dbraw/zinc/37/15/78/176371578.db2.gz	WHGVEINTAZNTCC-SECBINFHSA-N	1	0	263.732	1.603	50	0		CDAARO
O=c1ccc(-c2cccs2)nn1C[C@@H]1CCC[NH2+]C1	ZINC000072343593	176372195	/nfs/dbraw/zinc/37/21/95/176372195.db2.gz	MGIRFKATVIWBQY-LLVKDONJSA-N	1	0	275.377	1.971	50	0		CDAARO
O[C@]1(CNCc2c(F)ccc(Cl)c2F)CCC[NH2+]C1	ZINC000072411711	176398988	/nfs/dbraw/zinc/39/89/88/176398988.db2.gz	GOGXHTPYAMVKAC-CYBMUJFWSA-N	1	0	290.741	1.822	50	0		CDAARO
CCC(CC)[NH2+]C[C@@H]1CCN(c2cnn(C)c(=O)c2)C1	ZINC000077340431	177254245	/nfs/dbraw/zinc/25/42/45/177254245.db2.gz	DYLPHGZOYOZHSH-LBPRGKRZSA-N	1	0	278.400	1.385	50	0		CDAARO
C[C@H](CN1C(=O)NC2(CC[NH2+]CC2)C1=O)c1ccccc1	ZINC000077424313	177265910	/nfs/dbraw/zinc/26/59/10/177265910.db2.gz	JIDDORKRSMCXES-GFCCVEGCSA-N	1	0	287.363	1.464	50	0		CDAARO
Cc1cnc(C[NH2+][C@H]2CCOC3(CCOCC3)C2)cn1	ZINC000077488573	177274516	/nfs/dbraw/zinc/27/45/16/177274516.db2.gz	QSHIRVQFWWZZMD-ZDUSSCGKSA-N	1	0	277.368	1.603	50	0		CDAARO
Cc1nc[nH]c1CN1CCC[C@@](O)(C[NH+]2CCCC2)C1	ZINC000077505879	177276253	/nfs/dbraw/zinc/27/62/53/177276253.db2.gz	VYZKZZACHREVBV-OAHLLOKOSA-N	1	0	278.400	1.141	50	0		CDAARO
C[NH+](C)[C@H]1CCCC[C@H]1NC(=O)c1ccc(C(N)=O)cc1	ZINC000408512919	261068255	/nfs/dbraw/zinc/06/82/55/261068255.db2.gz	ZKQYSISPWLJXGF-KGLIPLIRSA-N	1	0	289.379	1.388	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)c1cccc(-n2cncn2)c1	ZINC000122217937	274240523	/nfs/dbraw/zinc/24/05/23/274240523.db2.gz	XZKPBWZSBCLWKJ-IUODEOHRSA-N	1	0	299.378	1.609	50	0		CDAARO
C[C@@H]1Cc2ccccc2N1C(=O)C[C@H]1COCC[NH2+]1	ZINC000128829570	274414037	/nfs/dbraw/zinc/41/40/37/274414037.db2.gz	GDVFNIIRGXBQLY-YPMHNXCESA-N	1	0	260.337	1.343	50	0		CDAARO
CC(C)([NH3+])C(=O)Nc1n[nH]c2c1cccc2Cl	ZINC000335071102	275550456	/nfs/dbraw/zinc/55/04/56/275550456.db2.gz	VETHRTMXYVDVQO-UHFFFAOYSA-N	1	0	252.705	1.314	50	0		CDAARO
CC1(C)CC(Nc2ncccc2C(N)=O)CC(C)(C)[NH2+]1	ZINC000024985276	275809340	/nfs/dbraw/zinc/80/93/40/275809340.db2.gz	YLMZPZSIQLQZJS-UHFFFAOYSA-N	1	0	276.384	1.902	50	0		CDAARO
CC[NH+](CC)CCCNC(=O)Nc1cccnc1	ZINC000012594718	276097300	/nfs/dbraw/zinc/09/73/00/276097300.db2.gz	CTZJIQGYCZSJNR-UHFFFAOYSA-N	1	0	250.346	1.935	50	0		CDAARO
C[NH+]1CCN(c2cccc(Br)n2)CC1	ZINC000000005914	277113205	/nfs/dbraw/zinc/11/32/05/277113205.db2.gz	KEYDJYZYBWRMLD-UHFFFAOYSA-N	1	0	256.147	1.596	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN(C[C@@H]2CCC[NH2+]C2)CC1	ZINC000040457334	277188163	/nfs/dbraw/zinc/18/81/63/277188163.db2.gz	LCBUIDRWWNJXKR-CYBMUJFWSA-N	1	0	283.416	1.539	50	0		CDAARO
CC(C)(CO)[NH2+]C[C@H](O)c1cc(Cl)c(N)c(Cl)c1	ZINC000003602671	277304231	/nfs/dbraw/zinc/30/42/31/277304231.db2.gz	BWURCANZQUYPLR-JTQLQIEISA-N	1	0	293.194	1.970	50	0	in-vitro	CDAARO
C[C@@H](CCn1cncn1)[NH2+]C[C@H]1COc2ccccc2O1	ZINC000095419262	278237207	/nfs/dbraw/zinc/23/72/07/278237207.db2.gz	UOIJTRKIQGUMGO-STQMWFEESA-N	1	0	288.351	1.486	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)Cn1c(C)ccc1C	ZINC000170622901	279309460	/nfs/dbraw/zinc/30/94/60/279309460.db2.gz	VJAZXWAPERFILZ-CQSZACIVSA-N	1	0	263.385	1.705	50	0		CDAARO
CC(C)[NH+](CC(=O)N[C@H](C)C(=O)N1CCCCC1)C(C)C	ZINC000097048564	279403422	/nfs/dbraw/zinc/40/34/22/279403422.db2.gz	XLBIGLKDKZXMFS-CQSZACIVSA-N	1	0	297.443	1.622	50	0		CDAARO
O=C1CSC2(CC[NH+](Cc3ccccc3)CC2)N1	ZINC000043827619	280267886	/nfs/dbraw/zinc/26/78/86/280267886.db2.gz	NSPQYHCLAIRMCN-UHFFFAOYSA-N	1	0	262.378	1.842	50	0		CDAARO
CC(C)N1CCC[C@H](N2CC[NH+](C3CCCC3)CC2)C1=O	ZINC000095407273	289062520	/nfs/dbraw/zinc/06/25/20/289062520.db2.gz	RWJVCLLLQVDWRG-INIZCTEOSA-N	1	0	293.455	1.946	50	0		CDAARO
[NH3+]C[C@H]1CCCN1C(=O)/C=C\c1c(F)cccc1F	ZINC000255124137	289357516	/nfs/dbraw/zinc/35/75/16/289357516.db2.gz	AKTNUSGHKAPJOE-JYESYGNLSA-N	1	0	266.291	1.928	50	0		CDAARO
C[C@@H]1CN(C(=O)/C=C\c2ccc(C(N)=O)cc2)C[C@@H](C)[NH2+]1	ZINC000255392152	289369891	/nfs/dbraw/zinc/36/98/91/289369891.db2.gz	GSPWYVLLIBZYJE-OBBGCOQJSA-N	1	0	287.363	1.008	50	0		CDAARO
Clc1cnc(N[C@H]2[C@H]3CCO[C@H]3[C@@H]2[NH+]2CCCC2)nc1	ZINC000222322941	294120916	/nfs/dbraw/zinc/12/09/16/294120916.db2.gz	INUGYLJBZLLUCA-YVECIDJPSA-N	1	0	294.786	1.794	50	0		CDAARO
O=C(NC[C@H]1CCC[NH2+]1)c1cccnc1N1CCCC1	ZINC000178769074	315959713	/nfs/dbraw/zinc/95/97/13/315959713.db2.gz	ZYIHUKNJJKPDKJ-GFCCVEGCSA-N	1	0	274.368	1.164	50	0		CDAARO
CC(C)C(=O)N[C@@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000011704917	329289372	/nfs/dbraw/zinc/28/93/72/329289372.db2.gz	JHCDNRYHGMNMLE-CYBMUJFWSA-N	1	0	267.417	1.317	50	0		CDAARO
C[NH+](C)CC[C@H](NC(=O)C1(C)COC1)c1ccccc1	ZINC000534631785	328331848	/nfs/dbraw/zinc/33/18/48/328331848.db2.gz	BNQVFJDVXCPMKA-AWEZNQCLSA-N	1	0	276.380	1.832	50	0		CDAARO
CSCC(=O)NCC1([NH+]2CCN(C)CC2)CCCC1	ZINC000534659746	328342543	/nfs/dbraw/zinc/34/25/43/328342543.db2.gz	UDBZPSOIXUCQLU-UHFFFAOYSA-N	1	0	285.457	1.026	50	0		CDAARO
CC(C)[C@H]1C[N@H+](C)CCN1Cc1ccc(C(=O)N(C)C)[nH]1	ZINC000097376927	323208292	/nfs/dbraw/zinc/20/82/92/323208292.db2.gz	HTARYEVTPMOGGP-OAHLLOKOSA-N	1	0	292.427	1.489	50	0		CDAARO
CCCS(=O)(=O)N1CC[NH+](C2CCC(C)CC2)CC1	ZINC000019867987	326857406	/nfs/dbraw/zinc/85/74/06/326857406.db2.gz	WWJYYJUXIPFREU-UHFFFAOYSA-N	1	0	288.457	1.923	50	0		CDAARO
Cc1ccc(OC2C[NH+]([C@H]3CCNC(=O)CC3)C2)cc1	ZINC000670437762	482978003	/nfs/dbraw/zinc/97/80/03/482978003.db2.gz	YZAWCVKRIAPBQI-CYBMUJFWSA-N	1	0	274.364	1.727	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CNC(=O)c2ccncc2Cl)C1	ZINC000670439118	482983546	/nfs/dbraw/zinc/98/35/46/482983546.db2.gz	IURXEYGAYJJMMT-LLVKDONJSA-N	1	0	297.786	1.433	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)c1cccn1C1CC1	ZINC000670444276	482993771	/nfs/dbraw/zinc/99/37/71/482993771.db2.gz	KQKDGUZGRFHAOV-UHFFFAOYSA-N	1	0	284.363	1.790	50	0		CDAARO
CCCc1nc(N2CCC3(CC[N@H+](C)C3)CC2)no1	ZINC000670455468	483030945	/nfs/dbraw/zinc/03/09/45/483030945.db2.gz	OZBIIYLDQVCQCA-UHFFFAOYSA-N	1	0	264.373	1.944	50	0		CDAARO
CN(C)c1nc(CNC(=O)N(C)[C@@H]2CC[N@H+](C)C2)cs1	ZINC000670456077	483032272	/nfs/dbraw/zinc/03/22/72/483032272.db2.gz	BAVIFSRLHHNUJA-LLVKDONJSA-N	1	0	297.428	1.055	50	0		CDAARO
CCCOC[C@@H]1CC[N@H+](CC(=O)N2CCCCC2)C1	ZINC000670461885	483049534	/nfs/dbraw/zinc/04/95/34/483049534.db2.gz	RYHICIFCQRTXCU-CQSZACIVSA-N	1	0	268.401	1.747	50	0		CDAARO
COc1ccc2c(c1)CC[N@@H+](C[C@@H]1CCC(=O)O1)C2	ZINC000670465854	483056036	/nfs/dbraw/zinc/05/60/36/483056036.db2.gz	BYTCNIRYKPYHOQ-AWEZNQCLSA-N	1	0	261.321	1.759	50	0		CDAARO
COc1ncc(C)cc1NC(=O)NC1C[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000667162009	483119469	/nfs/dbraw/zinc/11/94/69/483119469.db2.gz	KAZLGLVNHVEPID-FOSCPWQOSA-N	1	0	290.367	1.803	50	0		CDAARO
CC[C@H](C)[N@H+](C)CC(=O)N(CCC(N)=O)c1ccccc1	ZINC000084721803	483318153	/nfs/dbraw/zinc/31/81/53/483318153.db2.gz	NFZULTCLFCSZJK-ZDUSSCGKSA-N	1	0	291.395	1.625	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@H](CNc2cccc(F)n2)C1	ZINC000096453234	528018754	/nfs/dbraw/zinc/01/87/54/528018754.db2.gz	DURNBUSLVYZJEA-GFCCVEGCSA-N	1	0	267.348	1.989	50	0		CDAARO
CCO[C@H]1C[C@@H](NC(=O)NCC[N@H+](C)C2CC2)C12CCC2	ZINC000096444035	528084629	/nfs/dbraw/zinc/08/46/29/528084629.db2.gz	KPYHKZOZTORFLX-KGLIPLIRSA-N	1	0	295.427	1.728	50	0		CDAARO
COc1ccc2c(c1)OC[C@H](C(=O)N1CC[NH2+][C@H](C)C1)C2	ZINC000188431611	537001787	/nfs/dbraw/zinc/00/17/87/537001787.db2.gz	DUHHWFRJGUQNCE-DGCLKSJQSA-N	1	0	290.363	1.067	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@](O)([C@@H]([NH3+])C2CCC2)C1	ZINC000958528753	613980774	/nfs/dbraw/zinc/98/07/74/613980774.db2.gz	UGABYRSCXBBBBQ-SMDDNHRTSA-N	1	0	270.373	1.486	50	0		CDAARO
CC(=O)c1cc(C[NH2+]CCN2CCCC[C@H]2CO)n(C)c1	ZINC000952962445	614248725	/nfs/dbraw/zinc/24/87/25/614248725.db2.gz	BSFBBUBMRSGZIG-HNNXBMFYSA-N	1	0	293.411	1.164	50	0		CDAARO
CCN1CCC[C@@H]1C[NH2+]C1CSCCSC1	ZINC000952989975	615133621	/nfs/dbraw/zinc/13/36/21/615133621.db2.gz	QFOBDWVNQGPBOX-GFCCVEGCSA-N	1	0	260.472	1.909	50	0		CDAARO
CC[C@H]([NH3+])C1(O)CCN(C(=O)OC(C)(C)C)CC1	ZINC000958528715	615790964	/nfs/dbraw/zinc/79/09/64/615790964.db2.gz	SKKSUOBNUIGWRA-JTQLQIEISA-N	1	0	258.362	1.486	50	0		CDAARO
C[C@@H]([NH2+]CCCNc1ccccc1)[C@@H]1CN(C)CCN1C	ZINC000888098459	617761195	/nfs/dbraw/zinc/76/11/95/617761195.db2.gz	IZRWISSKDWSCMR-WBVHZDCISA-N	1	0	290.455	1.713	50	0		CDAARO
NS(=O)(=O)C[C@@H]1CCCC[N@@H+]1CCCc1ccccc1	ZINC000585133643	1164216023	/nfs/dbraw/zinc/21/60/23/1164216023.db2.gz	OXSNASYYJZEHGW-HNNXBMFYSA-N	1	0	296.436	1.762	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@H](C)CN1c1cc(Cl)nc(N)n1	ZINC000095982748	719144530	/nfs/dbraw/zinc/14/45/30/719144530.db2.gz	AUBAJSJDJICIOF-HTQZYQBOSA-N	1	0	255.753	1.241	50	0		CDAARO
C[C@@H](CCC(=O)NCCc1cc[nH]n1)[NH+]1CCCC1	ZINC000426673994	791007846	/nfs/dbraw/zinc/00/78/46/791007846.db2.gz	GJRHRTCGXNZWEU-LBPRGKRZSA-N	1	0	264.373	1.333	50	0		CDAARO
Cc1nc([C@@H]2CCC[NH2+]C2)cc(N2CCCOCC2)n1	ZINC000039430451	790014064	/nfs/dbraw/zinc/01/40/64/790014064.db2.gz	BNILQERTVPXMOG-CYBMUJFWSA-N	1	0	276.384	1.479	50	0		CDAARO
O=c1cc(C2CC[NH2+]CC2)nc(CCc2ccccn2)[nH]1	ZINC000082039608	790016047	/nfs/dbraw/zinc/01/60/47/790016047.db2.gz	JZFZGERYFUNWJY-UHFFFAOYSA-N	1	0	284.363	1.417	50	0		CDAARO
Cc1cccc(OCCNC(=O)[C@@H]2CCC[NH2+][C@H]2C)c1	ZINC000094647854	791767371	/nfs/dbraw/zinc/76/73/71/791767371.db2.gz	CLFIGCIKDCSZNW-DZGCQCFKSA-N	1	0	276.380	1.878	50	0		CDAARO
Cc1cccc(CC[NH2+][C@@H](C)CN(C)CCO)c1	ZINC000952974474	793725186	/nfs/dbraw/zinc/72/51/86/793725186.db2.gz	JAUMMRRSPYXYDQ-AWEZNQCLSA-N	1	0	250.386	1.440	50	0		CDAARO
Cn1cnc(C(=O)NC[C@@H]2CCC[N@@H+]3CCCC[C@H]23)c1	ZINC000299758252	793804096	/nfs/dbraw/zinc/80/40/96/793804096.db2.gz	KXEWJKYETMEXDM-GXTWGEPZSA-N	1	0	276.384	1.414	50	0		CDAARO
Cc1n[nH]c(C)c1CCC[N@@H+](C)CCN1CCCC1=O	ZINC000299778313	795342769	/nfs/dbraw/zinc/34/27/69/795342769.db2.gz	GJCQBXWDJCFPFU-UHFFFAOYSA-N	1	0	278.400	1.513	50	0		CDAARO
CC[N@@H+]1CCC[C@](C)(C(=O)NCCc2nnc(C)s2)C1	ZINC000095391662	795486181	/nfs/dbraw/zinc/48/61/81/795486181.db2.gz	XTOHTZYMFHOPNG-AWEZNQCLSA-N	1	0	296.440	1.627	50	0		CDAARO
CN1CC[N@H+](CC2CCCCCC2)C[C@@H]1CCO	ZINC000020727393	796020749	/nfs/dbraw/zinc/02/07/49/796020749.db2.gz	WAPTZUSWVNLKKP-HNNXBMFYSA-N	1	0	254.418	1.955	50	0		CDAARO
CCCCc1nc(CN2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)c[nH]1	ZINC000822884285	925654466	/nfs/dbraw/zinc/65/44/66/925654466.db2.gz	CGCIIGLFEBFSJP-BETUJISGSA-N	1	0	262.401	1.746	50	0		CDAARO
CCOCC[NH+]1CCC(CNC(=O)c2ccon2)CC1	ZINC000823331711	925684574	/nfs/dbraw/zinc/68/45/74/925684574.db2.gz	QPNHEOWARQHOQD-UHFFFAOYSA-N	1	0	281.356	1.153	50	0		CDAARO
Cc1cccc(Cn2ncnc2CN2CC[C@H]([NH+](C)C)C2)c1	ZINC000823664775	925718989	/nfs/dbraw/zinc/71/89/89/925718989.db2.gz	NWDGRNUCZCGQTN-INIZCTEOSA-N	1	0	299.422	1.771	50	0		CDAARO
C[C@@H](CCNc1ccncc1F)[NH+]1CCN(C)CC1	ZINC000823789375	925733348	/nfs/dbraw/zinc/73/33/48/925733348.db2.gz	IAKYHAGZXWKYSX-LBPRGKRZSA-N	1	0	266.364	1.081	50	0		CDAARO
COCC1(C[NH2+][C@H](C)Cn2ccnc2C)CCC1	ZINC000824346791	925817600	/nfs/dbraw/zinc/81/76/00/925817600.db2.gz	FFJFGGIWPWRFHE-GFCCVEGCSA-N	1	0	251.374	1.986	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@@H](C(=O)NCCC2(O)CCCC2)C1	ZINC000827733346	925963428	/nfs/dbraw/zinc/96/34/28/925963428.db2.gz	WXTAJQXKUAKIHL-CQSZACIVSA-N	1	0	282.428	1.918	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1CCCNc1cnccn1	ZINC000828711023	926169643	/nfs/dbraw/zinc/16/96/43/926169643.db2.gz	ZILHXPISVOJVRN-GFCCVEGCSA-N	1	0	250.346	1.125	50	0		CDAARO
CC[N@H+](C[C@H](O)CO)[C@H](C)c1cccc(OC)c1	ZINC000585116911	930969817	/nfs/dbraw/zinc/96/98/17/930969817.db2.gz	MEPKPWALRDHPQQ-YPMHNXCESA-N	1	0	253.342	1.431	50	0		CDAARO
Cc1c(CNC(=O)[C@@H]2CC[N@@H+]2C(C)(C)C)cnn1C	ZINC000585132221	931025445	/nfs/dbraw/zinc/02/54/45/931025445.db2.gz	QTFREZVSNCRUQV-LBPRGKRZSA-N	1	0	264.373	1.218	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CCCn2cccn2)n1	ZINC001506400661	975149370	/nfs/dbraw/zinc/14/93/70/975149370.db2.gz	OJODGMQZFDYOBQ-CYBMUJFWSA-N	1	0	261.373	1.765	50	0		CDAARO
Cn1nccc1C(=O)Nc1ccnn1C1CC[NH+](C)CC1	ZINC001506401097	975150683	/nfs/dbraw/zinc/15/06/83/975150683.db2.gz	DOHHYCZDVWMWAW-UHFFFAOYSA-N	1	0	288.355	1.136	50	0		CDAARO
CC[C@H]1CN(C(=O)c2cccc(=O)[nH]2)CC[N@@H+]1C(C)C	ZINC001506428738	975161860	/nfs/dbraw/zinc/16/18/60/975161860.db2.gz	QADVPJBPDIDVIP-LBPRGKRZSA-N	1	0	277.368	1.732	50	0		CDAARO
O=C(NCC1CC[NH+](CCO)CC1)[C@@H]1CC12CCCCC2	ZINC001506428793	975161894	/nfs/dbraw/zinc/16/18/94/975161894.db2.gz	ZBMUDIJYCSWRGB-HNNXBMFYSA-N	1	0	294.439	1.777	50	0		CDAARO
CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)NC[C@@H](C)O)C1	ZINC000192444851	342468031	/nfs/dbraw/zinc/46/80/31/342468031.db2.gz	ICYDOALFAYLIBQ-CHWSQXEVSA-N	1	0	285.432	1.567	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCN(c2ccc(F)cc2Cl)CC1	ZINC000095996424	342468198	/nfs/dbraw/zinc/46/81/98/342468198.db2.gz	XRGCCKMAPUYXBU-GFCCVEGCSA-N	1	0	299.777	1.865	50	0		CDAARO
CC[C@@H](N[C@@H]1CC[N@H+](CC2CCCC2)C1)C(=O)OC	ZINC000192853959	342468897	/nfs/dbraw/zinc/46/88/97/342468897.db2.gz	DNEFRJRNOPOUAD-ZIAGYGMSSA-N	1	0	268.401	1.792	50	0		CDAARO
Cc1cc(C(N)=O)c(NC[C@@H](C(C)C)[NH+](C)C)nc1C	ZINC000584902990	341986602	/nfs/dbraw/zinc/98/66/02/341986602.db2.gz	RBUXIAKWGYYBQW-ZDUSSCGKSA-N	1	0	278.400	1.795	50	0		CDAARO
C[NH+](C)C(C)(C)CNC(=O)N1CCSC(C)(C)C1	ZINC000083693953	539085726	/nfs/dbraw/zinc/08/57/26/539085726.db2.gz	CXSYSJNIZKKMLP-UHFFFAOYSA-N	1	0	273.446	1.864	50	0		CDAARO
CCc1csc(CC[NH2+][C@@H]2CCNC(=O)CC2)n1	ZINC000584904033	341994151	/nfs/dbraw/zinc/99/41/51/341994151.db2.gz	KAWAZDSJOFFSED-NSHDSACASA-N	1	0	267.398	1.506	50	0		CDAARO
NC(=O)c1cc([C@H]2CCC[N@H+](CCc3ccccn3)C2)n[nH]1	ZINC000095961707	185044414	/nfs/dbraw/zinc/04/44/14/185044414.db2.gz	XLXIQTGUMOEGPF-LBPRGKRZSA-N	1	0	299.378	1.326	50	0		CDAARO
C[C@H](O)CNC(=O)NC[C@H]1CCC[N@@H+]1C1CCCCC1	ZINC000241316777	361752473	/nfs/dbraw/zinc/75/24/73/361752473.db2.gz	LUVIPHYJBKHWLL-GXTWGEPZSA-N	1	0	283.416	1.464	50	0		CDAARO
CC(C)c1cc(C(=O)N2CC[C@@H]3CC[N@H+](C)C[C@H]32)no1	ZINC000241897150	361754525	/nfs/dbraw/zinc/75/45/25/361754525.db2.gz	TVZQTXMPFFFWRZ-WCQYABFASA-N	1	0	277.368	1.964	50	0		CDAARO
OCCOCCN1CC[NH+](C2CCCCCCC2)CC1	ZINC000019636919	342088961	/nfs/dbraw/zinc/08/89/61/342088961.db2.gz	DJSFUDLNRAQHGB-UHFFFAOYSA-N	1	0	284.444	1.726	50	0		CDAARO
COc1ccc(OC)c2[nH]c(C(=O)NCC[NH+](C)C)cc21	ZINC000096114294	185101657	/nfs/dbraw/zinc/10/16/57/185101657.db2.gz	JGSBQDBTKVCDSH-UHFFFAOYSA-N	1	0	291.351	1.477	50	0	biogenic	CDAARO
C[NH+](C)C[C@@]1(O)CCCN(Cc2ccc(F)cc2)C1=O	ZINC000012762674	282130964	/nfs/dbraw/zinc/13/09/64/282130964.db2.gz	MBFKQAZCRDNBPB-HNNXBMFYSA-N	1	0	280.343	1.241	50	0		CDAARO
CC(C)C[C@H](NC(=O)C[C@H]1C[NH2+]CCO1)C(C)(C)C	ZINC000195543584	342626606	/nfs/dbraw/zinc/62/66/06/342626606.db2.gz	FCIJEPBWVFZCPZ-STQMWFEESA-N	1	0	270.417	1.942	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2cccc(Cl)n2)[C@@H]1C[NH3+]	ZINC000195542969	342626721	/nfs/dbraw/zinc/62/67/21/342626721.db2.gz	AHUBNEOOOWNICW-MWLCHTKSSA-N	1	0	267.760	1.934	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1CCN(Cc1nc(-c3cccnc3)no1)C2	ZINC000244633328	361855485	/nfs/dbraw/zinc/85/54/85/361855485.db2.gz	GBAJYPIJAJPCDD-UONOGXRCSA-N	1	0	299.378	1.800	50	0		CDAARO
Cc1ccnc(C[C@@H](C)[N@H+](C)CCn2cc[nH]c2=O)c1	ZINC000244633287	361855511	/nfs/dbraw/zinc/85/55/11/361855511.db2.gz	GAMYYAAWEPFBDQ-CYBMUJFWSA-N	1	0	274.368	1.443	50	0		CDAARO
C[NH2+][C@@H](CC(C)C)C(=O)N(C)Cc1c[nH]nc1C	ZINC000244659620	361855619	/nfs/dbraw/zinc/85/56/19/361855619.db2.gz	HFWVSEJMGOQZON-LBPRGKRZSA-N	1	0	252.362	1.311	50	0		CDAARO
CC[C@@H]1C[N@@H+]([C@@H]2[C@@H]3CCO[C@H]3C2(C)C)CCN1C[C@H](C)O	ZINC000252477649	361840204	/nfs/dbraw/zinc/84/02/04/361840204.db2.gz	SBPKRZCDZFOEHU-ZVDSWSACSA-N	1	0	296.455	1.577	50	0		CDAARO
CCc1nnc(CN2CC([N@@H+]3CCCC[C@H]3C)C2)[nH]1	ZINC000244778770	361863822	/nfs/dbraw/zinc/86/38/22/361863822.db2.gz	PWJLCPWBPNBUEJ-LLVKDONJSA-N	1	0	263.389	1.426	50	0		CDAARO
COCCC1CC[NH+](CC[C@H]2CCS(=O)(=O)C2)CC1	ZINC000625630737	342192467	/nfs/dbraw/zinc/19/24/67/342192467.db2.gz	LQFIMJUMJMULFU-AWEZNQCLSA-N	1	0	289.441	1.560	50	0		CDAARO
CC[NH+](CC)C[C@H]1CCCN(CC2OCCO2)C1	ZINC000097232342	342205282	/nfs/dbraw/zinc/20/52/82/342205282.db2.gz	UPPSRCVYYADDGD-CYBMUJFWSA-N	1	0	256.390	1.413	50	0		CDAARO
CC[C@@H]1CN(C(=O)c2ccc(C[NH3+])o2)CCS1	ZINC000097019839	185153271	/nfs/dbraw/zinc/15/32/71/185153271.db2.gz	MMRMVWRXQSQNKE-SNVBAGLBSA-N	1	0	254.355	1.706	50	0		CDAARO
CSC[C@H](C)NC(=O)N1C[C@@H]2C[N@@H+]3CCCC[C@H]3[C@@H]2C1	ZINC000245343995	539041488	/nfs/dbraw/zinc/04/14/88/539041488.db2.gz	WWTWCMKWMPGOFA-FQUUOJAGSA-N	1	0	297.468	1.864	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@]2(C1)NC(=O)N(C(C)C)C2=O	ZINC000084544264	342264313	/nfs/dbraw/zinc/26/43/13/342264313.db2.gz	VJLXVUBIOLPZRW-CYBMUJFWSA-N	1	0	253.346	1.047	50	0		CDAARO
O=C1NCCN1c1ccc(N[C@@H]2C[NH+]3CCC2CC3)cc1	ZINC000037076251	539141735	/nfs/dbraw/zinc/14/17/35/539141735.db2.gz	XUVWGLAPEIAOLO-OAHLLOKOSA-N	1	0	286.379	1.722	50	0		CDAARO
CCCC[C@H]([NH3+])C(=O)N1CC[C@@H]2OCCC[C@H]2C1	ZINC000253370120	342416194	/nfs/dbraw/zinc/41/61/94/342416194.db2.gz	MJKATVHZWBRJMN-AVGNSLFASA-N	1	0	254.374	1.531	50	0		CDAARO
C[NH+](C)[C@H]1[C@@H]2OCC[C@@H]2[C@@H]1Nc1ncnc2sccc21	ZINC000223725257	282273075	/nfs/dbraw/zinc/27/30/75/282273075.db2.gz	QAZXKKNURLNDCJ-SASUGWTJSA-N	1	0	290.392	1.821	50	0		CDAARO
CN(C(=O)c1cccnc1N1CCCC1)[C@@H]1CC[NH2+]C1	ZINC000179102163	362252177	/nfs/dbraw/zinc/25/21/77/362252177.db2.gz	DXCHLHCGDAUFQG-GFCCVEGCSA-N	1	0	274.368	1.116	50	0		CDAARO
CN(CCOCC1CC1)C(=O)N[C@H]1CC[N@@H+]2CCCC[C@H]12	ZINC000083860992	362255152	/nfs/dbraw/zinc/25/51/52/362255152.db2.gz	RTQRPPDXLYBYRV-LSDHHAIUSA-N	1	0	295.427	1.681	50	0		CDAARO
CC1CC[NH+](CC(=O)N(C)Cc2ccccn2)CC1	ZINC000084698027	362269142	/nfs/dbraw/zinc/26/91/42/362269142.db2.gz	UTHMJDDRSMQCKB-UHFFFAOYSA-N	1	0	261.369	1.772	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@]2(C1)[NH2+]CCn1cccc12	ZINC000211568927	344157846	/nfs/dbraw/zinc/15/78/46/344157846.db2.gz	YSJLEROPYPYPID-OAHLLOKOSA-N	1	0	277.368	1.927	50	0		CDAARO
[NH3+][C@H]1C[C@@H](c2cc(NCCc3ccco3)ncn2)C1	ZINC000252550806	362393777	/nfs/dbraw/zinc/39/37/77/362393777.db2.gz	SYAYBEQSUXBRJG-PHIMTYICSA-N	1	0	258.325	1.929	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)C(C)(C)[NH3+])C1	ZINC000263263680	362409387	/nfs/dbraw/zinc/40/93/87/362409387.db2.gz	NABVAZOHCMCGMX-ZIAGYGMSSA-N	1	0	281.444	1.837	50	0		CDAARO
CCn1cc(Cl)c(C(=O)N[C@@H]2CCC[NH2+]C2)n1	ZINC000097797537	185669764	/nfs/dbraw/zinc/66/97/64/185669764.db2.gz	XQGRVWRLRZQAMX-MRVPVSSYSA-N	1	0	256.737	1.038	50	0		CDAARO
Cc1nnc(NC[C@H](O)C[NH+](C)C)c2ccccc12	ZINC000029585295	348746198	/nfs/dbraw/zinc/74/61/98/348746198.db2.gz	FKOUJPGWHZDPTD-NSHDSACASA-N	1	0	260.341	1.273	50	0		CDAARO
Nc1cccc2c1ccn2CCC[NH+]1CCOCC1	ZINC000148152849	348753308	/nfs/dbraw/zinc/75/33/08/348753308.db2.gz	VONSTPBDTFURKQ-UHFFFAOYSA-N	1	0	259.353	1.946	50	0		CDAARO
CN(CC1(CO)CCC1)C(=O)CC[C@H]1CCCC[N@@H+]1C	ZINC000584896285	349357602	/nfs/dbraw/zinc/35/76/02/349357602.db2.gz	YXFNRAKCSMBLRP-CQSZACIVSA-N	1	0	282.428	1.872	50	0		CDAARO
CO[C@H]1CN(C(C)C)C[C@@H]1[NH2+]C1CSCCSC1	ZINC000584888586	349347042	/nfs/dbraw/zinc/34/70/42/349347042.db2.gz	JLIDDDCARGZECO-STQMWFEESA-N	1	0	290.498	1.532	50	0		CDAARO
Cc1nccc(NCC2CC[NH+](CC3CC3)CC2)n1	ZINC000584888915	349347226	/nfs/dbraw/zinc/34/72/26/349347226.db2.gz	WAEQHGBCQDIQCU-UHFFFAOYSA-N	1	0	260.385	1.741	50	0		CDAARO
CC(=O)NC(C)(C)C[C@@H](C)[NH2+]CC1(CO)CCC1	ZINC000584891980	349351327	/nfs/dbraw/zinc/35/13/27/349351327.db2.gz	XCMUWGKJPKAKMX-LLVKDONJSA-N	1	0	256.390	1.432	50	0		CDAARO
C[C@H](CCC(=O)N(C)CC1(CO)CCC1)[NH+]1CCCC1	ZINC000584893339	349353230	/nfs/dbraw/zinc/35/32/30/349353230.db2.gz	LHLZBMXSSXSIFF-CQSZACIVSA-N	1	0	282.428	1.872	50	0		CDAARO
C[C@H](CCC(=O)N1CCc2nocc2C1)[NH+]1CCOCC1	ZINC000584894098	349354265	/nfs/dbraw/zinc/35/42/65/349354265.db2.gz	IXAHWMOZKKMLNI-GFCCVEGCSA-N	1	0	293.367	1.060	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@H]1NS(=O)(=O)c1ccc(F)c(F)c1	ZINC000091496879	180172513	/nfs/dbraw/zinc/17/25/13/180172513.db2.gz	XNKUWXHTCCQXHL-QPUJVOFHSA-N	1	0	290.335	1.384	50	0		CDAARO
CCC[C@H]1CN(S(=O)(=O)N2CCC(C)CC2)C[C@@H]1[NH3+]	ZINC000091645771	180214992	/nfs/dbraw/zinc/21/49/92/180214992.db2.gz	FPDOHXHXGPDKGC-STQMWFEESA-N	1	0	289.445	1.022	50	0		CDAARO
CCn1c(Cn2cccn2)nnc1C1CC[NH+](C)CC1	ZINC000091793699	180257655	/nfs/dbraw/zinc/25/76/55/180257655.db2.gz	NARWNMXXESJXII-UHFFFAOYSA-N	1	0	274.372	1.352	50	0		CDAARO
C[C@@H]1C[N@H+](CCC(=O)N2CCC(C)CC2)C[C@]1(C)O	ZINC000091738176	180243758	/nfs/dbraw/zinc/24/37/58/180243758.db2.gz	QIPCIWFZZHVANU-HIFRSBDPSA-N	1	0	268.401	1.338	50	0		CDAARO
CCC[C@@]1(CO)CCC[N@H+](CCc2cnn(C)c2)C1	ZINC000091876871	180279052	/nfs/dbraw/zinc/27/90/52/180279052.db2.gz	YTZIYOMUBGYWTM-OAHLLOKOSA-N	1	0	265.401	1.837	50	0		CDAARO
OC[C@@H]1CCC[N@@H+]1C[C@H](O)c1ccc(F)cc1F	ZINC000106772580	186135006	/nfs/dbraw/zinc/13/50/06/186135006.db2.gz	GMDOCBARPZOMRE-GWCFXTLKSA-N	1	0	257.280	1.455	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1ncnc2c1ncn2C	ZINC000583652258	366019778	/nfs/dbraw/zinc/01/97/78/366019778.db2.gz	SLJKBRWGYKQEBZ-NSHDSACASA-N	1	0	274.372	1.650	50	0		CDAARO
CCOC(=O)c1ccc(NC(=O)c2cc[n+](C)cc2)cc1	ZINC000001464926	363020467	/nfs/dbraw/zinc/02/04/67/363020467.db2.gz	VMKIWUGVQWNSOB-UHFFFAOYSA-O	1	0	285.323	1.940	50	0		CDAARO
COC(=O)[C@H]1CCCCC[C@@H]1[NH2+]Cc1nnc(C)n1C	ZINC000097099593	351600353	/nfs/dbraw/zinc/60/03/53/351600353.db2.gz	LNZDVKWXQHOOQY-RYUDHWBXSA-N	1	0	280.372	1.335	50	0		CDAARO
C[C@H]([C@@H](O)c1ccccc1)N(C)C(=O)C[NH+](C)C	ZINC000006183576	366029195	/nfs/dbraw/zinc/02/91/95/366029195.db2.gz	UCCQGZNDZPTPBS-BXUZGUMPSA-N	1	0	250.342	1.129	50	0		CDAARO
C[C@H]1C[C@H]1c1ccc(C[NH2+]CC2(CO)COC2)o1	ZINC000123032243	187067097	/nfs/dbraw/zinc/06/70/97/187067097.db2.gz	PEIJVGOYSIYVOW-CMPLNLGQSA-N	1	0	251.326	1.502	50	0		CDAARO
C[C@H]1CC[NH2+]C[C@@H]1NC(=O)c1ccc(F)c(F)c1F	ZINC000094184051	363239151	/nfs/dbraw/zinc/23/91/51/363239151.db2.gz	XSDVHYUVXJZHAT-XVKPBYJWSA-N	1	0	272.270	1.832	50	0		CDAARO
C[C@H](NC(=O)[C@H]1C[C@H](O)C[NH2+]1)c1ccc(C(C)(C)C)cc1	ZINC000037007484	363312545	/nfs/dbraw/zinc/31/25/45/363312545.db2.gz	WEGAQGJCAJBCGM-TUKIKUTGSA-N	1	0	290.407	1.884	50	0		CDAARO
COCC[NH2+]CCNC(=O)c1cc(Cl)ccc1Cl	ZINC000195547820	363453523	/nfs/dbraw/zinc/45/35/23/363453523.db2.gz	XMBFBNVMDJGLAX-UHFFFAOYSA-N	1	0	291.178	1.959	50	0		CDAARO
COC(=O)c1ccc(C[n+]2c(C)n(N)c3ccccc32)cc1	ZINC000000386963	355907749	/nfs/dbraw/zinc/90/77/49/355907749.db2.gz	MDHLUBUFKPJUGZ-UHFFFAOYSA-N	1	0	296.350	1.786	50	0		CDAARO
COc1cc(C[NH2+]C[C@H]2CCCO2)cc(OC)c1OC	ZINC000000874266	355923601	/nfs/dbraw/zinc/92/36/01/355923601.db2.gz	PLDISMFHHKDCEL-GFCCVEGCSA-N	1	0	281.352	1.981	50	0		CDAARO
O=C(CSC1=[NH+]CCN1)[C@H]1COc2ccccc2O1	ZINC000000226316	355897409	/nfs/dbraw/zinc/89/74/09/355897409.db2.gz	XJWGGICMAGRMSX-GFCCVEGCSA-N	1	0	278.333	1.088	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C\C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000255068279	355984265	/nfs/dbraw/zinc/98/42/65/355984265.db2.gz	MNITYQZAKWKYOX-XOULXFPDSA-N	1	0	282.775	1.202	50	0		CDAARO
COc1cc(C(=O)OCCC[NH+](C)C)cc(OC)c1OC	ZINC000001823765	355953226	/nfs/dbraw/zinc/95/32/26/355953226.db2.gz	YMLQTFQYYKHICX-UHFFFAOYSA-N	1	0	297.351	1.821	50	0		CDAARO
O=C(CSC1=[NH+]CCN1)[C@@H]1COc2ccccc2O1	ZINC000002475742	355970634	/nfs/dbraw/zinc/97/06/34/355970634.db2.gz	XJWGGICMAGRMSX-LBPRGKRZSA-N	1	0	278.333	1.088	50	0		CDAARO
Cc1ccc([C@@H](C)[NH2+]CCN2C(=O)NC(C)(C)C2=O)o1	ZINC000097374081	356094723	/nfs/dbraw/zinc/09/47/23/356094723.db2.gz	ZUTMWVDHGCJWED-SNVBAGLBSA-N	1	0	279.340	1.569	50	0		CDAARO
CCc1ncc(C(=O)N2CC[C@H](C[NH2+]C)C2)s1	ZINC000299740001	356285599	/nfs/dbraw/zinc/28/55/99/356285599.db2.gz	UOZJPTXZCWJJQV-SECBINFHSA-N	1	0	253.371	1.387	50	0		CDAARO
CC[N@H+](C)C[C@@]1(O)CCCN(Cc2cccc(C)c2)C1=O	ZINC000012574496	356309533	/nfs/dbraw/zinc/30/95/33/356309533.db2.gz	YQYQYTZWGDNVQU-KRWDZBQOSA-N	1	0	290.407	1.800	50	0		CDAARO
Cc1c2ccccc2nc(SCC(=O)NC2CC2)[n+]1C	ZINC000032739639	356356137	/nfs/dbraw/zinc/35/61/37/356356137.db2.gz	VOSQMQAOMFLVIR-UHFFFAOYSA-N	1	0	287.388	1.612	50	0		CDAARO
C[NH+](C)CCOc1ccc(Br)cc1N	ZINC000014630907	356392215	/nfs/dbraw/zinc/39/22/15/356392215.db2.gz	SNTNRGDBPUQLPI-UHFFFAOYSA-N	1	0	259.147	1.972	50	0		CDAARO
C[C@@H](C1CC1)[N@H+](C)CC(=O)Nc1sccc1C(N)=O	ZINC000032906872	356426179	/nfs/dbraw/zinc/42/61/79/356426179.db2.gz	DGLFMDAQFUCMBS-QMMMGPOBSA-N	1	0	281.381	1.516	50	0		CDAARO
CN1C(=O)/C(=C/C=C2/CCC[N@@H+]2C)N(C)C1=S	ZINC000016918996	356449398	/nfs/dbraw/zinc/44/93/98/356449398.db2.gz	SXRPCRZFBUCPSR-LFPVQMOXSA-N	1	0	251.355	1.169	50	0		CDAARO
CCOc1ccccc1C[NH2+]CCN1CCOCC1	ZINC000019370624	356482452	/nfs/dbraw/zinc/48/24/52/356482452.db2.gz	ZJFJKXZRZPVZRE-UHFFFAOYSA-N	1	0	264.369	1.507	50	0		CDAARO
C[NH+]1CCN(CCCOc2ccc(C=O)cc2)CC1	ZINC000019798109	356505172	/nfs/dbraw/zinc/50/51/72/356505172.db2.gz	DCQLGKNEZNUOKU-UHFFFAOYSA-N	1	0	262.353	1.515	50	0		CDAARO
COc1ccc(CN2CCC[N@H+](CCC(N)=O)CC2)cc1	ZINC000025306506	356672073	/nfs/dbraw/zinc/67/20/73/356672073.db2.gz	VLANXNWWPARUJV-UHFFFAOYSA-N	1	0	291.395	1.078	50	0		CDAARO
CSc1nc2c(cnn2CC[NH3+])c(N2CCCC2)n1	ZINC000026421742	356691989	/nfs/dbraw/zinc/69/19/89/356691989.db2.gz	VKZFXTYZMOWWFZ-UHFFFAOYSA-N	1	0	278.385	1.107	50	0		CDAARO
CCN(CCCNc1ccc2nnnn2n1)c1ccccc1	ZINC000028943798	356728721	/nfs/dbraw/zinc/72/87/21/356728721.db2.gz	ONVNVCJQCAQBGI-UHFFFAOYSA-N	1	0	297.366	1.848	50	0		CDAARO
C[C@@H]([NH2+]C[C@H]1CCCN1S(C)(=O)=O)c1ccsc1	ZINC000090799506	356833125	/nfs/dbraw/zinc/83/31/25/356833125.db2.gz	RWZLQSGYQIDCRH-ZYHUDNBSSA-N	1	0	288.438	1.823	50	0		CDAARO
C[NH+]1CCN(CCOCCOc2ccccc2F)CC1	ZINC000019792514	356814721	/nfs/dbraw/zinc/81/47/21/356814721.db2.gz	QBCKGQHDDYHONB-UHFFFAOYSA-N	1	0	282.359	1.469	50	0		CDAARO
C[NH+](C)Cc1ccc(CNC(=O)C[C@H]2CCOC2)cc1	ZINC000342916851	356823373	/nfs/dbraw/zinc/82/33/73/356823373.db2.gz	UWMDTCRNILYJHT-OAHLLOKOSA-N	1	0	276.380	1.791	50	0		CDAARO
COc1ccc(NC(=O)C2([NH3+])CCCC2)cc1OC	ZINC000037615992	356914227	/nfs/dbraw/zinc/91/42/27/356914227.db2.gz	KSWAUNWWIYSNGF-UHFFFAOYSA-N	1	0	264.325	1.914	50	0		CDAARO
CN(C(=O)[C@H]([NH3+])c1ccccc1)[C@@H]1CCSC1	ZINC000037175056	356901827	/nfs/dbraw/zinc/90/18/27/356901827.db2.gz	CXSIIEMTTWJLEK-VXGBXAGGSA-N	1	0	250.367	1.650	50	0		CDAARO
C[C@@H](CO)[NH+]1CCN(c2ccnc(C(C)(C)C)n2)CC1	ZINC000096453664	357476515	/nfs/dbraw/zinc/47/65/15/357476515.db2.gz	GDELIBPRKMNYQJ-LBPRGKRZSA-N	1	0	278.400	1.277	50	0		CDAARO
O=C(CC[NH+]1CCCCCCC1)N[C@H]1CCCCNC1=O	ZINC000063845319	357517832	/nfs/dbraw/zinc/51/78/32/357517832.db2.gz	RLHVWDFIXBZNPH-AWEZNQCLSA-N	1	0	295.427	1.428	50	0		CDAARO
CC(=O)N1CCN(CC2=CCC[N@@H+](CCC(C)C)C2)CC1	ZINC000065426030	357540216	/nfs/dbraw/zinc/54/02/16/357540216.db2.gz	KMGJDWDPOKDPGB-UHFFFAOYSA-N	1	0	293.455	1.829	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC000065516475	357546329	/nfs/dbraw/zinc/54/63/29/357546329.db2.gz	WRRCTWBSFUZXTC-AWEZNQCLSA-N	1	0	264.344	1.921	50	0		CDAARO
O=C(c1cc(=O)c2ccccc2o1)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065528244	357547874	/nfs/dbraw/zinc/54/78/74/357547874.db2.gz	GEUUUQISGMOCOF-NEPJUHHUSA-N	1	0	298.342	1.760	50	0		CDAARO
[NH3+]CC(=O)NCc1cccnc1N1CCc2ccccc2C1	ZINC000067788186	357627986	/nfs/dbraw/zinc/62/79/86/357627986.db2.gz	VWWUCGJQYOFMSQ-UHFFFAOYSA-N	1	0	296.374	1.219	50	0		CDAARO
CCN(CC)C(=O)[C@@H]1C[C@@H]([NH3+])CN1Cc1c(C)noc1C	ZINC000067561743	357612905	/nfs/dbraw/zinc/61/29/05/357612905.db2.gz	IVIHEAOGFZTJIJ-OCCSQVGLSA-N	1	0	294.399	1.061	50	0		CDAARO
CCNc1cc(C)[nH+]c(NCCNC(=O)C2CCCC2)n1	ZINC000067601883	357614419	/nfs/dbraw/zinc/61/44/19/357614419.db2.gz	YBKRLGHOAKHHIN-UHFFFAOYSA-N	1	0	291.399	1.935	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)NCC1(CO)CCCC1	ZINC000067641215	357616524	/nfs/dbraw/zinc/61/65/24/357616524.db2.gz	PSUTYVFTQQEHMV-UHFFFAOYSA-N	1	0	268.401	1.531	50	0		CDAARO
COc1ncccc1C(=O)Nc1cnc2n1CCCC2	ZINC000067694693	357618763	/nfs/dbraw/zinc/61/87/63/357618763.db2.gz	OCGJVLOFTZKDTM-UHFFFAOYSA-N	1	0	272.308	1.875	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)C(C)(C)C)CC1	ZINC000023014175	357646144	/nfs/dbraw/zinc/64/61/44/357646144.db2.gz	LBFVGAJSYJGWJI-UHFFFAOYSA-N	1	0	256.390	1.507	50	0		CDAARO
O=C(NCC1C[NH2+]C1)c1cnc(-c2ccncc2)s1	ZINC000261920850	357883117	/nfs/dbraw/zinc/88/31/17/357883117.db2.gz	IXUYKGOHJLWQTK-UHFFFAOYSA-N	1	0	274.349	1.154	50	0		CDAARO
COC(=O)Cn1cc(C[NH2+][C@@H]2CCC[C@@H](C)[C@H]2C)nn1	ZINC000097080741	357945003	/nfs/dbraw/zinc/94/50/03/357945003.db2.gz	ZLVQHAVNPPONMD-NQBHXWOUSA-N	1	0	280.372	1.365	50	0		CDAARO
CCNC(=O)COc1ccc(C[NH2+][C@@H](C)[C@@H](C)OC)cc1	ZINC000097104845	357968608	/nfs/dbraw/zinc/96/86/08/357968608.db2.gz	JZQATCPDCJMISS-QWHCGFSZSA-N	1	0	294.395	1.715	50	0		CDAARO
O=C(N[C@@H]1CC[NH2+]C[C@@H]1F)OCc1ccccc1	ZINC000079032938	358058173	/nfs/dbraw/zinc/05/81/73/358058173.db2.gz	DWPWWTIOOLQURY-NWDGAFQWSA-N	1	0	252.289	1.613	50	0		CDAARO
COC[C@@H]([NH2+]CC(=O)N1CCc2ccccc2C1)C1CC1	ZINC000097049013	358115913	/nfs/dbraw/zinc/11/59/13/358115913.db2.gz	HZYJHHOYVFRUHG-MRXNPFEDSA-N	1	0	288.391	1.586	50	0		CDAARO
O=C(CCCc1cccs1)NC[C@@H]1C[C@H](F)C[NH2+]1	ZINC000082133936	358148941	/nfs/dbraw/zinc/14/89/41/358148941.db2.gz	PEXHQXABOKOROW-QWRGUYRKSA-N	1	0	270.373	1.887	50	0		CDAARO
CC(C)[NH+]1CCC(Nc2cccc(NC(=O)CO)c2)CC1	ZINC000097082135	358182547	/nfs/dbraw/zinc/18/25/47/358182547.db2.gz	NRUUBSYXFTZBKH-UHFFFAOYSA-N	1	0	291.395	1.902	50	0		CDAARO
CCC[C@H]([NH3+])C(=O)N(C)Cc1cn(C)nc1C(F)(F)F	ZINC000097234126	358192192	/nfs/dbraw/zinc/19/21/92/358192192.db2.gz	BLFSDCGDEZFCSC-VIFPVBQESA-N	1	0	292.305	1.525	50	0		CDAARO
[NH3+][C@@H]1CC[C@H]2CN(C(=O)Cc3ccc(F)cc3)C[C@H]12	ZINC000248651949	363608509	/nfs/dbraw/zinc/60/85/09/363608509.db2.gz	VDEYYPIKJPANTB-FPMFFAJLSA-N	1	0	262.328	1.564	50	0		CDAARO
C[C@H](NC(=O)[C@H]1CCC[NH2+]1)c1cccc(F)c1F	ZINC000195554985	358557456	/nfs/dbraw/zinc/55/74/56/358557456.db2.gz	PKJNRXYXNUDCSW-GZMMTYOYSA-N	1	0	254.280	1.894	50	0		CDAARO
CCN(C)S(=O)(=O)NCC[NH2+]C1CCCCCC1	ZINC000195544631	358559842	/nfs/dbraw/zinc/55/98/42/358559842.db2.gz	VHNKPCPLGXFPIL-UHFFFAOYSA-N	1	0	277.434	1.085	50	0		CDAARO
CCC[C@H]1CN(S(=O)(=O)c2c(C)noc2C)C[C@@H]1[NH3+]	ZINC000095353158	358682655	/nfs/dbraw/zinc/68/26/55/358682655.db2.gz	BYFPKYCTIZDAIJ-QWRGUYRKSA-N	1	0	287.385	1.039	50	0		CDAARO
Cc1nc(CCN(C)C(=O)CC[C@H]2CCCC[N@@H+]2C)no1	ZINC000095357732	358684202	/nfs/dbraw/zinc/68/42/02/358684202.db2.gz	PSAUMDCVILBWJB-CYBMUJFWSA-N	1	0	294.399	1.643	50	0		CDAARO
CC[NH+]1CCC(CC(=O)N[C@@H](C)c2nncn2C)CC1	ZINC000095358887	358684857	/nfs/dbraw/zinc/68/48/57/358684857.db2.gz	HPYXYDVZPKVCAL-NSHDSACASA-N	1	0	279.388	1.114	50	0		CDAARO
Cc1cnc(N2CCC[C@](O)(C[NH+](C)C)CC2)nc1	ZINC000095363827	358685531	/nfs/dbraw/zinc/68/55/31/358685531.db2.gz	NOJYNRJAWBPXPQ-CQSZACIVSA-N	1	0	264.373	1.068	50	0		CDAARO
OC[C@@]12C[N@@H+](C3CCOCC3)C[C@@H]1c1ccccc1OC2	ZINC000095370986	358687652	/nfs/dbraw/zinc/68/76/52/358687652.db2.gz	GSHSHQUFDWVRFW-NVXWUHKLSA-N	1	0	289.375	1.636	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)c3ccc(Br)o3)C[C@@H]12	ZINC000184990175	358771561	/nfs/dbraw/zinc/77/15/61/358771561.db2.gz	FXOWRZULMKWGHY-IWSPIJDZSA-N	1	0	299.168	1.851	50	0		CDAARO
O=C(C[C@H]1NC(=O)c2ccccc21)N1CCc2[nH]cnc2C1	ZINC000096165255	358712320	/nfs/dbraw/zinc/71/23/20/358712320.db2.gz	WJHYPFDYWDXXIB-CYBMUJFWSA-N	1	0	296.330	1.169	50	0		CDAARO
CSc1ncc(C(=O)N2CCc3[nH]cnc3C2)cn1	ZINC000096180537	358713352	/nfs/dbraw/zinc/71/33/52/358713352.db2.gz	TUCUEOBFNXCDKZ-UHFFFAOYSA-N	1	0	275.337	1.120	50	0		CDAARO
Cc1nc(C(=O)N(C)CCC[NH+](C)C)c(C)s1	ZINC000097394312	358772901	/nfs/dbraw/zinc/77/29/01/358772901.db2.gz	ZIACOZGWOKAYNP-UHFFFAOYSA-N	1	0	255.387	1.784	50	0		CDAARO
CN(Cc1ccc2nonc2c1)C(=O)C[C@@H]1CCC[N@@H+]1C	ZINC000097522559	358782222	/nfs/dbraw/zinc/78/22/22/358782222.db2.gz	PVLVAEWMCWSMSI-LBPRGKRZSA-N	1	0	288.351	1.666	50	0		CDAARO
COC(=O)c1cccc(NC(=O)NC[C@@H]2CCC[NH2+]2)c1	ZINC000097660354	358791600	/nfs/dbraw/zinc/79/16/00/358791600.db2.gz	WWEIKZMUFWKQMF-LBPRGKRZSA-N	1	0	277.324	1.347	50	0		CDAARO
Cc1n[nH]c(C)c1CN1CCC[C@H]([NH+](C)C)CC1	ZINC000215074957	358873128	/nfs/dbraw/zinc/87/31/28/358873128.db2.gz	CPVYGNODEQXLCN-ZDUSSCGKSA-N	1	0	250.390	1.943	50	0		CDAARO
Cc1n[nH]c(C)c1C[N@H+]1CCC[C@]2(CN(C)C(=O)O2)CC1	ZINC000215714007	358900282	/nfs/dbraw/zinc/90/02/82/358900282.db2.gz	HGKFPKNAWPUNPX-OAHLLOKOSA-N	1	0	292.383	1.833	50	0		CDAARO
CN(C)c1ccc(C[NH+]2CCC(c3ncon3)CC2)cn1	ZINC000215857535	358906954	/nfs/dbraw/zinc/90/69/54/358906954.db2.gz	BFPRYGUPLJOMJZ-UHFFFAOYSA-N	1	0	287.367	1.910	50	0		CDAARO
COc1cc(CN2C[C@H]([NH+](C)C)C[C@H]2CO)ccc1F	ZINC000216028718	358918942	/nfs/dbraw/zinc/91/89/42/358918942.db2.gz	OMXIUNXQSACNGT-OLZOCXBDSA-N	1	0	282.359	1.331	50	0		CDAARO
CN1CCC[C@@H]([N@H+](C)CCCNC(=O)OC(C)(C)C)C1=O	ZINC000095466129	358927348	/nfs/dbraw/zinc/92/73/48/358927348.db2.gz	BQIJHKFTWRLBNT-GFCCVEGCSA-N	1	0	299.415	1.454	50	0		CDAARO
CCNC(=O)NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1C	ZINC000012775844	359005197	/nfs/dbraw/zinc/00/51/97/359005197.db2.gz	KEEOPGVHSKSFMK-NWDGAFQWSA-N	1	0	277.368	1.880	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)[C@H]1CCC[C@H](O)C1	ZINC000219628394	359108907	/nfs/dbraw/zinc/10/89/07/359108907.db2.gz	YOOUGEYIVWATGP-STQMWFEESA-N	1	0	277.368	1.469	50	0		CDAARO
Cc1ccc(C[N@@H+]2CCCOCCNC(=O)CC2)s1	ZINC000257194192	359603271	/nfs/dbraw/zinc/60/32/71/359603271.db2.gz	STJAEWPFGJOUDH-UHFFFAOYSA-N	1	0	282.409	1.785	50	0		CDAARO
COCC(=O)N(C)C[C@@H]1CC[N@H+](Cc2ccc(C)s2)C1	ZINC000408516782	359900530	/nfs/dbraw/zinc/90/05/30/359900530.db2.gz	XZAFEOQXGHQUHP-ZDUSSCGKSA-N	1	0	296.436	1.983	50	0		CDAARO
O=C(c1ccccc1)N1CCC[N@H+](C[C@@H]2CCOC2)CC1	ZINC000089822957	360191633	/nfs/dbraw/zinc/19/16/33/360191633.db2.gz	GBRBIDHPESMHCP-HNNXBMFYSA-N	1	0	288.391	1.871	50	0		CDAARO
CN(C)C(=O)c1cn(C2C[NH+](CC3CCCCC3)C2)nn1	ZINC000409420205	360222998	/nfs/dbraw/zinc/22/29/98/360222998.db2.gz	SQUNRTGZCBRHES-UHFFFAOYSA-N	1	0	291.399	1.417	50	0		CDAARO
Cc1cccc(C(=O)N2C[C@H](CO)C3(C2)CC[NH2+]CC3)c1	ZINC000409420844	360224729	/nfs/dbraw/zinc/22/47/29/360224729.db2.gz	OULSRZVNYDRVAF-OAHLLOKOSA-N	1	0	288.391	1.429	50	0		CDAARO
CCN1C(=O)[C@@H]2CC3(CN2C1=O)CC[NH+](C1CCC1)CC3	ZINC000409419987	360228219	/nfs/dbraw/zinc/22/82/19/360228219.db2.gz	PAFUHVHUHFEVDU-ZDUSSCGKSA-N	1	0	291.395	1.678	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@@H]1CCNC(=O)Cn1ccnn1	ZINC000426526003	360679734	/nfs/dbraw/zinc/67/97/34/360679734.db2.gz	HHNGHLBHUCTKPG-CYBMUJFWSA-N	1	0	279.388	1.047	50	0		CDAARO
Cn1cncc1CSc1nnc([C@@H]2CCC[NH2+]C2)n1C	ZINC000426387798	360662181	/nfs/dbraw/zinc/66/21/81/360662181.db2.gz	CZCOCPMYCLAFRZ-SNVBAGLBSA-N	1	0	292.412	1.308	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2csc(C)n2)n1C	ZINC000426414430	360667440	/nfs/dbraw/zinc/66/74/40/360667440.db2.gz	AZWDHNLFYSLDRZ-UHFFFAOYSA-N	1	0	269.399	1.592	50	0		CDAARO
CCCc1nc(C)c(C(=O)N2CC[C@@H](C[NH3+])C2)s1	ZINC000178551453	189126279	/nfs/dbraw/zinc/12/62/79/189126279.db2.gz	NPMJJOUFPQRSFD-JTQLQIEISA-N	1	0	267.398	1.825	50	0		CDAARO
CN(C(=O)c1c[nH]nc1-c1ccccc1F)[C@@H]1CC[NH2+]C1	ZINC000179095453	189168859	/nfs/dbraw/zinc/16/88/59/189168859.db2.gz	HKZBVOJJCGVONW-SNVBAGLBSA-N	1	0	288.326	1.650	50	0		CDAARO
CCCS(=O)(=O)N1CC[C@H](Cn2c(C)c[nH+]c2C)C1	ZINC000575557783	360911144	/nfs/dbraw/zinc/91/11/44/360911144.db2.gz	JISHUDZSYMIAET-ZDUSSCGKSA-N	1	0	285.413	1.562	50	0		CDAARO
COC[C@H](C)C(=O)N1CCC[C@H]1[C@H]1CCC[N@@H+]1C	ZINC000248114211	361271925	/nfs/dbraw/zinc/27/19/25/361271925.db2.gz	IEMVWFOTKMOAIQ-XQQFMLRXSA-N	1	0	254.374	1.354	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC[C@H]([NH3+])C2)c(Cl)c1	ZINC000036297045	361462410	/nfs/dbraw/zinc/46/24/10/361462410.db2.gz	YAYJZWFNDAARQK-JTQLQIEISA-N	1	0	288.800	1.760	50	0		CDAARO
CC(C)CN1C(=O)C[C@@H](Nc2ccc(N(C)C)cc2)C1=O	ZINC000017877543	364501533	/nfs/dbraw/zinc/50/15/33/364501533.db2.gz	JCQMMDMNSXCBKT-CQSZACIVSA-N	1	0	289.379	1.948	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)c2ccccc2Br)C1	ZINC000050228607	365501360	/nfs/dbraw/zinc/50/13/60/365501360.db2.gz	WAYUWUBPCHLGFK-MRVPVSSYSA-N	1	0	269.142	1.622	50	0		CDAARO
O=C(C[N@H+]1CCCC[C@@H]1CCO)NC(C1CC1)C1CC1	ZINC000089819033	366941252	/nfs/dbraw/zinc/94/12/52/366941252.db2.gz	MFZRZUKDZHTXOE-CQSZACIVSA-N	1	0	280.412	1.528	50	0		CDAARO
NC(=O)c1ccc(C[NH2+]C[C@H](O)c2ccccc2)s1	ZINC000089826360	366941603	/nfs/dbraw/zinc/94/16/03/366941603.db2.gz	TYMSAKNBNAXNCG-LBPRGKRZSA-N	1	0	276.361	1.670	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1Cc1csc(-c2ncccn2)n1	ZINC000089939307	366974054	/nfs/dbraw/zinc/97/40/54/366974054.db2.gz	ZNRJGDVYAAEWIG-LLVKDONJSA-N	1	0	289.408	1.736	50	0		CDAARO
CCNC(=O)C(C)(C)C[NH2+][C@@H]1C[C@@H]2OCCC[C@@H]12	ZINC000252523243	367784543	/nfs/dbraw/zinc/78/45/43/367784543.db2.gz	CEHUHTHQWKXSPY-TUAOUCFPSA-N	1	0	254.374	1.306	50	0		CDAARO
CC[NH+]1CCN(CC(=O)NCc2cc(F)ccc2F)CC1	ZINC000360134966	368134653	/nfs/dbraw/zinc/13/46/53/368134653.db2.gz	HUWNYDCEKPEWPS-UHFFFAOYSA-N	1	0	297.349	1.219	50	0		CDAARO
NC(=O)C[C@@H](c1ccc2c(c1)OCCCO2)n1ccnc1	ZINC000012540573	368627125	/nfs/dbraw/zinc/62/71/25/368627125.db2.gz	PWVQWQSUSJWSJC-LBPRGKRZSA-N	1	0	287.319	1.509	50	0		CDAARO
CCCN1C[C@H](C[NH2+][C@H]2CCCSC2)CC1=O	ZINC000421356229	244661285	/nfs/dbraw/zinc/66/12/85/244661285.db2.gz	WQZCLGSWYHXIIP-RYUDHWBXSA-N	1	0	256.415	1.730	50	0		CDAARO
COC1CC[NH+](C2CN(C(=O)/C=C/c3ccco3)C2)CC1	ZINC000575610276	370642609	/nfs/dbraw/zinc/64/26/09/370642609.db2.gz	GNZJGTPRKTYOTK-SNAWJCMRSA-N	1	0	290.363	1.614	50	0		CDAARO
Cc1nn[nH]c1C(=O)N[C@@H]1CCC[N@@H+](C2CCCCC2)C1	ZINC000299774904	372753270	/nfs/dbraw/zinc/75/32/70/372753270.db2.gz	JARKANOKOJBXAI-GFCCVEGCSA-N	1	0	291.399	1.640	50	0		CDAARO
COCCN1C[C@@H](C[NH+]2CC(c3nccs3)C2)CC1=O	ZINC000299788446	372762885	/nfs/dbraw/zinc/76/28/85/372762885.db2.gz	SOOJOLOUGAZCLX-LLVKDONJSA-N	1	0	295.408	1.037	50	0		CDAARO
O=C(NC[C@@]1(O)CC[NH2+]C1)c1cccc(-c2ccncc2)c1	ZINC000299790766	372764463	/nfs/dbraw/zinc/76/44/63/372764463.db2.gz	BPBYGWNNLDFJLS-QGZVFWFLSA-N	1	0	297.358	1.203	50	0		CDAARO
C[N@@H+]1CCC[C@]2(CCCN(C(=O)c3csnc3N)C2)C1	ZINC000299796208	372769909	/nfs/dbraw/zinc/76/99/09/372769909.db2.gz	MZFFJAMCRVAKKS-AWEZNQCLSA-N	1	0	294.424	1.673	50	0		CDAARO
CSCCN1CCN(C(=O)CCc2cccnc2)CC1	ZINC000299801220	372770956	/nfs/dbraw/zinc/77/09/56/372770956.db2.gz	WPBOUNCVCNURKO-UHFFFAOYSA-N	1	0	293.436	1.521	50	0		CDAARO
C[N@H+]1C[C@H]2CN(C(=O)c3ccnn3-c3ccccc3)C[C@H]2C1	ZINC000253419660	373728221	/nfs/dbraw/zinc/72/82/21/373728221.db2.gz	AQROMQJWUUQIMV-OKILXGFUSA-N	1	0	296.374	1.506	50	0		CDAARO
Cn1c(C[NH2+][C@@H]2CCCC[C@H]2O)nc2ccccc21	ZINC000104313582	374267363	/nfs/dbraw/zinc/26/73/63/374267363.db2.gz	OJLPVMGSZNPXDL-TZMCWYRMSA-N	1	0	259.353	1.966	50	0		CDAARO
O=C(NCCc1csc2ccccc12)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000276644304	374738921	/nfs/dbraw/zinc/73/89/21/374738921.db2.gz	MXBMYVXKGHDIIU-DGCLKSJQSA-N	1	0	290.388	1.283	50	0		CDAARO
CCOc1ncccc1C(=O)N1CCC[N@H+](C)CC1	ZINC000095351439	374888737	/nfs/dbraw/zinc/88/87/37/374888737.db2.gz	VRDNJYKCMMZFFG-UHFFFAOYSA-N	1	0	263.341	1.258	50	0		CDAARO
COCCNC(=O)CCNc1cc[nH+]c2cc(F)ccc12	ZINC000095396740	374901864	/nfs/dbraw/zinc/90/18/64/374901864.db2.gz	YZSQOPLWXXXTOV-UHFFFAOYSA-N	1	0	291.326	1.939	50	0		CDAARO
CCc1noc(CN(C)C(=O)[C@@H]2C[C@H]3CCCC[C@@H]3[NH2+]2)n1	ZINC000095426495	374927101	/nfs/dbraw/zinc/92/71/01/374927101.db2.gz	OCVGDLWYOLZNKY-WOPDTQHZSA-N	1	0	292.383	1.511	50	0		CDAARO
CCSC[C@H](C)[N@H+](C)CCN1C(=O)CCC1=O	ZINC000095432224	374933120	/nfs/dbraw/zinc/93/31/20/374933120.db2.gz	YUWAZULPTDRDRV-JTQLQIEISA-N	1	0	258.387	1.209	50	0		CDAARO
Nc1nnc(CC[N@H+](CCO)Cc2ccccc2)s1	ZINC000095435796	374936062	/nfs/dbraw/zinc/93/60/62/374936062.db2.gz	VBIUWVWKUHMXCB-UHFFFAOYSA-N	1	0	278.381	1.157	50	0		CDAARO
C[C@@H](Cc1cnccn1)[NH2+]C1CCN(c2ncccn2)CC1	ZINC000095509855	374976673	/nfs/dbraw/zinc/97/66/73/374976673.db2.gz	QUWYLLRRUDJJRB-ZDUSSCGKSA-N	1	0	298.394	1.456	50	0		CDAARO
NC(=O)c1ccc(N2CC[NH+](C[C@@H]3CCCO3)CC2)cc1	ZINC000096410354	375096934	/nfs/dbraw/zinc/09/69/34/375096934.db2.gz	UORLNMCBCLIMGU-HNNXBMFYSA-N	1	0	289.379	1.087	50	0		CDAARO
C(C[NH+]1CCCCC1)c1nc([C@@H]2CCOC2)no1	ZINC000096162799	375059432	/nfs/dbraw/zinc/05/94/32/375059432.db2.gz	DSGKJFPNPMVKKI-LLVKDONJSA-N	1	0	251.330	1.602	50	0		CDAARO
COCCn1ccc(NC(=O)[C@H](C)[N@H+]2[C@H](C)CC[C@@H]2C)n1	ZINC000097108168	375148786	/nfs/dbraw/zinc/14/87/86/375148786.db2.gz	NCFDLOMEDMOKKI-XQQFMLRXSA-N	1	0	294.399	1.729	50	0		CDAARO
CCCCOc1ncccc1CNC(=O)[C@@H]1CCC[N@@H+]1C	ZINC000299499918	375175628	/nfs/dbraw/zinc/17/56/28/375175628.db2.gz	KHEGUEJTDHVYNS-AWEZNQCLSA-N	1	0	291.395	1.971	50	0		CDAARO
CN(Cc1ccccc1F)C(=O)[C@]1(F)CC[NH2+]C1	ZINC000299739924	375200457	/nfs/dbraw/zinc/20/04/57/375200457.db2.gz	SYRSZLNYSGEDSM-ZDUSSCGKSA-N	1	0	254.280	1.486	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)/C=C\c2ccccn2)C1	ZINC000606441393	375823458	/nfs/dbraw/zinc/82/34/58/375823458.db2.gz	WQRRGHBOOQWTEW-WSROAFLRSA-N	1	0	259.353	1.553	50	0		CDAARO
Cn1cc(Cl)cc1C(=O)NC(C)(C)C[NH+](C)C	ZINC000457208673	375829985	/nfs/dbraw/zinc/82/99/85/375829985.db2.gz	BPBSNBUKVFGOFM-UHFFFAOYSA-N	1	0	257.765	1.749	50	0		CDAARO
CNc1nc(-c2cccc3c2O[C@@H](C[NH3+])C3)ncc1F	ZINC000067539910	377140449	/nfs/dbraw/zinc/14/04/49/377140449.db2.gz	DJDKPJTZZAKUAB-SECBINFHSA-N	1	0	274.299	1.587	50	0		CDAARO
C[C@H]1C[N@H+](CC(C)(C)O)CCN1C(=O)N[C@H]1C=CCCC1	ZINC000189295129	377227221	/nfs/dbraw/zinc/22/72/21/377227221.db2.gz	STDZHEPWMFWTBY-KBPBESRZSA-N	1	0	295.427	1.582	50	0		CDAARO
[NH3+]C[C@H](O)COCCC12CC3CC(CC(C3)C1)C2	ZINC000002271240	390141625	/nfs/dbraw/zinc/14/16/25/390141625.db2.gz	BTXJWBXVRNLYAC-IHXHZNKUSA-N	1	0	253.386	1.929	50	0		CDAARO
C[C@@H]1CN(C)CCN1C(=O)[C@H]1Cc2ccccc2S1	ZINC000336317296	390607177	/nfs/dbraw/zinc/60/71/77/390607177.db2.gz	FPCSHEJUYNDZKS-BXUZGUMPSA-N	1	0	276.405	1.866	50	0		CDAARO
C[C@H]([NH2+][C@@H](CO)[C@@H]1CCCOC1)[C@@H]1C[C@H]1C1CC1	ZINC000527722881	391943554	/nfs/dbraw/zinc/94/35/54/391943554.db2.gz	ZHUPBHJAEIEGIH-KLLKFSIISA-N	1	0	253.386	1.798	50	0		CDAARO
COC[C@H]1CCN(C(=O)[C@@H]2CCCC[N@@H+]2C(C)C)C1	ZINC000096421745	393185587	/nfs/dbraw/zinc/18/55/87/393185587.db2.gz	TYLQKQOETFMNHF-KBPBESRZSA-N	1	0	268.401	1.744	50	0		CDAARO
COC(=O)c1ccc(OC[C@H](O)C[NH+]2CCCCC2)cc1	ZINC000005021959	292014704	/nfs/dbraw/zinc/01/47/04/292014704.db2.gz	OQNDAPBQOQRXFY-CQSZACIVSA-N	1	0	293.363	1.699	50	0		CDAARO
O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCOC1	ZINC000093064764	135078263	/nfs/dbraw/zinc/07/82/63/135078263.db2.gz	KMDYRUJXTXMZNH-AWEZNQCLSA-N	1	0	289.379	1.451	50	0		CDAARO
CCc1nnsc1C(=O)NCc1cccnc1N(C)C	ZINC000032690005	397762657	/nfs/dbraw/zinc/76/26/57/397762657.db2.gz	BNAHNYVJIFLGLJ-UHFFFAOYSA-N	1	0	291.380	1.492	50	0		CDAARO
C[C@H](C(=O)Nc1sccc1C(N)=O)N1CCC[C@@H](C)C1	ZINC000104714220	397950118	/nfs/dbraw/zinc/95/01/18/397950118.db2.gz	PAJZXEZUOOIMMH-NXEZZACHSA-N	1	0	295.408	1.906	50	0		CDAARO
CCN(CC)c1ncnc(N2CCSCC2)c1N	ZINC000103408318	397900296	/nfs/dbraw/zinc/90/02/96/397900296.db2.gz	UIGVHZNVZYSAMI-UHFFFAOYSA-N	1	0	267.402	1.458	50	0		CDAARO
c1cc(C[N@@H+]2CCN3CCOC[C@H]3C2)cc2c1OCC2	ZINC000375238886	160356061	/nfs/dbraw/zinc/35/60/61/160356061.db2.gz	SEKXHZWBSALOKL-OAHLLOKOSA-N	1	0	274.364	1.138	50	0		CDAARO
O=C([C@H]1C[NH2+]CCN1c1ccccc1)N1CCCCO1	ZINC000020995023	304454912	/nfs/dbraw/zinc/45/49/12/304454912.db2.gz	ORWMVJDPCSYWFW-CQSZACIVSA-N	1	0	275.352	1.019	50	0		CDAARO
O[C@@H](COCc1ccc2c(c1)OCO2)C[NH+]1CCCCC1	ZINC000005029693	170058056	/nfs/dbraw/zinc/05/80/56/170058056.db2.gz	LRBZBYUWANWFAX-CQSZACIVSA-N	1	0	293.363	1.779	50	0		CDAARO
O=S(=O)(NCC[NH+]1CCCC1)c1ccc(F)c(F)c1	ZINC000009513645	170379796	/nfs/dbraw/zinc/37/97/96/170379796.db2.gz	STICVLVZWZKMHB-UHFFFAOYSA-N	1	0	290.335	1.339	50	0		CDAARO
Cc1ccc(OCC(=O)NCCC[NH+](C)C)c(C)c1	ZINC000009907322	170389324	/nfs/dbraw/zinc/38/93/24/170389324.db2.gz	YUKWAMURUDXKPP-UHFFFAOYSA-N	1	0	264.369	1.750	50	0		CDAARO
COc1ccc2[nH]c(CN3CC[NH2+][C@@H](C)C3)nc2c1	ZINC000022122127	171353871	/nfs/dbraw/zinc/35/38/71/171353871.db2.gz	DXZOYAMZSPMJAW-JTQLQIEISA-N	1	0	260.341	1.365	50	0		CDAARO
COc1ccc(Br)cc1CN1CC[NH2+]CC1	ZINC000022135333	171354972	/nfs/dbraw/zinc/35/49/72/171354972.db2.gz	BVVSAQBPJQCNRL-UHFFFAOYSA-N	1	0	285.185	1.863	50	0		CDAARO
CCOC(=O)[C@@H](C[NH3+])c1ccc(OC)c(OC)c1	ZINC000035287638	172105816	/nfs/dbraw/zinc/10/58/16/172105816.db2.gz	SVBYEXVSRYCLDO-JTQLQIEISA-N	1	0	253.298	1.309	50	0		CDAARO
CCCN(C(=O)c1ccc(OC)cc1)[C@H]1CC[NH2+]C1	ZINC000037540156	173262191	/nfs/dbraw/zinc/26/21/91/173262191.db2.gz	DOWJSUFAOXVZNO-ZDUSSCGKSA-N	1	0	262.353	1.909	50	0		CDAARO
O=S1(=O)CC[C@@H](C[NH2+]C2CC(c3ccccc3)C2)C1	ZINC000038083278	174092854	/nfs/dbraw/zinc/09/28/54/174092854.db2.gz	OBGIGIJXXRYFOB-GRTSSRMGSA-N	1	0	279.405	1.957	50	0		CDAARO
OCC[C@@H]1C[NH2+]CCN1Cc1ccccc1Cl	ZINC000038534549	174144703	/nfs/dbraw/zinc/14/47/03/174144703.db2.gz	UZJGQUXFKRPWNO-GFCCVEGCSA-N	1	0	254.761	1.496	50	0		CDAARO
Cc1cc(C(=O)N2CCC3(C2)CC[NH+](C)CC3)cc(=O)[nH]1	ZINC000067446825	175775097	/nfs/dbraw/zinc/77/50/97/175775097.db2.gz	RALHYWGKCWODEN-UHFFFAOYSA-N	1	0	289.379	1.241	50	0		CDAARO
Cc1nc(CC[NH3+])cc(N(C)Cc2ccsc2)n1	ZINC000067473497	175776016	/nfs/dbraw/zinc/77/60/16/175776016.db2.gz	IDKRYZISDXKDEJ-UHFFFAOYSA-N	1	0	262.382	1.984	50	0		CDAARO
Cc1cc(C)nc(CNc2cc(CC[NH3+])nc(C)n2)n1	ZINC000067821341	175794869	/nfs/dbraw/zinc/79/48/69/175794869.db2.gz	RFCUSMOFIKQZHU-UHFFFAOYSA-N	1	0	272.356	1.305	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@@H](CCNC(=O)c2cncs2)C1	ZINC000071314975	176121623	/nfs/dbraw/zinc/12/16/23/176121623.db2.gz	WKTBZLWZLIROBM-LBPRGKRZSA-N	1	0	297.424	1.620	50	0		CDAARO
C[NH2+]CC(=O)N[C@H]1CCC[C@H]1Cc1ccc(F)cc1	ZINC000071747975	176258993	/nfs/dbraw/zinc/25/89/93/176258993.db2.gz	NEFIRLXUKUFFSP-JSGCOSHPSA-N	1	0	264.344	1.873	50	0		CDAARO
Cc1ccc(C)c(OCCNC(=O)[C@@H]2CCCC[NH2+]2)c1	ZINC000071758745	176260804	/nfs/dbraw/zinc/26/08/04/176260804.db2.gz	GAHDJJNDQSJUOJ-AWEZNQCLSA-N	1	0	276.380	1.941	50	0		CDAARO
Cc1ccc([C@H](C)NC(=O)c2cn(CC[NH3+])nn2)c(C)c1	ZINC000071764332	176261860	/nfs/dbraw/zinc/26/18/60/176261860.db2.gz	VJEUBSBHDNSMJY-LBPRGKRZSA-N	1	0	287.367	1.345	50	0		CDAARO
Cc1cnccc1CN(C)Cc1cc2n(n1)CC[NH2+]C2	ZINC000072137032	176322411	/nfs/dbraw/zinc/32/24/11/176322411.db2.gz	LTSCAEMLFIYODD-UHFFFAOYSA-N	1	0	271.368	1.322	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)c2cnn3ccccc23)CC1	ZINC000072161719	176329931	/nfs/dbraw/zinc/32/99/31/176329931.db2.gz	FEHWUHBKYKWUHS-LLVKDONJSA-N	1	0	258.325	1.288	50	0		CDAARO
CC[C@H]1COCCN1C(=O)CSCC[NH+]1CCCC1	ZINC000077353988	177256342	/nfs/dbraw/zinc/25/63/42/177256342.db2.gz	WWITVAJREPLFGM-ZDUSSCGKSA-N	1	0	286.441	1.453	50	0		CDAARO
C[N@@H+]1CC[C@H]2CN(C(=O)c3ncoc3C3CC3)C[C@H]21	ZINC000077554212	177280817	/nfs/dbraw/zinc/28/08/17/177280817.db2.gz	AYCGEKHTVZGYLU-WDEREUQCSA-N	1	0	261.325	1.328	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2ncncc2Cl)[C@@H]1C[NH3+]	ZINC000179222200	287342505	/nfs/dbraw/zinc/34/25/05/287342505.db2.gz	MFVATGFOGLJSML-PSASIEDQSA-N	1	0	268.748	1.329	50	0		CDAARO
Brc1cccc(C2=NC3(CC[NH2+]CC3)ON2)c1	ZINC000085397322	275373436	/nfs/dbraw/zinc/37/34/36/275373436.db2.gz	RFNRBWULCBSZGX-UHFFFAOYSA-N	1	0	296.168	1.810	50	0		CDAARO
CC(C)(C)c1oc(C(N)=O)cc1CN1CC[C@H]2C[NH2+]C[C@H]21	ZINC000077393464	275853645	/nfs/dbraw/zinc/85/36/45/275853645.db2.gz	QEPWXRVZTKBKAI-CMPLNLGQSA-N	1	0	291.395	1.470	50	0		CDAARO
C[NH+]1CCC2(CC1)C[C@@H](NC=O)c1ccccc1O2	ZINC000003419253	277035553	/nfs/dbraw/zinc/03/55/53/277035553.db2.gz	ISPACVVZRNDVLR-CYBMUJFWSA-N	1	0	260.337	1.721	50	0		CDAARO
COC(=O)[C@]1(C)CC[N@@H+]([C@H]2Cc3ccccc3[C@@H]2O)C1	ZINC000271989881	277144869	/nfs/dbraw/zinc/14/48/69/277144869.db2.gz	PQPPUBZEKKLWJE-OFQRWUPVSA-N	1	0	275.348	1.530	50	0		CDAARO
C[NH2+]C1CCN(C(=O)c2cnn(C(C)(C)C)c2C)CC1	ZINC000179133011	277263289	/nfs/dbraw/zinc/26/32/89/277263289.db2.gz	ZSSSHMBMKCNPAK-UHFFFAOYSA-N	1	0	278.400	1.771	50	0		CDAARO
C[C@H]1CCC[C@H]1OC[C@@H](O)C[NH+]1C[C@@H](C)O[C@H](C)C1	ZINC000012414199	278354995	/nfs/dbraw/zinc/35/49/95/278354995.db2.gz	NOPQVBCPBSUPGR-VYDRJRHOSA-N	1	0	271.401	1.662	50	0		CDAARO
CC(C)(C)c1ncc(S(C)(=O)=O)c([C@H]2CCC[NH2+]C2)n1	ZINC000071752120	278572735	/nfs/dbraw/zinc/57/27/35/278572735.db2.gz	AYCCPJDWCUXMLE-JTQLQIEISA-N	1	0	297.424	1.645	50	0		CDAARO
CCCN(CCC)C(=O)C[NH2+][C@@H]1CCC[C@@]1(C)CO	ZINC000097105297	278780385	/nfs/dbraw/zinc/78/03/85/278780385.db2.gz	GHTNERPXLJXPEW-HIFRSBDPSA-N	1	0	270.417	1.776	50	0		CDAARO
C[C@]1(O)CCN(c2cc[nH+]c3ccccc32)C[C@@H]1O	ZINC000096130781	280171123	/nfs/dbraw/zinc/17/11/23/280171123.db2.gz	ZTVODRLTSFEKDW-GJZGRUSLSA-N	1	0	258.321	1.557	50	0		CDAARO
Cc1cc(C(F)(F)F)nc(N2CCC([NH3+])CC2)n1	ZINC000012396917	280377494	/nfs/dbraw/zinc/37/74/94/280377494.db2.gz	ZQDYYDUFNDPZDG-UHFFFAOYSA-N	1	0	260.263	1.731	50	0		CDAARO
c1cnn([C@H]2CCCC[C@H]2[NH2+]CC2OCCO2)c1	ZINC000128391933	280502877	/nfs/dbraw/zinc/50/28/77/280502877.db2.gz	JCNUJXUYCKURJX-NEPJUHHUSA-N	1	0	251.330	1.329	50	0		CDAARO
CN(C)CC(=O)N[C@@H]1CCC[N@@H+](C2CCCCCC2)C1	ZINC000011840357	282058848	/nfs/dbraw/zinc/05/88/48/282058848.db2.gz	OFQULTBYJYDJSZ-CQSZACIVSA-N	1	0	281.444	1.851	50	0		CDAARO
Cc1ncc(/C=C\C(=O)N2CCC[C@@H]([NH3+])C2)s1	ZINC000255126318	289357794	/nfs/dbraw/zinc/35/77/94/289357794.db2.gz	QFMJSUVPTKROBE-UMCURTJPSA-N	1	0	251.355	1.414	50	0		CDAARO
Cc1ncc(/C=C\C(=O)N2CC[NH2+][C@@H](C)C2)s1	ZINC000255165264	289360140	/nfs/dbraw/zinc/36/01/40/289360140.db2.gz	KZUAHERBLIWACD-TYRPZCRBSA-N	1	0	251.355	1.285	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)/C=C\c2ccc3c(c2)CCO3)C1	ZINC000255195918	289360527	/nfs/dbraw/zinc/36/05/27/289360527.db2.gz	HLDPLAFFVBHGKT-MFBWXBCUSA-N	1	0	286.375	1.703	50	0		CDAARO
[NH3+]C[C@H]1CCCN1C(=O)/C=C\c1ccc2c(c1)OCCO2	ZINC000255344757	289367706	/nfs/dbraw/zinc/36/77/06/289367706.db2.gz	LJGJITNLXXZTBE-RYWCDNDXSA-N	1	0	288.347	1.421	50	0		CDAARO
Cc1c[nH+]ccc1N1CCCN(C(=O)[C@H]2CCCO2)CC1	ZINC000082146741	292980315	/nfs/dbraw/zinc/98/03/15/292980315.db2.gz	HHTFGQFCBHRDHC-OAHLLOKOSA-N	1	0	289.379	1.608	50	0		CDAARO
C[C@@H](C[NH+]1CCCCC1)NC(=O)c1nc(C2CC2)nn1C	ZINC000562831068	293208872	/nfs/dbraw/zinc/20/88/72/293208872.db2.gz	BUQPJSSNCBDWLU-NSHDSACASA-N	1	0	291.399	1.297	50	0		CDAARO
Cc1ccsc1C[N@H+](CC(C)C)C[C@H](O)CO	ZINC000055576454	302302005	/nfs/dbraw/zinc/30/20/05/302302005.db2.gz	QNKNYULVZRSPOP-LBPRGKRZSA-N	1	0	257.399	1.868	50	0		CDAARO
Cc1ccc(-c2n[nH]cc2C[NH2+]C[C@]2(O)CCOC2)o1	ZINC000179027785	315967225	/nfs/dbraw/zinc/96/72/25/315967225.db2.gz	UVVDZRKCKROIJY-CQSZACIVSA-N	1	0	277.324	1.219	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)s1	ZINC000534589996	328317646	/nfs/dbraw/zinc/31/76/46/328317646.db2.gz	PIDTZYLYXMLBAT-BKUVIOGVSA-N	1	0	298.433	1.427	50	0		CDAARO
Cc1cccc(N2CCC([NH2+]CCn3ccnn3)CC2)c1	ZINC000534650920	328337144	/nfs/dbraw/zinc/33/71/44/328337144.db2.gz	WAYZBRSXKNUUQV-UHFFFAOYSA-N	1	0	285.395	1.845	50	0		CDAARO
Cc1ccc(C2(C(=O)NC[C@H](O)C[NH+](C)C)CC2)cc1	ZINC000534647352	328342840	/nfs/dbraw/zinc/34/28/40/328342840.db2.gz	KXYOTNKBHJBAFW-AWEZNQCLSA-N	1	0	276.380	1.065	50	0		CDAARO
Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]1C=CC[NH2+]1	ZINC000534648368	328343303	/nfs/dbraw/zinc/34/33/03/328343303.db2.gz	OBRQUZPOBCFTGG-OAHLLOKOSA-N	1	0	269.348	1.663	50	0		CDAARO
O=C(c1ccc2nccnc2c1)N1C[C@@H]2CC[NH2+][C@@H]2C1	ZINC000534660510	328339478	/nfs/dbraw/zinc/33/94/78/328339478.db2.gz	CTYRGQKRYYHVQR-SMDDNHRTSA-N	1	0	268.320	1.064	50	0		CDAARO
NC(=O)c1ccc(NC[C@H]2CC[N@@H+](C3CCCC3)C2)nc1	ZINC000534670885	328347321	/nfs/dbraw/zinc/34/73/21/328347321.db2.gz	VRTLWEJPRGFRES-GFCCVEGCSA-N	1	0	288.395	1.279	50	0		CDAARO
FC(F)(F)[C@]1(c2nc(-c3ccccn3)no2)CC[NH2+]C1	ZINC000111240724	330381618	/nfs/dbraw/zinc/38/16/18/330381618.db2.gz	OFKVXWJVHOBEGA-LLVKDONJSA-N	1	0	284.241	1.925	50	0		CDAARO
OC[C@@]12C[N@H+](Cc3ccncc3Cl)C[C@@H]1COCC2	ZINC001772707570	1159441543	/nfs/dbraw/zinc/44/15/43/1159441543.db2.gz	VFGIJOYQDJXUEV-TZMCWYRMSA-N	1	0	282.771	1.566	50	0		CDAARO
NC(=O)[C@@H]1C[C@H](O)C[N@@H+]1CCCc1cccc2ccccc21	ZINC000108083109	482449425	/nfs/dbraw/zinc/44/94/25/482449425.db2.gz	GCVWIEJGEDUPJV-RDJZCZTQSA-N	1	0	298.386	1.693	50	0		CDAARO
CC(C)=CC[C@@]1(CO)CCC[N@H+](CCC(N)=O)C1	ZINC000091468899	482567940	/nfs/dbraw/zinc/56/79/40/482567940.db2.gz	FDZHWNLGUNISDN-AWEZNQCLSA-N	1	0	254.374	1.293	50	0		CDAARO
C[NH+](C)[C@@H]1CCC[C@H]1NC(=O)CCN1CCCCCC1=O	ZINC000670434668	482970126	/nfs/dbraw/zinc/97/01/26/482970126.db2.gz	UJQBZPKEEWJDQG-ZIAGYGMSSA-N	1	0	295.427	1.378	50	0		CDAARO
CC(C)c1nnc(NCC[N@@H+]2CCC[C@H](CO)C2)s1	ZINC000670435557	482972035	/nfs/dbraw/zinc/97/20/35/482972035.db2.gz	YQYUEYDRQLFCBM-NSHDSACASA-N	1	0	284.429	1.778	50	0		CDAARO
CCCc1cnc(N2CCC[C@@](CO)(C[NH+](C)C)C2)nc1	ZINC000670442966	482989556	/nfs/dbraw/zinc/98/95/56/482989556.db2.gz	DNYNZCSOCQJRMX-MRXNPFEDSA-N	1	0	292.427	1.570	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CCCn2ccccc2=O)n1	ZINC000670450634	483008596	/nfs/dbraw/zinc/00/85/96/483008596.db2.gz	SVPOOLGUHUSOKT-AWEZNQCLSA-N	1	0	288.395	1.730	50	0		CDAARO
CN(Cc1c[nH]cn1)CC1([NH+]2CCOCC2)CCCCC1	ZINC000670460952	483046410	/nfs/dbraw/zinc/04/64/10/483046410.db2.gz	WCUDJLYXLYHVDY-UHFFFAOYSA-N	1	0	292.427	1.877	50	0		CDAARO
O=C(NC1CC[NH+](Cc2cccs2)CC1)c1ncc[nH]1	ZINC000670472956	483082325	/nfs/dbraw/zinc/08/23/25/483082325.db2.gz	GBQFTVZYYJMUOJ-UHFFFAOYSA-N	1	0	290.392	1.866	50	0		CDAARO
CNC(=O)C[C@H]1CC[N@H+](CC(=O)NC2CCCCCC2)C1	ZINC000670474328	483084313	/nfs/dbraw/zinc/08/43/13/483084313.db2.gz	HKIBIPXSJFFXIZ-CYBMUJFWSA-N	1	0	295.427	1.283	50	0		CDAARO
CS[C@H]1CCCC[N@@H+]([C@H](C)C(=O)NC2CC2)C1	ZINC000083966500	483229992	/nfs/dbraw/zinc/22/99/92/483229992.db2.gz	FIYBELUNFNBLBI-PWSUYJOCSA-N	1	0	256.415	1.871	50	0		CDAARO
CC(C)[C@@H](Cc1ccccc1)C(=O)NC[C@@H](O)C[NH+](C)C	ZINC000084410510	483276841	/nfs/dbraw/zinc/27/68/41/483276841.db2.gz	ZYGSNLNBXIOWLY-HZPDHXFCSA-N	1	0	292.423	1.540	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)c1ccc(C)c(Cl)c1	ZINC000063022293	524009367	/nfs/dbraw/zinc/00/93/67/524009367.db2.gz	AXJMIAFYFWIDPT-RYUDHWBXSA-N	1	0	268.744	1.365	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)/C=C/c1cnc(C)s1	ZINC000269191401	536466159	/nfs/dbraw/zinc/46/61/59/536466159.db2.gz	LZYJJYKWGVQIEN-MVIFTORASA-N	1	0	265.382	1.675	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(O)([C@@H]([NH3+])C2CCC2)CC1	ZINC000958528961	613974608	/nfs/dbraw/zinc/97/46/08/613974608.db2.gz	ZXYYMTGQUGHDTR-LBPRGKRZSA-N	1	0	284.400	1.876	50	0		CDAARO
COC[C@]1([NH2+]Cc2cnn(C(C)(C)C)c2)CCOC1	ZINC000888093703	617753358	/nfs/dbraw/zinc/75/33/58/617753358.db2.gz	VEFPKIIYJUXJKP-CQSZACIVSA-N	1	0	267.373	1.533	50	0		CDAARO
[NH3+][C@@H](Cc1cccc(F)c1)CN1C(=O)c2ccccc2C1=O	ZINC000114369379	617990221	/nfs/dbraw/zinc/99/02/21/617990221.db2.gz	VMLDWVQVTSBBHQ-ZDUSSCGKSA-N	1	0	298.317	1.992	50	0		CDAARO
C[NH+]1CCN(c2ccc(C(=O)OC(C)(C)C)c(N)c2)CC1	ZINC000114163814	1174877654	/nfs/dbraw/zinc/87/76/54/1174877654.db2.gz	DIFVPEGUJIXKOC-UHFFFAOYSA-N	1	0	291.395	1.976	50	0		CDAARO
CCc1cnc(N)nc1NC[C@H]1CCC[N@H+](CCOC)C1	ZINC001704336238	1177693193	/nfs/dbraw/zinc/69/31/93/1177693193.db2.gz	WPXCZRMOAAGKJC-GFCCVEGCSA-N	1	0	293.415	1.392	50	0		CDAARO
CCN(C)c1ccnc(N2CCCC[C@@H]([NH+](C)C)C2)n1	ZINC001704338621	1177695025	/nfs/dbraw/zinc/69/50/25/1177695025.db2.gz	VWQYQYKDPUYONO-CYBMUJFWSA-N	1	0	277.416	1.853	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3ccoc3)C[C@H]2O)[nH]n1	ZINC001704352955	1177698929	/nfs/dbraw/zinc/69/89/29/1177698929.db2.gz	HHGLWVHKXGMBOM-TZMCWYRMSA-N	1	0	261.325	1.347	50	0		CDAARO
CCc1cnc(C)nc1NCC1(O)CC[NH+](C)CC1	ZINC001704358224	1177700731	/nfs/dbraw/zinc/70/07/31/1177700731.db2.gz	GUTZFGMREYPTJB-UHFFFAOYSA-N	1	0	264.373	1.216	50	0		CDAARO
C[N@@H+]1CCN(C(=O)[C@@]2(C)CCC(=O)NC2)C[C@@H]1C(C)(C)C	ZINC000863947409	797623156	/nfs/dbraw/zinc/62/31/56/797623156.db2.gz	HBFIBGJBPYRUJB-WBMJQRKESA-N	1	0	295.427	1.091	50	0		CDAARO
Cc1nc(CN2CCC[C@@](CO)(C[NH+](C)C)C2)n(C)c1C	ZINC000952978604	797640369	/nfs/dbraw/zinc/64/03/69/797640369.db2.gz	BHYDPZUOYGFHJQ-MRXNPFEDSA-N	1	0	294.443	1.173	50	0		CDAARO
CCc1[nH+]c(N)nc(N(C)C[C@@H]2CCCCO2)c1C	ZINC000091326266	896933609	/nfs/dbraw/zinc/93/36/09/896933609.db2.gz	ZRMYCWYZXWFRMC-NSHDSACASA-N	1	0	264.373	1.935	50	0		CDAARO
C[N@H+](CCC[C@@H]1CCCO1)CCN1CCCC1=O	ZINC001506407117	908931544	/nfs/dbraw/zinc/93/15/44/908931544.db2.gz	IQDLRIFAYUBZQX-CYBMUJFWSA-N	1	0	254.374	1.500	50	0		CDAARO
Cc1ccccc1C[NH2+]CCN1CCC2(C1)OCCO2	ZINC000952848822	910404638	/nfs/dbraw/zinc/40/46/38/910404638.db2.gz	KFSJUXXEGFUPMX-UHFFFAOYSA-N	1	0	276.380	1.533	50	0		CDAARO
C[C@H](Cn1cccn1)C(=O)NCC1(C[NH+]2CCCC2)CC1	ZINC000952861823	910415252	/nfs/dbraw/zinc/41/52/52/910415252.db2.gz	LARHXTUEAOGBPI-CQSZACIVSA-N	1	0	290.411	1.511	50	0		CDAARO
[NH3+][C@@H](Cc1cnc[nH]1)C(=O)Nc1ccc2scnc2c1	ZINC000952978386	910529485	/nfs/dbraw/zinc/52/94/85/910529485.db2.gz	BWNNXDIBXZHJDN-JTQLQIEISA-N	1	0	287.348	1.528	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](NC(=O)c2cccc3nccnc32)C1	ZINC000071762969	936648046	/nfs/dbraw/zinc/64/80/46/936648046.db2.gz	YHPBJGDNJRLGSW-NXEZZACHSA-N	1	0	256.309	1.239	50	0		CDAARO
Cc1nc(C)c(CN2CCC([NH2+]C(C)C)CC2)[nH]1	ZINC000887268500	936940373	/nfs/dbraw/zinc/94/03/73/936940373.db2.gz	NKEXQSIAVZIGDF-UHFFFAOYSA-N	1	0	250.390	1.989	50	0		CDAARO
C[NH+](C)CCCC[C@@H]1NC(=O)[C@H](c2ccccc2)NC1=O	ZINC000823693024	925723619	/nfs/dbraw/zinc/72/36/19/925723619.db2.gz	APOQFLBIQPHKGO-KBPBESRZSA-N	1	0	289.379	1.074	50	0		CDAARO
C[C@H](CCNc1ccncc1F)[NH+]1CCN(C)CC1	ZINC000823789374	925732977	/nfs/dbraw/zinc/73/29/77/925732977.db2.gz	IAKYHAGZXWKYSX-GFCCVEGCSA-N	1	0	266.364	1.081	50	0		CDAARO
COC(C)(C)C[C@@H](C)[NH2+]CCc1nc(C)cc(=O)[nH]1	ZINC000824250106	925811487	/nfs/dbraw/zinc/81/14/87/925811487.db2.gz	WFDDWJDNAXULSA-LLVKDONJSA-N	1	0	267.373	1.826	50	0		CDAARO
O=C(NCc1nccs1)[C@H]1CC[C@H]2CCCC[N@@H+]21	ZINC000585122138	930987994	/nfs/dbraw/zinc/98/79/94/930987994.db2.gz	OMFJSSWRPHVFCR-GHMZBOCLSA-N	1	0	265.382	1.776	50	0		CDAARO
C[NH+]1CCC2(CC1)CN(c1nccs1)CCO2	ZINC000846750747	932125312	/nfs/dbraw/zinc/12/53/12/932125312.db2.gz	FYYJWUZJTYVUHA-UHFFFAOYSA-N	1	0	253.371	1.444	50	0		CDAARO
C[N@@H+](Cc1ccc[nH]c1=O)C[C@H](O)c1ccccc1	ZINC000020137543	935728477	/nfs/dbraw/zinc/72/84/77/935728477.db2.gz	MSWBPLWRQHJRJY-AWEZNQCLSA-N	1	0	258.321	1.540	50	0		CDAARO
C[NH+](C)CCc1nnc(NC(=O)C2CCCC2)s1	ZINC001529100011	968980843	/nfs/dbraw/zinc/98/08/43/968980843.db2.gz	MCSPJANANBRTEE-UHFFFAOYSA-N	1	0	268.386	1.771	50	0		CDAARO
O[C@@H]1C[N@@H+](C2CCCCC2)C[C@H]1Cc1cnccn1	ZINC001529185098	969006114	/nfs/dbraw/zinc/00/61/14/969006114.db2.gz	JOPXUDMDOFKWOW-IUODEOHRSA-N	1	0	261.369	1.645	50	0		CDAARO
Cc1c(NC(=O)[C@@H](C)C[NH+]2CCCCC2)cnn1C	ZINC001506401951	975150618	/nfs/dbraw/zinc/15/06/18/975150618.db2.gz	HHGPJPRWLNGJNY-NSHDSACASA-N	1	0	264.373	1.789	50	0		CDAARO
CC[C@@H]1CN(CCn2cnnc2)CC[N@@H+]1C(C)C	ZINC001506410792	975153399	/nfs/dbraw/zinc/15/33/99/975153399.db2.gz	XKLNIJUKSIUOEA-CYBMUJFWSA-N	1	0	251.378	1.083	50	0		CDAARO
CN(C)c1nc(N[C@@H]2CC[N@@H+](C(C)(C)C)C2)ncc1F	ZINC001506412481	975154342	/nfs/dbraw/zinc/15/43/42/975154342.db2.gz	DLIFEQFLXOPYEF-SNVBAGLBSA-N	1	0	281.379	1.966	50	0		CDAARO
C[C@@H]1C[NH+](CCCCNC(=O)c2csnn2)C[C@@H](C)O1	ZINC000096461214	230377921	/nfs/dbraw/zinc/37/79/21/230377921.db2.gz	GUTHTLHFECRGQZ-GHMZBOCLSA-N	1	0	298.412	1.157	50	0		CDAARO
C[NH+](C)C1CN(c2nc(C3CC3)nc3c2CCC3)C1	ZINC000096492838	230382962	/nfs/dbraw/zinc/38/29/62/230382962.db2.gz	CXHRBNHMRBMMIY-UHFFFAOYSA-N	1	0	258.369	1.593	50	0		CDAARO
Cn1cc(C[NH2+][C@@H](CC(N)=O)C2CCCCC2)cn1	ZINC000096494759	230383966	/nfs/dbraw/zinc/38/39/66/230383966.db2.gz	ZOYKHHZWCXHTLJ-ZDUSSCGKSA-N	1	0	264.373	1.334	50	0		CDAARO
CCOc1ncccc1C[NH2+][C@H](C)CCn1cncn1	ZINC000097016519	230386249	/nfs/dbraw/zinc/38/62/49/230386249.db2.gz	OFJPYAHLODGOPV-GFCCVEGCSA-N	1	0	275.356	1.640	50	0		CDAARO
COc1ccc2nc(N3CC[NH+](C)CC3)ccc2c1	ZINC000193507714	342473433	/nfs/dbraw/zinc/47/34/33/342473433.db2.gz	KQPAYEZMBZJNGQ-UHFFFAOYSA-N	1	0	257.337	1.995	50	0		CDAARO
CC(C)[C@@H]1CN(C(=O)c2ccncc2F)C[C@H]1[NH+](C)C	ZINC000095508802	185000558	/nfs/dbraw/zinc/00/05/58/185000558.db2.gz	NNYOGBADMYSNEQ-GXTWGEPZSA-N	1	0	279.359	1.879	50	0		CDAARO
Cc1nc(C(F)(F)F)ncc1CN1CC[C@H]2C[NH2+]C[C@H]21	ZINC000426368139	230415942	/nfs/dbraw/zinc/41/59/42/230415942.db2.gz	ACCOEVJPRPMPKY-GXSJLCMTSA-N	1	0	286.301	1.598	50	0		CDAARO
CCn1ncnc1[C@H](C)NC(=O)C1CC[NH+](C(C)C)CC1	ZINC000095527640	185004639	/nfs/dbraw/zinc/00/46/39/185004639.db2.gz	PITAWFVBKFLTOJ-LBPRGKRZSA-N	1	0	293.415	1.596	50	0		CDAARO
COc1ccnc(C[NH2+][C@@H]2CCC[C@@]2(C)CO)c1OC	ZINC000241447051	361751561	/nfs/dbraw/zinc/75/15/61/361751561.db2.gz	NQTKSJYJWGMUTO-HIFRSBDPSA-N	1	0	280.368	1.740	50	0		CDAARO
COCC(C)(C)CNC(=O)[C@H]1CC12CC[NH2+]CC2	ZINC000310947307	342089764	/nfs/dbraw/zinc/08/97/64/342089764.db2.gz	MTXSFHDMOFNMTP-LLVKDONJSA-N	1	0	254.374	1.165	50	0		CDAARO
Cc1cccn2cc(C(=O)NCC[NH+]3CCCC3)nc12	ZINC000097939103	342101597	/nfs/dbraw/zinc/10/15/97/342101597.db2.gz	AXTITYQEGJPPCS-UHFFFAOYSA-N	1	0	272.352	1.468	50	0		CDAARO
COCC[NH2+]CCOCCOc1c(OC)cccc1OC	ZINC000002385130	342088829	/nfs/dbraw/zinc/08/88/29/342088829.db2.gz	KSVGQCZFRIHZJQ-UHFFFAOYSA-N	1	0	299.367	1.335	50	0		CDAARO
COc1ccccc1OCCOCCN1CC[NH+](C)CC1	ZINC000019792478	342088988	/nfs/dbraw/zinc/08/89/88/342088988.db2.gz	OVOACCJOLDIALI-UHFFFAOYSA-N	1	0	294.395	1.338	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNC(=O)Nc2cncc(F)c2)C1	ZINC000096140243	185105887	/nfs/dbraw/zinc/10/58/87/185105887.db2.gz	XDKXQRSDCUBFOA-NSHDSACASA-N	1	0	296.346	1.311	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)[C@@H](C)Cc1ccccc1Cl	ZINC000195553987	342625826	/nfs/dbraw/zinc/62/58/26/342625826.db2.gz	SBSGREQCZXQENQ-GDLCADMTSA-N	1	0	296.798	1.622	50	0		CDAARO
CCCCn1nc(CCOC)nc1C1(C)CC[NH2+]CC1	ZINC000096149849	185107165	/nfs/dbraw/zinc/10/71/65/185107165.db2.gz	RFEBJJREIOAFCJ-UHFFFAOYSA-N	1	0	280.416	1.908	50	0		CDAARO
CC[C@H]1CN(S(C)(=O)=O)CC[C@H]1[NH2+]Cc1ccco1	ZINC000252517164	361849315	/nfs/dbraw/zinc/84/93/15/361849315.db2.gz	BDUXNQPJVJORBJ-WCQYABFASA-N	1	0	286.397	1.429	50	0		CDAARO
[NH3+][C@H]1C[C@H](c2cc(N3CCSCC3)ncn2)C1	ZINC000244741902	361860198	/nfs/dbraw/zinc/86/01/98/361860198.db2.gz	NYQLWVCGTSLGFP-MGCOHNPYSA-N	1	0	250.371	1.235	50	0		CDAARO
Cc1csc(CCCNC(=O)C[N@@H+]2C[C@@H]3CC[C@H]2C3)n1	ZINC000244735096	361860538	/nfs/dbraw/zinc/86/05/38/361860538.db2.gz	NSYLCDIPEAPENQ-OLZOCXBDSA-N	1	0	293.436	1.985	50	0		CDAARO
NC(=O)CC[N@@H+](Cc1ccccc1)C[C@H]1CCCOC1	ZINC000244787722	361863148	/nfs/dbraw/zinc/86/31/48/361863148.db2.gz	QCLNHQZZDREZPL-OAHLLOKOSA-N	1	0	276.380	1.791	50	0		CDAARO
CCc1c(C(=O)N2CCC([NH3+])CC2)cnn1-c1ccccc1	ZINC000096999921	185149674	/nfs/dbraw/zinc/14/96/74/185149674.db2.gz	QJXHTOZOKRLHGC-UHFFFAOYSA-N	1	0	298.390	1.998	50	0		CDAARO
c1n[nH]cc1O[C@@H]1COC[C@@H]1[NH2+][C@H]1CCc2ccccc2C1	ZINC000685941119	539045906	/nfs/dbraw/zinc/04/59/06/539045906.db2.gz	RSGGNOYTGINXRH-BHYGNILZSA-N	1	0	299.374	1.703	50	0		CDAARO
Cn1cccc1C(=O)Nc1cnn(CC[NH+](C)C)c1	ZINC000585146022	342223560	/nfs/dbraw/zinc/22/35/60/342223560.db2.gz	QXTZPNROUGIYBP-UHFFFAOYSA-N	1	0	261.329	1.036	50	0		CDAARO
CC(C)c1noc(-c2cccn3c(C[NH3+])nnc23)n1	ZINC000409444237	539071817	/nfs/dbraw/zinc/07/18/17/539071817.db2.gz	YQUDYRQJHJSSGN-UHFFFAOYSA-N	1	0	258.285	1.361	50	0		CDAARO
CCN1CCN(C(=O)c2nc(C)n(-c3ccccc3)n2)CC1	ZINC000034910464	539137964	/nfs/dbraw/zinc/13/79/64/539137964.db2.gz	UEGRGSMPZUNLLT-UHFFFAOYSA-N	1	0	299.378	1.353	50	0		CDAARO
Cc1cc(NC(=O)[C@H](C)[NH2+][C@H](C)[C@H]2CCCO2)on1	ZINC000248582422	342273096	/nfs/dbraw/zinc/27/30/96/342273096.db2.gz	IWXGZJSLNAVWTI-OUAUKWLOSA-N	1	0	267.329	1.467	50	0		CDAARO
C[N@H+]1C[C@H]2CN(c3ncnc4ccc(F)cc43)C[C@H]2C1	ZINC000192806892	539157247	/nfs/dbraw/zinc/15/72/47/539157247.db2.gz	NVRJLQBXGYGVNF-PHIMTYICSA-N	1	0	272.327	1.767	50	0		CDAARO
C[NH+](C)[C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccccc1	ZINC000000858964	282182103	/nfs/dbraw/zinc/18/21/03/282182103.db2.gz	VLEJSVXWQQVRQO-ZIAGYGMSSA-N	1	0	282.409	1.838	50	0		CDAARO
COc1cccc(C(=O)NCCC[N@H+](C)CCN(C)C)c1	ZINC000290128140	362195980	/nfs/dbraw/zinc/19/59/80/362195980.db2.gz	MTSOLRBSVVUHEY-UHFFFAOYSA-N	1	0	293.411	1.309	50	0		CDAARO
CNC(=O)C[N@@H+]1CC[C@H](OCCCc2ccccc2)C1	ZINC000096456550	529863365	/nfs/dbraw/zinc/86/33/65/529863365.db2.gz	LNBFYCBMXCQPLE-HNNXBMFYSA-N	1	0	276.380	1.456	50	0		CDAARO
C[C@H]1CN(C(=O)Cc2cccc(Br)c2)CC[NH2+]1	ZINC000084719036	362268914	/nfs/dbraw/zinc/26/89/14/362268914.db2.gz	OIDGDLXZLNMNOY-JTQLQIEISA-N	1	0	297.196	1.812	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1C(=O)/C=C/c1ccc2c(c1)CCO2	ZINC000089937725	362323659	/nfs/dbraw/zinc/32/36/59/362323659.db2.gz	DOFORYIRJBVTPP-DIECRNLCSA-N	1	0	286.375	1.797	50	0		CDAARO
C[C@H]1C[N@H+](CCCOc2ccc(C(N)=O)cc2)CCCO1	ZINC000252507840	362390129	/nfs/dbraw/zinc/39/01/29/362390129.db2.gz	WUQLEOQPOLYGNR-ZDUSSCGKSA-N	1	0	292.379	1.665	50	0		CDAARO
O[C@H]1C[C@@H]([C@H](Cc2ccncc2)[NH2+]C2CCOCC2)C1	ZINC000252572398	362393200	/nfs/dbraw/zinc/39/32/00/362393200.db2.gz	ZFNUXKIDZWQVDP-IMJJTQAJSA-N	1	0	276.380	1.532	50	0		CDAARO
CNC(=O)C[C@@H](C)[N@H+](C)Cc1[nH]cc(C)c(=O)c1C	ZINC000253536120	362435334	/nfs/dbraw/zinc/43/53/34/362435334.db2.gz	AGHZVANZQVGDOD-SNVBAGLBSA-N	1	0	265.357	1.360	50	0		CDAARO
NC(=O)C1([NH2+]Cc2ccc(Oc3cnccn3)cc2)CC1	ZINC000191483322	362444217	/nfs/dbraw/zinc/44/42/17/362444217.db2.gz	WRRXZWXOQMFHEJ-UHFFFAOYSA-N	1	0	284.319	1.376	50	0		CDAARO
Cc1c(C(=O)N[C@@H]2CC[N@@H+](C(C)(C)C)C2)ccn1C	ZINC000617343420	345175431	/nfs/dbraw/zinc/17/54/31/345175431.db2.gz	SKEDHSWNRWTLQR-GFCCVEGCSA-N	1	0	263.385	1.936	50	0		CDAARO
COc1cc(C)sc1C(=O)N1C[C@H]2C[NH2+]C[C@H]2C1	ZINC000097137206	185543448	/nfs/dbraw/zinc/54/34/48/185543448.db2.gz	XYBBJFSGEBUJNC-AOOOYVTPSA-N	1	0	266.366	1.357	50	0		CDAARO
Cc1noc(C)c1[C@@H](C)NC(=O)N1CC[C@@H](C[NH+](C)C)C1	ZINC000130001385	346179707	/nfs/dbraw/zinc/17/97/07/346179707.db2.gz	IYJCPMQSJPDURL-MFKMUULPSA-N	1	0	294.399	1.946	50	0		CDAARO
CC(C)NS(=O)(=O)CC[NH2+][C@H]1CC(C)(C)C[C@H]1C	ZINC000193131029	362831306	/nfs/dbraw/zinc/83/13/06/362831306.db2.gz	UJNUMLWWYNECJS-NEPJUHHUSA-N	1	0	276.446	1.729	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)c2c(F)cc(F)cc2F)C1	ZINC000086997905	179377347	/nfs/dbraw/zinc/37/73/47/179377347.db2.gz	JTBJUEFHABWCOJ-SSDOTTSWSA-N	1	0	258.243	1.525	50	0		CDAARO
CC(C)C[N@@H+]1CCCN(C(=O)Cn2ccc(=O)cc2)CC1	ZINC000584886693	349344622	/nfs/dbraw/zinc/34/46/22/349344622.db2.gz	BQVWVLAJELUOOG-UHFFFAOYSA-N	1	0	291.395	1.039	50	0		CDAARO
Cc1nccn1C[C@@H](C)[NH2+]CCc1nccs1	ZINC000584891079	349350214	/nfs/dbraw/zinc/35/02/14/349350214.db2.gz	LBZQWKCQIUIRAR-SNVBAGLBSA-N	1	0	250.371	1.869	50	0		CDAARO
CNc1ncccc1C[N@@H+]1C[C@H](O)[C@@H](OC(C)C)C1	ZINC000584891918	349351153	/nfs/dbraw/zinc/35/11/53/349351153.db2.gz	MYFAWEBYCNBEIY-STQMWFEESA-N	1	0	265.357	1.093	50	0		CDAARO
CC(=O)NC(C)(C)C[C@H](C)[NH2+]CC1(CO)CCC1	ZINC000584891981	349351248	/nfs/dbraw/zinc/35/12/48/349351248.db2.gz	XCMUWGKJPKAKMX-NSHDSACASA-N	1	0	256.390	1.432	50	0		CDAARO
O=C(CCC[NH+]1CCCC1)N1CCC[C@H](O)CC1	ZINC000584894599	349354228	/nfs/dbraw/zinc/35/42/28/349354228.db2.gz	XDOAFROVEDRZAH-ZDUSSCGKSA-N	1	0	254.374	1.236	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@H]1CCC[NH2+]C1	ZINC000104449346	186005662	/nfs/dbraw/zinc/00/56/62/186005662.db2.gz	XOCRVKPDIJCZIB-JTQLQIEISA-N	1	0	253.371	1.410	50	0		CDAARO
CC(C)([NH3+])C[N@@H+]1CC[C@H](Cc2cccc(C(=O)[O-])c2)C1	ZINC000091411665	180148829	/nfs/dbraw/zinc/14/88/29/180148829.db2.gz	MKLFGAMXUZCXDK-CYBMUJFWSA-N	1	0	276.380	1.987	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2ccc(-c3cc[nH]n3)cc2)C[C@@H]1C1CC1	ZINC000091595849	180202221	/nfs/dbraw/zinc/20/22/21/180202221.db2.gz	TWGGWOATKADQFJ-CABCVRRESA-N	1	0	296.374	1.886	50	0		CDAARO
COCCN(Cc1ccccc1)C(=O)[C@@H]1CC[C@@H]([NH3+])C1	ZINC000091548213	180188442	/nfs/dbraw/zinc/18/84/42/180188442.db2.gz	PJGJGMMSMAHYCM-HUUCEWRRSA-N	1	0	276.380	1.789	50	0		CDAARO
C[C@@H]1C[N@H+](CCCn2cccn2)C[C@@]1(O)C1CCC1	ZINC000091635561	180211185	/nfs/dbraw/zinc/21/11/85/180211185.db2.gz	HSCKKJPKZCPESK-HIFRSBDPSA-N	1	0	263.385	1.756	50	0		CDAARO
CC(C)COCCNC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@H]21	ZINC000096499718	351569978	/nfs/dbraw/zinc/56/99/78/351569978.db2.gz	VQLPYPQRMKTEMR-HUUCEWRRSA-N	1	0	297.443	1.785	50	0		CDAARO
C[C@@H]1CCCN(C(=O)CCN2CC([NH+]3CCCCC3)C2)C1	ZINC000065499548	363289931	/nfs/dbraw/zinc/28/99/31/363289931.db2.gz	AWSIYZRJNAPBNU-OAHLLOKOSA-N	1	0	293.455	1.805	50	0		CDAARO
CN(C)C(=O)Oc1ccc(OCc2n(C)cc[n+]2C)cc1	ZINC000000387354	355907881	/nfs/dbraw/zinc/90/78/81/355907881.db2.gz	ZPMSQAPEXKHSEJ-UHFFFAOYSA-N	1	0	290.343	1.489	50	0		CDAARO
c1coc(C[NH+]2CCC(N3CCOCC3)CC2)c1	ZINC000000550819	355916052	/nfs/dbraw/zinc/91/60/52/355916052.db2.gz	FURNTDSXZQOHII-UHFFFAOYSA-N	1	0	250.342	1.576	50	0		CDAARO
COc1ccccc1/C=C\C(=O)N1CCC[C@H]([NH3+])C1	ZINC000255176348	356007141	/nfs/dbraw/zinc/00/71/41/356007141.db2.gz	SFSGOQSQXXIKQZ-YXVBKTCISA-N	1	0	260.337	1.658	50	0		CDAARO
O=C([C@H]1CCC[NH2+]1)N1CCN(c2ccc(F)cc2)CC1	ZINC000006756568	356083684	/nfs/dbraw/zinc/08/36/84/356083684.db2.gz	MWCWRPYPVNASRL-CQSZACIVSA-N	1	0	277.343	1.226	50	0		CDAARO
O=C(C1CC[NH2+]CC1)N1CCC[C@H]1c1ccncc1	ZINC000036136548	356222547	/nfs/dbraw/zinc/22/25/47/356222547.db2.gz	DSXJVFWLAYNCNM-AWEZNQCLSA-N	1	0	259.353	1.745	50	0		CDAARO
CC1CC[NH+](CC(=O)Nc2cccc3nonc32)CC1	ZINC000032578580	356305132	/nfs/dbraw/zinc/30/51/32/356305132.db2.gz	JJOHDVHGPHWRHJ-UHFFFAOYSA-N	1	0	274.324	1.893	50	0		CDAARO
CNC(=O)NC(=O)[C@@H](c1ccccc1)[NH+]1CCCC1	ZINC000015376646	356414679	/nfs/dbraw/zinc/41/46/79/356414679.db2.gz	FIDJUGIGCKRJAB-GFCCVEGCSA-N	1	0	261.325	1.279	50	0		CDAARO
C[NH+](C)CC(=O)N[C@H]1CCCN(Cc2ccccc2F)C1	ZINC000014964292	356402548	/nfs/dbraw/zinc/40/25/48/356402548.db2.gz	QDNOZEQSKRXOAZ-AWEZNQCLSA-N	1	0	293.386	1.468	50	0		CDAARO
O=C1CCCN1CCN1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000032916358	356441114	/nfs/dbraw/zinc/44/11/14/356441114.db2.gz	KWMHESIYQCJGIL-OAHLLOKOSA-N	1	0	292.354	1.821	50	0		CDAARO
CC[NH+]1CCC(NC(=O)COc2ccc(F)cc2F)CC1	ZINC000016604606	356442960	/nfs/dbraw/zinc/44/29/60/356442960.db2.gz	IPARFSAHHHYIQU-UHFFFAOYSA-N	1	0	298.333	1.944	50	0		CDAARO
O=C(c1ccc(Br)o1)N1CC[NH2+]CC1	ZINC000019256931	356477855	/nfs/dbraw/zinc/47/78/55/356477855.db2.gz	UADOQGQGJDYASH-UHFFFAOYSA-N	1	0	259.103	1.088	50	0		CDAARO
Cc1ccc(OCCOCCNCC[NH3+])c(Cl)c1	ZINC000019772466	356501132	/nfs/dbraw/zinc/50/11/32/356501132.db2.gz	IQSFSOJFFNUUEM-UHFFFAOYSA-N	1	0	272.776	1.592	50	0		CDAARO
Cc1ccccc1OCCOCCN1CC[NH+](C)CC1	ZINC000019792608	356505233	/nfs/dbraw/zinc/50/52/33/356505233.db2.gz	FVGANNGJRCSLQJ-UHFFFAOYSA-N	1	0	278.396	1.638	50	0		CDAARO
COc1ccccc1CN1CC[N@H+](C(C)C)[C@@H](CCO)C1	ZINC000022851371	356622073	/nfs/dbraw/zinc/62/20/73/356622073.db2.gz	FEJLAKCEEGOXHH-INIZCTEOSA-N	1	0	292.423	1.972	50	0		CDAARO
Brc1csc(CN2CC[NH2+]CC2)c1	ZINC000023094288	356627327	/nfs/dbraw/zinc/62/73/27/356627327.db2.gz	KCJXRDRIUQICIC-UHFFFAOYSA-N	1	0	261.188	1.916	50	0		CDAARO
COc1cc(CNC(=O)C2(C)CC[NH2+]CC2)cc(OC)c1	ZINC000034928784	356824252	/nfs/dbraw/zinc/82/42/52/356824252.db2.gz	DRAAJXSKTTYXHJ-UHFFFAOYSA-N	1	0	292.379	1.710	50	0		CDAARO
COc1ccc(C(=O)N2CCC[C@@H]([NH+](C)C)C2)cc1	ZINC000058368851	357397443	/nfs/dbraw/zinc/39/74/43/357397443.db2.gz	SFHYWPCBSPGHPV-CYBMUJFWSA-N	1	0	262.353	1.861	50	0		CDAARO
Cc1c[nH+]ccc1N1CCCN(Cc2ncc[nH]2)CC1	ZINC000065371688	357531658	/nfs/dbraw/zinc/53/16/58/357531658.db2.gz	IOOCAQQHMKSSBU-UHFFFAOYSA-N	1	0	271.368	1.825	50	0		CDAARO
Cc1nc(CCNC(=O)C[NH+]2CCCCCC2)cc(=O)[nH]1	ZINC000065370052	357531973	/nfs/dbraw/zinc/53/19/73/357531973.db2.gz	ZFVWBRDFNYVWDD-UHFFFAOYSA-N	1	0	292.383	1.025	50	0		CDAARO
C[C@@H](NC(=O)CC[NH2+]CCc1c[nH]cn1)c1ccccc1	ZINC000065409565	357538861	/nfs/dbraw/zinc/53/88/61/357538861.db2.gz	CLNVXBKOJFSYAF-CYBMUJFWSA-N	1	0	286.379	1.809	50	0		CDAARO
CN1C[C@@H]2CC[C@H](CC1=O)[N@@H+]2C/C=C/c1ccco1	ZINC000067772275	357626408	/nfs/dbraw/zinc/62/64/08/357626408.db2.gz	PDJCWDKQUAABNW-VQGWDMPSSA-N	1	0	260.337	1.988	50	0		CDAARO
CCOc1ccc(CC(=O)N2CCC(C[NH3+])CC2)cc1	ZINC000067317269	357604583	/nfs/dbraw/zinc/60/45/83/357604583.db2.gz	CPWYGKHDGYAGRS-UHFFFAOYSA-N	1	0	276.380	1.825	50	0		CDAARO
CN(C)c1nc(-c2cccc3c2O[C@H](C[NH3+])C3)ncc1F	ZINC000067447350	357609598	/nfs/dbraw/zinc/60/95/98/357609598.db2.gz	FTDLVARCPGDQLD-JTQLQIEISA-N	1	0	288.326	1.611	50	0		CDAARO
Cc1nc(C(C)C)sc1C(=O)N1CCO[C@@H](C[NH3+])C1	ZINC000067908002	357636372	/nfs/dbraw/zinc/63/63/72/357636372.db2.gz	NBCRPJJHWJPYCO-JTQLQIEISA-N	1	0	283.397	1.375	50	0		CDAARO
COCCC[N@@H+]1CCC(=O)N(CC2CC2)[C@H](C(C)C)C1	ZINC000071776509	357781074	/nfs/dbraw/zinc/78/10/74/357781074.db2.gz	IWBLKMDLIIDDEQ-HNNXBMFYSA-N	1	0	282.428	1.992	50	0		CDAARO
COC[C@H](Nc1ncnc2c1CC[NH2+]CC2)c1ccccn1	ZINC000072436431	357836217	/nfs/dbraw/zinc/83/62/17/357836217.db2.gz	FFXCHKPMKWSGSE-HNNXBMFYSA-N	1	0	299.378	1.359	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCN(c2ccc3ccccc3n2)C1	ZINC000072454466	357836787	/nfs/dbraw/zinc/83/67/87/357836787.db2.gz	MNJINORQAIWVRB-MRXNPFEDSA-N	1	0	271.364	1.738	50	0		CDAARO
CN(C)CC(=O)Nc1ccc2c(c1)N(C)CC[N@@H+](C)C2	ZINC000097104304	357968618	/nfs/dbraw/zinc/96/86/18/357968618.db2.gz	PZDQRLZFXSOICO-UHFFFAOYSA-N	1	0	276.384	1.068	50	0		CDAARO
CC(C)(C)c1nsc(NCC2CC[NH+](CCO)CC2)n1	ZINC000097102085	357972201	/nfs/dbraw/zinc/97/22/01/357972201.db2.gz	CZDNRUGGQJQRQL-UHFFFAOYSA-N	1	0	298.456	1.952	50	0		CDAARO
CCC[N@@H+]1CCCn2nc(CNC(=O)CCOC)cc2C1	ZINC000082087890	358145738	/nfs/dbraw/zinc/14/57/38/358145738.db2.gz	QHGUBAFUXMKBQA-UHFFFAOYSA-N	1	0	294.399	1.152	50	0		CDAARO
C[NH+](C)[C@H]1CCCCN(C(=O)Cc2ccncc2)C1	ZINC000082106541	358147245	/nfs/dbraw/zinc/14/72/45/358147245.db2.gz	QNLKFDLGSWRCNE-AWEZNQCLSA-N	1	0	261.369	1.567	50	0		CDAARO
CC(=O)NC[C@H](c1ccc2c(c1)OCO2)[NH+](C)C	ZINC000012195990	358552585	/nfs/dbraw/zinc/55/25/85/358552585.db2.gz	DAQBJSNYZMYKAR-LLVKDONJSA-N	1	0	250.298	1.154	50	0	biogenic	CDAARO
CCc1cc(CNC(=O)[C@@]2(CC)CCC[NH2+]2)on1	ZINC000195566043	358565667	/nfs/dbraw/zinc/56/56/67/358565667.db2.gz	MSZYQNGBMDEQAV-CYBMUJFWSA-N	1	0	251.330	1.385	50	0		CDAARO
O=c1onc(-c2cnccn2)n1CCC[NH+]1CCCCC1	ZINC000195576210	358567626	/nfs/dbraw/zinc/56/76/26/358567626.db2.gz	MFDGPWCSGRNTFI-UHFFFAOYSA-N	1	0	289.339	1.169	50	0		CDAARO
Cc1cnc(NCCC[N@@H+]2CCCC[C@@H]2CO)nc1	ZINC000095369958	358687494	/nfs/dbraw/zinc/68/74/94/358687494.db2.gz	MOHNPOBHKVXDEO-CYBMUJFWSA-N	1	0	264.373	1.434	50	0		CDAARO
CC[C@](O)(CCCO)CNC(=O)Nc1cccc(C[NH3+])c1	ZINC000097117578	358752095	/nfs/dbraw/zinc/75/20/95/358752095.db2.gz	VCBQHNUQKZROBE-HNNXBMFYSA-N	1	0	295.383	1.180	50	0		CDAARO
CC(C)(C)OC(=O)[C@@H](c1ccccc1)N1CC[C@@H]([NH3+])C1=O	ZINC000096300614	358731744	/nfs/dbraw/zinc/73/17/44/358731744.db2.gz	XDUUTRYCHAVIAF-CHWSQXEVSA-N	1	0	290.363	1.629	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1C(=O)c1ccccc1-n1cnnc1	ZINC000097480176	358779717	/nfs/dbraw/zinc/77/97/17/358779717.db2.gz	DPXNQLNTYGOQNW-GFCCVEGCSA-N	1	0	285.351	1.221	50	0		CDAARO
O=C(NCc1cc2n(n1)CC[NH2+]C2)c1ccc(Cl)o1	ZINC000097785244	358798843	/nfs/dbraw/zinc/79/88/43/358798843.db2.gz	QDNHCIBHYZLHBJ-UHFFFAOYSA-N	1	0	280.715	1.163	50	0		CDAARO
COCc1cc(CN2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)ccc1OC	ZINC000216113359	358926290	/nfs/dbraw/zinc/92/62/90/358926290.db2.gz	NGKMNSOGIXYXFP-IYBDPMFKSA-N	1	0	290.407	1.835	50	0		CDAARO
Cc1c(O)cccc1C(=O)N1CCOC[C@H](C[NH+](C)C)C1	ZINC000216242907	358933212	/nfs/dbraw/zinc/93/32/12/358933212.db2.gz	SRFCCJHFZKSETF-CYBMUJFWSA-N	1	0	292.379	1.351	50	0		CDAARO
CCn1c(CN(C)[C@H]2COC[C@@H]2O)nc2ccccc21	ZINC000216481448	358947437	/nfs/dbraw/zinc/94/74/37/358947437.db2.gz	IDPOZCMKYIFKKP-KBPBESRZSA-N	1	0	275.352	1.248	50	0		CDAARO
CSc1ccc(C[NH+]2C[C@@H](CO)[C@H](CO)C2)cc1	ZINC000216541740	358950272	/nfs/dbraw/zinc/95/02/72/358950272.db2.gz	VZNPBKNWFZKJLU-STQMWFEESA-N	1	0	267.394	1.441	50	0		CDAARO
CSc1ncc(C(=O)N2CCC[C@H]([NH+](C)C)CC2)cn1	ZINC000220420714	359172306	/nfs/dbraw/zinc/17/23/06/359172306.db2.gz	KMUYEIPWTWHOHP-LBPRGKRZSA-N	1	0	294.424	1.755	50	0		CDAARO
CC1(C)C[C@H]([NH2+]C2CCC(CS(C)(=O)=O)CC2)CO1	ZINC000572379693	359177914	/nfs/dbraw/zinc/17/79/14/359177914.db2.gz	NSJUHJJHGCBRPN-BPCQOVAHSA-N	1	0	289.441	1.747	50	0		CDAARO
CCO[C@H]1C[N@H+](Cc2ccc(CC)cn2)C[C@@H]1O	ZINC000223302764	359414493	/nfs/dbraw/zinc/41/44/93/359414493.db2.gz	WZFGTLPQJBJMPB-KBPBESRZSA-N	1	0	250.342	1.226	50	0		CDAARO
CN(CC1CCOCC1)c1cc(C2CC([NH3+])C2)nc(N)n1	ZINC000223317508	359415844	/nfs/dbraw/zinc/41/58/44/359415844.db2.gz	OYIGHKQRCAXFLM-UHFFFAOYSA-N	1	0	291.399	1.126	50	0		CDAARO
Cc1c[nH]c(C(=O)NCC[C@H]2CCC[N@@H+](C)C2)n1	ZINC000223722310	359450138	/nfs/dbraw/zinc/45/01/38/359450138.db2.gz	DOFCXHRYDSPAEJ-LLVKDONJSA-N	1	0	250.346	1.180	50	0		CDAARO
[NH3+]CC1(O)CN(C(c2ccccc2)c2ccccc2)C1	ZINC000118144350	359752328	/nfs/dbraw/zinc/75/23/28/359752328.db2.gz	HPZPZJYCMNLIKS-UHFFFAOYSA-N	1	0	268.360	1.781	50	0		CDAARO
C[C@@H](CCc1ccccc1)[NH2+]CCS(=O)(=O)N(C)C	ZINC000065406384	360094634	/nfs/dbraw/zinc/09/46/34/360094634.db2.gz	WONVNSYNKCSCCJ-ZDUSSCGKSA-N	1	0	284.425	1.489	50	0		CDAARO
Cc1cccc([C@@H](C)[NH2+]CCN2CCCS2(=O)=O)c1C	ZINC000089520162	360137280	/nfs/dbraw/zinc/13/72/80/360137280.db2.gz	XXMFWEPLFAVOHN-CQSZACIVSA-N	1	0	296.436	1.990	50	0		CDAARO
[NH3+]Cc1nnc2c(Cl)cc(C(F)(F)F)cn12	ZINC000004218669	283531846	/nfs/dbraw/zinc/53/18/46/283531846.db2.gz	CBRZKSUBDJBKIM-UHFFFAOYSA-N	1	0	250.611	1.860	50	0		CDAARO
[NH3+]C[C@@]12CCC[C@@H](C[N@H+](Cc3ccccc3)C1)[C@H]2O	ZINC000238855101	360560953	/nfs/dbraw/zinc/56/09/53/360560953.db2.gz	QLVGVVNOORRUNH-XHSDSOJGSA-N	1	0	260.381	1.608	50	0		CDAARO
Cn1c(SC[C@@H]2CCC(=O)O2)nnc1C1CC[NH2+]CC1	ZINC000426529440	360681039	/nfs/dbraw/zinc/68/10/39/360681039.db2.gz	RLNFHEMMZMBZGV-JTQLQIEISA-N	1	0	296.396	1.080	50	0		CDAARO
CC(C)Cn1c(C[NH3+])nnc1SCC[C@H]1CCOC1	ZINC000426545503	360682730	/nfs/dbraw/zinc/68/27/30/360682730.db2.gz	XBWIDXRGBIIEFV-LLVKDONJSA-N	1	0	284.429	1.912	50	0		CDAARO
CCN(CC)C(=O)c1cc(C)ccc1OCC[NH3+]	ZINC000426358312	360658671	/nfs/dbraw/zinc/65/86/71/360658671.db2.gz	MFHIBKVNUWLWSI-UHFFFAOYSA-N	1	0	250.342	1.815	50	0		CDAARO
CN(Cc1cc(C2CC2)n[nH]1)C(=O)NCCC[NH+](C)C	ZINC000426387059	360662943	/nfs/dbraw/zinc/66/29/43/360662943.db2.gz	IJHAUDNZSSDXLL-UHFFFAOYSA-N	1	0	279.388	1.380	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)CCc2cc(F)ccc2F)C1	ZINC000178570711	189127890	/nfs/dbraw/zinc/12/78/90/189127890.db2.gz	JDGAPIDRWZAWNX-JTQLQIEISA-N	1	0	268.307	1.705	50	0		CDAARO
O=C(NCCc1cccnc1)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000426739055	360700991	/nfs/dbraw/zinc/70/09/91/360700991.db2.gz	NFQZKFQAWKKVHZ-KGLIPLIRSA-N	1	0	274.368	1.160	50	0		CDAARO
O=C1c2ccccc2C(=O)N1OCCC1CC[NH2+]CC1	ZINC000114524226	361214359	/nfs/dbraw/zinc/21/43/59/361214359.db2.gz	SBAAPANEVTVRSF-UHFFFAOYSA-N	1	0	274.320	1.604	50	0		CDAARO
C[C@@H](CN(C)CC[NH+](C)C)NC(=O)OC(C)(C)C	ZINC000238392562	361625555	/nfs/dbraw/zinc/62/55/55/361625555.db2.gz	VLLCUUVHXJOVTM-NSHDSACASA-N	1	0	259.394	1.393	50	0		CDAARO
Cc1cc(C[N@@H+](C)CC(C)(C)CN2CCOCC2)on1	ZINC000178943165	364965648	/nfs/dbraw/zinc/96/56/48/364965648.db2.gz	PZPOBKFSCSALBT-UHFFFAOYSA-N	1	0	281.400	1.773	50	0		CDAARO
COCC[NH2+]CC(=O)N1CCc2ccccc2[C@H]1C	ZINC000034928750	364995617	/nfs/dbraw/zinc/99/56/17/364995617.db2.gz	JTJWLTQJRXRJLQ-GFCCVEGCSA-N	1	0	262.353	1.368	50	0		CDAARO
Cc1nc(/C=C\C(=O)N2C[C@@H](C)[NH2+][C@@H](C)C2)cs1	ZINC000606441626	366875482	/nfs/dbraw/zinc/87/54/82/366875482.db2.gz	BNRYCODFTCGOGV-QOYVELHUSA-N	1	0	265.382	1.674	50	0		CDAARO
NS(=O)(=O)[C@@H]1CC[N@H+](CCCC2CCCC2)C1	ZINC000089818063	366939992	/nfs/dbraw/zinc/93/99/92/366939992.db2.gz	IXGZJXQBBDZBIP-GFCCVEGCSA-N	1	0	260.403	1.320	50	0		CDAARO
O[C@H]1CCCC[C@H]1[NH+]1CCN(Cc2cscn2)CC1	ZINC000089764772	366931107	/nfs/dbraw/zinc/93/11/07/366931107.db2.gz	CXDOATPSQASQCR-KGLIPLIRSA-N	1	0	281.425	1.564	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCCNC(=O)C2CC=CC2)C[C@H](C)O1	ZINC000089930310	366971110	/nfs/dbraw/zinc/97/11/10/366971110.db2.gz	VWWRJRGKUMGLKW-OKILXGFUSA-N	1	0	280.412	1.958	50	0		CDAARO
Cc1ccc(F)cc1C(=O)N[C@@H]1CC[NH2+]C[C@H]1C	ZINC000094345417	367468792	/nfs/dbraw/zinc/46/87/92/367468792.db2.gz	ZBCSOGYAIKSGKV-ZWNOBZJWSA-N	1	0	250.317	1.862	50	0		CDAARO
OC[C@H]1C[C@H](O)C[N@@H+]1CCSC1CCCCC1	ZINC000252488459	367577775	/nfs/dbraw/zinc/57/77/75/367577775.db2.gz	ISHPOYHPSRVTLM-NEPJUHHUSA-N	1	0	259.415	1.480	50	0		CDAARO
CC(C)[C@@H](O)C[N@@H+]1CCC[C@H](c2ccnc(N)n2)C1	ZINC000367928098	369291191	/nfs/dbraw/zinc/29/11/91/369291191.db2.gz	HVVVGZZCRFCNFU-AAEUAGOBSA-N	1	0	264.373	1.085	50	0		CDAARO
CNC(=O)N(Cc1ccco1)C1CC[NH+](C)CC1	ZINC000075572625	369426153	/nfs/dbraw/zinc/42/61/53/369426153.db2.gz	VPEBWGURXOWPLB-UHFFFAOYSA-N	1	0	251.330	1.515	50	0		CDAARO
COc1nnc(NC(=O)N2C[C@H]3CCC[N@@H+]3C[C@H]2C)s1	ZINC000276557561	193380334	/nfs/dbraw/zinc/38/03/34/193380334.db2.gz	PBRNOIJIFIGOPT-RKDXNWHRSA-N	1	0	297.384	1.247	50	0		CDAARO
CS(=O)(=O)CCNCc1c(F)cccc1Cl	ZINC000037740524	370039222	/nfs/dbraw/zinc/03/92/22/370039222.db2.gz	UNDRBODYYKQSBI-UHFFFAOYSA-N	1	0	265.737	1.613	50	0		CDAARO
Cc1ccc(-c2n[nH]cc2C[NH2+]C[C@@]2(O)CCOC2)o1	ZINC000179027796	372238452	/nfs/dbraw/zinc/23/84/52/372238452.db2.gz	UVVDZRKCKROIJY-AWEZNQCLSA-N	1	0	277.324	1.219	50	0		CDAARO
c1nnn2c1CO[C@H]1CC[N@@H+](Cc3cccnc3)C[C@@H]12	ZINC000299755168	372745658	/nfs/dbraw/zinc/74/56/58/372745658.db2.gz	CTWQKLXDKOGGQT-KBPBESRZSA-N	1	0	271.324	1.019	50	0		CDAARO
O=c1cc(C[N@H+]2CC[C@@](O)(CO)C2)[nH]c2ccc(F)cc12	ZINC000299765252	372748377	/nfs/dbraw/zinc/74/83/77/372748377.db2.gz	KZVGTALGEZSOQX-HNNXBMFYSA-N	1	0	292.310	1.009	50	0		CDAARO
Cc1cc[nH+]c(NCCNC(=O)C2CCOCC2)c1	ZINC000299764310	372748580	/nfs/dbraw/zinc/74/85/80/372748580.db2.gz	UDNGEGDEYTVZJS-UHFFFAOYSA-N	1	0	263.341	1.345	50	0		CDAARO
Cc1noc(C)c1CN1CC[C@@H]([NH2+]C2CCCC2)[C@H](O)C1	ZINC000299783705	372760131	/nfs/dbraw/zinc/76/01/31/372760131.db2.gz	XHERGCZZCCHDGQ-HZPDHXFCSA-N	1	0	293.411	1.759	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)Nc2ccc3n[nH]cc3c2)C1	ZINC000299789501	372764057	/nfs/dbraw/zinc/76/40/57/372764057.db2.gz	YPJGZMHDHXIJOY-SNVBAGLBSA-N	1	0	259.313	1.518	50	0		CDAARO
CCn1c(CN2CCC(F)CC2)nnc1[C@H]1C[C@@H]([NH3+])C1	ZINC000244900106	189915247	/nfs/dbraw/zinc/91/52/47/189915247.db2.gz	ZWCYMDYDFPVLDA-KLPPZKSPSA-N	1	0	281.379	1.437	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)Cc2c(F)cccc2F)C1	ZINC000095045481	373692871	/nfs/dbraw/zinc/69/28/71/373692871.db2.gz	VJTCIWOEUFOCAD-VIFPVBQESA-N	1	0	254.280	1.315	50	0		CDAARO
C[C@@H](COCC(F)(F)F)NC(=O)[C@@H]1CCCC[NH2+]1	ZINC000253430213	373736228	/nfs/dbraw/zinc/73/62/28/373736228.db2.gz	DWRFNVPSEMBMAU-IUCAKERBSA-N	1	0	268.279	1.212	50	0		CDAARO
Cc1nn(C)cc1C(=O)NCCC[NH2+]Cc1cccnc1	ZINC000120758107	374165147	/nfs/dbraw/zinc/16/51/47/374165147.db2.gz	NZHSBMWBLFKPMV-UHFFFAOYSA-N	1	0	287.367	1.033	50	0		CDAARO
CCNC(=O)C(C)(C)CNC(=O)[C@@H](C)[N@H+]1[C@H](C)CC[C@@H]1C	ZINC000095431068	374933186	/nfs/dbraw/zinc/93/31/86/374933186.db2.gz	ZILVRDFXAZGRLD-FRRDWIJNSA-N	1	0	297.443	1.526	50	0		CDAARO
CC[N@H+](CC(=O)NCc1ncccc1F)C1CC1	ZINC000095434369	374933993	/nfs/dbraw/zinc/93/39/93/374933993.db2.gz	IGCNFRGHNLZIEH-UHFFFAOYSA-N	1	0	251.305	1.321	50	0		CDAARO
CN1CC[C@@H]([NH2+]Cc2ccc(OC(F)F)c(F)c2)C1=O	ZINC000095437388	374937302	/nfs/dbraw/zinc/93/73/02/374937302.db2.gz	HDSUQCQRJKPFSC-SNVBAGLBSA-N	1	0	288.269	1.747	50	0		CDAARO
COc1cccc(Cl)c1C[N@@H+]1CC[C@@H](C(N)=O)C1	ZINC000095453830	374951989	/nfs/dbraw/zinc/95/19/89/374951989.db2.gz	SJWGHESFUAJSDB-SECBINFHSA-N	1	0	268.744	1.656	50	0		CDAARO
Cc1ccsc1[C@H](C)[NH2+]CC(=O)N1CCOCC1	ZINC000095988824	375048291	/nfs/dbraw/zinc/04/82/91/375048291.db2.gz	GOSJSPCDGPDZQW-NSHDSACASA-N	1	0	268.382	1.566	50	0		CDAARO
c1[nH]nc(-c2cccnc2)c1C[NH2+]CCNc1ncccn1	ZINC000097160043	375151130	/nfs/dbraw/zinc/15/11/30/375151130.db2.gz	HDRNGZZYGOIHCE-UHFFFAOYSA-N	1	0	295.350	1.463	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@H]2CSc3ccccc3O2)C1	ZINC000299739033	375199664	/nfs/dbraw/zinc/19/96/64/375199664.db2.gz	JRVGTEPZXFIWPB-CMPLNLGQSA-N	1	0	278.377	1.347	50	0		CDAARO
Cc1ccc(CN2C[C@H]([C@H](C)O)[NH2+]C[C@H]2[C@H](C)O)cc1F	ZINC000585657554	376360701	/nfs/dbraw/zinc/36/07/01/376360701.db2.gz	LOAGMTIBSYNWDE-RKLWJJNISA-N	1	0	296.386	1.038	50	0		CDAARO
[NH2+]=C1S[C@H]2CS(=O)(=O)C[C@@H]2N1Cc1ccccc1	ZINC000004226904	376699217	/nfs/dbraw/zinc/69/92/17/376699217.db2.gz	YWVLQFWRKMBPBJ-QWRGUYRKSA-N	1	0	282.390	1.336	50	0		CDAARO
C[C@@H]1C[N@H+](CC(C)(C)O)CCN1C(=O)N[C@H]1C=CCCC1	ZINC000189295109	377226301	/nfs/dbraw/zinc/22/63/01/377226301.db2.gz	STDZHEPWMFWTBY-KGLIPLIRSA-N	1	0	295.427	1.582	50	0		CDAARO
COc1cccc2c1CC[C@@H]([NH2+]C1(C(N)=O)CC1)C2	ZINC000190522673	377725460	/nfs/dbraw/zinc/72/54/60/377725460.db2.gz	ZUXOQFWDTMZVDJ-LLVKDONJSA-N	1	0	260.337	1.160	50	0		CDAARO
Brc1cnc(N2CC[NH+](C3CCC3)CC2)nc1	ZINC000244955836	377811952	/nfs/dbraw/zinc/81/19/52/377811952.db2.gz	GBWGIXNFYDJWOL-UHFFFAOYSA-N	1	0	297.200	1.914	50	0		CDAARO
C1=CO[C@H](C[NH2+]CCc2nnc3n2CCCCC3)CC1	ZINC000194196379	378336436	/nfs/dbraw/zinc/33/64/36/378336436.db2.gz	FFZNHJBNXMOUOS-ZDUSSCGKSA-N	1	0	276.384	1.829	50	0		CDAARO
O=C(C[NH+]1CCCC1)NC[C@@H]1OCCc2ccccc21	ZINC000001421843	378464431	/nfs/dbraw/zinc/46/44/31/378464431.db2.gz	GDXVMGULELNRNO-HNNXBMFYSA-N	1	0	274.364	1.512	50	0		CDAARO
CC[NH+]1CCN(CC(=O)N2CCC(CC)(CC)C2)CC1	ZINC000446696092	250306982	/nfs/dbraw/zinc/30/69/82/250306982.db2.gz	JLVNYVLFTRMWRV-UHFFFAOYSA-N	1	0	281.444	1.663	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@H]1NC(=O)Cc1ccc(F)cc1F	ZINC000095066532	184930499	/nfs/dbraw/zinc/93/04/99/184930499.db2.gz	FNGZTJNRLRFTOO-TVQRCGJNSA-N	1	0	268.307	1.764	50	0		CDAARO
Cc1[nH]ccc1C(=O)NCC1([N@H+](C)CCO)CCCCC1	ZINC000095434266	184983284	/nfs/dbraw/zinc/98/32/84/184983284.db2.gz	LMOVDJMGELNSNZ-UHFFFAOYSA-N	1	0	293.411	1.680	50	0		CDAARO
CC[C@H]1CN(Cc2ccccc2)CCN1C(=O)c1cn[nH]n1	ZINC000096431762	390520075	/nfs/dbraw/zinc/52/00/75/390520075.db2.gz	JVADQGAXOQXCCE-AWEZNQCLSA-N	1	0	299.378	1.541	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F)[C@H]1CC[NH2+]C1	ZINC000179074413	390940303	/nfs/dbraw/zinc/94/03/03/390940303.db2.gz	JSVRXNAALNFYKK-DMDPSCGWSA-N	1	0	280.318	1.889	50	0		CDAARO
Cc1cc2c(cc1C)O[C@H](C(=O)N1CC[NH2+][C@H](C)C1)C2	ZINC000188383948	390957529	/nfs/dbraw/zinc/95/75/29/390957529.db2.gz	OLKCDDOWNZCUJD-DOMZBBRYSA-N	1	0	274.364	1.427	50	0		CDAARO
COC(=O)CN1CCC[N@H+](Cc2cccc(OC)c2)CC1	ZINC000096483385	533503669	/nfs/dbraw/zinc/50/36/69/533503669.db2.gz	CBFQBJNDLMKXGG-UHFFFAOYSA-N	1	0	292.379	1.376	50	0		CDAARO
Cc1cc(C)cc(OC[C@@H](O)CN2CC[NH+](C)CC2)c1	ZINC000019790708	391327813	/nfs/dbraw/zinc/32/78/13/391327813.db2.gz	JDCFXZAFTPTPMD-HNNXBMFYSA-N	1	0	278.396	1.291	50	0		CDAARO
CCC[C@@]1(C(=O)OCC)C[C@H](CSC(N)=[NH2+])OC1=O	ZINC000004112207	391937338	/nfs/dbraw/zinc/93/73/38/391937338.db2.gz	FVMXZJUGGLQTQM-PELKAZGASA-N	1	0	288.369	1.278	50	0		CDAARO
CCOC(=O)[C@H](C)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1	ZINC000246822288	392019931	/nfs/dbraw/zinc/01/99/31/392019931.db2.gz	NUAGYNOMYKZNEN-GUTXKFCHSA-N	1	0	280.412	1.887	50	0		CDAARO
O=C(N[C@@H]1CCSc2ccccc21)[C@H]1C[C@H](O)C[NH2+]1	ZINC000037004299	392039385	/nfs/dbraw/zinc/03/93/85/392039385.db2.gz	ZSZXHLQHZWSGMV-MVWJERBFSA-N	1	0	278.377	1.063	50	0		CDAARO
CC(=O)N[C@H]1CC[N@H+](C[C@@H]2CCCN3CCCC[C@H]23)C1	ZINC000055132485	392864686	/nfs/dbraw/zinc/86/46/86/392864686.db2.gz	FXFBVSQNYRPCCA-HRCADAONSA-N	1	0	279.428	1.461	50	0		CDAARO
CCO[C@@H]1CCCN(C(=O)[C@@H](C2CC2)[NH+]2CCCC2)C1	ZINC000095939779	393153985	/nfs/dbraw/zinc/15/39/85/393153985.db2.gz	ANZCHLXPDCBAHP-HUUCEWRRSA-N	1	0	280.412	1.888	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NCCOc1cccnc1	ZINC000096421715	393184994	/nfs/dbraw/zinc/18/49/94/393184994.db2.gz	TZKIVAHBPWBTCD-OAHLLOKOSA-N	1	0	291.395	1.840	50	0		CDAARO
C[n+]1ccn(C(=O)N2CCN(c3ccccc3)CC2)c1	ZINC000032628664	134767749	/nfs/dbraw/zinc/76/77/49/134767749.db2.gz	GUTLIBYUBBQFCU-UHFFFAOYSA-N	1	0	271.344	1.103	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)COc1ccc(F)cc1F	ZINC000178285585	140002895	/nfs/dbraw/zinc/00/28/95/140002895.db2.gz	BBWDJAPRVODTDJ-LLVKDONJSA-N	1	0	284.306	1.554	50	0		CDAARO
COCC[N@@H+]1CCN(C[C@@H](O)c2ccccc2F)C[C@H]1C	ZINC000247246185	397829672	/nfs/dbraw/zinc/82/96/72/397829672.db2.gz	SUSCAMJSSBGZJO-CZUORRHYSA-N	1	0	296.386	1.512	50	0		CDAARO
CN1CCN([C@H]2CCCC[N@H+](CC3CCC3)C2)CC1	ZINC000104376997	397942401	/nfs/dbraw/zinc/94/24/01/397942401.db2.gz	PNBQRUDBVSWRIF-INIZCTEOSA-N	1	0	265.445	1.888	50	0		CDAARO
Cc1ccc(C)c(OCC(=O)NCC[NH+](C)C)c1	ZINC000002986144	169847407	/nfs/dbraw/zinc/84/74/07/169847407.db2.gz	NOKJRNQKBXVMQG-UHFFFAOYSA-N	1	0	250.342	1.360	50	0		CDAARO
COc1ccc(/C=C2/SC(=O)N(CC[NH3+])C2=O)cc1	ZINC000003208522	169868411	/nfs/dbraw/zinc/86/84/11/169868411.db2.gz	YNCIJVJXJBRZMA-DHZHZOJOSA-N	1	0	278.333	1.690	50	0		CDAARO
O=C1C[C@@H]([NH2+]C[C@@H]2CCCO2)C(=O)N1c1ccc(F)cc1	ZINC000004903734	170039018	/nfs/dbraw/zinc/03/90/18/170039018.db2.gz	JWUKCIQEXQYHGG-QWHCGFSZSA-N	1	0	292.310	1.226	50	0		CDAARO
COCC[NH2+]CC(=O)NCC12CC3CC(CC(C3)C1)C2	ZINC000005094144	170065872	/nfs/dbraw/zinc/06/58/72/170065872.db2.gz	WYGSUDVJGGEMJI-UHFFFAOYSA-N	1	0	280.412	1.555	50	0		CDAARO
C[C@H](C(=O)N1CCNC1=O)[N@H+](C)Cc1ccc(Cl)cc1	ZINC000007444918	170285255	/nfs/dbraw/zinc/28/52/55/170285255.db2.gz	PMYVQPSFZMSYMM-SNVBAGLBSA-N	1	0	295.770	1.712	50	0		CDAARO
CC(C)NC(=O)NC(=O)C[NH+]1CCCCCCC1	ZINC000007486683	170287243	/nfs/dbraw/zinc/28/72/43/170287243.db2.gz	IOJRRDPKIPLFGW-UHFFFAOYSA-N	1	0	255.362	1.487	50	0		CDAARO
NC(=O)C1CC[NH+](CCOc2ccc(F)cc2)CC1	ZINC000008317258	170330594	/nfs/dbraw/zinc/33/05/94/170330594.db2.gz	MTSPSBLNBJYWCP-UHFFFAOYSA-N	1	0	266.316	1.402	50	0		CDAARO
O=C(CCCc1c[nH]c2ccccc12)N1CC[NH2+]CC1	ZINC000009531971	170380718	/nfs/dbraw/zinc/38/07/18/170380718.db2.gz	AZLTWNYZOFEENN-UHFFFAOYSA-N	1	0	271.364	1.922	50	0		CDAARO
C[C@@H](CCNc1noc(C2CC2)n1)[NH+]1CCN(C)CC1	ZINC000534665450	411829090	/nfs/dbraw/zinc/82/90/90/411829090.db2.gz	JOJYVZMSTZECDZ-NSHDSACASA-N	1	0	279.388	1.385	50	0		CDAARO
Cn1cc(CNC2CC(C)(C)[NH2+]C(C)(C)C2)cn1	ZINC000020143437	171028856	/nfs/dbraw/zinc/02/88/56/171028856.db2.gz	GABITMMYCRVJPW-UHFFFAOYSA-N	1	0	250.390	1.819	50	0		CDAARO
c1cc(-c2noc(CN3CC[NH2+]CC3)n2)cs1	ZINC000020268701	171124786	/nfs/dbraw/zinc/12/47/86/171124786.db2.gz	UYTNVKUEBLIXNR-UHFFFAOYSA-N	1	0	250.327	1.203	50	0		CDAARO
C[C@@H]1CN(CCOc2ccc(C=O)cc2)C[C@@H](C)O1	ZINC000020639424	171269151	/nfs/dbraw/zinc/26/91/51/171269151.db2.gz	FWGFRHFIGCOVLE-CHWSQXEVSA-N	1	0	263.337	1.987	50	0		CDAARO
C[N@H+](Cc1ccc(C(F)F)cc1)[C@@H]1COC[C@H]1O	ZINC000285624021	196347456	/nfs/dbraw/zinc/34/74/56/196347456.db2.gz	QTDOOWBMIPLMAX-VXGBXAGGSA-N	1	0	257.280	1.816	50	0		CDAARO
O=C(CC[NH2+]C1CC1)N(Cc1ccccn1)C1CC1	ZINC000037803380	173743121	/nfs/dbraw/zinc/74/31/21/173743121.db2.gz	ULEKJPZIWDIWEO-UHFFFAOYSA-N	1	0	259.353	1.715	50	0		CDAARO
CCCN(Cc1ccccc1OC)C(=O)[C@H]1C=CC[NH2+]1	ZINC000055254399	175574984	/nfs/dbraw/zinc/57/49/84/175574984.db2.gz	NXQSNLDHJBOWTD-CQSZACIVSA-N	1	0	274.364	1.962	50	0		CDAARO
C[NH2+]CC(=O)NCc1cnc(-c2cccc(OC)c2)s1	ZINC000071715216	176249338	/nfs/dbraw/zinc/24/93/38/176249338.db2.gz	SUUBVZQTGGIYJN-UHFFFAOYSA-N	1	0	291.376	1.654	50	0		CDAARO
C[NH+]1CCN(Cn2nc(-c3cccs3)ccc2=O)CC1	ZINC000072402219	176396758	/nfs/dbraw/zinc/39/67/58/176396758.db2.gz	QJQOTUXWMUPHHP-UHFFFAOYSA-N	1	0	290.392	1.177	50	0		CDAARO
c1ccc(COCCCN2CC[C@H]3C[NH2+]C[C@H]32)cc1	ZINC000077285117	177248799	/nfs/dbraw/zinc/24/87/99/177248799.db2.gz	BFVSDUBVEZNXSY-JKSUJKDBSA-N	1	0	260.381	1.887	50	0		CDAARO
[NH3+]CCn1cc(C(=O)NCCSC2CCCCC2)nn1	ZINC000077287349	177249305	/nfs/dbraw/zinc/24/93/05/177249305.db2.gz	ZMYQNICGGOGGHI-UHFFFAOYSA-N	1	0	297.428	1.033	50	0		CDAARO
C[NH+](C)[C@H]1CCCC[C@@H]1NC(=O)c1ccc(C(N)=O)cc1	ZINC000408512918	261068214	/nfs/dbraw/zinc/06/82/14/261068214.db2.gz	ZKQYSISPWLJXGF-KBPBESRZSA-N	1	0	289.379	1.388	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@]2(C1)[NH2+]CCc1nc[nH]c12	ZINC000258634848	265376118	/nfs/dbraw/zinc/37/61/18/265376118.db2.gz	SYPPZHWZYJYVER-AWEZNQCLSA-N	1	0	278.356	1.392	50	0		CDAARO
NC(=O)C[N@@H+]1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000097086454	424622936	/nfs/dbraw/zinc/62/29/36/424622936.db2.gz	RUVQNFLIBGSIKU-JTQLQIEISA-N	1	0	272.270	1.980	50	0		CDAARO
O=C1Nc2ccccc2NC12CC[NH+](CCCO)CC2	ZINC000082126398	275026103	/nfs/dbraw/zinc/02/61/03/275026103.db2.gz	KWLCMJHOKDWRGG-UHFFFAOYSA-N	1	0	275.352	1.268	50	0		CDAARO
CCN1CC2(CC1=O)CC[NH+](Cc1cncn1C)CC2	ZINC000072462854	276148565	/nfs/dbraw/zinc/14/85/65/276148565.db2.gz	RURQTUKOZKYDOF-UHFFFAOYSA-N	1	0	276.384	1.255	50	0		CDAARO
CC(=O)Nc1ccc(OC[C@@H](O)C[NH+]2CCCCC2)cc1	ZINC000000816540	277080250	/nfs/dbraw/zinc/08/02/50/277080250.db2.gz	MYRQKKRFNHLSRI-HNNXBMFYSA-N	1	0	292.379	1.871	50	0		CDAARO
COc1ccncc1C[N@@H+]1CC[C@@H](N2CCOCC2)[C@H]1C	ZINC000289699280	278067832	/nfs/dbraw/zinc/06/78/32/278067832.db2.gz	HISOKSOXZMOMKV-UKRRQHHQSA-N	1	0	291.395	1.385	50	0		CDAARO
C[C@@]12C[NH2+]C[C@@](C)(CN(Cc3ccccc3)C1)C2O	ZINC000013729306	278131867	/nfs/dbraw/zinc/13/18/67/278131867.db2.gz	NRTKUYGHEKNAOU-MQVJKMGUSA-N	1	0	260.381	1.479	50	0		CDAARO
C[C@@]1(O)CCN(C(=O)CC[NH3+])C[C@@H]1Cc1ccccc1	ZINC000072129402	279173490	/nfs/dbraw/zinc/17/34/90/279173490.db2.gz	FNBMDMAHLINZGW-GOEBONIOSA-N	1	0	276.380	1.177	50	0		CDAARO
CCS(=O)(=O)N1CCC([NH+]2CCCCC2)CC1	ZINC000004744123	280010644	/nfs/dbraw/zinc/01/06/44/280010644.db2.gz	BQDABACPXLWPJD-UHFFFAOYSA-N	1	0	260.403	1.286	50	0		CDAARO
CCS(=O)(=O)NCC[NH2+][C@@H]1CC[C@@H](C)C[C@H]1C	ZINC000241515668	280026319	/nfs/dbraw/zinc/02/63/19/280026319.db2.gz	OGXCHLIVQXYDQI-IJLUTSLNSA-N	1	0	262.419	1.340	50	0		CDAARO
CC(C)[C@H]([NH2+][C@H]1CCCC[C@H]1C)C(=O)NC(N)=O	ZINC000006085210	280334693	/nfs/dbraw/zinc/33/46/93/280334693.db2.gz	FZFSRBWGDBJSTF-VWYCJHECSA-N	1	0	255.362	1.374	50	0		CDAARO
Cc1ccc(CN2C(=[NH2+])S[C@H]3CS(=O)(=O)C[C@@H]32)cc1	ZINC000005443347	280812563	/nfs/dbraw/zinc/81/25/63/280812563.db2.gz	JYVNZVYQTGDGNP-RYUDHWBXSA-N	1	0	296.417	1.644	50	0		CDAARO
C[C@@]12C[NH2+]C[C@@](C)(CN(Cc3ccccc3)C1)C2=O	ZINC000005008200	289230732	/nfs/dbraw/zinc/23/07/32/289230732.db2.gz	HRZLFKFDCKAGQY-IYBDPMFKSA-N	1	0	258.365	1.687	50	0	biogenic	CDAARO
C[C@H](C(=O)N1CCCCCC1)N1CCO[C@@H](C[NH+](C)C)C1	ZINC000106869414	289266961	/nfs/dbraw/zinc/26/69/61/289266961.db2.gz	AXLVBPCOOVRNTK-CABCVRRESA-N	1	0	297.443	1.040	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C\C(=O)N1C[C@@H](C)[NH2+][C@@H](C)C1	ZINC000255088140	289355690	/nfs/dbraw/zinc/35/56/90/289355690.db2.gz	AFQFNUSLXGIVGQ-PHKQTQANSA-N	1	0	296.802	1.604	50	0		CDAARO
COc1ccc([C@H]([NH2+]C(C)C)[C@H]2C[C@H](O)C2)cn1	ZINC000253378483	295244525	/nfs/dbraw/zinc/24/45/25/295244525.db2.gz	GKGWFEKMJKYTPQ-OBJOEFQTSA-N	1	0	250.342	1.900	50	0		CDAARO
CC(C)c1cccc(C(=O)NC[C@@H]2CC[NH2+]C[C@H]2O)c1	ZINC000534653725	328338625	/nfs/dbraw/zinc/33/86/25/328338625.db2.gz	GSXJLLDYPZNKBV-LSDHHAIUSA-N	1	0	276.380	1.510	50	0		CDAARO
CN(Cc1cnc2ccccc2n1)C(=O)[C@H]1CCC[NH2+]CC1	ZINC000534662379	328350379	/nfs/dbraw/zinc/35/03/79/328350379.db2.gz	AJALKFVLRVWYGG-ZDUSSCGKSA-N	1	0	298.390	1.978	50	0		CDAARO
[NH3+]C[C@@H]1CCN(S(=O)(=O)c2cc3ccccc3s2)C1	ZINC000534676285	328351810	/nfs/dbraw/zinc/35/18/10/328351810.db2.gz	OULWJBHGMMLTLE-JTQLQIEISA-N	1	0	296.417	1.871	50	0		CDAARO
CCc1nc(C)sc1CNC(=O)[C@H]1C=CC[NH2+]1	ZINC000534675378	328356191	/nfs/dbraw/zinc/35/61/91/328356191.db2.gz	ANMMXBNDMLIXPC-SNVBAGLBSA-N	1	0	251.355	1.158	50	0		CDAARO
O=C(NC[C@H](c1ccccc1)[NH+]1CCCC1)c1cn[nH]n1	ZINC000108285649	482683842	/nfs/dbraw/zinc/68/38/42/482683842.db2.gz	PTCLWKFIHPZKKQ-CQSZACIVSA-N	1	0	285.351	1.372	50	0		CDAARO
O=C(C[NH+]1CCCC1)NCc1ccc(-c2ncon2)cc1	ZINC000670457021	483037035	/nfs/dbraw/zinc/03/70/35/483037035.db2.gz	UHOWOSPCIVHQDV-UHFFFAOYSA-N	1	0	286.335	1.449	50	0		CDAARO
COCCc1nc(C2(C)CC2)n(-c2ccncc2)n1	ZINC000670461601	483044800	/nfs/dbraw/zinc/04/48/00/483044800.db2.gz	BAEYKHMCVAGXJU-UHFFFAOYSA-N	1	0	258.325	1.903	50	0		CDAARO
Cc1nc[nH]c1C(=O)N1C[C@H]2CCC[C@@H](C1)[N@H+](C)C2	ZINC000670469381	483063253	/nfs/dbraw/zinc/06/32/53/483063253.db2.gz	KGSSTIKLGPWVOW-RYUDHWBXSA-N	1	0	262.357	1.274	50	0		CDAARO
CCn1cc([C@H]2OCC[C@@H]2C[NH2+]Cc2c[nH]nc2C)cn1	ZINC000083843478	483203999	/nfs/dbraw/zinc/20/39/99/483203999.db2.gz	OSTFOBNLGHQMBE-DOMZBBRYSA-N	1	0	289.383	1.802	50	0		CDAARO
CCn1cc([C@@H]2OCC[C@H]2C[NH2+]Cc2cnn(C)c2)cn1	ZINC000083843561	483204405	/nfs/dbraw/zinc/20/44/05/483204405.db2.gz	RHVHFZGIUTZSEO-DZGCQCFKSA-N	1	0	289.383	1.504	50	0		CDAARO
CC(C)[C@@H](Cc1ccccc1)C(=O)NC[C@H](O)C[NH+](C)C	ZINC000084410505	483276871	/nfs/dbraw/zinc/27/68/71/483276871.db2.gz	ZYGSNLNBXIOWLY-JKSUJKDBSA-N	1	0	292.423	1.540	50	0		CDAARO
Cc1nc([C@H]2C[C@H]([NH2+]C3CCOCC3)C2)cc(=O)[nH]1	ZINC000220010148	534615760	/nfs/dbraw/zinc/61/57/60/534615760.db2.gz	KWQTXQPMZASISA-KLPPZKSPSA-N	1	0	263.341	1.093	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)c1ccnc(C2CC2)n1	ZINC000429501516	536458229	/nfs/dbraw/zinc/45/82/29/536458229.db2.gz	ACUOTQOYZOCFIN-NSHDSACASA-N	1	0	260.341	1.178	50	0		CDAARO
CCN(CC)C(=O)COC(=O)C[C@@H](C[NH3+])CC(C)C	ZINC000408525687	528027563	/nfs/dbraw/zinc/02/75/63/528027563.db2.gz	SBVNBLSTKKDNCT-LBPRGKRZSA-N	1	0	272.389	1.409	50	0		CDAARO
CCOc1cc(N2CC[C@H]([NH+](C)C)[C@@H]2C)ncn1	ZINC000408523540	528312836	/nfs/dbraw/zinc/31/28/36/528312836.db2.gz	LBGDICQUHBGCRH-QWRGUYRKSA-N	1	0	250.346	1.404	50	0		CDAARO
CC[C@@H]([NH2+]Cc1cc(=O)n2ccsc2n1)[C@H]1CCCO1	ZINC000182367881	535805346	/nfs/dbraw/zinc/80/53/46/535805346.db2.gz	BTFRYZFNYNMUND-VXGBXAGGSA-N	1	0	293.392	1.803	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]CCC(=O)NC1CCCCC1	ZINC000097159386	567904940	/nfs/dbraw/zinc/90/49/40/567904940.db2.gz	LGPPDNAPDLAPCD-UHFFFAOYSA-N	1	0	264.373	1.647	50	0		CDAARO
COc1ccc(-c2nn(CC[NH3+])c(=O)n2C2CC2)cc1	ZINC000952963456	617220133	/nfs/dbraw/zinc/22/01/33/617220133.db2.gz	SPUZGXZVZNLRTR-UHFFFAOYSA-N	1	0	274.324	1.014	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1C(=O)N(C)CC1(CO)CCC1	ZINC000952973955	615143607	/nfs/dbraw/zinc/14/36/07/615143607.db2.gz	INSCGFAWBCCCMG-LBPRGKRZSA-N	1	0	254.374	1.092	50	0		CDAARO
COC[C@H](O)C[NH2+]C1CC(Sc2ccccc2)C1	ZINC000888099232	617763564	/nfs/dbraw/zinc/76/35/64/617763564.db2.gz	XJJNJDNCOKSWMA-MBHSVXNSSA-N	1	0	267.394	1.907	50	0		CDAARO
CCc1cnc(N)nc1NCC(C)(C)[NH+]1CCCC1	ZINC001772701496	1159437724	/nfs/dbraw/zinc/43/77/24/1159437724.db2.gz	QJYKSDYFGNWQCE-UHFFFAOYSA-N	1	0	263.389	1.908	50	0		CDAARO
CCc1[nH+]c(N)nc(NC[C@H](CO)Cc2ccco2)c1C	ZINC001772709355	1159443299	/nfs/dbraw/zinc/44/32/99/1159443299.db2.gz	GFSVFKFOVGKROL-LLVKDONJSA-N	1	0	290.367	1.786	50	0		CDAARO
Cc1ccc(O)cc1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@@H]1C	ZINC000585135286	1164216763	/nfs/dbraw/zinc/21/67/63/1164216763.db2.gz	AGBYZSGOMGHARG-NEPJUHHUSA-N	1	0	262.353	1.865	50	0		CDAARO
CCC[C@H]1C[C@H]1C(=O)N(CC[NH+](C)C)Cc1c[nH]cn1	ZINC001704337660	1177694166	/nfs/dbraw/zinc/69/41/66/1177694166.db2.gz	XWYAZWCLNPPMQO-GXTWGEPZSA-N	1	0	278.400	1.736	50	0		CDAARO
CC1(C)C[N@H+](CCN2CCCC2=O)CC[C@]1(C)O	ZINC000091663352	805047683	/nfs/dbraw/zinc/04/76/83/805047683.db2.gz	JHONNGJWJIGRNI-AWEZNQCLSA-N	1	0	254.374	1.092	50	0		CDAARO
COc1ccc(/C=C(/C)C[NH2+][C@@H]2CCS(=O)(=O)C2)cc1	ZINC000095437356	811749753	/nfs/dbraw/zinc/74/97/53/811749753.db2.gz	CPHUICYZRDUNRZ-FWLQQBITSA-N	1	0	295.404	1.875	50	0		CDAARO
COc1cc(NC[C@@H]2Cc3ccccc3C[N@@H+]2C)ncn1	ZINC000065526353	811858797	/nfs/dbraw/zinc/85/87/97/811858797.db2.gz	ZIPRVKPZUFYMES-AWEZNQCLSA-N	1	0	284.363	1.954	50	0		CDAARO
C[N@H+]1C[C@H]2CN(Cc3ccc4c(c3)OCCO4)C[C@H]2C1	ZINC000193616537	812328131	/nfs/dbraw/zinc/32/81/31/812328131.db2.gz	CQBJFBAQXHSYON-OKILXGFUSA-N	1	0	274.364	1.451	50	0		CDAARO
[NH3+][C@H]1C[C@H](c2cc(N3CCC(c4cc[nH]n4)CC3)ncn2)C1	ZINC000220100502	812809135	/nfs/dbraw/zinc/80/91/35/812809135.db2.gz	HYSOQAFOKNPFCC-BETUJISGSA-N	1	0	298.394	1.788	50	0		CDAARO
C[C@H](C[N@H+](C)Cc1ccc2c(c1)CCO2)N1CCOCC1	ZINC000065509237	812811516	/nfs/dbraw/zinc/81/15/16/812811516.db2.gz	JZKABUDMFKIMSN-CQSZACIVSA-N	1	0	290.407	1.774	50	0		CDAARO
C[N@@H+]1Cc2ccccc2C[C@H]1CNc1ncccn1	ZINC000032577554	813071861	/nfs/dbraw/zinc/07/18/61/813071861.db2.gz	QTXAALCRFIVEBX-AWEZNQCLSA-N	1	0	254.337	1.945	50	0		CDAARO
CS(=O)(=O)Nc1ccc([C@@H]2CCCC[NH2+]2)cc1	ZINC000258710967	813891508	/nfs/dbraw/zinc/89/15/08/813891508.db2.gz	RUPZEAYWIIWCGS-LBPRGKRZSA-N	1	0	254.355	1.873	50	0		CDAARO
N#Cc1ccc(N2CCC([NH2+]CCc3c[nH]cn3)CC2)nc1	ZINC000095517806	817790244	/nfs/dbraw/zinc/79/02/44/817790244.db2.gz	NAVVXWAOZGNPJG-UHFFFAOYSA-N	1	0	296.378	1.477	50	0		CDAARO
COc1cc(C[C@@H](C)[NH+]2CCN(C)CC2)ccc1O	ZINC000022917003	896806435	/nfs/dbraw/zinc/80/64/35/896806435.db2.gz	UOFSOAVLFXFWPT-GFCCVEGCSA-N	1	0	264.369	1.579	50	0		CDAARO
CCc1nccn1C[C@H](C)N1CC[NH+](C(C)C)CC1	ZINC001506397405	908903836	/nfs/dbraw/zinc/90/38/36/908903836.db2.gz	UXQQBRDMODMDGE-AWEZNQCLSA-N	1	0	264.417	1.860	50	0		CDAARO
CCNC(=O)c1ccnc(C[C@@H]2CC[C@H](C[NH+](C)C)O2)c1	ZINC000952854566	910409626	/nfs/dbraw/zinc/40/96/26/910409626.db2.gz	XEEVHJVPUCJUQA-LSDHHAIUSA-N	1	0	291.395	1.483	50	0		CDAARO
CN(C)c1ncc(Br)c2c1C[NH2+]CC2	ZINC000952876307	910432016	/nfs/dbraw/zinc/43/20/16/910432016.db2.gz	LXYVXNSEDYUNPD-UHFFFAOYSA-N	1	0	256.147	1.556	50	0		CDAARO
CN(C)c1nc(NCC[C@H]2CCCC[N@@H+]2C)ncc1F	ZINC000823777745	925727392	/nfs/dbraw/zinc/72/73/92/925727392.db2.gz	NNWHMKWBUSMEDM-LLVKDONJSA-N	1	0	281.379	1.968	50	0		CDAARO
COCCOC1CCN(Cc2cnc(OC)nc2)CC1	ZINC000824445048	925823438	/nfs/dbraw/zinc/82/34/38/925823438.db2.gz	KJFJMZXJWWSMOC-UHFFFAOYSA-N	1	0	281.356	1.113	50	0		CDAARO
Cc1nc(C[C@H](C)[NH+]2CCCCCC2)n(CCO)n1	ZINC000828776945	926179948	/nfs/dbraw/zinc/17/99/48/926179948.db2.gz	MXVZYUVKMDWAKY-LBPRGKRZSA-N	1	0	266.389	1.386	50	0		CDAARO
Cc1cc(C)c(C[NH2+][C@@H](C)CN(C)CCO)cn1	ZINC000828760191	926186094	/nfs/dbraw/zinc/18/60/94/926186094.db2.gz	ZBKVHPBDSDJPMV-ZDUSSCGKSA-N	1	0	251.374	1.101	50	0		CDAARO
O=C(CCC[NH+]1CCCC1)NCc1cccc(CO)c1	ZINC000828827596	926194301	/nfs/dbraw/zinc/19/43/01/926194301.db2.gz	MSFOJJPRFJJHJX-UHFFFAOYSA-N	1	0	276.380	1.671	50	0		CDAARO
C[N@H+](CCCO)C[C@H]1CN(c2cccc(Cl)c2)C(=O)O1	ZINC000585116775	930969154	/nfs/dbraw/zinc/96/91/54/930969154.db2.gz	IBPGZIUCJKBOCN-ZDUSSCGKSA-N	1	0	298.770	1.979	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1CCC(=O)NC1(CO)CCSCC1	ZINC000585121862	930988709	/nfs/dbraw/zinc/98/87/09/930988709.db2.gz	CUKUWYXVIISLRS-GFCCVEGCSA-N	1	0	286.441	1.235	50	0		CDAARO
CC[C@H](C)[C@@H](C[NH+](C)C)NC(=O)c1ccn(C)n1	ZINC000585125975	931003268	/nfs/dbraw/zinc/00/32/68/931003268.db2.gz	JXUUYNPGNCDBNT-CMPLNLGQSA-N	1	0	252.362	1.126	50	0		CDAARO
C[C@@H]1CCC[C@H](CC[NH+](C)C)N1C(=O)c1ccn(C)n1	ZINC000585128240	931012821	/nfs/dbraw/zinc/01/28/21/931012821.db2.gz	WVCHUCQJWSTTIS-CHWSQXEVSA-N	1	0	278.400	1.755	50	0		CDAARO
CSC[C@H](C)C(=O)N[C@@H]1C[C@@H]([NH+](C)C)C12CCC2	ZINC000585130856	931022426	/nfs/dbraw/zinc/02/24/26/931022426.db2.gz	DPPKEWIMOJCZRC-QJPTWQEYSA-N	1	0	270.442	1.975	50	0		CDAARO
Cc1nnc(CN(C)CC[C@@H](C)[NH+]2CCCC2)[nH]1	ZINC000243885785	937583632	/nfs/dbraw/zinc/58/36/32/937583632.db2.gz	ACGHXWIHJXJGEE-LLVKDONJSA-N	1	0	251.378	1.419	50	0		CDAARO
CCn1ncc(NC(=O)[C@]2(C)CC[N@H+](C)C2)c1C	ZINC001529146395	968994054	/nfs/dbraw/zinc/99/40/54/968994054.db2.gz	OEAULUASNCUJLQ-CYBMUJFWSA-N	1	0	250.346	1.492	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C[C@@H]1COCCO1	ZINC001529167277	969000204	/nfs/dbraw/zinc/00/02/04/969000204.db2.gz	HQIHZNMGWBNTLC-CQSZACIVSA-N	1	0	256.390	1.208	50	0		CDAARO
CC[C@H](CNc1ccnc(C)n1)[NH+]1CCN(C)CC1	ZINC001529172442	969001602	/nfs/dbraw/zinc/00/16/02/969001602.db2.gz	HRSGPOBBYDVXFC-CYBMUJFWSA-N	1	0	263.389	1.223	50	0		CDAARO
CN(C[C@H]1CCCC[N@@H+]1C)C(=O)c1cccc(=O)[nH]1	ZINC001506405285	975151554	/nfs/dbraw/zinc/15/15/54/975151554.db2.gz	AVRGKSQUNKAROX-LLVKDONJSA-N	1	0	263.341	1.344	50	0		CDAARO
Cc1nc(C(=O)Nc2nnc(CC[NH+](C)C)s2)cs1	ZINC001506405727	975152104	/nfs/dbraw/zinc/15/21/04/975152104.db2.gz	WTAVKHDBRUEROL-UHFFFAOYSA-N	1	0	297.409	1.659	50	0		CDAARO
Cc1nc(N)nc(N2CCC[C@@H]([NH+](C)C)C2)c1Cl	ZINC001506411147	975154497	/nfs/dbraw/zinc/15/44/97/975154497.db2.gz	WZXWXAXQEZLION-SECBINFHSA-N	1	0	269.780	1.551	50	0		CDAARO
Cc1cnc(N[C@@H]2CCC[C@H]2[NH+](C)C)nc1N(C)C	ZINC001506412030	975154610	/nfs/dbraw/zinc/15/46/10/975154610.db2.gz	MMVSXTGKCLYUCU-VXGBXAGGSA-N	1	0	263.389	1.746	50	0		CDAARO
c1cn(CCN2CC[NH+](CC3CCCC3)CC2)cn1	ZINC001506429618	975161820	/nfs/dbraw/zinc/16/18/20/975161820.db2.gz	SEBORQRTOCVHSJ-UHFFFAOYSA-N	1	0	262.401	1.691	50	0		CDAARO
CCOCC[N@H+](C)[C@@H]1CCC(=O)N(CC2CC2)CC1	ZINC001506430178	975161938	/nfs/dbraw/zinc/16/19/38/975161938.db2.gz	XNWQJSJXIPMWIL-CQSZACIVSA-N	1	0	268.401	1.746	50	0		CDAARO
[NH3+][C@H]1CCCCN(C(=O)c2ccc(Cn3cccn3)o2)C1	ZINC000082086917	177918781	/nfs/dbraw/zinc/91/87/81/177918781.db2.gz	UAXOWIIYNGVLQH-LBPRGKRZSA-N	1	0	288.351	1.478	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCC[C@H]2CC[NH2+]C2)cc1F	ZINC000110797778	230394084	/nfs/dbraw/zinc/39/40/84/230394084.db2.gz	OIJIKBRPJHWECM-LLVKDONJSA-N	1	0	286.372	1.412	50	0		CDAARO
O=C(C1CCCC1)N1CC[N@H+](CC2CC2)[C@@H](CCO)C1	ZINC000584904048	341994124	/nfs/dbraw/zinc/99/41/24/341994124.db2.gz	RFWDFTWCQZPAQB-HNNXBMFYSA-N	1	0	280.412	1.482	50	0		CDAARO
COc1ccc(N2C(=O)C[C@H]([NH2+]CC3CC3)C2=O)cc1	ZINC000095630532	185017058	/nfs/dbraw/zinc/01/70/58/185017058.db2.gz	QATLTGNYAGNVSK-ZDUSSCGKSA-N	1	0	274.320	1.327	50	0		CDAARO
COC(=O)CCCC(=O)N1CCC[C@H]([NH+]2CCCCC2)C1	ZINC000095943086	185037382	/nfs/dbraw/zinc/03/73/82/185037382.db2.gz	WYUNXFMVUDLKFE-AWEZNQCLSA-N	1	0	296.411	1.807	50	0		CDAARO
Brc1cnc(OC[C@H]2CCC[NH2+]2)nc1	ZINC000082662684	178151484	/nfs/dbraw/zinc/15/14/84/178151484.db2.gz	IFSWJXNUJUHKLE-MRVPVSSYSA-N	1	0	258.119	1.370	50	0		CDAARO
O[C@@H]1CCC[C@@H]1C[NH2+]C1CCN(c2nccs2)CC1	ZINC000095990360	185057651	/nfs/dbraw/zinc/05/76/51/185057651.db2.gz	AXMRKGQFHUAROT-DGCLKSJQSA-N	1	0	281.425	1.863	50	0		CDAARO
CC(C)(C)C[NH2+][C@@H]1CCCc2cn(CC(N)=O)nc21	ZINC000096002668	185062273	/nfs/dbraw/zinc/06/22/73/185062273.db2.gz	VVAGJABCPHWSIN-LLVKDONJSA-N	1	0	264.373	1.382	50	0		CDAARO
COCC[C@H]1CCCC[N@H+](C[C@H]2CCS(=O)(=O)C2)C1	ZINC000241965753	361754196	/nfs/dbraw/zinc/75/41/96/361754196.db2.gz	UVIGCKKYVRJHBO-ZIAGYGMSSA-N	1	0	289.441	1.560	50	0		CDAARO
NC(=[NH2+])NC[C@H](O)CN(c1ccccc1)c1ccccc1	ZINC000000492770	365672928	/nfs/dbraw/zinc/67/29/28/365672928.db2.gz	MOBSQAWJINLGBZ-HNNXBMFYSA-N	1	0	284.363	1.669	50	0		CDAARO
c1cc([C@H]2CCC[N@@H+](CCOC[C@H]3CCCO3)C2)n[nH]1	ZINC000106916144	349543579	/nfs/dbraw/zinc/54/35/79/349543579.db2.gz	WMXZNDFOAFMUSG-UONOGXRCSA-N	1	0	279.384	1.785	50	0		CDAARO
C[C@@]1(O)CC[N@H+](CCc2c[nH]c3ccccc23)C[C@@H]1O	ZINC000096148790	185107132	/nfs/dbraw/zinc/10/71/32/185107132.db2.gz	YOIQVSBCKFRVHZ-JKSUJKDBSA-N	1	0	274.364	1.528	50	0		CDAARO
CNC(=O)c1ccc(C[N@H+](C)[C@@H](C)Cc2cnccn2)o1	ZINC000244874412	361867123	/nfs/dbraw/zinc/86/71/23/361867123.db2.gz	XAXDHDNZDJCDNV-NSHDSACASA-N	1	0	288.351	1.492	50	0		CDAARO
CN(CC[N@@H+]1C[C@H]2CC[C@@H]1C2)Cc1[nH]nc2c1CCC2	ZINC000244899292	361868598	/nfs/dbraw/zinc/86/85/98/361868598.db2.gz	ZHCYHGJKCRTPFW-QWHCGFSZSA-N	1	0	274.412	1.815	50	0		CDAARO
Nc1cc(N)[nH+]c(SCC(=O)Nc2ccccc2F)n1	ZINC000000420695	361907598	/nfs/dbraw/zinc/90/75/98/361907598.db2.gz	KLDCMKISMMTDGE-UHFFFAOYSA-N	1	0	293.327	1.511	50	0		CDAARO
CC(C)CO[C@@H]1C[C@H]([NH2+]C[C@]2(O)CCOC2)C1(C)C	ZINC000097034788	185157293	/nfs/dbraw/zinc/15/72/93/185157293.db2.gz	FPBCOBZJHWOKAE-GZBFAFLISA-N	1	0	271.401	1.567	50	0		CDAARO
Cc1cn2c(n1)CC[C@H](NC(=O)c1ccnc(N(C)C)c1)C2	ZINC000097198631	342217143	/nfs/dbraw/zinc/21/71/43/342217143.db2.gz	YGMBRCIATAYUTL-ZDUSSCGKSA-N	1	0	299.378	1.397	50	0		CDAARO
C[NH+]1CCN(c2ccccc2NC(=O)C2CC2)CC1	ZINC000008780380	539083504	/nfs/dbraw/zinc/08/35/04/539083504.db2.gz	LEMCEOOWJFKITQ-UHFFFAOYSA-N	1	0	259.353	1.787	50	0		CDAARO
c1ccc2c(c1)CC[NH+](CCN1CCOCC1)CC2	ZINC000084582015	342265161	/nfs/dbraw/zinc/26/51/61/342265161.db2.gz	VWTIYVZJLKOKOQ-UHFFFAOYSA-N	1	0	260.381	1.419	50	0		CDAARO
COc1ccc(CCC(=O)N2CC[NH2+]C[C@@H]2C)cc1F	ZINC000125927948	187205487	/nfs/dbraw/zinc/20/54/87/187205487.db2.gz	HBOAZXYCFAVQFO-NSHDSACASA-N	1	0	280.343	1.587	50	0		CDAARO
CN(Cc1csc2ccccc12)C(=O)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000276609966	362094961	/nfs/dbraw/zinc/09/49/61/362094961.db2.gz	HGSJVZJSUOUEAJ-DGCLKSJQSA-N	1	0	290.388	1.583	50	0		CDAARO
CN(C)[C@H]1[C@@H]2OCC[C@@H]2[C@@H]1[NH2+]C1CSCCSC1	ZINC000222341801	282273020	/nfs/dbraw/zinc/27/30/20/282273020.db2.gz	HAZKHWUCOKZWQE-YVECIDJPSA-N	1	0	288.482	1.142	50	0		CDAARO
CNC(=O)CC[NH+]1CCC(OC[C@H]2CCCCO2)CC1	ZINC000096455937	529857327	/nfs/dbraw/zinc/85/73/27/529857327.db2.gz	DRZCCTFVRZBYLL-CQSZACIVSA-N	1	0	284.400	1.173	50	0		CDAARO
CCOc1c(F)cccc1C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179053145	362251432	/nfs/dbraw/zinc/25/14/32/362251432.db2.gz	FYDIAZGQRYJPEK-SNVBAGLBSA-N	1	0	266.316	1.658	50	0		CDAARO
CC[NH+](CC)CCNC(=O)[C@H](c1ccccc1)N(C)C	ZINC000084771296	362272487	/nfs/dbraw/zinc/27/24/87/362272487.db2.gz	FSNXBLAJMPHONY-HNNXBMFYSA-N	1	0	277.412	1.747	50	0		CDAARO
C[C@@]1(C2CC2)NC(=O)N(c2ccc(C[NH3+])cc2)C1=O	ZINC000148587587	362456308	/nfs/dbraw/zinc/45/63/08/362456308.db2.gz	IUGNOUXIEPLKPC-AWEZNQCLSA-N	1	0	259.309	1.370	50	0		CDAARO
COCc1ccc(C[N@@H+]2CCCC[C@H]2[C@H]2CNC(=O)C2)o1	ZINC000092104693	345624266	/nfs/dbraw/zinc/62/42/66/345624266.db2.gz	APFGGBOEFWLFIW-DOMZBBRYSA-N	1	0	292.379	1.917	50	0		CDAARO
COCc1nc([C@H]2C[C@@H]([NH3+])C2)cc(N2CCC(F)CC2)n1	ZINC000252537310	136593549	/nfs/dbraw/zinc/59/35/49/136593549.db2.gz	KXXIUINZZPCZHN-KLPPZKSPSA-N	1	0	294.374	1.766	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]CCn1ccnc1C	ZINC000584896031	349357507	/nfs/dbraw/zinc/35/75/07/349357507.db2.gz	LGFMOHMSYUYQEX-LBPRGKRZSA-N	1	0	261.373	1.629	50	0		CDAARO
Cn1ncnc1CC[NH2+][C@H]1CCN(c2ccccc2)C1	ZINC000584886074	349344141	/nfs/dbraw/zinc/34/41/41/349344141.db2.gz	FHDQJEHTXWCIKB-ZDUSSCGKSA-N	1	0	271.368	1.226	50	0		CDAARO
CN(CC1(CO)CCC1)C(=O)[C@H]1CCCCC[N@@H+]1C	ZINC000584888736	349347486	/nfs/dbraw/zinc/34/74/86/349347486.db2.gz	QYEISNPOWBDAAU-CYBMUJFWSA-N	1	0	268.401	1.482	50	0		CDAARO
OCc1ccc2c(c1)C[N@H+]([C@@H]1CCSC1)CCO2	ZINC000584890891	349349358	/nfs/dbraw/zinc/34/93/58/349349358.db2.gz	RIXVLKBNZCQSGK-CYBMUJFWSA-N	1	0	265.378	1.879	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@@H](NC(=O)c2cnc(N)s2)C1	ZINC000584893985	349353654	/nfs/dbraw/zinc/35/36/54/349353654.db2.gz	NCXQBIZAYBZTSI-MRVPVSSYSA-N	1	0	268.386	1.158	50	0		CDAARO
COc1ccc([C@H](C)[NH2+]C[C@]2(O)CCOC2)c(F)c1	ZINC000090850214	180046064	/nfs/dbraw/zinc/04/60/64/180046064.db2.gz	RXCLZTASSAVEOI-IINYFYTJSA-N	1	0	269.316	1.636	50	0		CDAARO
OC[C@H]1CN(c2nccs2)C[C@H]1C[NH+]1CCCC1	ZINC000091435185	180154581	/nfs/dbraw/zinc/15/45/81/180154581.db2.gz	JBDZIHPPZSIYFA-VXGBXAGGSA-N	1	0	267.398	1.284	50	0		CDAARO
Cc1ccccc1OCCN(C)C(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000091544115	180185032	/nfs/dbraw/zinc/18/50/32/180185032.db2.gz	GAWVMXAIRMSFQS-UONOGXRCSA-N	1	0	276.380	1.960	50	0		CDAARO
CC(C)[C@@H]1CN(c2nc(C(N)=O)cs2)C[C@H]1[NH+](C)C	ZINC000091707164	180230396	/nfs/dbraw/zinc/23/03/96/180230396.db2.gz	DJLYSMJDXMCNSC-GXSJLCMTSA-N	1	0	282.413	1.264	50	0		CDAARO
Cc1cnc(CN2CCC[C@H]2C[N@@H+]2CCC[C@H]2CO)o1	ZINC000110675075	350256625	/nfs/dbraw/zinc/25/66/25/350256625.db2.gz	AKFSWRSOWGLADH-KBPBESRZSA-N	1	0	279.384	1.404	50	0		CDAARO
CC[N@H+](C)C[C@@H]1CN(Cc2cccnc2)C[C@@H]1CO	ZINC000091847797	180270883	/nfs/dbraw/zinc/27/08/83/180270883.db2.gz	JGJDXVGTASJHEO-HUUCEWRRSA-N	1	0	263.385	1.074	50	0		CDAARO
CC[N@H+](C)C[C@@H]1CN(Cc2cccc(O)c2)C[C@@H]1CO	ZINC000091932145	180288647	/nfs/dbraw/zinc/28/86/47/180288647.db2.gz	AHTAXZNQESSPLE-HUUCEWRRSA-N	1	0	278.396	1.384	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2cc(Cl)cn2C)C[C@@H]1[NH3+]	ZINC000091877193	180278638	/nfs/dbraw/zinc/27/86/38/180278638.db2.gz	PUQOBWKZQOZTQN-ONGXEEELSA-N	1	0	269.776	1.878	50	0		CDAARO
C[NH+](C)[C@H]1CCN(Cc2ccncc2)C[C@H]1CCCO	ZINC000092046704	180311221	/nfs/dbraw/zinc/31/12/21/180311221.db2.gz	NEMRTAARJJGDFY-CVEARBPZSA-N	1	0	277.412	1.606	50	0		CDAARO
CC(=O)NC1CC[NH+](Cc2ccc3c(c2)CCO3)CC1	ZINC000111210025	350435451	/nfs/dbraw/zinc/43/54/51/350435451.db2.gz	VUDOEAACHFDSIS-UHFFFAOYSA-N	1	0	274.364	1.722	50	0		CDAARO
CCCC[C@H]([NH2+][C@H](C)[C@H](C)n1cccn1)C(N)=O	ZINC000106790399	186135587	/nfs/dbraw/zinc/13/55/87/186135587.db2.gz	CKMWRMFYBLTZPM-WOPDTQHZSA-N	1	0	252.362	1.466	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCC[C@@H]2CC[NH2+]C2)cc1C	ZINC000110797081	186325835	/nfs/dbraw/zinc/32/58/35/186325835.db2.gz	SFEDNLCLIYAKMK-ZDUSSCGKSA-N	1	0	282.409	1.581	50	0		CDAARO
C[C@@H](NC(=O)c1ccc2nccn2c1)[C@H]1CCCC[NH2+]1	ZINC000583652121	366019309	/nfs/dbraw/zinc/01/93/09/366019309.db2.gz	YXWSPNOUHGWRTJ-DGCLKSJQSA-N	1	0	272.352	1.595	50	0		CDAARO
C[C@H]1O[C@H](C(Cl)(Cl)Cl)N(CC[NH+](C)C)C1=O	ZINC000096026576	351474241	/nfs/dbraw/zinc/47/42/41/351474241.db2.gz	BCBYNSIATNYIDO-HTRCEHHLSA-N	1	0	289.590	1.492	50	0		CDAARO
Cc1ccc(N2C(=N)S[C@H]3CS(=O)(=O)C[C@H]32)cc1C	ZINC000005516063	363212287	/nfs/dbraw/zinc/21/22/87/363212287.db2.gz	ASGGTJFQLVODKB-NEPJUHHUSA-N	1	0	296.417	1.957	50	0		CDAARO
O=C(NC1CCN(c2ccccn2)CC1)[C@@H]1CCC[NH2+]C1	ZINC000037008424	363311821	/nfs/dbraw/zinc/31/18/21/363311821.db2.gz	XADFFCKNTJWSCY-CYBMUJFWSA-N	1	0	288.395	1.166	50	0		CDAARO
O=C(NCc1ccccc1Cl)C1CC[NH2+]CC1	ZINC000002585088	355977504	/nfs/dbraw/zinc/97/75/04/355977504.db2.gz	LKNLSFOVSWDIEO-UHFFFAOYSA-N	1	0	252.745	1.956	50	0		CDAARO
[NH3+]CCN1C(=O)S/C(=C/c2cccs2)C1=O	ZINC000003215136	355996526	/nfs/dbraw/zinc/99/65/26/355996526.db2.gz	OIWQNIDSQBDLEN-SOFGYWHQSA-N	1	0	254.336	1.743	50	0		CDAARO
C[NH+](C)[C@H]1CCN(C(=O)c2sccc2Cl)C[C@@H]1O	ZINC000584901682	355956217	/nfs/dbraw/zinc/95/62/17/355956217.db2.gz	XMZAYLYGJPZMID-UWVGGRQHSA-N	1	0	288.800	1.539	50	0		CDAARO
COC[C@H](C)C(=O)N[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C	ZINC000097378828	356105391	/nfs/dbraw/zinc/10/53/91/356105391.db2.gz	BKLKMICMVIKKGQ-DZKIICNBSA-N	1	0	290.407	1.906	50	0		CDAARO
COc1ccc([C@@H](C)[NH2+]CC(C)(C)C(N)=O)c(F)c1	ZINC000097370944	356089612	/nfs/dbraw/zinc/08/96/12/356089612.db2.gz	GXHZKXOAXQLEPJ-SECBINFHSA-N	1	0	268.332	1.996	50	0		CDAARO
CC(C)(C)OC(=O)NCCCOCCOCCC[NH3+]	ZINC000059859318	356361949	/nfs/dbraw/zinc/36/19/49/356361949.db2.gz	VENKBTRFJOWPPW-UHFFFAOYSA-N	1	0	276.377	1.283	50	0		CDAARO
CCC[NH+]1CCN(C(=O)c2cccc(OC)c2)CC1	ZINC000016579903	356442132	/nfs/dbraw/zinc/44/21/32/356442132.db2.gz	VSHANHYFKVDMCQ-UHFFFAOYSA-N	1	0	262.353	1.863	50	0		CDAARO
COc1cc(CN2CC[NH+](C)CC2)cc(OC)c1OC	ZINC000019360876	356482774	/nfs/dbraw/zinc/48/27/74/356482774.db2.gz	FGWAFIJYVQGPKE-UHFFFAOYSA-N	1	0	280.368	1.460	50	0		CDAARO
C[C@@H]1CN(C(=O)C[C@@H]([NH3+])c2ccccc2)C[C@H](C)O1	ZINC000019426036	356484868	/nfs/dbraw/zinc/48/48/68/356484868.db2.gz	CMVFCAPGNXSBNG-MBNYWOFBSA-N	1	0	262.353	1.712	50	0		CDAARO
Cc1cc(C)n(CC(=O)NCC[NH+]2C[C@H](C)C[C@@H](C)C2)n1	ZINC000019573470	356492484	/nfs/dbraw/zinc/49/24/84/356492484.db2.gz	JYOLWFUPXOQWIG-CHWSQXEVSA-N	1	0	292.427	1.594	50	0		CDAARO
COc1cc(C=O)ccc1OCCN1CC[NH+](C)CC1	ZINC000019702425	356496176	/nfs/dbraw/zinc/49/61/76/356496176.db2.gz	LWWBHHPHFNSQMV-UHFFFAOYSA-N	1	0	278.352	1.134	50	0		CDAARO
CCOc1ccc(CN2CC[NH2+]C[C@H]2CCO)cc1	ZINC000019860708	356511098	/nfs/dbraw/zinc/51/10/98/356511098.db2.gz	QIHCCUFYBADKBX-CQSZACIVSA-N	1	0	264.369	1.242	50	0		CDAARO
O=C(c1ccc(-c2ccccc2)o1)N1CC[NH2+]CC1	ZINC000049846009	356584817	/nfs/dbraw/zinc/58/48/17/356584817.db2.gz	VKYVIFSTABEKKJ-UHFFFAOYSA-N	1	0	256.305	1.992	50	0		CDAARO
Cc1cc(C[N@@H+]2CCC[C@@H]2[C@@H]2COCC[C@]2(C)O)on1	ZINC000328954275	202127995	/nfs/dbraw/zinc/12/79/95/202127995.db2.gz	IKTWEQWPPUGCLC-ZNMIVQPWSA-N	1	0	280.368	1.735	50	0		CDAARO
[NH3+]C[C@H]1CCN(Cc2coc3ccccc3c2=O)C1	ZINC000426382623	358508678	/nfs/dbraw/zinc/50/86/78/358508678.db2.gz	IENRKQRBKYHRGW-LLVKDONJSA-N	1	0	258.321	1.574	50	0		CDAARO
COCC[NH+]1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000025053661	356667415	/nfs/dbraw/zinc/66/74/15/356667415.db2.gz	GLZJQVPQLAVZFU-UHFFFAOYSA-N	1	0	298.408	1.076	50	0		CDAARO
O=C(NCCc1ccccc1)[C@@H]1CC12CC[NH2+]CC2	ZINC000070251975	363559396	/nfs/dbraw/zinc/55/93/96/363559396.db2.gz	AFQHXDGOPDUSIE-AWEZNQCLSA-N	1	0	258.365	1.735	50	0		CDAARO
CCc1nnc(NC(=O)N2C[C@H]3CCC[N@@H+]3C[C@H]2C)s1	ZINC000247174730	356715904	/nfs/dbraw/zinc/71/59/04/356715904.db2.gz	VLOMGYUAMHSGNV-NXEZZACHSA-N	1	0	295.412	1.801	50	0		CDAARO
O=c1[nH]c(C23CC4CC(CC(C4)C2)C3)nc2c1CC[NH2+]C2	ZINC000077377899	356957158	/nfs/dbraw/zinc/95/71/58/356957158.db2.gz	JJVGQFRORVAQII-UHFFFAOYSA-N	1	0	285.391	1.883	50	0		CDAARO
CC(=O)N1CCC[N@H+](C[C@@H](O)c2ccccc2)CC1	ZINC000049932688	363572239	/nfs/dbraw/zinc/57/22/39/363572239.db2.gz	XHXDXNKNKOANAB-OAHLLOKOSA-N	1	0	262.353	1.274	50	0		CDAARO
O=C(c1ccoc1)N1CCC(C[NH+]2CCOCC2)CC1	ZINC000047387254	357157041	/nfs/dbraw/zinc/15/70/41/357157041.db2.gz	UDISIGYOTSDHLN-UHFFFAOYSA-N	1	0	278.352	1.464	50	0		CDAARO
Oc1ccc(N2CC[NH+](CCn3cccn3)CC2)cc1	ZINC000049000241	357203465	/nfs/dbraw/zinc/20/34/65/357203465.db2.gz	JLGKICXSJUZDMI-UHFFFAOYSA-N	1	0	272.352	1.411	50	0		CDAARO
C[C@H](N1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)C(F)(F)F	ZINC000119310182	357370414	/nfs/dbraw/zinc/37/04/14/357370414.db2.gz	HEFQBLKYQXOKIC-TUAOUCFPSA-N	1	0	280.334	1.858	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CNC(=O)CCOc2ccccc2)C1	ZINC000067771161	357625802	/nfs/dbraw/zinc/62/58/02/357625802.db2.gz	JLBIEBJTKJKYST-AWEZNQCLSA-N	1	0	276.380	1.914	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2ccc(F)cc2)CC1	ZINC000023014201	357646484	/nfs/dbraw/zinc/64/64/84/357646484.db2.gz	ONZPQCRPUVLFDC-UHFFFAOYSA-N	1	0	294.370	1.914	50	0		CDAARO
CCN(CC)C(=O)C(=O)NC[C@H]1CC[N@@H+](C2CCCC2)C1	ZINC000067841544	357631655	/nfs/dbraw/zinc/63/16/55/357631655.db2.gz	POPDCMCHYJFOPC-CYBMUJFWSA-N	1	0	295.427	1.236	50	0		CDAARO
CN1C[C@@H]([NH3+])C[C@H]1C(=O)NCc1csc2c1CCCC2	ZINC000067855032	357632446	/nfs/dbraw/zinc/63/24/46/357632446.db2.gz	DNEWUUMDLQWSMI-AAEUAGOBSA-N	1	0	293.436	1.275	50	0		CDAARO
Cc1cc2c(c(-c3cccc(N)n3)c1)O[C@H](C[NH3+])C2	ZINC000067910308	357637201	/nfs/dbraw/zinc/63/72/01/357637201.db2.gz	QVERDXCFXVJOFX-NSHDSACASA-N	1	0	255.321	1.901	50	0		CDAARO
Cc1ccc(CNC(=O)N[C@@H](C)CO)c(N2CCCC2)n1	ZINC000097080664	357943990	/nfs/dbraw/zinc/94/39/90/357943990.db2.gz	FCOZJOFRZICYCW-LBPRGKRZSA-N	1	0	292.383	1.170	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+]Cc1cn2ccccc2n1	ZINC000097081570	357944999	/nfs/dbraw/zinc/94/49/99/357944999.db2.gz	DCWPCYXOBGGVEK-UHFFFAOYSA-N	1	0	261.325	1.623	50	0		CDAARO
O=C(c1ccc(F)c(F)c1)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000027932407	357946414	/nfs/dbraw/zinc/94/64/14/357946414.db2.gz	LQXRWIPBQPCNAH-NSHDSACASA-N	1	0	266.291	1.885	50	0		CDAARO
Cc1cc(NC(=O)C[NH2+][C@@H]2CC(C)(C)OC2(C)C)n(C)n1	ZINC000097100295	357971492	/nfs/dbraw/zinc/97/14/92/357971492.db2.gz	TXUOIJRXFXCDFU-LLVKDONJSA-N	1	0	294.399	1.603	50	0		CDAARO
COc1ccc2oc([C@@H](C)[NH2+]CC(N)=O)c(C)c2c1	ZINC000097112136	357987126	/nfs/dbraw/zinc/98/71/26/357987126.db2.gz	HGFDFTHMGGZXSY-SECBINFHSA-N	1	0	262.309	1.886	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2ccccc2)CC1	ZINC000023127942	358062429	/nfs/dbraw/zinc/06/24/29/358062429.db2.gz	GJFBNXJSGUFIEB-UHFFFAOYSA-N	1	0	276.380	1.775	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2cnc(C3CCCCC3)nc2)C[C@H]1O	ZINC000082126236	358147688	/nfs/dbraw/zinc/14/76/88/358147688.db2.gz	AHXRQOHZYMHLDY-HUUCEWRRSA-N	1	0	290.411	1.418	50	0		CDAARO
CCN(CC)C(=O)C[N@@H+]1CCC[C@@H](c2nccn2C)C1	ZINC000082119927	358147879	/nfs/dbraw/zinc/14/78/79/358147879.db2.gz	AJTFYJNTEYBBMA-CYBMUJFWSA-N	1	0	278.400	1.468	50	0		CDAARO
CC(C)[C@@H](O)CC[NH2+][C@@H]1CCN(CC(F)(F)F)C1	ZINC000088734832	366429220	/nfs/dbraw/zinc/42/92/20/366429220.db2.gz	NIZGLMBHXWHSKZ-MNOVXSKESA-N	1	0	268.323	1.620	50	0		CDAARO
C[C@H]1COCC[C@@H]1Nc1cc(C(N)=O)ccc1C[NH+](C)C	ZINC000195104712	358410812	/nfs/dbraw/zinc/41/08/12/358410812.db2.gz	BGRXQOKUDNGFGR-FZMZJTMJSA-N	1	0	291.395	1.684	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)[C@@H]1CC[NH2+]C1	ZINC000247452533	358447952	/nfs/dbraw/zinc/44/79/52/358447952.db2.gz	ZXPWLZIIQYCWHW-GMTAPVOTSA-N	1	0	280.318	1.889	50	0		CDAARO
O=S(=O)(CCc1ccccc1)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000247510822	358551361	/nfs/dbraw/zinc/55/13/61/358551361.db2.gz	PPUOSVMKHMSGHH-HNNXBMFYSA-N	1	0	294.420	1.339	50	0		CDAARO
CO[C@@H]1CCN(C(=O)Cc2cc(F)ccc2F)[C@@H](C[NH3+])C1	ZINC000195557540	358560965	/nfs/dbraw/zinc/56/09/65/358560965.db2.gz	GDFHQBJBSVXZII-CHWSQXEVSA-N	1	0	298.333	1.472	50	0		CDAARO
Cc1cc2ncc([C@@H](C)[NH2+][C@@H]3C=C[C@H](CO)C3)c(C)n2n1	ZINC000195558625	358564459	/nfs/dbraw/zinc/56/44/59/358564459.db2.gz	XXFVQPVDNZNPPC-KWCYVHTRSA-N	1	0	286.379	1.934	50	0		CDAARO
CC(C)[C@H](CCO)[NH2+]CC(=O)N1C[C@H](C)C[C@@H](C)C1	ZINC000195563993	358565497	/nfs/dbraw/zinc/56/54/97/358565497.db2.gz	IXQGBRHOVLBGMG-MCIONIFRSA-N	1	0	270.417	1.488	50	0		CDAARO
C[N@@H+]1CCOC[C@@H](CNc2nnc(C3CCC3)o2)C1	ZINC000095363586	358685689	/nfs/dbraw/zinc/68/56/89/358685689.db2.gz	VBKPGZONHBMZFP-JTQLQIEISA-N	1	0	266.345	1.327	50	0		CDAARO
CCc1nnc(CNC(=O)CCC[NH+]2CCCCC2)s1	ZINC000095383034	358690579	/nfs/dbraw/zinc/69/05/79/358690579.db2.gz	BXTYBKLDDZZNIW-UHFFFAOYSA-N	1	0	296.440	1.983	50	0		CDAARO
Cn1c2ccccc2cc(CN2C[C@@H]3CC[C@H]2C[NH2+]C3)c1=O	ZINC000097360214	358770330	/nfs/dbraw/zinc/77/03/30/358770330.db2.gz	PVCHAJQKZMFBDZ-CJNGLKHVSA-N	1	0	297.402	1.722	50	0		CDAARO
Cc1c[nH+]ccc1N1CCN(C(=O)c2cn[nH]c2)CC1	ZINC000215840243	358905634	/nfs/dbraw/zinc/90/56/34/358905634.db2.gz	JJHQEKHJRZIVDV-UHFFFAOYSA-N	1	0	271.324	1.076	50	0		CDAARO
CCc1nccc(CN2CC[NH+](C3CCOCC3)CC2)n1	ZINC000216182730	358929785	/nfs/dbraw/zinc/92/97/85/358929785.db2.gz	OLBDKYZKJGXODL-UHFFFAOYSA-N	1	0	290.411	1.336	50	0		CDAARO
Nc1ccc(NC(=O)[C@@H]2C[C@H]3CCCC[C@H]3[NH2+]2)cn1	ZINC000262450056	359170989	/nfs/dbraw/zinc/17/09/89/359170989.db2.gz	RDCZMMMSVGSZQK-JLLWLGSASA-N	1	0	260.341	1.523	50	0		CDAARO
[NH3+][C@H]1C[C@@H](c2cc(NCCCN3CCCC3=O)ncn2)C1	ZINC000223419821	359424835	/nfs/dbraw/zinc/42/48/35/359424835.db2.gz	UATGEUCIRXRRMK-HAQNSBGRSA-N	1	0	289.383	1.106	50	0		CDAARO
CC[N@H+](C1CN(C(=O)c2cccn2C)C1)C1CCOCC1	ZINC000257181909	359432348	/nfs/dbraw/zinc/43/23/48/359432348.db2.gz	OCRKEFVPVRUGIR-UHFFFAOYSA-N	1	0	291.395	1.350	50	0		CDAARO
Cc1cnc(C)c(N[C@@H]2CCOC[C@H]2OCC[NH+](C)C)n1	ZINC000223663741	359445055	/nfs/dbraw/zinc/44/50/55/359445055.db2.gz	KJISCEWGRAISGA-ZIAGYGMSSA-N	1	0	294.399	1.241	50	0		CDAARO
CN(C)c1ncc(C[N@H+](C)C[C@H]2CCCCO2)cn1	ZINC000118944472	359825306	/nfs/dbraw/zinc/82/53/06/359825306.db2.gz	MGSCHJYBJNYDSH-CYBMUJFWSA-N	1	0	264.373	1.544	50	0		CDAARO
COc1cc(C[NH2+][C@H]2CCCNC2=O)ccc1SC	ZINC000089429315	359908851	/nfs/dbraw/zinc/90/88/51/359908851.db2.gz	WRKAPYITLHZAOG-NSHDSACASA-N	1	0	280.393	1.785	50	0		CDAARO
O=C(N1CCCC1)C1(F)CC[NH+](CC2CC2)CC1	ZINC000409419515	360226020	/nfs/dbraw/zinc/22/60/20/360226020.db2.gz	LHOYGRIOAVKUSO-UHFFFAOYSA-N	1	0	254.349	1.823	50	0		CDAARO
NC(=O)[C@@H]1C[C@H](Oc2ccccc2)C[N@@H+]1C1CCC1	ZINC000409421530	360231883	/nfs/dbraw/zinc/23/18/83/360231883.db2.gz	HRZCCRNHMMKNEH-KBPBESRZSA-N	1	0	260.337	1.546	50	0		CDAARO
[NH3+]C[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2)CCO1	ZINC000011887430	360400561	/nfs/dbraw/zinc/40/05/61/360400561.db2.gz	VLOPLTFWADMLSQ-NSHDSACASA-N	1	0	288.269	1.505	50	0		CDAARO
CC(C)n1ccc(C(=O)N2CCOC3(CC[NH2+]CC3)C2)n1	ZINC000426490719	360575133	/nfs/dbraw/zinc/57/51/33/360575133.db2.gz	PAOZXSRKIQSJBI-UHFFFAOYSA-N	1	0	292.383	1.059	50	0		CDAARO
c1cnn(Cc2ccc(CN3C[C@@H]4CC[NH2+][C@@H]4C3)cc2)c1	ZINC000426651972	360692135	/nfs/dbraw/zinc/69/21/35/360692135.db2.gz	GJOULWHOEBBBRF-DLBZAZTESA-N	1	0	282.391	1.725	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@H](CNC(=O)CCc2cnccn2)C1	ZINC000426370515	360660238	/nfs/dbraw/zinc/66/02/38/360660238.db2.gz	MQVYTJBRPUDTLG-CYBMUJFWSA-N	1	0	290.411	1.646	50	0		CDAARO
CCSCCNC(=O)Cn1nccc1[C@H]1CCC[NH2+]C1	ZINC000426410443	360666077	/nfs/dbraw/zinc/66/60/77/360666077.db2.gz	GTPZPONPDKGUSH-LBPRGKRZSA-N	1	0	296.440	1.219	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2ccccc2COC)C1	ZINC000178981428	189158838	/nfs/dbraw/zinc/15/88/38/189158838.db2.gz	QNZXYDIMUIYKIX-GFCCVEGCSA-N	1	0	262.353	1.515	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cc(F)cc3nccnc32)C1	ZINC000178985668	189159592	/nfs/dbraw/zinc/15/95/92/189159592.db2.gz	GTSQEOKIYCCFHC-SNVBAGLBSA-N	1	0	288.326	1.450	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2ccc(-n3ccnc3)cc2)C1	ZINC000178990707	189159916	/nfs/dbraw/zinc/15/99/16/189159916.db2.gz	MVXVLMXEUVIULR-ZDUSSCGKSA-N	1	0	284.363	1.554	50	0		CDAARO
C[C@@H](C[NH+]1CCCCC1)NS(=O)(=O)c1cccnc1	ZINC000189130594	361201317	/nfs/dbraw/zinc/20/13/17/361201317.db2.gz	IDHJFFNPNVMQNB-LBPRGKRZSA-N	1	0	283.397	1.234	50	0		CDAARO
C[NH+](C)CCNc1c(=O)c(=O)c1NCc1cccc(F)c1	ZINC000101694939	364036405	/nfs/dbraw/zinc/03/64/05/364036405.db2.gz	VLUQJQZHCRXKAP-UHFFFAOYSA-N	1	0	291.326	1.007	50	0		CDAARO
OC1(C[N@@H+]2CCc3sccc3C2)CCOCC1	ZINC000269358651	364184131	/nfs/dbraw/zinc/18/41/31/364184131.db2.gz	INWOBHBFDSCZGK-UHFFFAOYSA-N	1	0	253.367	1.648	50	0		CDAARO
COC(=O)[C@@H]1CC12CCN(CC[NH2+]C(C)C)CC2	ZINC000253420890	291305258	/nfs/dbraw/zinc/30/52/58/291305258.db2.gz	NHCARJNKRPMLTI-LBPRGKRZSA-N	1	0	254.374	1.260	50	0		CDAARO
O=C(C1CC[NH+](C[C@@H]2CCCOC2)CC1)N1CCCC1	ZINC000336386444	283759757	/nfs/dbraw/zinc/75/97/57/283759757.db2.gz	RXZUZAQKQREBSF-AWEZNQCLSA-N	1	0	280.412	1.747	50	0		CDAARO
C1=CO[C@@H](C[NH2+]CCc2nnc3n2CCCCC3)CC1	ZINC000194196397	189656161	/nfs/dbraw/zinc/65/61/61/189656161.db2.gz	FFZNHJBNXMOUOS-CYBMUJFWSA-N	1	0	276.384	1.829	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)CCCOc2ccc(F)cc2)C1	ZINC000195116653	189672125	/nfs/dbraw/zinc/67/21/25/189672125.db2.gz	RFPAZQGLQJRQPZ-ZDUSSCGKSA-N	1	0	280.343	1.934	50	0		CDAARO
CC(C)(C[NH+]1CCC(c2ncon2)CC1)N1CCOCC1	ZINC000215981950	189699318	/nfs/dbraw/zinc/69/93/18/189699318.db2.gz	IOGDYMYLMJUAFX-UHFFFAOYSA-N	1	0	294.399	1.360	50	0		CDAARO
O=C1CCC(=O)N1CC[N@@H+]1CCC[C@@H]1c1ccc[nH]1	ZINC000089767985	366930617	/nfs/dbraw/zinc/93/06/17/366930617.db2.gz	VXFOBQNTORNAFL-GFCCVEGCSA-N	1	0	261.325	1.301	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CC[NH2+]C[C@@H]2C)c(C)c1	ZINC000094345690	367481843	/nfs/dbraw/zinc/48/18/43/367481843.db2.gz	PMQJYNPUTRBAEG-STQMWFEESA-N	1	0	282.409	1.580	50	0		CDAARO
Cc1ccc(C[N@@H+](CCO)CCN2CCO[C@@H](C)C2)o1	ZINC000252537571	367800769	/nfs/dbraw/zinc/80/07/69/367800769.db2.gz	LPBKUWKFFXJPCS-AWEZNQCLSA-N	1	0	282.384	1.103	50	0		CDAARO
CCN(Cc1ccccn1)C(=O)C(C)(C)N1CCOCC1	ZINC000283149338	368203575	/nfs/dbraw/zinc/20/35/75/368203575.db2.gz	JFRMARHRCNNALG-UHFFFAOYSA-N	1	0	291.395	1.541	50	0		CDAARO
CN1CCc2ncnc(N3CCC[N@@H+]4CCC[C@H]4C3)c2C1	ZINC000241144879	368874798	/nfs/dbraw/zinc/87/47/98/368874798.db2.gz	JTWBHWTXNXWCQU-ZDUSSCGKSA-N	1	0	287.411	1.139	50	0		CDAARO
c1cnc(CN2CCCC[C@H]2CN2CCOCC2)nc1	ZINC000192047729	371793561	/nfs/dbraw/zinc/79/35/61/371793561.db2.gz	UYAYLJFGTCDGBI-AWEZNQCLSA-N	1	0	276.384	1.163	50	0		CDAARO
Cc1ccc2nc(CNC(=O)[C@H]3CCC[NH2+]CC3)cn2c1	ZINC000299785789	372761233	/nfs/dbraw/zinc/76/12/33/372761233.db2.gz	NWJPAMYZANYOGZ-ZDUSSCGKSA-N	1	0	286.379	1.649	50	0		CDAARO
Cc1nc(N)sc1-c1ccn(CC[NH+](C)C)n1	ZINC000299794307	372767293	/nfs/dbraw/zinc/76/72/93/372767293.db2.gz	JQSFZPDANTYEES-UHFFFAOYSA-N	1	0	251.359	1.459	50	0		CDAARO
C[NH+](C)CCNC(=O)Nc1ccc(C(F)(F)F)nc1	ZINC000097052314	541882162	/nfs/dbraw/zinc/88/21/62/541882162.db2.gz	VWINFGJYRZZCRD-UHFFFAOYSA-N	1	0	276.262	1.784	50	0		CDAARO
O=C(O[C@H]1C[NH+]2CCC1CC2)c1cccc2[nH]cnc21	ZINC000000385644	373640731	/nfs/dbraw/zinc/64/07/31/373640731.db2.gz	GWWYTCNQOVHBHJ-ZDUSSCGKSA-N	1	0	271.320	1.814	50	0		CDAARO
CC(C)[C@H]([NH2+][C@H](C(N)=O)c1ccc(F)cc1)C(C)(C)O	ZINC000253429357	373736235	/nfs/dbraw/zinc/73/62/35/373736235.db2.gz	MYILKVMYNZSCNO-STQMWFEESA-N	1	0	282.359	1.737	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@@]1(C)CC[NH2+]C1	ZINC000111668929	374198775	/nfs/dbraw/zinc/19/87/75/374198775.db2.gz	WDFCNYDTRDRQQC-LBPRGKRZSA-N	1	0	253.371	1.410	50	0		CDAARO
Cc1cc(F)ccc1C[NH2+]CC1(O)CCOCC1	ZINC000112717354	374227869	/nfs/dbraw/zinc/22/78/69/374227869.db2.gz	UQBVPNRWELCJBS-UHFFFAOYSA-N	1	0	253.317	1.765	50	0		CDAARO
c1cc2n(n1)C[C@H](C[NH2+][C@H]1CCN3CCCC[C@@H]13)CN2	ZINC000106188013	374430320	/nfs/dbraw/zinc/43/03/20/374430320.db2.gz	SAYGZKJFZCAIQD-RDBSUJKOSA-N	1	0	275.400	1.141	50	0		CDAARO
[NH3+]C[C@@H]1CCCN1C(=O)Cc1cccc(F)c1F	ZINC000094714868	374644056	/nfs/dbraw/zinc/64/40/56/374644056.db2.gz	QIUVPTZWONSZTG-JTQLQIEISA-N	1	0	254.280	1.457	50	0		CDAARO
COC(=O)[C@@]12CCC[C@@H]1C[N@H+](CC(=O)NC(C)(C)C)C2	ZINC000108466447	412828840	/nfs/dbraw/zinc/82/88/40/412828840.db2.gz	VTNIGDBHHYLXSJ-IAQYHMDHSA-N	1	0	282.384	1.176	50	0		CDAARO
C[NH+]1CCN(CCOCCOc2ccc(F)cc2)CC1	ZINC000019707792	374776730	/nfs/dbraw/zinc/77/67/30/374776730.db2.gz	WGQZJOVNEJHNKH-UHFFFAOYSA-N	1	0	282.359	1.469	50	0		CDAARO
O=C(c1ccccc1F)N1CCC[N@@H+]([C@H]2CCOC2)CC1	ZINC000334286716	374779996	/nfs/dbraw/zinc/77/99/96/374779996.db2.gz	CMBBCIUXMXRIEG-ZDUSSCGKSA-N	1	0	292.354	1.763	50	0		CDAARO
C[NH+]1CCC(N[C@H](Cn2cncn2)c2ccccc2)CC1	ZINC000095421765	374923453	/nfs/dbraw/zinc/92/34/53/374923453.db2.gz	DTWWFMXQQBIZKU-MRXNPFEDSA-N	1	0	285.395	1.703	50	0		CDAARO
CCn1cc(CN(C)[C@@H](C)C(=O)N2CCCCC2)cn1	ZINC000095430691	374932573	/nfs/dbraw/zinc/93/25/73/374932573.db2.gz	FPHUMWNLIOGQCM-ZDUSSCGKSA-N	1	0	278.400	1.736	50	0		CDAARO
Cc1c(F)cccc1S(=O)(=O)NC(C)(C)C[NH3+]	ZINC000095972607	375045549	/nfs/dbraw/zinc/04/55/49/375045549.db2.gz	RXIKDFKHQGGNFK-UHFFFAOYSA-N	1	0	260.334	1.150	50	0		CDAARO
CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)Nc1cccnn1	ZINC000096000052	375049704	/nfs/dbraw/zinc/04/97/04/375049704.db2.gz	QWEORKBROPCFFS-NSHDSACASA-N	1	0	263.345	1.281	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)COc2cccc(F)c2)C1	ZINC000299740346	375201233	/nfs/dbraw/zinc/20/12/33/375201233.db2.gz	YQPZBWGYRSSJEO-VXGBXAGGSA-N	1	0	280.343	1.790	50	0		CDAARO
Cc1cc(S(=O)(=O)N2CC[C@H]([NH3+])C[C@H]2C)c(C)o1	ZINC000299748284	375206696	/nfs/dbraw/zinc/20/66/96/375206696.db2.gz	GRNXGOHZPMWYGD-KCJUWKMLSA-N	1	0	272.370	1.397	50	0		CDAARO
CC1CC[NH+](CC(=O)NC(=O)NCc2ccccc2)CC1	ZINC000003583247	375755517	/nfs/dbraw/zinc/75/55/17/375755517.db2.gz	JRZMCWLUKJHLCT-UHFFFAOYSA-N	1	0	289.379	1.744	50	0		CDAARO
O=C(C[NH+]1CCCCC1)NC(=O)NCc1ccccc1	ZINC000003582621	375756143	/nfs/dbraw/zinc/75/61/43/375756143.db2.gz	OWEKXAHQQCJZQR-UHFFFAOYSA-N	1	0	275.352	1.498	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCCC[NH+]2CCCC2)cc1	ZINC000004104984	375873261	/nfs/dbraw/zinc/87/32/61/375873261.db2.gz	PQSPRJCWUCYYOV-UHFFFAOYSA-N	1	0	282.409	1.759	50	0		CDAARO
COc1cccc(/C(C)=C\C(=O)N2CC[NH2+]C[C@H]2C)c1	ZINC000254949897	375925554	/nfs/dbraw/zinc/92/55/54/375925554.db2.gz	BUNCVYBLLOPZKN-KIWPFMIBSA-N	1	0	274.364	1.919	50	0		CDAARO
CCc1cc(C)nc(N2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)n1	ZINC000241124190	376016705	/nfs/dbraw/zinc/01/67/05/376016705.db2.gz	JGFNZULREWEKLQ-STQMWFEESA-N	1	0	278.400	1.239	50	0		CDAARO
COc1ccc(CN2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)cc1F	ZINC000241884814	376018233	/nfs/dbraw/zinc/01/82/33/376018233.db2.gz	SYABXLYVKOFQNJ-STQMWFEESA-N	1	0	296.386	1.721	50	0		CDAARO
CCCc1noc([C@H](C)[NH2+][C@H]2CCN(C(C)=O)C[C@H]2C)n1	ZINC000241969533	376020557	/nfs/dbraw/zinc/02/05/57/376020557.db2.gz	UXDFIYUWEUWTPH-MDZLAQPJSA-N	1	0	294.399	1.930	50	0		CDAARO
O=C(C[N@@H+]1CC[C@@H]2CCCC[C@H]2C1)NC(=O)NC1CC1	ZINC000008267137	376516111	/nfs/dbraw/zinc/51/61/11/376516111.db2.gz	XFOVAHPTPXAMRY-RYUDHWBXSA-N	1	0	279.384	1.487	50	0		CDAARO
CCc1nnc(C2CC[NH+](C[C@H](O)C(F)(F)F)CC2)[nH]1	ZINC000190712514	378317735	/nfs/dbraw/zinc/31/77/35/378317735.db2.gz	MUPSIBRIVYTESR-VIFPVBQESA-N	1	0	292.305	1.470	50	0		CDAARO
CCc1ccc(-n2cc(C(=O)N3CCC([NH3+])CC3)nn2)cc1	ZINC000071768200	184575350	/nfs/dbraw/zinc/57/53/50/184575350.db2.gz	OVKXENJXBISZJB-UHFFFAOYSA-N	1	0	299.378	1.393	50	0		CDAARO
C[NH2+][C@H]1CCN(C(=O)c2cccc(F)c2Cl)C1	ZINC000096482491	533037817	/nfs/dbraw/zinc/03/78/17/533037817.db2.gz	JYEZOOUSKMPQKE-QMMMGPOBSA-N	1	0	256.708	1.913	50	0		CDAARO
C[C@@H]1CCCN(S(=O)(=O)N2CCC[C@@H](C)[C@H]2C[NH3+])C1	ZINC000252156696	296394545	/nfs/dbraw/zinc/39/45/45/296394545.db2.gz	NKBJUSUOLVHEKB-JHJVBQTASA-N	1	0	289.445	1.022	50	0		CDAARO
O[C@@H](C[C@H]1CC2(CC[NH2+]1)OCCO2)c1ccccc1	ZINC000001578710	285307502	/nfs/dbraw/zinc/30/75/02/285307502.db2.gz	MUYSQNAMKXQDPT-KBPBESRZSA-N	1	0	263.337	1.605	50	0		CDAARO
CC[NH+]1CCN(C(=O)/C=C\c2ccc3c(c2)CCO3)CC1	ZINC000096400621	256773247	/nfs/dbraw/zinc/77/32/47/256773247.db2.gz	LEWUWOOHIKMYLM-XQRVVYSFSA-N	1	0	286.375	1.799	50	0		CDAARO
COC(=O)[C@H](NC(=O)OC(C)(C)C)[C@H]1CCC[NH2+]C1	ZINC000002527606	390143138	/nfs/dbraw/zinc/14/31/38/390143138.db2.gz	HKYHGXQKYQHGFW-VHSXEESVSA-N	1	0	272.345	1.052	50	0		CDAARO
c1c([C@H]2CCC[NH2+]C2)nnn1CCNc1ccccc1	ZINC000095368120	184956018	/nfs/dbraw/zinc/95/60/18/184956018.db2.gz	XFGXRXICZHPGEJ-ZDUSSCGKSA-N	1	0	271.368	1.857	50	0		CDAARO
CCN(CCC[NH+]1CCCC1)C(=O)c1cc[nH]n1	ZINC000188112456	390949900	/nfs/dbraw/zinc/94/99/00/390949900.db2.gz	IGOVTBGAWFCBGV-UHFFFAOYSA-N	1	0	250.346	1.358	50	0		CDAARO
[NH3+][C@H]1CN(C2CCN(C(=O)C3CCC3)CC2)C[C@@H]1C1CC1	ZINC000091416835	390889771	/nfs/dbraw/zinc/88/97/71/390889771.db2.gz	ACLHQWHYLNVWLP-CVEARBPZSA-N	1	0	291.439	1.447	50	0		CDAARO
COC(=O)CCN1CCN(c2ncc(Cl)cn2)[C@@H](C)C1	ZINC000089265503	391437331	/nfs/dbraw/zinc/43/73/31/391437331.db2.gz	CEJZNJTYSKLMJS-JTQLQIEISA-N	1	0	298.774	1.204	50	0		CDAARO
CC(C)[NH2+]C[C@]1(O)CCCN(CC(C)(C)C)C1=O	ZINC000015068285	391516950	/nfs/dbraw/zinc/51/69/50/391516950.db2.gz	DOLYOCDXRDUODF-CQSZACIVSA-N	1	0	256.390	1.384	50	0		CDAARO
C[N@@H+]1CC[C@@H](NC(=O)C(F)F)[C@H]1c1ccccc1	ZINC000248823173	391553514	/nfs/dbraw/zinc/55/35/14/391553514.db2.gz	YTLVKVDVNPNSIH-GHMZBOCLSA-N	1	0	254.280	1.813	50	0		CDAARO
Cc1ccc(N2CCOC3(CC[NH+](C)CC3)C2)nn1	ZINC000664055114	413050601	/nfs/dbraw/zinc/05/06/01/413050601.db2.gz	LDNUMJFXICLEPB-UHFFFAOYSA-N	1	0	262.357	1.086	50	0		CDAARO
Cc1c2ccccc2[nH]c(=O)c1C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179063966	391821138	/nfs/dbraw/zinc/82/11/38/391821138.db2.gz	ORNJPTDKCWNOLK-LLVKDONJSA-N	1	0	285.347	1.683	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)C1	ZINC000269172508	132124758	/nfs/dbraw/zinc/12/47/58/132124758.db2.gz	JUTKEDZZCQGLRF-GLQYFDAESA-N	1	0	276.355	1.997	50	0		CDAARO
CCCC[C@H]1C(=O)N(C)CC[N@@H+]1C1CCN(C(C)=O)CC1	ZINC000065409492	393401811	/nfs/dbraw/zinc/40/18/11/393401811.db2.gz	AMPAXBYDEWVVFD-HNNXBMFYSA-N	1	0	295.427	1.330	50	0		CDAARO
C[C@@H]1CCCN(C(=O)C[C@@H]2CCCCO2)[C@H]1C[NH3+]	ZINC000095032530	147107434	/nfs/dbraw/zinc/10/74/34/147107434.db2.gz	NEMIIYIMYJGNHJ-AGIUHOORSA-N	1	0	254.374	1.531	50	0		CDAARO
COc1ccc(NC(=O)NCCC[NH+](C)C)cc1OC	ZINC000005508977	170105397	/nfs/dbraw/zinc/10/53/97/170105397.db2.gz	LPKRBROMEQBSTO-UHFFFAOYSA-N	1	0	281.356	1.777	50	0		CDAARO
CCC[C@]1(C(=O)OCC)C[C@@H](CSC(N)=[NH2+])OC1=O	ZINC000005978995	170165284	/nfs/dbraw/zinc/16/52/84/170165284.db2.gz	FVMXZJUGGLQTQM-QPUJVOFHSA-N	1	0	288.369	1.278	50	0		CDAARO
NC(=[NH2+])N1CCN(Cc2cccc3ccccc32)CC1	ZINC000006590924	170217532	/nfs/dbraw/zinc/21/75/32/170217532.db2.gz	SIHPNJPVHRGBAY-UHFFFAOYSA-N	1	0	268.364	1.851	50	0		CDAARO
NC(=O)c1ccc(NC(=O)C[NH+]2CCCCCC2)cc1	ZINC000006639356	170221390	/nfs/dbraw/zinc/22/13/90/170221390.db2.gz	AXIFBKZHCIQNIY-UHFFFAOYSA-N	1	0	275.352	1.600	50	0		CDAARO
Cc1ccc2cc(C[NH2+]C[C@H](C)O)c(=O)[nH]c2c1C	ZINC000006748264	170239993	/nfs/dbraw/zinc/23/99/93/170239993.db2.gz	UBFORYYZNURFPH-JTQLQIEISA-N	1	0	260.337	1.615	50	0		CDAARO
Nc1cc(N)[nH+]c(SCc2ccc3c(c2)OCO3)n1	ZINC000006831852	170247890	/nfs/dbraw/zinc/24/78/90/170247890.db2.gz	VDZCXNDELHVYBL-UHFFFAOYSA-N	1	0	276.321	1.662	50	0		CDAARO
CC(C)[N@H+](CCOc1ccc(F)cc1)CC(N)=O	ZINC000007443061	170285554	/nfs/dbraw/zinc/28/55/54/170285554.db2.gz	AFJUBGDJNVJDBM-UHFFFAOYSA-N	1	0	254.305	1.400	50	0		CDAARO
C[C@H]([NH2+]CCCN1CCOCC1)C(=O)Nc1ccccc1	ZINC000008076215	170317576	/nfs/dbraw/zinc/31/75/76/170317576.db2.gz	BMSXDJGHABBTMP-AWEZNQCLSA-N	1	0	291.395	1.326	50	0		CDAARO
C[NH+](C)CCCNC(=O)Cc1cc(-c2ccccc2)on1	ZINC000012861499	170515340	/nfs/dbraw/zinc/51/53/40/170515340.db2.gz	SNYAMYJRQKPLGZ-UHFFFAOYSA-N	1	0	287.363	1.952	50	0		CDAARO
CN1CCC([N@@H+]2CCC[C@H](NC(=O)C3CCCC3)C2)CC1	ZINC000020201144	171065238	/nfs/dbraw/zinc/06/52/38/171065238.db2.gz	FZZYTNFZHFRZGR-HNNXBMFYSA-N	1	0	293.455	1.851	50	0		CDAARO
O=C(NC1CC[NH2+]CC1)c1cccc(Br)c1	ZINC000020271969	171126791	/nfs/dbraw/zinc/12/67/91/171126791.db2.gz	ZXBWMPLWUNTTFN-UHFFFAOYSA-N	1	0	283.169	1.931	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC[C@@H]([NH3+])C2)c(C)c1	ZINC000020432124	171196867	/nfs/dbraw/zinc/19/68/67/171196867.db2.gz	DFCLLRATQLCLDR-GFCCVEGCSA-N	1	0	268.382	1.415	50	0		CDAARO
C[N@H+](CCc1cn[nH]c1)C[C@H]1COc2ccccc2O1	ZINC000020450029	171207626	/nfs/dbraw/zinc/20/76/26/171207626.db2.gz	VDOFZMUNPHVDGL-ZDUSSCGKSA-N	1	0	273.336	1.724	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2ccccc2C)CC1	ZINC000020608843	171267318	/nfs/dbraw/zinc/26/73/18/171267318.db2.gz	MWLIDWHYXUIBJG-UHFFFAOYSA-N	1	0	261.369	1.571	50	0		CDAARO
O=C1C[C@@H]([NH2+]CCCCO)C(=O)N1c1ccc(Cl)cc1	ZINC000022063509	171351795	/nfs/dbraw/zinc/35/17/95/171351795.db2.gz	QPFMANWYZAYJAI-GFCCVEGCSA-N	1	0	296.754	1.334	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)c1ccc(=O)[nH]n1)c1cccs1	ZINC000022687694	171395659	/nfs/dbraw/zinc/39/56/59/171395659.db2.gz	OJRCFAWAXKBUOI-JTQLQIEISA-N	1	0	292.364	1.276	50	0		CDAARO
CCNC(=O)C[C@H]1CCCC[N@@H+]1Cc1cccnc1	ZINC000284881698	196149516	/nfs/dbraw/zinc/14/95/16/196149516.db2.gz	SYUIJHVAGPJPRS-CQSZACIVSA-N	1	0	261.369	1.962	50	0		CDAARO
CN(C)C(=O)C[NH2+]Cc1ccc(Br)cc1	ZINC000037207312	173028947	/nfs/dbraw/zinc/02/89/47/173028947.db2.gz	PTLQKWCWTQDIMJ-UHFFFAOYSA-N	1	0	271.158	1.627	50	0		CDAARO
O=C(OC[C@@H]1CCC[NH2+]C1)c1cc(Cl)ccn1	ZINC000042768357	174870085	/nfs/dbraw/zinc/87/00/85/174870085.db2.gz	UTKLRUIYCNFSRV-SECBINFHSA-N	1	0	254.717	1.891	50	0		CDAARO
COc1ccc(OC)c([C@H]2CCN(C(=O)C3([NH3+])CC3)C2)c1	ZINC000071415533	176160560	/nfs/dbraw/zinc/16/05/60/176160560.db2.gz	RPXSGJFMOHGGGG-NSHDSACASA-N	1	0	290.363	1.511	50	0		CDAARO
C[NH2+]CC(=O)NC[C@@H]1CCN(c2ccccc2C)C1	ZINC000071662298	176242461	/nfs/dbraw/zinc/24/24/61/176242461.db2.gz	SPHKTAPPNGIYTA-ZDUSSCGKSA-N	1	0	261.369	1.157	50	0		CDAARO
COC[C@H](C)Nc1nc(-c2cccnc2)nc2c1CC[NH2+]C2	ZINC000071682146	176245446	/nfs/dbraw/zinc/24/54/46/176245446.db2.gz	ZCKTYGRHFWEHPE-NSHDSACASA-N	1	0	299.378	1.631	50	0		CDAARO
OC[C@@]1(O)CCC[N@H+](Cc2ccc(F)c(F)c2)CC1	ZINC000072132110	176321662	/nfs/dbraw/zinc/32/16/62/176321662.db2.gz	HQAYHBQYEFQQKI-CQSZACIVSA-N	1	0	271.307	1.674	50	0		CDAARO
O=C(c1cc[nH]c1)N1CCC([N@@H+]2CCC[C@H](O)C2)CC1	ZINC000072137030	176322301	/nfs/dbraw/zinc/32/23/01/176322301.db2.gz	MQNKDQHPTNQJJT-AWEZNQCLSA-N	1	0	277.368	1.076	50	0		CDAARO
C[N@@H+]1CC[C@@H](NC(=O)c2ccc(Cl)cc2[O-])C1	ZINC000042375487	260185831	/nfs/dbraw/zinc/18/58/31/260185831.db2.gz	JUNRVGSGVKNRAC-SECBINFHSA-N	1	0	254.717	1.480	50	0		CDAARO
C/C=C/C[C@H](CO)[NH2+]C1CCN([C@H]2CCOC2)CC1	ZINC000655757672	424446814	/nfs/dbraw/zinc/44/68/14/424446814.db2.gz	WRSPHRZEUDJINT-ZHAXYTGKSA-N	1	0	268.401	1.156	50	0		CDAARO
COc1cccc2c1ncn(C1CC[NH2+]CC1)c2=O	ZINC000032513747	274155408	/nfs/dbraw/zinc/15/54/08/274155408.db2.gz	PEKAPEUFDOQLOO-UHFFFAOYSA-N	1	0	259.309	1.330	50	0		CDAARO
C[C@H](c1cccnc1)N1CC[N@@H+](C[C@H](C)O)[C@H](C)C1	ZINC000252475108	278313842	/nfs/dbraw/zinc/31/38/42/278313842.db2.gz	SRZSJHATCWPYQU-HZSPNIEDSA-N	1	0	263.385	1.530	50	0		CDAARO
CC[C@H](O)C[N@@H+]1CCC[C@@H](c2n[nH]cc2C(=O)N(C)C)C1	ZINC000252504814	288104279	/nfs/dbraw/zinc/10/42/79/288104279.db2.gz	VMEFENNTVPEKJB-NEPJUHHUSA-N	1	0	294.399	1.062	50	0		CDAARO
C[C@H]1CCCN(C(=O)c2ccncc2Cl)[C@H]1C[NH3+]	ZINC000091457055	279665121	/nfs/dbraw/zinc/66/51/21/279665121.db2.gz	RCTRLSJUAKDYIJ-CABZTGNLSA-N	1	0	267.760	1.934	50	0		CDAARO
COc1ccc2c3c1O[C@H]1C(=O)CC[C@H]4[C@@H](C2)[NH2+]CC[C@]314	ZINC000038816863	295278621	/nfs/dbraw/zinc/27/86/21/295278621.db2.gz	JGORUXKMRLIJSV-YNHQPCIGSA-N	1	0	285.343	1.591	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2cccc3c2NCCC3)C[C@@H]1C1CC1	ZINC000091444781	295342601	/nfs/dbraw/zinc/34/26/01/295342601.db2.gz	ASAAEFHNFAPMKI-CABCVRRESA-N	1	0	285.391	1.854	50	0		CDAARO
C[C@@H](CN1CCOCC1)[NH2+]CCCOC1CCCC1	ZINC000534576172	328309939	/nfs/dbraw/zinc/30/99/39/328309939.db2.gz	XONIFXAMMKOTEJ-AWEZNQCLSA-N	1	0	270.417	1.646	50	0		CDAARO
Cc1nc(NCC[C@H](C)[NH+]2CCN(C)CC2)sc1C	ZINC000534579041	328311293	/nfs/dbraw/zinc/31/12/93/328311293.db2.gz	OLIBTBIRHLGBFY-NSHDSACASA-N	1	0	282.457	1.620	50	0		CDAARO
c1coc(CN2CCC([NH2+]CCc3ncc[nH]3)CC2)c1	ZINC000534586252	328315569	/nfs/dbraw/zinc/31/55/69/328315569.db2.gz	BQKZKMSJLALZLQ-UHFFFAOYSA-N	1	0	274.368	1.799	50	0		CDAARO
Cn1c(Sc2cnccn2)nnc1C1CC[NH2+]CC1	ZINC000534588222	328316490	/nfs/dbraw/zinc/31/64/90/328316490.db2.gz	SJJQCVTXLBWYTI-UHFFFAOYSA-N	1	0	276.369	1.223	50	0		CDAARO
[NH3+]C[C@@H]1CCC[N@H+](Cc2ccc(CC(=O)[O-])cc2)C1	ZINC000534588948	328316983	/nfs/dbraw/zinc/31/69/83/328316983.db2.gz	OIXOHUBOVBKYEC-AWEZNQCLSA-N	1	0	262.353	1.484	50	0		CDAARO
C[C@H](C(=O)NCc1cc[nH]n1)[NH+]1CCCCCC1	ZINC000534589505	328317207	/nfs/dbraw/zinc/31/72/07/328317207.db2.gz	JGDYRUYJCVRRSU-LLVKDONJSA-N	1	0	250.346	1.290	50	0		CDAARO
C[C@@H](C(=O)NCc1cc[nH]n1)[NH+]1CCCCCC1	ZINC000534589506	328317322	/nfs/dbraw/zinc/31/73/22/328317322.db2.gz	JGDYRUYJCVRRSU-NSHDSACASA-N	1	0	250.346	1.290	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2COC[C@@H]2[NH+]2CCCC2)cs1	ZINC000534637739	328334679	/nfs/dbraw/zinc/33/46/79/328334679.db2.gz	RTCVGOMYQAIFAA-STQMWFEESA-N	1	0	280.393	1.650	50	0		CDAARO
C[C@@H]1C[C@H]([NH3+])CCN1S(=O)(=O)CCOc1ccccc1	ZINC000534653101	328338165	/nfs/dbraw/zinc/33/81/65/328338165.db2.gz	JZGDREJERWCIJN-CHWSQXEVSA-N	1	0	298.408	1.207	50	0		CDAARO
CCOC(=O)N1CCC([NH2+][C@@H](C)c2nc(C)c[nH]2)CC1	ZINC000534660554	328339575	/nfs/dbraw/zinc/33/95/75/328339575.db2.gz	NANFFKKUINTOLG-NSHDSACASA-N	1	0	280.372	1.990	50	0		CDAARO
Cc1ccc(C(N)=O)c(NCC2([NH+](C)C)CCCC2)n1	ZINC000534661841	328349539	/nfs/dbraw/zinc/34/95/39/328349539.db2.gz	JTXDUFFRMNQCSI-UHFFFAOYSA-N	1	0	276.384	1.775	50	0		CDAARO
COc1cc2c(cc1CNC(=O)[C@H]1C=CC[NH2+]1)CCC2	ZINC000534673906	328349035	/nfs/dbraw/zinc/34/90/35/328349035.db2.gz	GEXJOOMYADTTIP-CQSZACIVSA-N	1	0	272.348	1.328	50	0		CDAARO
CN(CC[NH+](C)C)C(=O)c1ccc(-c2ccncc2N)cc1	ZINC000534662629	328350318	/nfs/dbraw/zinc/35/03/18/328350318.db2.gz	SYDZULMDJSKHHR-UHFFFAOYSA-N	1	0	298.390	1.964	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2	ZINC000097373404	323207815	/nfs/dbraw/zinc/20/78/15/323207815.db2.gz	MPZYGQRISHGQGJ-XQQFMLRXSA-N	1	0	280.412	1.696	50	0		CDAARO
O=C(Nc1ccncc1F)N1CC[NH+](CC2CC2)CC1	ZINC000184215769	323359094	/nfs/dbraw/zinc/35/90/94/323359094.db2.gz	VAINDFRROXLODO-UHFFFAOYSA-N	1	0	278.331	1.780	50	0		CDAARO
CC(C)N1CC[C@H]([NH2+][C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)C1=O	ZINC000195533591	323571472	/nfs/dbraw/zinc/57/14/72/323571472.db2.gz	UYKYTYGNRCVPIW-RVMXOQNASA-N	1	0	266.385	1.399	50	0		CDAARO
CC(C)[N@@H+]1CCCN(CC[C@@H]2CCS(=O)(=O)C2)CC1	ZINC000677681785	482748567	/nfs/dbraw/zinc/74/85/67/482748567.db2.gz	MAMSONUXKDXOCV-CQSZACIVSA-N	1	0	288.457	1.227	50	0		CDAARO
CN1CC2(CC[NH+](CCCn3cccc3)CC2)OCC1=O	ZINC000670434590	482970052	/nfs/dbraw/zinc/97/00/52/482970052.db2.gz	CKDQOQQYJYKCFU-UHFFFAOYSA-N	1	0	291.395	1.201	50	0		CDAARO
Cn1nccc1C[N@H+](C)C[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000670447410	483000407	/nfs/dbraw/zinc/00/04/07/483000407.db2.gz	CMTSXURPLMDUKP-CYBMUJFWSA-N	1	0	290.411	1.643	50	0		CDAARO
CCCN1CC[C@H]([NH2+]C2CSCCSC2)C1	ZINC000670458260	483039724	/nfs/dbraw/zinc/03/97/24/483039724.db2.gz	ABVGTNZVGPJPOO-NSHDSACASA-N	1	0	260.472	1.909	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(C(=O)CCC(F)(F)F)C[C@H]1O	ZINC000670461857	483049446	/nfs/dbraw/zinc/04/94/46/483049446.db2.gz	XBXDTQHYZBTCKA-VHSXEESVSA-N	1	0	282.306	1.100	50	0		CDAARO
CCC1CC[NH+](CCNC(=O)C[C@@H]2CCOC2)CC1	ZINC000670470906	483074570	/nfs/dbraw/zinc/07/45/70/483074570.db2.gz	JYPHSBVAYUIXEG-AWEZNQCLSA-N	1	0	268.401	1.651	50	0		CDAARO
Cc1cccc(C(C)(C)[NH2+]CC(=O)N2CCN(C)CC2)c1	ZINC000096491921	534636478	/nfs/dbraw/zinc/63/64/78/534636478.db2.gz	TUCJRNLWFRIVQQ-UHFFFAOYSA-N	1	0	289.423	1.594	50	0		CDAARO
CC[C@@H]1CN(C(=O)COCC(F)(F)C(F)F)CC[NH2+]1	ZINC000067872285	523386945	/nfs/dbraw/zinc/38/69/45/523386945.db2.gz	UETOEIFCSCEHQI-MRVPVSSYSA-N	1	0	286.269	1.114	50	0		CDAARO
C[C@@H](C(=O)N1CCO[C@@H](c2cccs2)C1)[C@H](C)[NH3+]	ZINC000249018860	524130449	/nfs/dbraw/zinc/13/04/49/524130449.db2.gz	KNRHXPRXHHUKOF-OUAUKWLOSA-N	1	0	268.382	1.631	50	0		CDAARO
[NH3+][C@@H]1CCC[C@H](CNS(=O)(=O)CCC2CCC2)C1	ZINC000261590485	527358038	/nfs/dbraw/zinc/35/80/38/527358038.db2.gz	XBYLMXXFOKGFKS-QWHCGFSZSA-N	1	0	274.430	1.614	50	0		CDAARO
CC[NH+](CC)[C@H]1CCN(C(=O)N[C@H](C)CSC)C1	ZINC000096440482	528285321	/nfs/dbraw/zinc/28/53/21/528285321.db2.gz	JAVJKSZHPJTCGK-NEPJUHHUSA-N	1	0	273.446	1.864	50	0		CDAARO
CCOCC[N@@H+]1CCN([C@H](C)C(=O)NC2CC2)C[C@@H]1CC	ZINC000106777302	528756320	/nfs/dbraw/zinc/75/63/20/528756320.db2.gz	OBPMBUCLZIIYDH-HIFRSBDPSA-N	1	0	297.443	1.086	50	0		CDAARO
Cn1cc(C[NH2+]CCNC(=O)c2cccs2)cn1	ZINC000097159105	567905098	/nfs/dbraw/zinc/90/50/98/567905098.db2.gz	SJGWYIFBLONHTC-UHFFFAOYSA-N	1	0	264.354	1.001	50	0		CDAARO
CCc1nccn1CCC[NH2+]Cc1nc(C)c(C)n1C	ZINC000952965023	615777400	/nfs/dbraw/zinc/77/74/00/615777400.db2.gz	BHZFAYACSFNHFA-UHFFFAOYSA-N	1	0	275.400	1.976	50	0		CDAARO
C[C@@H]1[NH2+]CCN(C(=O)C[C@@H](O)c2cccc(F)c2)[C@H]1C	ZINC000888096330	617758661	/nfs/dbraw/zinc/75/86/61/617758661.db2.gz	AUXYOANJCDNZNL-COPLHBTASA-N	1	0	280.343	1.458	50	0		CDAARO
COC(=O)C1CC[NH+](C[C@]23CCC[C@H]2OCC3)CC1	ZINC000952993168	616468065	/nfs/dbraw/zinc/46/80/65/616468065.db2.gz	PLHKNPOBVIMYDT-UKRRQHHQSA-N	1	0	267.369	1.831	50	0		CDAARO
[NH3+]CCNC(=O)CCC(=O)Nc1cccc2ccccc21	ZINC000204238051	1159512254	/nfs/dbraw/zinc/51/22/54/1159512254.db2.gz	VICLEJPVHYUVOQ-UHFFFAOYSA-N	1	0	285.347	1.633	50	0		CDAARO
O=C1CC[C@@H]([NH2+]CCn2cccn2)CCN1CC1CC1	ZINC000952977201	818622833	/nfs/dbraw/zinc/62/28/33/818622833.db2.gz	XHMXPQORKXIHBI-CQSZACIVSA-N	1	0	276.384	1.264	50	0		CDAARO
COc1ncccc1C[NH2+]CCN1CCCC[C@@H]1CO	ZINC000952992223	818950422	/nfs/dbraw/zinc/95/04/22/818950422.db2.gz	YVUNLQGELZYSSW-CQSZACIVSA-N	1	0	279.384	1.027	50	0		CDAARO
OCc1cc(N2CCN(Cc3ccccn3)CC2)cc[nH+]1	ZINC000828837197	819336099	/nfs/dbraw/zinc/33/60/99/819336099.db2.gz	AZUCQYFPKKSBRM-UHFFFAOYSA-N	1	0	284.363	1.291	50	0		CDAARO
Cc1cccc(OCCOCC[N@H+](C)CCO)c1C	ZINC000002975081	819359944	/nfs/dbraw/zinc/35/99/44/819359944.db2.gz	CSSLCSYGKRPMNM-UHFFFAOYSA-N	1	0	267.369	1.623	50	0		CDAARO
C[C@H](C[NH+]1CCCCC1)NCc1cc(=O)[nH]cn1	ZINC000023312257	820039157	/nfs/dbraw/zinc/03/91/57/820039157.db2.gz	CQCFAVQNMMXFOQ-LLVKDONJSA-N	1	0	250.346	1.146	50	0		CDAARO
C[N@@H+]1CCN(C(=O)[C@]2(C)CCC(=O)NC2)C[C@@H]1C(C)(C)C	ZINC000863947408	820813958	/nfs/dbraw/zinc/81/39/58/820813958.db2.gz	HBFIBGJBPYRUJB-MLGOLLRUSA-N	1	0	295.427	1.091	50	0		CDAARO
OCCCCCCN1CCN(CC(F)(F)F)CC1	ZINC000226833840	821325404	/nfs/dbraw/zinc/32/54/04/821325404.db2.gz	IMWOVNYSINPHTH-UHFFFAOYSA-N	1	0	268.323	1.719	50	0		CDAARO
COc1ccc2c(c1)ncn([C@@H]1CCC[NH2+]C1)c2=O	ZINC000258073522	821847714	/nfs/dbraw/zinc/84/77/14/821847714.db2.gz	FJZJVJRPTVKISD-SNVBAGLBSA-N	1	0	259.309	1.330	50	0		CDAARO
C[N@@H+](Cc1ccccc1-c1nn[nH]n1)C[C@H]1CCCCO1	ZINC000019743598	822395467	/nfs/dbraw/zinc/39/54/67/822395467.db2.gz	YHQICHCNMHNRBB-CYBMUJFWSA-N	1	0	287.367	1.868	50	0		CDAARO
Cc1cccc([C@@H](CNC(=O)c2nccn2C)[NH+](C)C)c1	ZINC000952989640	822560849	/nfs/dbraw/zinc/56/08/49/822560849.db2.gz	XUUKYWRIAGNGRO-CQSZACIVSA-N	1	0	286.379	1.761	50	0		CDAARO
OC1CCN(CC[NH2+][C@H]2COc3ccccc3C2)CC1	ZINC000023158409	897178052	/nfs/dbraw/zinc/17/80/52/897178052.db2.gz	ZRUQNSCTIWTTBQ-CQSZACIVSA-N	1	0	276.380	1.036	50	0		CDAARO
Cc1noc(C)c1[C@H](C)NC(=O)N1CC[NH+]2CCC1CC2	ZINC000952845197	910401006	/nfs/dbraw/zinc/40/10/06/910401006.db2.gz	FAWOWGGJTHFWKI-JTQLQIEISA-N	1	0	292.383	1.842	50	0		CDAARO
COc1ccc(C[N@H+](C)[C@H](C)CC(N)=O)c(C)c1	ZINC000952860137	910413129	/nfs/dbraw/zinc/41/31/29/910413129.db2.gz	FYNLMVNOFULJCN-LLVKDONJSA-N	1	0	250.342	1.699	50	0		CDAARO
COCCCC1CCN(C(=O)C2(O)CC[NH+](C)CC2)CC1	ZINC000824385246	925819070	/nfs/dbraw/zinc/81/90/70/925819070.db2.gz	DCLTVOVVEVNXOW-UHFFFAOYSA-N	1	0	298.427	1.108	50	0		CDAARO
C[C@H](c1nc2cc(Cl)ccc2[nH]1)N(C)C[C@@H](O)[C@H](C)O	ZINC000585117050	930972638	/nfs/dbraw/zinc/97/26/38/930972638.db2.gz	PWBWDRJZJOMYTR-VYUIOLGVSA-N	1	0	297.786	1.951	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@H]1C(=O)NCCc1ccccn1	ZINC000585120679	930991919	/nfs/dbraw/zinc/99/19/19/930991919.db2.gz	AQXSGZPAMITGQS-ZDUSSCGKSA-N	1	0	261.369	1.613	50	0		CDAARO
Cc1cnc(C)c(NCC[N@@H+]2CCC[C@@H](CO)C2)n1	ZINC001529112898	968983331	/nfs/dbraw/zinc/98/33/31/968983331.db2.gz	VFFZWRJWNKTUBX-CYBMUJFWSA-N	1	0	264.373	1.210	50	0		CDAARO
CN1CCC([NH2+][C@H]2COC[C@H]2Cc2ccncc2)CC1	ZINC001529126968	968988976	/nfs/dbraw/zinc/98/89/76/968988976.db2.gz	VKJNEVFTAILCOD-ZBFHGGJFSA-N	1	0	275.396	1.323	50	0		CDAARO
CCn1ccc(CN(C)C[C@@H]2CC[N@H+](CCOC)C2)n1	ZINC001506403308	975150505	/nfs/dbraw/zinc/15/05/05/975150505.db2.gz	SXSBQZYENAOLLB-AWEZNQCLSA-N	1	0	280.416	1.303	50	0		CDAARO
Cc1nc(NC[C@H]2C[N@@H+](C)CCN2C)ccc1Cl	ZINC001506405626	975152155	/nfs/dbraw/zinc/15/21/55/975152155.db2.gz	KPHCMPLMEAXVIT-NSHDSACASA-N	1	0	268.792	1.701	50	0		CDAARO
Cc1nc(N)nc(NC[C@H]2CCCC[N@H+]2C)c1Cl	ZINC001506409037	975153118	/nfs/dbraw/zinc/15/31/18/975153118.db2.gz	ODUFVUATBBXRCP-SECBINFHSA-N	1	0	269.780	1.917	50	0		CDAARO
Cc1cccnc1N1CC[N@@H+](CC(C)C)[C@H](CCO)C1	ZINC001506423288	975159260	/nfs/dbraw/zinc/15/92/60/975159260.db2.gz	DZXVCGVBRHIPRO-OAHLLOKOSA-N	1	0	277.412	1.919	50	0		CDAARO
CN1C[C@H]([NH2+]C2CSCCSC2)CCC1=O	ZINC001506426871	975160543	/nfs/dbraw/zinc/16/05/43/975160543.db2.gz	TZSMTIKATLBAHW-SECBINFHSA-N	1	0	260.428	1.045	50	0		CDAARO
CC(C)c1ccc(N(C)C[C@H]2CCC[N@H+](CCO)C2)nn1	ZINC001506428453	975162048	/nfs/dbraw/zinc/16/20/48/975162048.db2.gz	QMORLYQKIGEVLC-CQSZACIVSA-N	1	0	292.427	1.741	50	0		CDAARO
CCc1nccn1[C@@H]1CCCN(C(=O)C[NH2+]C2CC2)C1	ZINC000178925540	342450460	/nfs/dbraw/zinc/45/04/60/342450460.db2.gz	FPXOMUOSUWRZSU-CYBMUJFWSA-N	1	0	276.384	1.361	50	0		CDAARO
COCC[N@H+]1C[C@@H](c2ccc(OC)cc2)[C@H](NC(C)=O)C1	ZINC000095512388	185001459	/nfs/dbraw/zinc/00/14/59/185001459.db2.gz	GGKYUERKSVZAOS-JKSUJKDBSA-N	1	0	292.379	1.246	50	0		CDAARO
Cc1cc(C[NH+]2CCC3(CC2)OCCC[C@H]3O)on1	ZINC000215796593	398205405	/nfs/dbraw/zinc/20/54/05/398205405.db2.gz	GRAZMFGCCOIQOZ-CYBMUJFWSA-N	1	0	266.341	1.489	50	0		CDAARO
C[N@H+](CCc1ccccn1)Cc1cccc(C(N)=O)c1	ZINC000095953928	185040883	/nfs/dbraw/zinc/04/08/83/185040883.db2.gz	QKVUCGUVBFEZGZ-UHFFFAOYSA-N	1	0	269.348	1.855	50	0		CDAARO
CCOc1cc(C)ccc1C[NH2+][C@H](C)CC(N)=O	ZINC000095969295	185047608	/nfs/dbraw/zinc/04/76/08/185047608.db2.gz	WBPDJXGKCBLLBT-LLVKDONJSA-N	1	0	250.342	1.747	50	0		CDAARO
CC(C)(C[NH2+]C1CCN(CC(N)=O)CC1)c1ccccc1	ZINC000095984262	185055698	/nfs/dbraw/zinc/05/56/98/185055698.db2.gz	VQRNGPAMQAVOPR-UHFFFAOYSA-N	1	0	289.423	1.504	50	0		CDAARO
Cn1c(CN2CC[NH+](CC3CC3)CC2)nnc1C1CCC1	ZINC000096008315	185064061	/nfs/dbraw/zinc/06/40/61/185064061.db2.gz	CMWQWLOQQUHCBP-UHFFFAOYSA-N	1	0	289.427	1.610	50	0		CDAARO
C[C@]1(C(=O)N(CCO)CCc2ccccc2)CCC[NH2+]C1	ZINC000195554233	342625871	/nfs/dbraw/zinc/62/58/71/342625871.db2.gz	MDRQARLBVCKWAV-KRWDZBQOSA-N	1	0	290.407	1.440	50	0		CDAARO
NC(=O)[C@@H](C[NH2+][C@@H]1CCCSC1)Cc1ccc(F)cc1	ZINC000195561833	342628470	/nfs/dbraw/zinc/62/84/70/342628470.db2.gz	AVOVMYYDHOHUFD-TZMCWYRMSA-N	1	0	296.411	1.955	50	0		CDAARO
CCOC(=O)[C@@]1(COC)CCCN(Cc2nccn2C)C1	ZINC000252478569	361838877	/nfs/dbraw/zinc/83/88/77/361838877.db2.gz	APQOGNILFRZZHY-HNNXBMFYSA-N	1	0	295.383	1.212	50	0		CDAARO
Cc1cnccc1CN1CCC([N@@H+]2CCC[C@H](O)C2)CC1	ZINC000244701308	361856837	/nfs/dbraw/zinc/85/68/37/361856837.db2.gz	KDXASKYJJJFPFS-KRWDZBQOSA-N	1	0	289.423	1.811	50	0		CDAARO
Cc1cnccc1CN1CCC([N@@H+]2CCC[C@@H](O)C2)CC1	ZINC000244701309	361856982	/nfs/dbraw/zinc/85/69/82/361856982.db2.gz	KDXASKYJJJFPFS-QGZVFWFLSA-N	1	0	289.423	1.811	50	0		CDAARO
Cc1ccc(C[N@H+](CCO)CCc2cn[nH]c2)s1	ZINC000244774188	361863302	/nfs/dbraw/zinc/86/33/02/361863302.db2.gz	PPIXYTCXKWHJPX-UHFFFAOYSA-N	1	0	265.382	1.817	50	0		CDAARO
O=C(C[N@@H+]1C[C@@H]2CC[C@H]1C2)NCCCNc1cccnc1	ZINC000244866595	361866434	/nfs/dbraw/zinc/86/64/34/361866434.db2.gz	VYTJXDBPLCILLL-HIFRSBDPSA-N	1	0	288.395	1.484	50	0		CDAARO
COc1cccc([C@@H]2C[C@@H]2C(=O)N2CC[NH2+]C[C@@H]2C)c1	ZINC000125445265	187185341	/nfs/dbraw/zinc/18/53/41/187185341.db2.gz	YNGHHRANQQACSL-CQDKDKBSSA-N	1	0	274.364	1.619	50	0		CDAARO
CNc1cc(C(=O)N2CCC([NH2+]C)CC2)cc(Cl)n1	ZINC000097019644	185152563	/nfs/dbraw/zinc/15/25/63/185152563.db2.gz	MIOUQJLQRWVBOQ-UHFFFAOYSA-N	1	0	282.775	1.601	50	0		CDAARO
Cc1nc2ccccc2n1[C@H]1CCN(S(C)(=O)=O)C1	ZINC000585149300	342225685	/nfs/dbraw/zinc/22/56/85/342225685.db2.gz	HHOWEVICYSTRSK-NSHDSACASA-N	1	0	279.365	1.551	50	0		CDAARO
C[C@H]1C[N@H+](C)C[C@H]1NS(=O)(=O)Cc1cccc(F)c1	ZINC000257366338	539096225	/nfs/dbraw/zinc/09/62/25/539096225.db2.gz	SQRLRIPLTKSQCW-GXFFZTMASA-N	1	0	286.372	1.195	50	0		CDAARO
CNC(=O)C1CC[NH+](CC(=O)N2[C@H](C)CCC[C@@H]2C)CC1	ZINC000025755261	539133670	/nfs/dbraw/zinc/13/36/70/539133670.db2.gz	UWZLBWPIDFMDJH-BETUJISGSA-N	1	0	295.427	1.234	50	0		CDAARO
O=C1C[C@H]([C@H]2CCCC[N@@H+]2CCO[C@H]2CCCCO2)CN1	ZINC000252569061	342385139	/nfs/dbraw/zinc/38/51/39/342385139.db2.gz	VVZZJYWKSVYZCZ-LZWOXQAQSA-N	1	0	296.411	1.520	50	0		CDAARO
CC(C)(C)C[C@@H]1CCC[N@@H+]1CCN1C(=O)CNC1=O	ZINC000084169761	362259094	/nfs/dbraw/zinc/25/90/94/362259094.db2.gz	CULKWBQJDQQGHB-NSHDSACASA-N	1	0	267.373	1.439	50	0		CDAARO
CCO[C@@H]1C[C@@H]([N@H+](C)CCC(=O)N2CCOCC2)C1(C)C	ZINC000084800722	362274967	/nfs/dbraw/zinc/27/49/67/362274967.db2.gz	SHVFYLOFFRRNDC-ZIAGYGMSSA-N	1	0	298.427	1.371	50	0		CDAARO
CC[C@H](C(=O)[O-])[N@@H+]1CC[C@H](CNc2cccc(C)[nH+]2)C1	ZINC000191438990	362435432	/nfs/dbraw/zinc/43/54/32/362435432.db2.gz	NELRWQPZGWPYAU-CHWSQXEVSA-N	1	0	277.368	1.987	50	0		CDAARO
CN(Cc1ccoc1)Cc1nnc([C@H]2C[C@@H]([NH3+])C2)n1C	ZINC000220675902	530013005	/nfs/dbraw/zinc/01/30/05/530013005.db2.gz	DASQGWOUTSJIGL-HAQNSBGRSA-N	1	0	275.356	1.245	50	0		CDAARO
C[NH+](C)[C@H]1CC[C@H](NC(=O)N[C@H](CO)c2ccccc2)C1	ZINC000097048341	185514123	/nfs/dbraw/zinc/51/41/23/185514123.db2.gz	WQJPIECQLNSZCE-SOUVJXGZSA-N	1	0	291.395	1.502	50	0		CDAARO
[NH3+]CCNS(=O)(=O)Cc1ccc(Cl)c(Cl)c1	ZINC000097229248	185568352	/nfs/dbraw/zinc/56/83/52/185568352.db2.gz	HDINQAASYDIWQF-UHFFFAOYSA-N	1	0	283.180	1.372	50	0		CDAARO
C[NH2+]CCCNC(=O)Cc1csc(C(C)=O)c1	ZINC000097492601	185616816	/nfs/dbraw/zinc/61/68/16/185616816.db2.gz	ZMBOTCHMRIGNCA-UHFFFAOYSA-N	1	0	254.355	1.219	50	0		CDAARO
CC(C)[N@@H+]1CCO[C@@H](CC(=O)NCc2ccccn2)C1	ZINC000097572369	185628227	/nfs/dbraw/zinc/62/82/27/185628227.db2.gz	ZXCQNQZPNZRMBH-AWEZNQCLSA-N	1	0	277.368	1.197	50	0		CDAARO
Cc1ccc(CN2CCN([C@H]3CC[NH2+]C3)C2=O)cc1	ZINC000085347887	179029020	/nfs/dbraw/zinc/02/90/20/179029020.db2.gz	QUHOIOJLDRSVSC-AWEZNQCLSA-N	1	0	259.353	1.595	50	0		CDAARO
Cc1cc(C(=O)NC[C@H](C(C)C)[NH+]2CCCC2)c(O)cn1	ZINC000584891271	349350094	/nfs/dbraw/zinc/35/00/94/349350094.db2.gz	MRJUCFPQNHBVLH-CQSZACIVSA-N	1	0	291.395	1.946	50	0		CDAARO
Cc1cc(=O)[nH]c(CC[NH2+][C@H]2CCCSC2)n1	ZINC000584891591	349350301	/nfs/dbraw/zinc/35/03/01/349350301.db2.gz	QTQRVKKFZNGARX-JTQLQIEISA-N	1	0	253.371	1.518	50	0		CDAARO
Cc1cccc(C[C@H](C)NC(=O)CC[NH+]2CCCC2)n1	ZINC000584893714	349353526	/nfs/dbraw/zinc/35/35/26/349353526.db2.gz	SXVOCYSWNYEYCM-AWEZNQCLSA-N	1	0	275.396	1.923	50	0		CDAARO
CC(C)n1cnnc1CCNC(=O)[C@H](C)C[NH+]1CCCC1	ZINC000584894059	349354297	/nfs/dbraw/zinc/35/42/97/349354297.db2.gz	GCUVRXAOMLIUNF-CYBMUJFWSA-N	1	0	293.415	1.250	50	0		CDAARO
CN(Cc1ccc2c(c1)C[N@@H+](C)C2)C(=O)c1cn[nH]n1	ZINC000584897198	349359219	/nfs/dbraw/zinc/35/92/19/349359219.db2.gz	CRIZRZYCPKUCQR-UHFFFAOYSA-N	1	0	271.324	1.022	50	0		CDAARO
COCC1(C(=O)N(C)CC[N@H+](C)C2CCCC2)CC1	ZINC000584900370	349362301	/nfs/dbraw/zinc/36/23/01/349362301.db2.gz	XYICXXQUNCQOKA-UHFFFAOYSA-N	1	0	268.401	1.746	50	0		CDAARO
CO[C@@H]1CCN(C(=O)C2([NH+]3CCCC3)CCCC2)C1	ZINC000584900852	349362995	/nfs/dbraw/zinc/36/29/95/349362995.db2.gz	VXXCOXNNGUZTJW-CYBMUJFWSA-N	1	0	266.385	1.642	50	0		CDAARO
O=C(C[C@H]1C[NH2+]CCO1)NCc1nc2ccccc2s1	ZINC000091310455	180132073	/nfs/dbraw/zinc/13/20/73/180132073.db2.gz	NVTLKPUZFVFLBW-JTQLQIEISA-N	1	0	291.376	1.291	50	0		CDAARO
CCc1ccc(CN2C[C@H](CO)[C@H](C[NH+](C)C)C2)o1	ZINC000091326098	180135367	/nfs/dbraw/zinc/13/53/67/180135367.db2.gz	MHYHPZOCXUCOEZ-CHWSQXEVSA-N	1	0	266.385	1.444	50	0		CDAARO
CCCCc1nc(CN2C[C@H]([NH3+])[C@@H](C3CC3)C2)c[nH]1	ZINC000091468513	180164961	/nfs/dbraw/zinc/16/49/61/180164961.db2.gz	KBKSMBYDUOLUPP-KGLIPLIRSA-N	1	0	262.401	1.921	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC000091496689	180172619	/nfs/dbraw/zinc/17/26/19/180172619.db2.gz	PUUVSVOPWBUDRQ-WRWORJQWSA-N	1	0	272.270	1.974	50	0		CDAARO
CCC[C@H]1CN(Cc2cnc(C)nc2)C[C@@H]1[NH+](C)C	ZINC000091535210	180182306	/nfs/dbraw/zinc/18/23/06/180182306.db2.gz	CTOZOYSEUIHPIH-GJZGRUSLSA-N	1	0	262.401	1.947	50	0		CDAARO
COCC[C@@]1(CO)CCC[N@H+](Cc2cccnc2N)C1	ZINC000091664796	180221077	/nfs/dbraw/zinc/22/10/77/180221077.db2.gz	IDCCHDGTOHSHSC-HNNXBMFYSA-N	1	0	279.384	1.275	50	0		CDAARO
Cc1nc(CC(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)cs1	ZINC000091768750	180248578	/nfs/dbraw/zinc/24/85/78/180248578.db2.gz	BROFWWXBKIBZAS-NEPJUHHUSA-N	1	0	265.382	1.190	50	0		CDAARO
COC(=O)N1C[C@H]2CC[C@@H]1C[N@H+](Cc1c(C)noc1C)C2	ZINC000091830368	180265885	/nfs/dbraw/zinc/26/58/85/180265885.db2.gz	YBKCRAGIVCBTBY-QWHCGFSZSA-N	1	0	293.367	1.954	50	0		CDAARO
CCc1cc(N2C[C@H](CO)[C@H](C[N@@H+](C)CC)C2)nc(C)n1	ZINC000091943807	180290314	/nfs/dbraw/zinc/29/03/14/180290314.db2.gz	VHOMQEILTZJXNZ-ZIAGYGMSSA-N	1	0	292.427	1.344	50	0		CDAARO
COCC[C@]1(O)CC[N@H+](CCCn2cc(C)cn2)C[C@H]1C	ZINC000091964832	180293992	/nfs/dbraw/zinc/29/39/92/180293992.db2.gz	JIAVALZRYMXDBX-HZPDHXFCSA-N	1	0	295.427	1.691	50	0		CDAARO
CC(=O)NCC[NH2+]Cc1cc(=O)c2cc(C)ccc2[nH]1	ZINC000091876563	180278722	/nfs/dbraw/zinc/27/87/22/180278722.db2.gz	KJWFQBLPPPZXCJ-UHFFFAOYSA-N	1	0	273.336	1.062	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2cc(C(C)C)n[nH]2)C[C@@H]1[NH3+]	ZINC000092020190	180307364	/nfs/dbraw/zinc/30/73/64/180307364.db2.gz	QIEHGNGLRYDVPJ-QWRGUYRKSA-N	1	0	264.373	1.733	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)[C@H]2CSc3ccccc32)C1	ZINC000092239247	180351072	/nfs/dbraw/zinc/35/10/72/180351072.db2.gz	WCVFTYSWBRFJRF-PWSUYJOCSA-N	1	0	262.378	1.683	50	0		CDAARO
C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1ncccn1	ZINC000106913937	186150503	/nfs/dbraw/zinc/15/05/03/186150503.db2.gz	HJMSRKBDSUYKSK-XQQFMLRXSA-N	1	0	276.384	1.573	50	0		CDAARO
C[C@H]1Cc2ccccc2N1C[C@@]1(O)CCC[N@H+](C)C1	ZINC000106933270	186152484	/nfs/dbraw/zinc/15/24/84/186152484.db2.gz	XHIONXYOTPIENM-XJKSGUPXSA-N	1	0	260.381	1.894	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCC[C@H]2CC[NH2+]C2)c(C)c1	ZINC000110796796	186325832	/nfs/dbraw/zinc/32/58/32/186325832.db2.gz	LVGBWNFZDUUDSB-CYBMUJFWSA-N	1	0	282.409	1.581	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000130051304	187468011	/nfs/dbraw/zinc/46/80/11/187468011.db2.gz	KPDXNTGDERSZJA-TXEJJXNPSA-N	1	0	291.461	1.316	50	0		CDAARO
C[NH+](C)CCCNC(=S)NCCc1ccccc1	ZINC000013820751	366010401	/nfs/dbraw/zinc/01/04/01/366010401.db2.gz	HSERYACDMOBZPL-UHFFFAOYSA-N	1	0	265.426	1.645	50	0		CDAARO
CCC[N@@H+]1CCC[C@H]1C(=O)N1CCC[C@H]1Cn1cccn1	ZINC000257365831	350963412	/nfs/dbraw/zinc/96/34/12/350963412.db2.gz	SVNKQGKCNOSRKQ-GJZGRUSLSA-N	1	0	290.411	1.749	50	0		CDAARO
CC(C)[NH+](CCNC(=O)N(C)Cc1nccn1C)C(C)C	ZINC000271648324	191259488	/nfs/dbraw/zinc/25/94/88/191259488.db2.gz	AQNJTRYLUQTMQX-UHFFFAOYSA-N	1	0	295.431	1.680	50	0		CDAARO
CCc1ccccc1OCCOCC[NH2+]CCO	ZINC000002981118	355990139	/nfs/dbraw/zinc/99/01/39/355990139.db2.gz	RMPOAGWUSSQHMZ-UHFFFAOYSA-N	1	0	253.342	1.226	50	0		CDAARO
COc1cccc(CN2CC[N@H+](C)[C@H](C)C2)c1OC	ZINC000043058629	356006672	/nfs/dbraw/zinc/00/66/72/356006672.db2.gz	BSKLUCGUPGRDHQ-GFCCVEGCSA-N	1	0	264.369	1.840	50	0		CDAARO
O=C(NC[C@H]1CC[N@@H+](C2CC2)C1)NC1Cc2ccccc2C1	ZINC000097377451	356102874	/nfs/dbraw/zinc/10/28/74/356102874.db2.gz	NKGXFMXEGSHQJS-CYBMUJFWSA-N	1	0	299.418	1.937	50	0		CDAARO
CCCc1c(C)nc(N2CC[NH+](C)CC2)[nH]c1=O	ZINC000008914277	356174510	/nfs/dbraw/zinc/17/45/10/356174510.db2.gz	WFJVRZWNXLHPHQ-UHFFFAOYSA-N	1	0	250.346	1.195	50	0		CDAARO
Cc1cccc(CN2CCC[C@](O)(C[NH2+]C3CC3)C2=O)c1	ZINC000012441142	356300478	/nfs/dbraw/zinc/30/04/78/356300478.db2.gz	KTDIFONIFLFBTC-KRWDZBQOSA-N	1	0	288.391	1.601	50	0		CDAARO
O[C@H]1/C(=C/c2ccc3c(c2)OCO3)[NH+]2CCC1CC2	ZINC000013495534	356347550	/nfs/dbraw/zinc/34/75/50/356347550.db2.gz	GBJBJJSHFYGKAG-WASHYIJTSA-N	1	0	259.305	1.843	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2cncnc2)CCCCC1	ZINC000273568427	192208406	/nfs/dbraw/zinc/20/84/06/192208406.db2.gz	CWLYVHHSRMLHAP-UHFFFAOYSA-N	1	0	262.357	1.471	50	0		CDAARO
Cc1cnc(C(=O)NC[C@H](C)N2C[C@@H](C)O[C@@H](C)C2)cn1	ZINC000032828437	356383173	/nfs/dbraw/zinc/38/31/73/356383173.db2.gz	ALAJWRUSURRLSN-RWMBFGLXSA-N	1	0	292.383	1.013	50	0		CDAARO
CCc1noc(C)c1C(=O)NCC[NH+]1CCCCC1	ZINC000016603619	356442983	/nfs/dbraw/zinc/44/29/83/356442983.db2.gz	HMKJKXRAONYFEH-UHFFFAOYSA-N	1	0	265.357	1.761	50	0		CDAARO
COc1ccc(CN2CC[NH+](CCO)CC2)c(OC)c1C	ZINC000019606807	356493527	/nfs/dbraw/zinc/49/35/27/356493527.db2.gz	VROKIDRANOFZGZ-UHFFFAOYSA-N	1	0	294.395	1.122	50	0		CDAARO
CC(C)(CO)C[N@@H+]1CCC[C@@H](N2CCC(CO)CC2)C1	ZINC000019794597	356505700	/nfs/dbraw/zinc/50/57/00/356505700.db2.gz	FOMMSUURWXOQMF-OAHLLOKOSA-N	1	0	284.444	1.174	50	0		CDAARO
C[NH+]1CCN(CCNC(=O)[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC000019812470	356505908	/nfs/dbraw/zinc/50/59/08/356505908.db2.gz	RHUXJRUSGMCKPM-JKSUJKDBSA-N	1	0	287.407	1.154	50	0		CDAARO
COc1cc(OC)c(OC)cc1C[N@@H+]1CCC[C@H]1CO	ZINC000023279990	356638408	/nfs/dbraw/zinc/63/84/08/356638408.db2.gz	NXABZMMTJIWKHH-LBPRGKRZSA-N	1	0	281.352	1.669	50	0		CDAARO
O=C(CCN1CCO[C@@H](c2ccccc2)C1)NC1CC1	ZINC000026927855	356701435	/nfs/dbraw/zinc/70/14/35/356701435.db2.gz	KWLXTLBGNJOANF-OAHLLOKOSA-N	1	0	274.364	1.729	50	0		CDAARO
CC[NH2+]Cc1nc(-c2cccc(C(=O)NC3CC3)c2)no1	ZINC000034924910	356823142	/nfs/dbraw/zinc/82/31/42/356823142.db2.gz	ONIVOFKXFQCLFM-UHFFFAOYSA-N	1	0	286.335	1.738	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1ccc(C)s1	ZINC000095432141	357516769	/nfs/dbraw/zinc/51/67/69/357516769.db2.gz	BZLWLQCLRAICNE-VIFPVBQESA-N	1	0	262.400	1.462	50	0		CDAARO
CCc1cc(N(C)CCCO)nc(N2CCCC2)[nH+]1	ZINC000065383935	357534684	/nfs/dbraw/zinc/53/46/84/357534684.db2.gz	UPFYVHQSFQLYEA-UHFFFAOYSA-N	1	0	264.373	1.458	50	0		CDAARO
C[C@@H](CC1CCCCC1)[NH2+]CCS(=O)(=O)N(C)C	ZINC000067472943	357610096	/nfs/dbraw/zinc/61/00/96/357610096.db2.gz	RTDIYZLEEWNLAP-LBPRGKRZSA-N	1	0	276.446	1.826	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](CNC(=O)c2c(O)cccc2O)C1	ZINC000067673386	357618118	/nfs/dbraw/zinc/61/81/18/357618118.db2.gz	GBIRQQUAWLGXBI-GFCCVEGCSA-N	1	0	292.379	1.806	50	0		CDAARO
Cc1cc2nc(C)cc(N(C)Cc3ncc[nH]3)n2n1	ZINC000072480341	357839061	/nfs/dbraw/zinc/83/90/61/357839061.db2.gz	BCJCSXPPUWWGAI-UHFFFAOYSA-N	1	0	256.313	1.706	50	0		CDAARO
CCCCn1ncc(NC(=O)N2CC([NH+](C)C)C2)c1C	ZINC000097113449	357982647	/nfs/dbraw/zinc/98/26/47/357982647.db2.gz	URHCHAXCZZJJBK-UHFFFAOYSA-N	1	0	279.388	1.769	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2cccs2)CC1	ZINC000023127931	358062183	/nfs/dbraw/zinc/06/21/83/358062183.db2.gz	OATUJLZAJSDOLM-UHFFFAOYSA-N	1	0	282.409	1.836	50	0		CDAARO
CCOc1ccc(CN2CC[NH+](CCO)CC2)cc1	ZINC000019606518	358106802	/nfs/dbraw/zinc/10/68/02/358106802.db2.gz	UKYZGPDBBYRKMK-UHFFFAOYSA-N	1	0	264.369	1.195	50	0		CDAARO
C[C@@H](NC(=O)N[C@@H](C)CO)[C@@H]1CCC[N@@H+](C2CCC2)C1	ZINC000097080684	358145430	/nfs/dbraw/zinc/14/54/30/358145430.db2.gz	RYXDPNHBGUSMKL-YNEHKIRRSA-N	1	0	283.416	1.319	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@@H](O)C2)cc1OC	ZINC000003684383	358554352	/nfs/dbraw/zinc/55/43/52/358554352.db2.gz	GNPRZUFJSPOMEM-GFCCVEGCSA-N	1	0	251.326	1.661	50	0		CDAARO
CCC[C@@H](CCc1ccccc1)NC(=O)[C@@H]1C[NH2+]CCO1	ZINC000195543618	358559886	/nfs/dbraw/zinc/55/98/86/358559886.db2.gz	QLBCFSIRLMEIKJ-HOTGVXAUSA-N	1	0	290.407	1.893	50	0		CDAARO
CCc1nccn1CCNC(=O)CC1CC[NH+](CC)CC1	ZINC000095355464	358683983	/nfs/dbraw/zinc/68/39/83/358683983.db2.gz	YKONXERXKYSIEG-UHFFFAOYSA-N	1	0	292.427	1.684	50	0		CDAARO
[NH3+][C@H]1CN(c2nccc(C(F)(F)F)n2)C[C@@H]1C1CC1	ZINC000095372584	358688666	/nfs/dbraw/zinc/68/86/66/358688666.db2.gz	RHAATPHTDXLPOA-BDAKNGLRSA-N	1	0	272.274	1.669	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)N[C@H](C)Cc2cnccn2)CC1	ZINC000095387007	358691384	/nfs/dbraw/zinc/69/13/84/358691384.db2.gz	ZPVDHBVJIJKIEK-CYBMUJFWSA-N	1	0	290.411	1.644	50	0		CDAARO
CSc1ccc(C[N@@H+]2CC[C@](C)(O)[C@@H](O)C2)cc1	ZINC000096138053	358709641	/nfs/dbraw/zinc/70/96/41/358709641.db2.gz	QEEDLKNJISJEEM-KBPBESRZSA-N	1	0	267.394	1.726	50	0		CDAARO
O=C(c1ccc2cccc(F)c2n1)N1C[C@H]2C[NH2+]C[C@H]2C1	ZINC000097547428	358783935	/nfs/dbraw/zinc/78/39/35/358783935.db2.gz	PBFRBFXOFMMREO-TXEJJXNPSA-N	1	0	285.322	1.665	50	0		CDAARO
Cc1cc(CNC(=O)[C@@H]2CCC[N@@H+]3CCCC[C@H]23)n(C)n1	ZINC000097604303	358787325	/nfs/dbraw/zinc/78/73/25/358787325.db2.gz	ROOJTISPDNSMKE-HUUCEWRRSA-N	1	0	290.411	1.609	50	0		CDAARO
O=C(Nc1ccc2c(c1)OCO2)N1C[C@@H]2CC[C@H]1C[NH2+]C2	ZINC000097636641	358789605	/nfs/dbraw/zinc/78/96/05/358789605.db2.gz	XYEYRWDQBXFHLZ-PWSUYJOCSA-N	1	0	289.335	1.631	50	0		CDAARO
Cc1nccn1CC[N@@H+](C)Cc1cnn2c1nc(C)cc2C	ZINC000215995069	358915173	/nfs/dbraw/zinc/91/51/73/358915173.db2.gz	OWAJQAVMBXCAMB-UHFFFAOYSA-N	1	0	298.394	1.983	50	0		CDAARO
CCc1ccc(CN2C[C@H]([NH+](C)C)C[C@H]2CO)cc1	ZINC000215647168	358897681	/nfs/dbraw/zinc/89/76/81/358897681.db2.gz	ORIFLEDCDYUXSA-CVEARBPZSA-N	1	0	262.397	1.746	50	0		CDAARO
Cc1n[nH]c(C)c1CNc1cc(C2CC([NH3+])C2)nc(N)n1	ZINC000218904525	359070375	/nfs/dbraw/zinc/07/03/75/359070375.db2.gz	CDPYUAZFHHGRIY-UHFFFAOYSA-N	1	0	287.371	1.216	50	0		CDAARO
Cc1ccc(C)c(CC(=O)N2CCN(C)[C@H](CCO)C2)c1	ZINC000219201098	359082629	/nfs/dbraw/zinc/08/26/29/359082629.db2.gz	MIHJMLXLDFDHMS-MRXNPFEDSA-N	1	0	290.407	1.371	50	0		CDAARO
NC(=O)COc1ccc(-c2ccc(C[NH3+])cc2)cc1	ZINC000036672249	359093315	/nfs/dbraw/zinc/09/33/15/359093315.db2.gz	OIKOWZMJHIRODN-UHFFFAOYSA-N	1	0	256.305	1.676	50	0		CDAARO
Cc1cc(=O)cc(C(=O)N[C@H](C)C2CC[NH+](C)CC2)o1	ZINC000219932775	359138775	/nfs/dbraw/zinc/13/87/75/359138775.db2.gz	SLLPSBFHZLDYLX-LLVKDONJSA-N	1	0	278.352	1.408	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCCN1C(=O)c1ccc(N(C)C)nc1	ZINC000121965899	359215234	/nfs/dbraw/zinc/21/52/34/359215234.db2.gz	AKHLLJDLOSYWSL-WCQYABFASA-N	1	0	276.384	1.490	50	0		CDAARO
COCCCC[N@@H+]1CC[C@@H](CN2CCOCC2)C1	ZINC000089410231	359265049	/nfs/dbraw/zinc/26/50/49/359265049.db2.gz	LNQNPMDZJBRGRL-CQSZACIVSA-N	1	0	256.390	1.067	50	0		CDAARO
NC(=O)[C@H]1CCC[N@H+](Cc2ccc(F)cc2F)C1	ZINC000000183238	359273223	/nfs/dbraw/zinc/27/32/23/359273223.db2.gz	CAQGZBMVALQNCM-JTQLQIEISA-N	1	0	254.280	1.662	50	0		CDAARO
CC[C@@H](NC(=O)CN1CCC[N@H+](C)CC1)c1nccs1	ZINC000223400882	359423674	/nfs/dbraw/zinc/42/36/74/359423674.db2.gz	YOAGDEWBHSZMDW-GFCCVEGCSA-N	1	0	296.440	1.348	50	0		CDAARO
O=C(C[NH+]1CCCC1)N1CCc2sccc2C1	ZINC000032888189	359695018	/nfs/dbraw/zinc/69/50/18/359695018.db2.gz	CZAPADGFFHXSBD-UHFFFAOYSA-N	1	0	250.367	1.729	50	0		CDAARO
CC1(C)CC[N@H+](CC(=O)N[C@H]2CCOC(C)(C)C2)C1	ZINC000408517174	359900290	/nfs/dbraw/zinc/90/02/90/359900290.db2.gz	AUNYXUBXXVHATR-LBPRGKRZSA-N	1	0	268.401	1.792	50	0		CDAARO
C[C@H](c1nc(C2CC2)no1)N1CCC[C@H]1Cn1cncn1	ZINC000257365644	359946524	/nfs/dbraw/zinc/94/65/24/359946524.db2.gz	CWFSIMMKDLUNGB-PWSUYJOCSA-N	1	0	288.355	1.764	50	0		CDAARO
C[C@@H](Cc1nc2c([nH]1)C(=O)NCC(C)(C)C2)[NH+]1CCCC1	ZINC000065428486	296007782	/nfs/dbraw/zinc/00/77/82/296007782.db2.gz	TXTHDBKKUWTCPS-NSHDSACASA-N	1	0	290.411	1.749	50	0		CDAARO
Nc1ncccc1CN1CC[C@@H]([NH+]2CCCCC2)C1	ZINC000062969574	360037148	/nfs/dbraw/zinc/03/71/48/360037148.db2.gz	JKVOEJSZMQEGLS-CQSZACIVSA-N	1	0	260.385	1.724	50	0		CDAARO
Cn1cnc(C(=O)N2CCC(CC3CC3)([NH+](C)C)CC2)c1	ZINC000409421397	360230563	/nfs/dbraw/zinc/23/05/63/360230563.db2.gz	IXPDDXCVZNBDPE-UHFFFAOYSA-N	1	0	290.411	1.757	50	0		CDAARO
C[NH2+]Cc1nnc(SCC[C@H]2CC2(F)F)n1C	ZINC000426518870	360679803	/nfs/dbraw/zinc/67/98/03/360679803.db2.gz	YJGMLQBZPWPTFJ-ZETCQYMHSA-N	1	0	262.329	1.672	50	0		CDAARO
Cc1ccc(C(=O)NC[C@@]2(O)CCC[NH2+]C2)n1C(F)F	ZINC000426628340	360690765	/nfs/dbraw/zinc/69/07/65/360690765.db2.gz	VCFOTKSKFQGREV-CYBMUJFWSA-N	1	0	287.310	1.036	50	0		CDAARO
Cc1cccc(C)c1OCC(=O)N1CC[C@H](C[NH3+])C1	ZINC000178586704	189128529	/nfs/dbraw/zinc/12/85/29/189128529.db2.gz	QOOKIPMRPKRHRX-CYBMUJFWSA-N	1	0	262.353	1.489	50	0		CDAARO
CC(C)n1nccc1C(=O)N[C@H]1COC[C@@H]1[NH+]1CCCC1	ZINC000426690284	360696933	/nfs/dbraw/zinc/69/69/33/360696933.db2.gz	LASGRBPARXNKNS-JSGCOSHPSA-N	1	0	292.383	1.057	50	0		CDAARO
CCC[N@@H+]1CC[C@H](NC(=O)Cc2nc3ccccc3[nH]2)C1	ZINC000426707294	360698136	/nfs/dbraw/zinc/69/81/36/360698136.db2.gz	XSGYYJAUOUIHKO-LBPRGKRZSA-N	1	0	286.379	1.706	50	0		CDAARO
CC[N@@H+]1CCC[C@@](C)(C(=O)NCCc2cc[nH]n2)C1	ZINC000426727314	360700300	/nfs/dbraw/zinc/70/03/00/360700300.db2.gz	CJQRMKWHALAICS-CQSZACIVSA-N	1	0	264.373	1.190	50	0		CDAARO
Cc1c[nH]cc1C(=O)N1CCC([N@H+]2CCOC[C@H]2C)CC1	ZINC000584345352	360795351	/nfs/dbraw/zinc/79/53/51/360795351.db2.gz	QGIWVLCLBBMLKP-CYBMUJFWSA-N	1	0	291.395	1.648	50	0		CDAARO
Cn1nccc1C[NH2+]C(C)(C)C(=O)NCC1CCCC1	ZINC000178846502	189149758	/nfs/dbraw/zinc/14/97/58/189149758.db2.gz	BMYOTYDFVMQRQW-UHFFFAOYSA-N	1	0	278.400	1.595	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)COc2ccc(C)cc2)C1	ZINC000178970052	189158452	/nfs/dbraw/zinc/15/84/52/189158452.db2.gz	UQCVLLXVLQVEOW-ZDUSSCGKSA-N	1	0	262.353	1.442	50	0		CDAARO
O=C(c1ccncc1)N1CCC(C[NH+]2CCOCC2)CC1	ZINC000036103475	360922622	/nfs/dbraw/zinc/92/26/22/360922622.db2.gz	PASIUBSXNCEAFY-UHFFFAOYSA-N	1	0	289.379	1.266	50	0		CDAARO
C[C@@H](O)CSc1nnc(C[NH3+])n1Cc1ccccc1	ZINC000426503212	360932424	/nfs/dbraw/zinc/93/24/24/360932424.db2.gz	CNVGSSZSUSOKFY-SNVBAGLBSA-N	1	0	278.381	1.258	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2noc(CC(C)C)n2)n1C	ZINC000426552122	361013043	/nfs/dbraw/zinc/01/30/43/361013043.db2.gz	UYZOGDWUKKANLE-UHFFFAOYSA-N	1	0	296.400	1.408	50	0		CDAARO
C[C@@H](C(=O)N1CC[C@H]([NH3+])C1)c1ccc(F)c(F)c1	ZINC000299739785	200852039	/nfs/dbraw/zinc/85/20/39/200852039.db2.gz	RIHRUPADCIHTTK-SCZZXKLOSA-N	1	0	254.280	1.628	50	0		CDAARO
C[N@@H+]1CCC[C@H]1Cn1cc(C(F)(F)F)ccc1=O	ZINC000521394948	363943839	/nfs/dbraw/zinc/94/38/39/363943839.db2.gz	DPJFNOAXXKLVEK-JTQLQIEISA-N	1	0	260.259	1.961	50	0		CDAARO
CC(C)CNC(=O)NC(=O)C[N@@H+]1CCCC[C@H]1C	ZINC000007486482	364119500	/nfs/dbraw/zinc/11/95/00/364119500.db2.gz	XZZUMZKCHBASNK-LLVKDONJSA-N	1	0	255.362	1.343	50	0		CDAARO
CN(CC[NH+]1CCCC1)S(=O)(=O)N1CCCCCC1	ZINC000103162313	364607704	/nfs/dbraw/zinc/60/77/04/364607704.db2.gz	MAVBSOTVYQYCFI-UHFFFAOYSA-N	1	0	289.445	1.135	50	0		CDAARO
CCc1oncc1C(=O)N1CC[C@H]([NH+](CC)CC)C1	ZINC000216127831	189701125	/nfs/dbraw/zinc/70/11/25/189701125.db2.gz	HNJDVIOZLRWILR-NSHDSACASA-N	1	0	265.357	1.793	50	0		CDAARO
CN1CC[N@H+](C)C[C@H]1CNC(=O)NC(C)(C)CC(C)(C)C	ZINC000089642995	366896206	/nfs/dbraw/zinc/89/62/06/366896206.db2.gz	RUSSGIBEOXMKJL-CYBMUJFWSA-N	1	0	298.475	1.746	50	0		CDAARO
CC[N@@H+]1CCCN(CC(=O)N[C@@H](C)c2ccccc2)CC1	ZINC000089977260	366993529	/nfs/dbraw/zinc/99/35/29/366993529.db2.gz	UUSQOZCASFZAPE-HNNXBMFYSA-N	1	0	289.423	1.891	50	0		CDAARO
Cn1ccnc1C[C@@H]1CCC[N@H+](CC(=O)N2CCCC2)C1	ZINC000090004524	367006407	/nfs/dbraw/zinc/00/64/07/367006407.db2.gz	JUIJUXWVRMAINN-AWEZNQCLSA-N	1	0	290.411	1.297	50	0		CDAARO
CC(C)c1cc(C(=O)N2CCC[N@@H+]([C@@H](C)CO)CC2)no1	ZINC000252496344	367643569	/nfs/dbraw/zinc/64/35/69/367643569.db2.gz	PHBOYVBICTWMKM-LBPRGKRZSA-N	1	0	295.383	1.327	50	0		CDAARO
CCOCCO[C@H]1CC[N@@H+]([C@@H]2CCCC[C@H]2O)C1	ZINC000252511467	367676336	/nfs/dbraw/zinc/67/63/36/367676336.db2.gz	HCWXHEICORCUPU-BFHYXJOUSA-N	1	0	257.374	1.417	50	0		CDAARO
CCN(CCn1cccn1)Cc1nc(-c2ccccn2)no1	ZINC000012570814	370147759	/nfs/dbraw/zinc/14/77/59/370147759.db2.gz	SMHLVXLXVVRCNP-UHFFFAOYSA-N	1	0	298.350	1.850	50	0		CDAARO
O=C(NCC1CC[NH+]([C@@H]2CCOC2)CC1)c1cccs1	ZINC000575608084	370624423	/nfs/dbraw/zinc/62/44/23/370624423.db2.gz	QLHXIDUHAUECQL-CYBMUJFWSA-N	1	0	294.420	1.979	50	0		CDAARO
Cc1ccccc1C(=O)N[C@@H](C)c1nnc2n1CC[NH2+]CC2	ZINC000299755674	372745259	/nfs/dbraw/zinc/74/52/59/372745259.db2.gz	BMQIAISNELPTGF-LBPRGKRZSA-N	1	0	299.378	1.223	50	0		CDAARO
O=C(Cc1ccccc1)N1CC[C@@H]2[NH2+]CCC[C@@H]2C1	ZINC000299758477	372746780	/nfs/dbraw/zinc/74/67/80/372746780.db2.gz	NOYOYLCQXHBJQO-CABCVRRESA-N	1	0	258.365	1.830	50	0		CDAARO
C[C@@H]1CCC[C@H](C)[N@H+]1CCNc1ccc(C(N)=O)cn1	ZINC000341111506	373305841	/nfs/dbraw/zinc/30/58/41/373305841.db2.gz	XCJZQCPUVJQCLV-TXEJJXNPSA-N	1	0	276.384	1.277	50	0		CDAARO
C[C@H](C(=O)NC(C)(C)C)[N@H+](C)CCO[C@H]1CCCCO1	ZINC000253394373	373683610	/nfs/dbraw/zinc/68/36/10/373683610.db2.gz	GKNREJQFUSJDDI-OLZOCXBDSA-N	1	0	286.416	1.765	50	0		CDAARO
C[C@@H]1C[N@@H+](C[C@@H]2CCOC2)C[C@H](C)N1C[C@@H]1CCOC1	ZINC000253396687	373686508	/nfs/dbraw/zinc/68/65/08/373686508.db2.gz	DXKAABMWUJOQEF-FZKCQIBNSA-N	1	0	282.428	1.454	50	0		CDAARO
NC(=O)CSc1ncnc2c1cnn2Cc1ccccc1	ZINC000002441268	374500033	/nfs/dbraw/zinc/50/00/33/374500033.db2.gz	ASDPGVUTJADXHZ-UHFFFAOYSA-N	1	0	299.359	1.452	50	0		CDAARO
CCc1cc(C)nc(N2CC[N@H+](C[C@H](C)O)[C@H](C)C2)n1	ZINC000108333670	412824450	/nfs/dbraw/zinc/82/44/50/412824450.db2.gz	JGFNZULREWEKLQ-OLZOCXBDSA-N	1	0	278.400	1.239	50	0		CDAARO
Cc1ccc(CC[C@H](C)[NH2+]CCS(C)(=O)=O)cc1	ZINC000095421216	374923259	/nfs/dbraw/zinc/92/32/59/374923259.db2.gz	LKKHWSNFNQRQPL-ZDUSSCGKSA-N	1	0	269.410	1.950	50	0		CDAARO
CCO[C@H]1C[C@H]([NH2+]C2CCN(C(N)=O)CC2)C12CCCC2	ZINC000095423473	374924011	/nfs/dbraw/zinc/92/40/11/374924011.db2.gz	MYZFJXVJBHFYIW-KBPBESRZSA-N	1	0	295.427	1.857	50	0		CDAARO
O=C(CO)N[C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21	ZINC000108497727	412831639	/nfs/dbraw/zinc/83/16/39/412831639.db2.gz	OJRAQLLUEHDQHZ-OWCLPIDISA-N	1	0	288.391	1.396	50	0		CDAARO
Cc1cccc(CNC(=O)C[NH2+][C@H](CO)C(C)(C)C)c1	ZINC000097238081	375159330	/nfs/dbraw/zinc/15/93/30/375159330.db2.gz	XGTRYOZJFPRRQT-CQSZACIVSA-N	1	0	278.396	1.608	50	0		CDAARO
CC[C@H](CO)[NH2+]CC(=O)Nc1cc(Cl)ccc1C	ZINC000003440317	375698694	/nfs/dbraw/zinc/69/86/94/375698694.db2.gz	MWCMAZFDGMMEGN-LLVKDONJSA-N	1	0	270.760	1.947	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)/C=C\c2ccc3c(c2)OCCO3)C1	ZINC000254950266	375927284	/nfs/dbraw/zinc/92/72/84/375927284.db2.gz	RLVLLDXNMFQEBC-LSYFEZSPSA-N	1	0	288.347	1.278	50	0		CDAARO
CC[C@H]1C[N@@H+]2CCC[C@H]2CN1CC(=O)N(CC)CC	ZINC000239761679	376016781	/nfs/dbraw/zinc/01/67/81/376016781.db2.gz	CKENJVGWRLIJJW-KBPBESRZSA-N	1	0	267.417	1.413	50	0		CDAARO
CN1CCC[C@H]([NH2+][C@H]2CCN(CC(F)(F)F)C2)C1	ZINC000240744093	376017110	/nfs/dbraw/zinc/01/71/10/376017110.db2.gz	HULNCOUMAWUBCT-QWRGUYRKSA-N	1	0	265.323	1.307	50	0		CDAARO
CC[N@H+](C)C[C@@H](C)CNC(=O)[C@H]1CC[C@@H](O)CC1	ZINC000247967508	377189471	/nfs/dbraw/zinc/18/94/71/377189471.db2.gz	BZJNLPRYYFPLBH-RWMBFGLXSA-N	1	0	256.390	1.242	50	0		CDAARO
COC(=O)N[C@H](C)c1nc(CC2CC[NH+](C)CC2)no1	ZINC000067688730	377208708	/nfs/dbraw/zinc/20/87/08/377208708.db2.gz	AIJXSBXVYHFUHI-SECBINFHSA-N	1	0	282.344	1.371	50	0		CDAARO
CC(C)(C(=O)N1CCC[C@]2(CC[NH2+]C2)C1)n1cccc1	ZINC000067758960	377236360	/nfs/dbraw/zinc/23/63/60/377236360.db2.gz	MUUKSDXZZKEDMF-MRXNPFEDSA-N	1	0	275.396	1.825	50	0		CDAARO
Cc1cc(C2CCC2)nc(N[C@@H]2C[C@@H](CO)[N@H+](C)C2)n1	ZINC000071767791	379632576	/nfs/dbraw/zinc/63/25/76/379632576.db2.gz	OFDURXBOYXLVJE-OLZOCXBDSA-N	1	0	276.384	1.529	50	0		CDAARO
COCCN1CCC[C@@H]1C[NH2+][C@@H]1[C@H]2CCCO[C@@H]2C1(C)C	ZINC000242284650	285029188	/nfs/dbraw/zinc/02/91/88/285029188.db2.gz	YIOJOBYLYDHOJH-FPCVCCKLSA-N	1	0	296.455	1.890	50	0		CDAARO
C[C@H]1COCC[C@H]1[NH2+]Cc1cccc(-n2cncn2)c1	ZINC000281020319	195072295	/nfs/dbraw/zinc/07/22/95/195072295.db2.gz	XNPWEXXQUFAHCZ-SWLSCSKDSA-N	1	0	272.352	1.782	50	0		CDAARO
C[NH+](C)CCCNC(=O)/C=C\c1nc2ccccc2o1	ZINC000490823878	253050680	/nfs/dbraw/zinc/05/06/80/253050680.db2.gz	SMGYCQVMGCLUKY-HJWRWDBZSA-N	1	0	273.336	1.909	50	0		CDAARO
OC[C@@H]1CCC[N@@H+]1Cc1cc(F)ccc1-n1cccn1	ZINC000219766186	285274548	/nfs/dbraw/zinc/27/45/48/285274548.db2.gz	APHQQHJGBCJHBN-AWEZNQCLSA-N	1	0	275.327	1.968	50	0		CDAARO
CC[N@@H+]1CCC[C@](C)(C(=O)NCCn2cccc2)C1	ZINC000095355320	184950839	/nfs/dbraw/zinc/95/08/39/184950839.db2.gz	HSPMSXUIMVEYFG-HNNXBMFYSA-N	1	0	263.385	1.726	50	0		CDAARO
C[NH2+]C1CCN(C(=O)c2ccc(C)cc2F)CC1	ZINC000094905362	184890117	/nfs/dbraw/zinc/89/01/17/184890117.db2.gz	BNHVORUQEBMZPU-UHFFFAOYSA-N	1	0	250.317	1.958	50	0		CDAARO
Cc1nc(C[C@@H]2CCCN(C(=O)[C@H]3CCC[C@H]3[NH3+])C2)no1	ZINC000299738421	390198859	/nfs/dbraw/zinc/19/88/59/390198859.db2.gz	AQKNJRXWKBYTJP-RWMBFGLXSA-N	1	0	292.383	1.287	50	0		CDAARO
COCCN1CC[N@H+](C[C@H]2CCCCO2)C[C@@H]1C	ZINC000247101635	390243504	/nfs/dbraw/zinc/24/35/04/390243504.db2.gz	IFPSMSFNHFHRTL-UONOGXRCSA-N	1	0	256.390	1.208	50	0		CDAARO
Cc1nc(C)c(C[N@@H+]2CCCN(C(N)=O)CC2)s1	ZINC000096424624	390516238	/nfs/dbraw/zinc/51/62/38/390516238.db2.gz	LUTNQQKHEYKZIH-UHFFFAOYSA-N	1	0	268.386	1.346	50	0		CDAARO
CC(C)(C)[C@@H](O)C[C@H](CO)[NH2+]Cc1cccs1	ZINC000283897464	195938743	/nfs/dbraw/zinc/93/87/43/195938743.db2.gz	HSHABHJEJDPIQO-PWSUYJOCSA-N	1	0	257.399	1.996	50	0		CDAARO
CCOC(=O)[C@@]12CC[NH2+][C@H]1CCN2C(=O)OC(C)(C)C	ZINC000095707243	390911358	/nfs/dbraw/zinc/91/13/58/390911358.db2.gz	QLPXWVCIJGAGHW-IINYFYTJSA-N	1	0	284.356	1.291	50	0		CDAARO
Cc1ccc2[nH]c(=O)cc(C(=O)NCC[NH+]3CCCC3)c2c1	ZINC000096150450	390913081	/nfs/dbraw/zinc/91/30/81/390913081.db2.gz	YZSFYRXPTJIUDW-UHFFFAOYSA-N	1	0	299.374	1.662	50	0		CDAARO
CC(C)(C)OC(=O)[C@@](C)(O)C[NH2+][C@@H]1CCC[C@H]2C[C@H]21	ZINC000549376100	391934716	/nfs/dbraw/zinc/93/47/16/391934716.db2.gz	FVDLTYUJOZHBPQ-YFCNSXCBSA-N	1	0	269.385	1.857	50	0		CDAARO
CCC[NH+]1CCN(C(=S)NC[C@H]2CCCO2)CC1	ZINC000002766754	392126556	/nfs/dbraw/zinc/12/65/56/392126556.db2.gz	PQZYHZQRUXZUTF-GFCCVEGCSA-N	1	0	271.430	1.068	50	0		CDAARO
[NH3+]Cc1ccc(C(=O)N2CC[C@](O)(C(F)(F)F)C2)cc1	ZINC000261691827	131162062	/nfs/dbraw/zinc/16/20/62/131162062.db2.gz	HRETXMWVWMSBMI-GFCCVEGCSA-N	1	0	288.269	1.285	50	0		CDAARO
CC[C@H]1COCCN1C(=O)C[C@H]([NH3+])c1ccccc1	ZINC000036326648	392442750	/nfs/dbraw/zinc/44/27/50/392442750.db2.gz	JVASEWDVOCOGIL-KBPBESRZSA-N	1	0	262.353	1.714	50	0		CDAARO
Cc1nn(C)c(C)c1OCC(=O)N1CCC[C@@H]([C@@H](C)[NH3+])C1	ZINC000269231434	132137546	/nfs/dbraw/zinc/13/75/46/132137546.db2.gz	AOQWCKFXIRHPJK-ZWNOBZJWSA-N	1	0	294.399	1.002	50	0		CDAARO
CC(C)[N@@H+]1CC[C@@H](Cn2ncn3cccc3c2=O)C1	ZINC000095385979	393144952	/nfs/dbraw/zinc/14/49/52/393144952.db2.gz	IVOSMTSUDGDJDD-GFCCVEGCSA-N	1	0	260.341	1.226	50	0		CDAARO
COCCNc1ccc(CNC(=O)C[N@H+](C)C(C)C)cc1	ZINC000096410535	393182153	/nfs/dbraw/zinc/18/21/53/393182153.db2.gz	GTHKZUGIQAGRSI-UHFFFAOYSA-N	1	0	293.411	1.701	50	0		CDAARO
CCn1cc(CN(C)C(=O)[C@@H]([NH3+])CC(C)C)cn1	ZINC000195543829	393280976	/nfs/dbraw/zinc/28/09/76/393280976.db2.gz	RESJXZOTNRGPOK-LBPRGKRZSA-N	1	0	252.362	1.235	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C\C(=O)N1CCC(C[NH3+])CC1	ZINC000493810115	393442878	/nfs/dbraw/zinc/44/28/78/393442878.db2.gz	KHUVOPAPGHVVPY-ARJAWSKDSA-N	1	0	296.802	1.592	50	0		CDAARO
C[C@@H](CCc1ccc(O)cc1)NC(=O)C[NH+](C)C	ZINC000097101806	397966970	/nfs/dbraw/zinc/96/69/70/397966970.db2.gz	RQWYPTUFBFWKGO-NSHDSACASA-N	1	0	250.342	1.391	50	0		CDAARO
CCOC(=O)[C@]12CC[NH2+][C@@H]1CCN2C(=O)OC(C)(C)C	ZINC000095707242	285958941	/nfs/dbraw/zinc/95/89/41/285958941.db2.gz	QLPXWVCIJGAGHW-YGRLFVJLSA-N	1	0	284.356	1.291	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)N1C[C@@H](C)O[C@H](C)C1)[C@H](C)n1cccn1	ZINC000106845471	287014990	/nfs/dbraw/zinc/01/49/90/287014990.db2.gz	QADKZEOOKQKYHJ-SYQHCUMBSA-N	1	0	294.399	1.058	50	0		CDAARO
C[NH+](C)CCn1cnc2c3cc(F)ccc3[nH]c2c1=O	ZINC000004811370	170021051	/nfs/dbraw/zinc/02/10/51/170021051.db2.gz	YYPLKEDFMNKXOB-UHFFFAOYSA-N	1	0	274.299	1.579	50	0		CDAARO
CCOc1ccc(S(=O)(=O)NCCC[NH+](C)C)cc1	ZINC000007374525	170279997	/nfs/dbraw/zinc/27/99/97/170279997.db2.gz	TXKGBPKGKDEOFW-UHFFFAOYSA-N	1	0	286.397	1.315	50	0		CDAARO
COc1ccc(CN2CC[NH2+]C[C@H]2CCO)cc1C	ZINC000019368014	170777197	/nfs/dbraw/zinc/77/71/97/170777197.db2.gz	ZQHYBIGZQONQPV-CQSZACIVSA-N	1	0	264.369	1.160	50	0		CDAARO
CN1CCC([NH2+]Cc2ccc(N3CCCC3=O)cc2)CC1	ZINC000020129496	171018006	/nfs/dbraw/zinc/01/80/06/171018006.db2.gz	HLCWUPAABSBVMO-UHFFFAOYSA-N	1	0	287.407	1.997	50	0		CDAARO
OCC[C@H]1CN(Cc2cc[nH]n2)CC[N@@H+]1C1CCCC1	ZINC000020776693	171272068	/nfs/dbraw/zinc/27/20/68/171272068.db2.gz	SYOVIELTPPILJS-HNNXBMFYSA-N	1	0	278.400	1.221	50	0		CDAARO
Cc1nc(-n2cccc2)sc1C(=O)NCC[NH+](C)C	ZINC000020865632	171276750	/nfs/dbraw/zinc/27/67/50/171276750.db2.gz	NNKKVXCCGLYCSI-UHFFFAOYSA-N	1	0	278.381	1.534	50	0		CDAARO
COc1cccc(CNC2CC[NH+](C)CC2)c1OC	ZINC000037248583	173061431	/nfs/dbraw/zinc/06/14/31/173061431.db2.gz	NISVOOGEVWDWGL-UHFFFAOYSA-N	1	0	264.369	1.888	50	0		CDAARO
CCC(CC)[C@H](CNC(=O)c1ccc(=O)[nH]c1)[NH+](C)C	ZINC000040435749	174261362	/nfs/dbraw/zinc/26/13/62/174261362.db2.gz	FOMFCZUNOLXYRW-ZDUSSCGKSA-N	1	0	279.384	1.883	50	0		CDAARO
CN(Cc1cscn1)C(=O)[C@H]1CC12CC[NH2+]CC2	ZINC000070255795	175885093	/nfs/dbraw/zinc/88/50/93/175885093.db2.gz	LIPWYUHYIKLKAA-LLVKDONJSA-N	1	0	265.382	1.491	50	0		CDAARO
Cc1ccc([C@@H](C)NC(=O)c2cn(CC[NH3+])nn2)c(C)c1	ZINC000071764331	176261796	/nfs/dbraw/zinc/26/17/96/176261796.db2.gz	VJEUBSBHDNSMJY-GFCCVEGCSA-N	1	0	287.367	1.345	50	0		CDAARO
O=C(NC[C@]1(O)CCC[NH2+]CC1)c1ccc2ncccc2c1	ZINC000072128439	176321100	/nfs/dbraw/zinc/32/11/00/176321100.db2.gz	UCVMKGNJOQWRMU-KRWDZBQOSA-N	1	0	299.374	1.469	50	0		CDAARO
C[NH+]1CCC(N(CCc2ccccc2)S(C)(=O)=O)CC1	ZINC000072154034	176327822	/nfs/dbraw/zinc/32/78/22/176327822.db2.gz	WKARTLMLNXWREA-UHFFFAOYSA-N	1	0	296.436	1.585	50	0		CDAARO
CN(C)C(=O)[C@@]1(CCCc2ccccn2)CCC[NH2+]1	ZINC000072343776	176372142	/nfs/dbraw/zinc/37/21/42/176372142.db2.gz	YENKTPSIUOQLCE-OAHLLOKOSA-N	1	0	261.369	1.615	50	0		CDAARO
CCCc1cc(N2CC[C@H](C[NH3+])C2)n2nccc2n1	ZINC000072409134	176398285	/nfs/dbraw/zinc/39/82/85/176398285.db2.gz	BLRQQTJIBPYHNT-LLVKDONJSA-N	1	0	259.357	1.467	50	0		CDAARO
COC(=O)[C@@H](C[NH3+])Oc1ccc(Br)cc1	ZINC000076420148	177023315	/nfs/dbraw/zinc/02/33/15/177023315.db2.gz	AVUHNQLIRTYAKN-SECBINFHSA-N	1	0	274.114	1.328	50	0		CDAARO
Brc1ccc(N2CCC[NH2+]CC2)nc1	ZINC000022172536	275369520	/nfs/dbraw/zinc/36/95/20/275369520.db2.gz	HGPQRNSDOVULHZ-UHFFFAOYSA-N	1	0	256.147	1.644	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+](C[C@@H]2COCCO2)C1	ZINC000431010250	276040396	/nfs/dbraw/zinc/04/03/96/276040396.db2.gz	NFVAZVCQMPNXPU-RRFJBIMHSA-N	1	0	298.427	1.419	50	0		CDAARO
CCOCCN1CC[N@H+](C[C@@H]2CCCCO2)C[C@H]1C	ZINC000247034459	276322663	/nfs/dbraw/zinc/32/26/63/276322663.db2.gz	DIMNYQCJPCYKAR-CABCVRRESA-N	1	0	270.417	1.598	50	0		CDAARO
CS[C@H]1CN(c2nc(C)cc(C)n2)C[C@@H]1[NH+](C)C	ZINC000271098648	278168283	/nfs/dbraw/zinc/16/82/83/278168283.db2.gz	MJAXLAINCZCQHO-RYUDHWBXSA-N	1	0	266.414	1.575	50	0		CDAARO
C[C@H]1CCSCC[N@@H+]1C[C@@H](O)COC(C)(C)C	ZINC000241644156	278376456	/nfs/dbraw/zinc/37/64/56/278376456.db2.gz	POSIQBPLJALLAP-NWDGAFQWSA-N	1	0	261.431	1.990	50	0		CDAARO
C[C@@H]1OC(=O)[C@H]2[C@H]1[N@@H+]1CCc3ccccc3[C@@H]1C[C@H]2O	ZINC000035361460	279038908	/nfs/dbraw/zinc/03/89/08/279038908.db2.gz	MPEJFJFZVUSBET-NBUQLFNLSA-N	1	0	273.332	1.281	50	0	biogenic	CDAARO
C[C@H]1C[NH2+]CCN1C(=O)[C@@H]1CCOc2ccccc21	ZINC000111188996	279906712	/nfs/dbraw/zinc/90/67/12/279906712.db2.gz	DGIVSORBBMSFHR-WCQYABFASA-N	1	0	260.337	1.373	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@@H]1[NH2+][C@@H](C)C(=O)N(CC)CC	ZINC000089948621	280396337	/nfs/dbraw/zinc/39/63/37/280396337.db2.gz	DCMODUOHPKERKF-CFVMTHIKSA-N	1	0	297.443	1.480	50	0		CDAARO
Cc1ccc2c(c1)[C@@H]1C[N@H+](C)CC[C@H]1N2S(C)(=O)=O	ZINC000017136162	281099689	/nfs/dbraw/zinc/09/96/89/281099689.db2.gz	DGKGNEDJNWYORV-GXTWGEPZSA-N	1	0	280.393	1.562	50	0		CDAARO
COc1ccc([C@H](C[NH3+])N2CCCC2)c(OC)c1	ZINC000032497115	295241566	/nfs/dbraw/zinc/24/15/66/295241566.db2.gz	UXIZCIXMGABFTM-ZDUSSCGKSA-N	1	0	250.342	1.799	50	0		CDAARO
CN(C)c1nccnc1NCC1(C[NH+]2CCCC2)CC1	ZINC000534581066	328311513	/nfs/dbraw/zinc/31/15/13/328311513.db2.gz	XTSTUSZPTJFPGU-UHFFFAOYSA-N	1	0	275.400	1.252	50	0		CDAARO
CC1(C)CC(CC(=O)NCC2(CO)CC2)CC(C)(C)[NH2+]1	ZINC000534644128	328330112	/nfs/dbraw/zinc/33/01/12/328330112.db2.gz	KERIADUCQSMUBM-UHFFFAOYSA-N	1	0	282.428	1.822	50	0		CDAARO
CC[C@@H](NC(=O)CN(C)CCOC)c1ncccc1C	ZINC000534653322	328338468	/nfs/dbraw/zinc/33/84/68/328338468.db2.gz	CIAGVFKEJZYSDD-CYBMUJFWSA-N	1	0	279.384	1.536	50	0		CDAARO
C[N@H+](CC(=O)NCc1cccnc1N)C1CCCC1	ZINC000534639979	328335428	/nfs/dbraw/zinc/33/54/28/328335428.db2.gz	WGYZREDORVLOCJ-UHFFFAOYSA-N	1	0	262.357	1.154	50	0		CDAARO
O=C(C[C@@H]1CCOC1)N1CCCC2(CC[NH2+]CC2)C1	ZINC000534659640	328342326	/nfs/dbraw/zinc/34/23/26/328342326.db2.gz	OAHQDFKGMGAHTM-ZDUSSCGKSA-N	1	0	266.385	1.405	50	0		CDAARO
Cc1cccnc1[C@@H](C)NC(=O)CN(C)C1CC[NH2+]CC1	ZINC000534647818	328343136	/nfs/dbraw/zinc/34/31/36/328343136.db2.gz	HNHHGXMDIWNSLO-CYBMUJFWSA-N	1	0	290.411	1.251	50	0		CDAARO
Cc1ncsc1C(=O)N[C@H]1COC[C@@H]1N1CCCCC1	ZINC000534656725	328340181	/nfs/dbraw/zinc/34/01/81/328340181.db2.gz	OEMUXIPLZGVMDJ-RYUDHWBXSA-N	1	0	295.408	1.435	50	0		CDAARO
O=C(C[NH+]1CCCC1)NC1(c2ccccc2)CCOCC1	ZINC000534664768	328344816	/nfs/dbraw/zinc/34/48/16/328344816.db2.gz	IJIKLCODLSZWIM-UHFFFAOYSA-N	1	0	288.391	1.904	50	0		CDAARO
CC(C)c1cccc(S(=O)(=O)NCCC[NH3+])c1	ZINC000097229278	323207675	/nfs/dbraw/zinc/20/76/75/323207675.db2.gz	IPXJNGBQCDFCFC-UHFFFAOYSA-N	1	0	256.371	1.437	50	0		CDAARO
Cc1cccc(S(=O)(=O)N(C)[C@H](C)C[NH3+])c1Cl	ZINC000183172600	323323260	/nfs/dbraw/zinc/32/32/60/323323260.db2.gz	VNEJWWDHNKUUPH-SECBINFHSA-N	1	0	276.789	1.616	50	0		CDAARO
Cc1ccc(O[C@H](C)C(=O)N2CC[NH2+]CC2)c(C)c1	ZINC000019519279	326856066	/nfs/dbraw/zinc/85/60/66/326856066.db2.gz	GBHANYNRBPPGSI-CYBMUJFWSA-N	1	0	262.353	1.503	50	0		CDAARO
CO[C@@H]1CC[NH2+]C[C@@H]1NC(=O)c1cc(C)c(O)c(C)c1	ZINC001772711662	1159446259	/nfs/dbraw/zinc/44/62/59/1159446259.db2.gz	CBTZWLCMYVYPCJ-QWHCGFSZSA-N	1	0	278.352	1.116	50	0		CDAARO
[NH3+][C@H]1CC[C@H](C(=O)N2CCOc3ccccc3C2)C1	ZINC000091543757	482570811	/nfs/dbraw/zinc/57/08/11/482570811.db2.gz	VNARBPZONBSUDR-AAEUAGOBSA-N	1	0	260.337	1.535	50	0		CDAARO
C[NH+](C)[C@@H]1CC[C@@H](NC(=O)Cc2noc3ccccc23)C1	ZINC000092473141	482623506	/nfs/dbraw/zinc/62/35/06/482623506.db2.gz	RMSXXYQVXKDJNY-VXGBXAGGSA-N	1	0	287.363	1.969	50	0		CDAARO
Cc1nn(CCC[NH2+][C@H](C)CS(C)(=O)=O)c(C)c1C	ZINC000670447843	483002007	/nfs/dbraw/zinc/00/20/07/483002007.db2.gz	OXOBOBZFIYRTEI-SNVBAGLBSA-N	1	0	287.429	1.221	50	0		CDAARO
Cc1n[nH]cc1CN(C)C(=O)C[C@@H]1C[N@H+](C(C)C)CCO1	ZINC000670449770	483010363	/nfs/dbraw/zinc/01/03/63/483010363.db2.gz	FBEBINDOQAZLSY-CQSZACIVSA-N	1	0	294.399	1.176	50	0		CDAARO
Cc1cc(C(N)=O)c(N2CC[N@@H+](C(C)C)[C@H](C)C2)nc1C	ZINC000670456149	483034629	/nfs/dbraw/zinc/03/46/29/483034629.db2.gz	INXQZLFGRITBQQ-GFCCVEGCSA-N	1	0	290.411	1.716	50	0		CDAARO
Cc1nnc([C@H](C)NC(=O)c2ccc(CN(C)C)o2)[nH]1	ZINC000670455868	483034633	/nfs/dbraw/zinc/03/46/33/483034633.db2.gz	IFWXDZRZSXECBZ-QMMMGPOBSA-N	1	0	277.328	1.259	50	0		CDAARO
CN(C)c1ncc(CN2C[C@H]3CCC[C@@H](C2)[N@H+](C)C3)cn1	ZINC000670461878	483048977	/nfs/dbraw/zinc/04/89/77/483048977.db2.gz	GUGFQOYZHRPTTF-ZFWWWQNUSA-N	1	0	289.427	1.459	50	0		CDAARO
CC(C)[NH+]1CCC(CC(=O)NCC2(CO)CCC2)CC1	ZINC000670467485	483058805	/nfs/dbraw/zinc/05/88/05/483058805.db2.gz	FIXVKXNTUOGFRD-UHFFFAOYSA-N	1	0	282.428	1.776	50	0		CDAARO
O=C(CC1CCCC1)NCC[N@H+]1CCCC[C@@H]1CO	ZINC000670467763	483060282	/nfs/dbraw/zinc/06/02/82/483060282.db2.gz	FHDGZCBIAPCBSU-CQSZACIVSA-N	1	0	268.401	1.530	50	0		CDAARO
CCn1cnnc1CC[NH2+][C@H]1CCN(c2ccccc2)C1	ZINC000674882493	483168026	/nfs/dbraw/zinc/16/80/26/483168026.db2.gz	ODRZTZZGXRTSQO-AWEZNQCLSA-N	1	0	285.395	1.709	50	0		CDAARO
Cc1cnc(CN(C)[C@H]2CC[N@H+](CC3CCOCC3)C2)o1	ZINC000084258827	483269540	/nfs/dbraw/zinc/26/95/40/483269540.db2.gz	ZEFWZNOYMPYXDE-HNNXBMFYSA-N	1	0	293.411	1.916	50	0		CDAARO
Cc1ccc(C[N@@H+]2CCC[C@@H](NS(C)(=O)=O)C2)cc1C	ZINC000096489808	533922623	/nfs/dbraw/zinc/92/26/23/533922623.db2.gz	IXMCSLHUZDSYJK-OAHLLOKOSA-N	1	0	296.436	1.817	50	0		CDAARO
CC[C@H](C)[C@@H]([NH3+])C(=O)N1CCN(CC(F)F)[C@H](CC)C1	ZINC000262538680	521830565	/nfs/dbraw/zinc/83/05/65/521830565.db2.gz	KPAFUXLKODNQTH-DMDPSCGWSA-N	1	0	291.386	1.548	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)COc2cccc(F)c2)C1	ZINC000178606819	522493001	/nfs/dbraw/zinc/49/30/01/522493001.db2.gz	XCDGONJRKAHDKV-LBPRGKRZSA-N	1	0	266.316	1.415	50	0		CDAARO
CC(C)(CO)CCCNC(=O)N1CC[C@H]([NH+]2CCCC2)C1	ZINC000096452821	527191427	/nfs/dbraw/zinc/19/14/27/527191427.db2.gz	PXJWBGMSTRRPAS-AWEZNQCLSA-N	1	0	297.443	1.665	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)c3cc(Cl)ccn3)C[C@H]12	ZINC000242302075	527368896	/nfs/dbraw/zinc/36/88/96/527368896.db2.gz	YPIHEGPZCTYZTH-DVVUODLYSA-N	1	0	265.744	1.544	50	0		CDAARO
COC1(C(=O)NC[C@@H](C)c2ccc(F)cc2)CC[NH2+]CC1	ZINC000262608330	536531501	/nfs/dbraw/zinc/53/15/01/536531501.db2.gz	HNEZZNUBOQDBNF-GFCCVEGCSA-N	1	0	294.370	1.814	50	0		CDAARO
CC(C)n1nccc1C(=O)N1CCOC2(CC[NH2+]CC2)C1	ZINC000426668265	528672168	/nfs/dbraw/zinc/67/21/68/528672168.db2.gz	HRLWGRZYYOZGEU-UHFFFAOYSA-N	1	0	292.383	1.059	50	0		CDAARO
CCC(CC)(CO)CN(C)c1cc(C2CC([NH3+])C2)ncn1	ZINC000222752231	528696420	/nfs/dbraw/zinc/69/64/20/528696420.db2.gz	WGKLOERPQNJSBF-UHFFFAOYSA-N	1	0	292.427	1.916	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNC(=O)NCc2cccs2)C1	ZINC000952979883	616387721	/nfs/dbraw/zinc/38/77/21/616387721.db2.gz	UXCDVCBQAGLXHG-LBPRGKRZSA-N	1	0	297.424	1.516	50	0		CDAARO
C[N@H+]1C[C@H](C(F)(F)F)[C@H](C(=O)N2CC=CCC2)C1	ZINC000952992021	616478609	/nfs/dbraw/zinc/47/86/09/616478609.db2.gz	HVGWLJGCGPURMA-ZJUUUORDSA-N	1	0	262.275	1.515	50	0		CDAARO
CCOC(=O)N1CCC([N@@H+]2CCC[C@H](CO)C2)CC1	ZINC000003683471	824048619	/nfs/dbraw/zinc/04/86/19/824048619.db2.gz	AVSAELGUBFEEIM-LBPRGKRZSA-N	1	0	270.373	1.312	50	0		CDAARO
Cc1nnc(CNC(=O)CC2CC(C)(C)[NH2+]C(C)(C)C2)[nH]1	ZINC000426658152	824201444	/nfs/dbraw/zinc/20/14/44/824201444.db2.gz	AVUJDEGTUTVNNW-UHFFFAOYSA-N	1	0	293.415	1.676	50	0		CDAARO
[NH3+][C@@H](c1nccs1)C1(O)CCC2(CC1)OCCO2	ZINC000958527608	824208700	/nfs/dbraw/zinc/20/87/00/824208700.db2.gz	BBJPGQXSTSKLKA-VIFPVBQESA-N	1	0	270.354	1.191	50	0		CDAARO
CCC(CC)C[N@H+]1CCc2nnc(CNC(C)=O)n2CC1	ZINC000011910481	824519356	/nfs/dbraw/zinc/51/93/56/824519356.db2.gz	UDBGSLNPCPAFGL-UHFFFAOYSA-N	1	0	293.415	1.209	50	0		CDAARO
Fc1cccc(-c2cnnc(N3CC[N@@H+]4CCC[C@@H]4C3)n2)c1	ZINC000012074305	825203051	/nfs/dbraw/zinc/20/30/51/825203051.db2.gz	UGKVAUSPYFPDCS-CQSZACIVSA-N	1	0	299.353	1.962	50	0		CDAARO
CNC(=O)c1nn(C)c2c1C[C@H]([NH2+]CCC(C)C)CC2	ZINC000020452117	825434114	/nfs/dbraw/zinc/43/41/14/825434114.db2.gz	VXBTWFUFGALIFY-LLVKDONJSA-N	1	0	278.400	1.273	50	0		CDAARO
C[NH+](C)[C@H]1CCN(Cc2cccnc2N)C[C@H]1CCCO	ZINC000091269775	828807981	/nfs/dbraw/zinc/80/79/81/828807981.db2.gz	PYUSXRGKKNEEHL-HIFRSBDPSA-N	1	0	292.427	1.188	50	0		CDAARO
CS(=O)(=O)N[C@@H]1CC[N@H+](Cc2coc3ccccc23)C1	ZINC000093530907	825672223	/nfs/dbraw/zinc/67/22/23/825672223.db2.gz	WJBHSVHRTOQZEJ-GFCCVEGCSA-N	1	0	294.376	1.556	50	0		CDAARO
CCCCn1nc(C)nc1CC[C@H](C)[NH+]1CCN(C)CC1	ZINC000096163300	826333092	/nfs/dbraw/zinc/33/30/92/826333092.db2.gz	RBZPNHSUHGESKT-AWEZNQCLSA-N	1	0	293.459	1.955	50	0		CDAARO
CC(C)c1cc(N2CC[NH+](C)CC2)n2nccc2n1	ZINC000072439906	826390509	/nfs/dbraw/zinc/39/05/09/826390509.db2.gz	PYYONEZYHMEWFU-UHFFFAOYSA-N	1	0	259.357	1.605	50	0		CDAARO
COCCN1CCC[C@@](O)(C[N@H+](C)C2CCCCC2)C1=O	ZINC000011880114	827272587	/nfs/dbraw/zinc/27/25/87/827272587.db2.gz	IKBVHWKEXYIARN-MRXNPFEDSA-N	1	0	298.427	1.251	50	0		CDAARO
CCOC(=O)CCCCN[C@@H](O)C(Cl)(Cl)Cl	ZINC000002900721	827712417	/nfs/dbraw/zinc/71/24/17/827712417.db2.gz	NDFODQCSMZZEJK-QMMMGPOBSA-N	1	0	292.590	1.998	50	0		CDAARO
C[N@@H+]1C[C@H]2C[NH+](Cc3ccc4[nH]ccc4c3)C[C@@]2(C(=O)[O-])C1	ZINC000198094202	906134555	/nfs/dbraw/zinc/13/45/55/906134555.db2.gz	LAVOXVMCJNVTAI-YOEHRIQHSA-N	1	0	299.374	1.616	50	0		CDAARO
c1cnc(C[C@@H]2CC[C@H](C[N@@H+]3CCCOCC3)O2)nc1	ZINC000952854435	910408994	/nfs/dbraw/zinc/40/89/94/910408994.db2.gz	HZSWGDNUKICNLK-UONOGXRCSA-N	1	0	277.368	1.289	50	0		CDAARO
CCCCOC(=O)CN1C=NC2=[NH+][C@@H](C)CCN21	ZINC000952883819	910459909	/nfs/dbraw/zinc/45/99/09/910459909.db2.gz	RBUKOHHAUFJULF-JTQLQIEISA-N	1	0	252.318	1.039	50	0		CDAARO
C[C@@H](C[NH+](C)C)NCc1nncn1C1CCCCC1	ZINC000821209133	925567947	/nfs/dbraw/zinc/56/79/47/925567947.db2.gz	VXAGZXNYXHGUNF-LBPRGKRZSA-N	1	0	265.405	1.823	50	0		CDAARO
C[C@@H](C[NH+]1CCCCC1)c1ncnn1CC(C)(C)O	ZINC000822279780	925614848	/nfs/dbraw/zinc/61/48/48/925614848.db2.gz	KMPDRUWXQCQYQB-LBPRGKRZSA-N	1	0	266.389	1.638	50	0		CDAARO
CN(C)[C@H](C(=O)N[C@H]1CC[C@@H]([NH3+])CC1)c1ccccc1F	ZINC000827523353	925944682	/nfs/dbraw/zinc/94/46/82/925944682.db2.gz	SXVPOQYFEBJGGN-ZOWXZIJZSA-N	1	0	293.386	1.815	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)c1cc(C(F)F)n[nH]1	ZINC000828209806	926073139	/nfs/dbraw/zinc/07/31/39/926073139.db2.gz	AKQOHIPTCUCRCI-UHFFFAOYSA-N	1	0	295.293	1.315	50	0		CDAARO
CCCn1nc(C)cc1NC(=O)[C@@H]([NH3+])CCSC	ZINC001529118906	968986214	/nfs/dbraw/zinc/98/62/14/968986214.db2.gz	PTMDALHHPRGUOH-JTQLQIEISA-N	1	0	270.402	1.620	50	0		CDAARO
CCC[C@H](CNc1cc(OC(C)C)nc(N)n1)[NH+](C)C	ZINC001529160167	968997085	/nfs/dbraw/zinc/99/70/85/968997085.db2.gz	YRCWOCKYMIPPFA-LLVKDONJSA-N	1	0	281.404	1.988	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]CCCC(=O)N(C)C	ZINC001506396085	975147561	/nfs/dbraw/zinc/14/75/61/975147561.db2.gz	NBVAREZDGBLXAH-GFCCVEGCSA-N	1	0	266.389	1.292	50	0		CDAARO
Cc1cc(F)ccc1N1CCC([NH2+]CCOCCO)CC1	ZINC001506403323	975150742	/nfs/dbraw/zinc/15/07/42/975150742.db2.gz	XTXZUEULTJZHBI-UHFFFAOYSA-N	1	0	296.386	1.701	50	0		CDAARO
Cc1nncn1CCN1C[C@]2(C)C[N@@H+](C)C[C@](C)(C1)C2	ZINC001506419431	975157373	/nfs/dbraw/zinc/15/73/73/975157373.db2.gz	PNBJICXMNFVJQJ-GASCZTMLSA-N	1	0	277.416	1.250	50	0		CDAARO
O=C(N1CCCC1)N1CCC(Nc2ccncc2F)CC1	ZINC001506422529	975158106	/nfs/dbraw/zinc/15/81/06/975158106.db2.gz	CIBTWXXCVUHJJZ-UHFFFAOYSA-N	1	0	292.358	1.735	50	0		CDAARO
Cc1c(NC(=O)CC2C[NH2+]C2)cccc1-c1nncn1C	ZINC001506423677	975159348	/nfs/dbraw/zinc/15/93/48/975159348.db2.gz	HEEBPZAEFFMDQZ-UHFFFAOYSA-N	1	0	285.351	1.339	50	0		CDAARO
Cc1cccc(OC[C@H](O)C[NH2+]CCCn2ccnc2)c1	ZINC000002630965	230367409	/nfs/dbraw/zinc/36/74/09/230367409.db2.gz	JLUXMUOTISGGDF-OAHLLOKOSA-N	1	0	289.379	1.611	50	0		CDAARO
CNC(=O)CC[N@H+](C)C[C@@H]1CCOc2ccccc2C1	ZINC000095509773	185001852	/nfs/dbraw/zinc/00/18/52/185001852.db2.gz	UYKXAXYCDQEFRT-CYBMUJFWSA-N	1	0	276.380	1.696	50	0		CDAARO
CC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@@H+]1Cc1cnc(C)cn1	ZINC000106668259	349446282	/nfs/dbraw/zinc/44/62/82/349446282.db2.gz	RYFBXIFVWJGKAM-JKSUJKDBSA-N	1	0	288.395	1.760	50	0		CDAARO
C[C@H](OCC1CC1)C(=O)N1CCC[C@H]1[C@H]1CCC[N@@H+]1C	ZINC000106661814	349446298	/nfs/dbraw/zinc/44/62/98/349446298.db2.gz	ZGVPQPCMJARCGI-CFVMTHIKSA-N	1	0	280.412	1.887	50	0		CDAARO
CCO[C@@H](C)c1nc(CC(=O)N2CC[NH2+]C[C@H]2C)cs1	ZINC000124571782	187143561	/nfs/dbraw/zinc/14/35/61/187143561.db2.gz	DWPQLIOQXYTPBY-MNOVXSKESA-N	1	0	297.424	1.603	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H](O)[C@H]([N@H+](C)Cc2ccc(C)s2)C1	ZINC000107511088	398149361	/nfs/dbraw/zinc/14/93/61/398149361.db2.gz	RBYJZLKGHGQVAS-CYZMBNFOSA-N	1	0	283.393	1.801	50	0		CDAARO
CC(C)(C)c1ccc(OC[C@@H](O)C[NH+]2CC(CO)C2)cc1	ZINC000095942196	185035765	/nfs/dbraw/zinc/03/57/65/185035765.db2.gz	PJGQELGCOFHWLW-HNNXBMFYSA-N	1	0	293.407	1.648	50	0		CDAARO
CC[C@@H](COC)[NH2+][C@@H](C)Cc1c(C)nn(C)c1C	ZINC000095968571	185047875	/nfs/dbraw/zinc/04/78/75/185047875.db2.gz	MCLHPUZVLMNTKN-GWCFXTLKSA-N	1	0	253.390	1.983	50	0		CDAARO
C[C@@H](CO)[N@@H+]1CCCN(C(=O)c2cc(C3CC3)on2)CC1	ZINC000242324462	361756304	/nfs/dbraw/zinc/75/63/04/361756304.db2.gz	ZBMCMSCCPQEYJU-NSHDSACASA-N	1	0	293.367	1.081	50	0		CDAARO
O=c1[nH]c(C[NH2+][C@H]2CCCSC2)nc2ccccc21	ZINC000136375396	342071466	/nfs/dbraw/zinc/07/14/66/342071466.db2.gz	OTHKIZHMRBCGBO-JTQLQIEISA-N	1	0	275.377	1.908	50	0		CDAARO
COCC1(CNC(=O)c2ccc(CC[NH3+])cc2)CCC1	ZINC000380667008	342089992	/nfs/dbraw/zinc/08/99/92/342089992.db2.gz	VHWOXBNZARBOTO-UHFFFAOYSA-N	1	0	276.380	1.734	50	0		CDAARO
O=C(C1CCCC1)N1CC[C@H]([NH2+]C2CCOCC2)C1	ZINC000089818005	539087554	/nfs/dbraw/zinc/08/75/54/539087554.db2.gz	CENHTJXDBYCCSR-AWEZNQCLSA-N	1	0	266.385	1.546	50	0		CDAARO
CCC(=O)N1CCC([NH2+][C@H]2CCN3CCCC[C@H]23)CC1	ZINC000089941634	539087656	/nfs/dbraw/zinc/08/76/56/539087656.db2.gz	XJBXDRNIQXEHLD-LSDHHAIUSA-N	1	0	279.428	1.604	50	0		CDAARO
Cc1ccn(CC[N@@H+](C)[C@H](C)Cc2cnccn2)n1	ZINC000244685566	361856949	/nfs/dbraw/zinc/85/69/49/361856949.db2.gz	ISMUEWMXHMOUJD-CYBMUJFWSA-N	1	0	259.357	1.545	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+]C[C@](C)(O)c2cnn(C)c2)C1(C)C	ZINC000097034563	185157069	/nfs/dbraw/zinc/15/70/69/185157069.db2.gz	MCMNZPYQDCRKAK-NFAWXSAZSA-N	1	0	281.400	1.421	50	0		CDAARO
Cc1cc(C(=O)Nc2c[nH+]ccc2NC2CC2)n(C)n1	ZINC000585139271	342216640	/nfs/dbraw/zinc/21/66/40/342216640.db2.gz	YVTHSSRXPNYMAR-UHFFFAOYSA-N	1	0	271.324	1.372	50	0		CDAARO
c1c(-c2nc(-c3ccccc3)no2)nnn1[C@@H]1CCC[NH2+]C1	ZINC000424342746	539071798	/nfs/dbraw/zinc/07/17/98/539071798.db2.gz	ZHLWTQPTMRVTPC-GFCCVEGCSA-N	1	0	296.334	1.920	50	0		CDAARO
c1cn([C@@H]2CCC[N@@H+](CCO[C@@H]3CCCCO3)CC2)nn1	ZINC000585116340	362043764	/nfs/dbraw/zinc/04/37/64/362043764.db2.gz	RBLIVZWAXAORLQ-HUUCEWRRSA-N	1	0	294.399	1.848	50	0		CDAARO
CC(C)Oc1ccccc1CC(=O)NC[C@H]1CCC[NH2+]1	ZINC000178731554	362247867	/nfs/dbraw/zinc/24/78/67/362247867.db2.gz	GGKPYTYGDCTYLN-CQSZACIVSA-N	1	0	276.380	1.885	50	0		CDAARO
Cc1cc(NC(=O)CC[N@@H+](C)CC2(O)CCCC2)no1	ZINC000084119909	362258084	/nfs/dbraw/zinc/25/80/84/362258084.db2.gz	OONXUGUANJGYPU-UHFFFAOYSA-N	1	0	281.356	1.549	50	0		CDAARO
COC(=O)C[C@H]1CN(C/C=C/c2ccccc2)CCO1	ZINC000089400673	362308648	/nfs/dbraw/zinc/30/86/48/362308648.db2.gz	ZLLGXUUIQLKQNW-PXTSUWAFSA-N	1	0	275.348	1.964	50	0		CDAARO
COc1ccccc1/C=C/C(=O)N1CC[N@H+](C)C[C@H]1C	ZINC000089937761	362323589	/nfs/dbraw/zinc/32/35/89/362323589.db2.gz	VXWNCDJFTYBMHI-MMQHEFTJSA-N	1	0	274.364	1.871	50	0		CDAARO
CNC(=O)C[C@H](C)[N@H+](C)Cc1cncn1CC(C)C	ZINC000252479834	362383695	/nfs/dbraw/zinc/38/36/95/362383695.db2.gz	BNMLNRHYZASBMN-LBPRGKRZSA-N	1	0	266.389	1.496	50	0		CDAARO
C[N@@H+]1CC[C@H](CN2CCN(c3ccccc3F)CC2)C1	ZINC000252488619	362386722	/nfs/dbraw/zinc/38/67/22/362386722.db2.gz	IVQLVIVGZQXYNI-AWEZNQCLSA-N	1	0	277.387	1.899	50	0		CDAARO
COc1ccc([C@H]2CN(C)C(=O)[C@]23CCC[NH2+]C3)cc1	ZINC000044137133	345421520	/nfs/dbraw/zinc/42/15/20/345421520.db2.gz	DXBJNJAMXPGLDM-ZBFHGGJFSA-N	1	0	274.364	1.621	50	0		CDAARO
C[C@H](NC(=O)N1CCC(CO)CC1)C(C)(C)C[NH+](C)C	ZINC000085424498	179059961	/nfs/dbraw/zinc/05/99/61/179059961.db2.gz	WFFGXFONBURGEX-LBPRGKRZSA-N	1	0	285.432	1.377	50	0		CDAARO
Cn1ncc2c1ncnc2NCC[NH+]1CCCCCC1	ZINC000025570819	362782671	/nfs/dbraw/zinc/78/26/71/362782671.db2.gz	IPUHFYPKRAWHDN-UHFFFAOYSA-N	1	0	274.372	1.651	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)c2c(F)cc(F)cc2F)C1	ZINC000086997913	179377467	/nfs/dbraw/zinc/37/74/67/179377467.db2.gz	JTRNBKNYYOCRBE-SECBINFHSA-N	1	0	272.270	1.928	50	0		CDAARO
c1cc(C[NH2+][C@@H]2CCCSC2)cc(-c2nn[nH]n2)c1	ZINC000095143877	348749083	/nfs/dbraw/zinc/74/90/83/348749083.db2.gz	ZHOBKYMNVWOTOF-GFCCVEGCSA-N	1	0	275.381	1.852	50	0		CDAARO
COCC1(CNC(=O)[C@]2(C)CCC[NH2+]C2)CCCC1	ZINC000584884612	349342454	/nfs/dbraw/zinc/34/24/54/349342454.db2.gz	ATHUGVURPQYWJH-CQSZACIVSA-N	1	0	268.401	1.699	50	0		CDAARO
Cc1ccc(O)cc1C(=O)N[C@@H]1CCC[C@H]1[NH+](C)C	ZINC000584885092	349343307	/nfs/dbraw/zinc/34/33/07/349343307.db2.gz	FSPBJNZFNCJBNY-ZIAGYGMSSA-N	1	0	262.353	1.913	50	0		CDAARO
C[NH+](C)CC1(O)CCN(C(=O)[C@H]2CC23CCC3)CC1	ZINC000584892952	349352892	/nfs/dbraw/zinc/35/28/92/349352892.db2.gz	FLJDJBDKQBMVKG-GFCCVEGCSA-N	1	0	266.385	1.092	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1NC(=O)c1ncoc1C(C)C	ZINC000584898122	349359698	/nfs/dbraw/zinc/35/96/98/349359698.db2.gz	KNZAYJOJJGNOEE-RYUDHWBXSA-N	1	0	295.383	1.635	50	0		CDAARO
CC(C)c1nc(CN(C)C(=O)[C@@H]2C[NH2+]CCO2)cs1	ZINC000091270461	180117812	/nfs/dbraw/zinc/11/78/12/180117812.db2.gz	OVHLITARKAALQW-NSHDSACASA-N	1	0	283.397	1.213	50	0		CDAARO
C[NH+](C)Cc1ccc(-c2nc(-c3cccnn3)no2)o1	ZINC000091459936	180161837	/nfs/dbraw/zinc/16/18/37/180161837.db2.gz	IJPWMHZLUZEXAS-UHFFFAOYSA-N	1	0	271.280	1.848	50	0		CDAARO
Cc1c[nH]c(CN(C)c2cc(C(C)C)[nH+]c(N)n2)n1	ZINC000091664207	180221047	/nfs/dbraw/zinc/22/10/47/180221047.db2.gz	DWQVOVJAVGMKLN-UHFFFAOYSA-N	1	0	260.345	1.850	50	0		CDAARO
CC(C)Cc1cc(C(=O)N2CC[C@H]([NH+](C)C)C2)n(C)n1	ZINC000091756747	180247333	/nfs/dbraw/zinc/24/73/33/180247333.db2.gz	NMFWTGHSBPNNQT-ZDUSSCGKSA-N	1	0	278.400	1.395	50	0		CDAARO
CCc1cnc(N)nc1NCCC[N@@H+]1CCCC[C@H]1CO	ZINC000091819435	180263707	/nfs/dbraw/zinc/26/37/07/180263707.db2.gz	JPGQFGPCNBGDHS-ZDUSSCGKSA-N	1	0	293.415	1.270	50	0		CDAARO
O=C(N[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@H]1CCCO1	ZINC000106059882	186100287	/nfs/dbraw/zinc/10/02/87/186100287.db2.gz	OMFBYUQFHOHFMH-HZPDHXFCSA-N	1	0	288.391	1.946	50	0		CDAARO
COc1ncccc1C[N@@H+]1CC[C@H](C)[C@@H](OC)C1	ZINC000193573912	362963159	/nfs/dbraw/zinc/96/31/59/362963159.db2.gz	NOCAKIYTRXPEDZ-AAEUAGOBSA-N	1	0	250.342	1.947	50	0		CDAARO
[NH3+]CCNS(=O)(=O)c1ccc(F)cc1C(F)(F)F	ZINC000122465599	187033690	/nfs/dbraw/zinc/03/36/90/187033690.db2.gz	CQOFCIFHVYYWLR-UHFFFAOYSA-N	1	0	286.250	1.082	50	0		CDAARO
CNc1cc(C(=O)NC[C@@]2([NH+](C)C)CCSC2)ccn1	ZINC000065500824	363289587	/nfs/dbraw/zinc/28/95/87/363289587.db2.gz	XLJQJGWQJNEBBR-AWEZNQCLSA-N	1	0	294.424	1.290	50	0		CDAARO
Cc1ccc(NCCCNC(=O)Cc2cccnc2)nc1	ZINC000265634253	363359648	/nfs/dbraw/zinc/35/96/48/363359648.db2.gz	SOGHKYIKQAVKTP-UHFFFAOYSA-N	1	0	284.363	1.946	50	0		CDAARO
COC(=O)c1cc(N2CC[NH2+]CC2)nc2ccccc21	ZINC000000033812	355880145	/nfs/dbraw/zinc/88/01/45/355880145.db2.gz	RYPDJGVKFIXLDP-UHFFFAOYSA-N	1	0	271.320	1.431	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1ccc(N)c(Cl)c1	ZINC000001546399	355938991	/nfs/dbraw/zinc/93/89/91/355938991.db2.gz	YEYAKZXEBSVURO-UHFFFAOYSA-N	1	0	269.776	1.994	50	0	investigational	CDAARO
CN(C)CC(=O)Nc1ccccc1Br	ZINC000002861174	355984294	/nfs/dbraw/zinc/98/42/94/355984294.db2.gz	HRPBOJWDVDHWEP-UHFFFAOYSA-N	1	0	257.131	1.949	50	0		CDAARO
CC(C)(C)[NH2+]C[C@@H](O)c1cc(Br)no1	ZINC000001999557	355957446	/nfs/dbraw/zinc/95/74/46/355957446.db2.gz	JBRBWHCVRGURBA-ZCFIWIBFSA-N	1	0	263.135	1.859	50	0	in-man	CDAARO
CN(C)CC(=O)Nc1c2c(nc3c1CCCC3)CCC2	ZINC000004003475	356014826	/nfs/dbraw/zinc/01/48/26/356014826.db2.gz	SSJNGRWRVAYFMH-UHFFFAOYSA-N	1	0	273.380	1.949	50	0		CDAARO
OCC[N@H+](C[C@@H](O)C(F)(F)F)C1CCCCC1	ZINC000004050530	356017114	/nfs/dbraw/zinc/01/71/14/356017114.db2.gz	FTDPRWLODNNXTF-SNVBAGLBSA-N	1	0	255.280	1.537	50	0		CDAARO
COCCNC(=O)NC[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000193921557	358501566	/nfs/dbraw/zinc/50/15/66/358501566.db2.gz	IDLKNFJVJNTPJG-HNNXBMFYSA-N	1	0	291.395	1.454	50	0		CDAARO
CC(C)(C)NC(=O)c1cccnc1N1CC[NH2+]CC1	ZINC000019015144	356474625	/nfs/dbraw/zinc/47/46/25/356474625.db2.gz	UHVOJZSCTIGFND-UHFFFAOYSA-N	1	0	262.357	1.020	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COc2cc(C)cc(C)c2)CC1	ZINC000019790738	356504293	/nfs/dbraw/zinc/50/42/93/356504293.db2.gz	GBSKQYUVKRBSIL-MRXNPFEDSA-N	1	0	292.423	1.681	50	0		CDAARO
[NH3+]CC1(C(F)(F)F)CCN(C(=O)C2CCC2)CC1	ZINC000725264778	538455762	/nfs/dbraw/zinc/45/57/62/538455762.db2.gz	VYWGUJDINLVGLY-UHFFFAOYSA-N	1	0	264.291	1.916	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(N)=[NH2+])C1	ZINC000034219177	363531350	/nfs/dbraw/zinc/53/13/50/363531350.db2.gz	IGEJQPQAAYKGLR-VIFPVBQESA-N	1	0	256.350	1.117	50	0		CDAARO
CS(=O)(=O)NC1CC[NH+](CCc2ccccc2)CC1	ZINC000030380478	356749291	/nfs/dbraw/zinc/74/92/91/356749291.db2.gz	IAZJNJKOJUBTOV-UHFFFAOYSA-N	1	0	282.409	1.243	50	0		CDAARO
Cc1ccc(C[NH2+]C2CCN(S(C)(=O)=O)CC2)o1	ZINC000030656530	356750715	/nfs/dbraw/zinc/75/07/15/356750715.db2.gz	HVLXLULWIQHBFH-UHFFFAOYSA-N	1	0	272.370	1.102	50	0		CDAARO
Cc1ccccc1-c1ccc(N2CC[NH2+]CC2)nn1	ZINC000032918448	356790630	/nfs/dbraw/zinc/79/06/30/356790630.db2.gz	OFYPDLXZDQZFSL-UHFFFAOYSA-N	1	0	254.337	1.862	50	0		CDAARO
NC(=O)C1CC[NH+]([C@@H]2CCc3ccccc3C2)CC1	ZINC000003683478	356815488	/nfs/dbraw/zinc/81/54/88/356815488.db2.gz	TZZDIBHBQBPEDS-OAHLLOKOSA-N	1	0	258.365	1.741	50	0		CDAARO
Cc1c(C)c(C)c(S(=O)(=O)N2CCNCC2)c(C)c1C	ZINC000034781247	356820443	/nfs/dbraw/zinc/82/04/43/356820443.db2.gz	XJXUQRNJJYGDSL-UHFFFAOYSA-N	1	0	296.436	1.823	50	0		CDAARO
C[N@H+](Cc1ccsc1)Cc1cc(=O)n2nccc2[nH]1	ZINC000100839693	356869598	/nfs/dbraw/zinc/86/95/98/356869598.db2.gz	KYGRAURDDMOBLX-UHFFFAOYSA-N	1	0	274.349	1.716	50	0		CDAARO
COCC(=O)N1CCC[N@H+](Cc2cccs2)CC1	ZINC000041363514	357032939	/nfs/dbraw/zinc/03/29/39/357032939.db2.gz	DITBRDNOMCUJNA-UHFFFAOYSA-N	1	0	268.382	1.429	50	0		CDAARO
COC(=O)[C@H](CC[NH2+]Cc1ccc(OC)cc1)[C@@H](C)O	ZINC000043214670	363571630	/nfs/dbraw/zinc/57/16/30/363571630.db2.gz	CEENHDWLURPRQT-BXUZGUMPSA-N	1	0	281.352	1.345	50	0		CDAARO
Cc1cc(C)c(C[NH2+]C[C@H]2CC[C@@H](C(N)=O)O2)c(C)c1	ZINC000095414160	357284888	/nfs/dbraw/zinc/28/48/88/357284888.db2.gz	UHCUTWSROSAWPO-HIFRSBDPSA-N	1	0	276.380	1.734	50	0		CDAARO
[NH3+]CCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000051870191	357262268	/nfs/dbraw/zinc/26/22/68/357262268.db2.gz	MREOPMZJNSWBQS-UHFFFAOYSA-N	1	0	269.244	1.318	50	0		CDAARO
C[C@@H]1C[N@@H+](C[C@H]2CCOC2)C[C@H](C)N1C[C@@H]1CCOC1	ZINC000255961404	357353384	/nfs/dbraw/zinc/35/33/84/357353384.db2.gz	DXKAABMWUJOQEF-QXSJWSMHSA-N	1	0	282.428	1.454	50	0		CDAARO
Cc1cnc(NCC(C)(C)C[NH+](C)C)nc1N(C)C	ZINC000065373367	357532748	/nfs/dbraw/zinc/53/27/48/357532748.db2.gz	BMDQBNVOFVIRRT-UHFFFAOYSA-N	1	0	265.405	1.851	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H]([NH+](C)C)CN1Cc1ccc(C)cc1C	ZINC000065434856	357541063	/nfs/dbraw/zinc/54/10/63/357541063.db2.gz	DVSJTLDJEHAEFD-CVEARBPZSA-N	1	0	290.407	1.981	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCC[NH2+][C@@H]2C)c(C)c1	ZINC000091496857	357602590	/nfs/dbraw/zinc/60/25/90/357602590.db2.gz	KYZNYRGCPAPKPY-OLZOCXBDSA-N	1	0	282.409	1.722	50	0		CDAARO
C[NH+]1CCC(C)(C(=O)NCCC[C@H]2CCOC2)CC1	ZINC000067679159	357617802	/nfs/dbraw/zinc/61/78/02/357617802.db2.gz	ORUUWQSYUINWSE-ZDUSSCGKSA-N	1	0	268.401	1.651	50	0		CDAARO
COc1ccc(C(=O)NC[C@@H]2CC[N@H+](C)C2)cc1F	ZINC000067712786	357620110	/nfs/dbraw/zinc/62/01/10/357620110.db2.gz	WYDNCFWFTOPPFI-JTQLQIEISA-N	1	0	266.316	1.516	50	0		CDAARO
COc1ccc(CC(=O)N(C)[C@@H]2CC[NH2+]C2)c(Cl)c1	ZINC000299740262	357700262	/nfs/dbraw/zinc/70/02/62/357700262.db2.gz	XRFWEQXNWPDKCZ-LLVKDONJSA-N	1	0	282.771	1.711	50	0		CDAARO
C[C@H](O)C[NH+]1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000072319658	357829039	/nfs/dbraw/zinc/82/90/39/357829039.db2.gz	RILCRPPNPSBVRQ-JTQLQIEISA-N	1	0	258.362	1.356	50	0		CDAARO
CC(C)(O)CCc1ccc(C[N@@H+]2CC[C@@](O)(CO)C2)cc1	ZINC000072423382	357834093	/nfs/dbraw/zinc/83/40/93/357834093.db2.gz	AKUMMXQJPZNHNE-KRWDZBQOSA-N	1	0	293.407	1.319	50	0		CDAARO
CC[N@H+](Cc1ccc(C(=O)N(C)C)cc1)C(C)(C)CO	ZINC000097096413	357953567	/nfs/dbraw/zinc/95/35/67/357953567.db2.gz	UVSQKOLODPAZDB-UHFFFAOYSA-N	1	0	278.396	1.981	50	0		CDAARO
CCOc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H]2CO)nc1	ZINC000097104498	357968449	/nfs/dbraw/zinc/96/84/49/357968449.db2.gz	NVDVKJWJAUQYII-RISCZKNCSA-N	1	0	250.342	1.683	50	0		CDAARO
CNC(=O)CC[N@@H+]1CCSC2(CCCCC2)C1	ZINC000079504803	283305663	/nfs/dbraw/zinc/30/56/63/283305663.db2.gz	OXFDQEREQYEQNH-UHFFFAOYSA-N	1	0	256.415	1.874	50	0		CDAARO
O[C@@H]1COCC[N@H+](CCCCOc2ccccc2)C1	ZINC000077438510	358018584	/nfs/dbraw/zinc/01/85/84/358018584.db2.gz	MSOBCGVOANDRFJ-AWEZNQCLSA-N	1	0	265.353	1.539	50	0		CDAARO
Cc1cc(F)c(S(=O)(=O)N[C@H](C[NH3+])C2CC2)cc1F	ZINC000097229399	358043246	/nfs/dbraw/zinc/04/32/46/358043246.db2.gz	PPIOIFNNOQVVFK-LLVKDONJSA-N	1	0	290.335	1.289	50	0		CDAARO
CC[C@H](C(=O)[O-])[N@@H+]1CC[C@H](CNc2cc(C)cc[nH+]2)C1	ZINC000364253805	358126941	/nfs/dbraw/zinc/12/69/41/358126941.db2.gz	GMWJYEIZJQRLCX-CHWSQXEVSA-N	1	0	277.368	1.987	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2ccc(F)c(C(F)(F)F)c2)C[C@H]1O	ZINC000082098197	358146714	/nfs/dbraw/zinc/14/67/14/358146714.db2.gz	IRUDDYQIBAMVRP-VXGBXAGGSA-N	1	0	292.276	1.738	50	0		CDAARO
CCCCc1nc(Cl)c(CN2CC[C@@H]([NH3+])[C@H](O)C2)[nH]1	ZINC000082134244	358149041	/nfs/dbraw/zinc/14/90/41/358149041.db2.gz	NKTSJVGBJKROMU-MWLCHTKSSA-N	1	0	286.807	1.300	50	0		CDAARO
CCOc1ccc(Cl)cc1CCNC(=O)C[NH2+]C	ZINC000193138386	358269678	/nfs/dbraw/zinc/26/96/78/358269678.db2.gz	RDVIOFHNQFWVGY-UHFFFAOYSA-N	1	0	270.760	1.617	50	0		CDAARO
NC(=O)NC(=O)CC[N@@H+]1CCC[C@H]1/C=C\c1ccccc1	ZINC000543731727	358557209	/nfs/dbraw/zinc/55/72/09/358557209.db2.gz	ULNHNVOVNWBCEQ-CKXPSTMWSA-N	1	0	287.363	1.749	50	0		CDAARO
CCC(CC)(C[NH3+])NS(=O)(=O)Cc1ccccc1F	ZINC000195544527	358559825	/nfs/dbraw/zinc/55/98/25/358559825.db2.gz	HGPRJOFDQXPZEX-UHFFFAOYSA-N	1	0	288.388	1.763	50	0		CDAARO
CC[N@@H+]1CC[C@@H](N(C)Cc2c[nH]c(C(=O)OC)c2)[C@@H](C)C1	ZINC000195548293	358560644	/nfs/dbraw/zinc/56/06/44/358560644.db2.gz	KQLCPLWCBAMGBO-SWLSCSKDSA-N	1	0	293.411	1.963	50	0		CDAARO
CC(C)c1cc(N2CC[C@@]3(CN(C)C(=O)O3)C2)nc(N)[nH+]1	ZINC000095360443	358684798	/nfs/dbraw/zinc/68/47/98/358684798.db2.gz	UDFAFMOZNJPAMQ-CQSZACIVSA-N	1	0	291.355	1.213	50	0		CDAARO
Cc1ccc(F)cc1NC(=O)N1CCO[C@@H](C[NH+](C)C)C1	ZINC000095398680	358692816	/nfs/dbraw/zinc/69/28/16/358692816.db2.gz	BMWJMHIDYRCSNK-ZDUSSCGKSA-N	1	0	295.358	1.928	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@H](C[NH3+])C(F)(F)C1	ZINC000095628877	358697866	/nfs/dbraw/zinc/69/78/66/358697866.db2.gz	WYFLAUNQWVXXHB-MRVPVSSYSA-N	1	0	250.289	1.837	50	0		CDAARO
OCCCCC[N@@H+]1C[C@@H]2C[NH+]3CCCC[C@H]3[C@@H]2C1	ZINC000247764694	358762824	/nfs/dbraw/zinc/76/28/24/358762824.db2.gz	JUEBTNNNOCUEPL-KFWWJZLASA-N	1	0	252.402	1.565	50	0		CDAARO
O=C(Nc1ccc(F)nc1)N[C@H]1COC[C@@H]1[NH+]1CCCC1	ZINC000096153272	358710213	/nfs/dbraw/zinc/71/02/13/358710213.db2.gz	YQRIMZYIGVKQEF-RYUDHWBXSA-N	1	0	294.330	1.205	50	0		CDAARO
COc1ccccc1N1CCN(C(C)(C)C[NH3+])CC1	ZINC000096828961	358740424	/nfs/dbraw/zinc/74/04/24/358740424.db2.gz	NABYBPODRULLMO-UHFFFAOYSA-N	1	0	263.385	1.555	50	0		CDAARO
[NH3+][C@H]1CCN(c2ccc(-c3ccccc3F)nn2)C1	ZINC000098211192	358816628	/nfs/dbraw/zinc/81/66/28/358816628.db2.gz	IADPMZVVJXBWJO-JTQLQIEISA-N	1	0	258.300	1.820	50	0		CDAARO
O[C@@H]1COC2(C1)CC[NH+](Cc1cccc3nonc31)CC2	ZINC000097696169	358793868	/nfs/dbraw/zinc/79/38/68/358793868.db2.gz	KCNSBFIBRZPACH-LBPRGKRZSA-N	1	0	289.335	1.339	50	0		CDAARO
C[NH+](C)Cc1ccccc1-c1cc(NCCO)ncn1	ZINC000097823561	358801364	/nfs/dbraw/zinc/80/13/64/358801364.db2.gz	OSNFTAPQWJHKJG-UHFFFAOYSA-N	1	0	272.352	1.609	50	0		CDAARO
C[N@@H+]1CCOC[C@@H](CNC(=O)c2ccc(Cl)cc2O)C1	ZINC000215586890	358895387	/nfs/dbraw/zinc/89/53/87/358895387.db2.gz	CYPGRPFJDVPCHW-JTQLQIEISA-N	1	0	298.770	1.354	50	0		CDAARO
COc1cccc(-n2c(C[NH3+])nnc2SCCCO)c1	ZINC000426431369	358920152	/nfs/dbraw/zinc/92/01/52/358920152.db2.gz	RALLIYRRMPLWGB-UHFFFAOYSA-N	1	0	294.380	1.209	50	0		CDAARO
Cc1noc(C)c1C[N@@H+]1CCC[C@@H](c2nnc[nH]2)C1	ZINC000216439049	358945550	/nfs/dbraw/zinc/94/55/50/358945550.db2.gz	RUYUXPOGDQUICA-LLVKDONJSA-N	1	0	261.329	1.789	50	0		CDAARO
c1cncc(C[N@@H+]2CCC[C@@H](Nc3ncncn3)C2)c1	ZINC000219076200	359077396	/nfs/dbraw/zinc/07/73/96/359077396.db2.gz	HKVFWWGBCXRYOW-CYBMUJFWSA-N	1	0	270.340	1.343	50	0		CDAARO
COC[C@H]1CCN(C(=O)CN(C)Cc2cccnc2)C1	ZINC000221397629	359245386	/nfs/dbraw/zinc/24/53/86/359245386.db2.gz	ZCDJHBAQXFNKQD-AWEZNQCLSA-N	1	0	277.368	1.008	50	0		CDAARO
Nc1nc(NCc2ccccn2)cc(C2CC(O)C2)[nH+]1	ZINC000222275873	359330726	/nfs/dbraw/zinc/33/07/26/359330726.db2.gz	CSYYGBLJZIVESF-UHFFFAOYSA-N	1	0	271.324	1.304	50	0		CDAARO
O=C1CC[N@H+](Cc2cccc(F)c2)CCCOCCN1	ZINC000257186373	359521176	/nfs/dbraw/zinc/52/11/76/359521176.db2.gz	KIUWUJQWSOCGKE-UHFFFAOYSA-N	1	0	280.343	1.554	50	0		CDAARO
OCC[C@@H]1CSCC[N@@H+]1CCO[C@H]1CCCCO1	ZINC000408514852	359904494	/nfs/dbraw/zinc/90/44/94/359904494.db2.gz	MWMBXNBOYZLUKN-OLZOCXBDSA-N	1	0	275.414	1.329	50	0		CDAARO
CCc1nccn1CCCNC(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000072424810	359933968	/nfs/dbraw/zinc/93/39/68/359933968.db2.gz	ZUSOBWDRWSNNAU-NWDGAFQWSA-N	1	0	264.373	1.079	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@H]1CCN(C(=O)c2cc(C)n(C)n2)C1	ZINC000409420736	360224202	/nfs/dbraw/zinc/22/42/02/360224202.db2.gz	VAVKATHKYCZECR-ZDUSSCGKSA-N	1	0	287.367	1.629	50	0		CDAARO
C[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)COCC1CC1	ZINC000248161098	360414837	/nfs/dbraw/zinc/41/48/37/360414837.db2.gz	XNUWMFQFZFQJSD-UONOGXRCSA-N	1	0	266.385	1.498	50	0		CDAARO
COC(=O)[C@H](Sc1nnc(C[NH3+])n1C)c1ccccc1	ZINC000426477635	360565079	/nfs/dbraw/zinc/56/50/79/360565079.db2.gz	WFNNXARAVYWHPZ-LLVKDONJSA-N	1	0	292.364	1.280	50	0		CDAARO
CCOCCSc1nnc([C@H]2CCC[NH2+]C2)n1C	ZINC000426556068	360683570	/nfs/dbraw/zinc/68/35/70/360683570.db2.gz	WVZNCOCHLHYEBW-JTQLQIEISA-N	1	0	270.402	1.411	50	0		CDAARO
CC(C)n1ccnc1CNC(=O)C(C)(C)[NH+]1CCCC1	ZINC000426566828	360684646	/nfs/dbraw/zinc/68/46/46/360684646.db2.gz	DWFLLBILFBKNTJ-UHFFFAOYSA-N	1	0	278.400	1.955	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2ccc3cc[nH]c3n2)n1C	ZINC000426620032	360689915	/nfs/dbraw/zinc/68/99/15/360689915.db2.gz	LNNFNPAAWHQEOF-UHFFFAOYSA-N	1	0	288.380	1.703	50	0		CDAARO
Cc1nccn1[C@H](C)C(=O)N(C)CCc1cnn(C)c1	ZINC000426369969	360659812	/nfs/dbraw/zinc/65/98/12/360659812.db2.gz	QEWMKERSWWEOIG-LLVKDONJSA-N	1	0	275.356	1.187	50	0		CDAARO
Cc1cnc(CNC(=O)C(C)(C)[NH+]2CCCC2)cn1	ZINC000426471380	360674391	/nfs/dbraw/zinc/67/43/91/360674391.db2.gz	NROVUWKXNAHFCY-UHFFFAOYSA-N	1	0	262.357	1.276	50	0		CDAARO
CC[C@H](Oc1ccccc1C)C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178592163	189129306	/nfs/dbraw/zinc/12/93/06/189129306.db2.gz	BSLCTCMLORBGTD-KBPBESRZSA-N	1	0	276.380	1.960	50	0		CDAARO
O=C(C1CCOCC1)N1CC[C@@H]2[NH2+]CCC[C@@H]2C1	ZINC000299759210	200862444	/nfs/dbraw/zinc/86/24/44/200862444.db2.gz	BWLKTHGTLGHSFF-OLZOCXBDSA-N	1	0	252.358	1.014	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000299750481	200856298	/nfs/dbraw/zinc/85/62/98/200856298.db2.gz	NNPHBEYLGVZKEG-QLFBSQMISA-N	1	0	276.380	1.838	50	0		CDAARO
CC(C)([NH3+])CNS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000129639738	361183598	/nfs/dbraw/zinc/18/35/98/361183598.db2.gz	ORVSAXWSBMYWNC-UHFFFAOYSA-N	1	0	296.314	1.721	50	0		CDAARO
C[C@H]([NH2+]CC(C)(C)C(N)=O)c1ccc2c(c1)OCO2	ZINC000183640694	189364733	/nfs/dbraw/zinc/36/47/33/189364733.db2.gz	MCGFTHIDUYTZGN-VIFPVBQESA-N	1	0	264.325	1.577	50	0		CDAARO
COc1cccc(CCNC(=O)[C@@H]2CC23CC[NH2+]CC3)c1	ZINC000231327153	361599201	/nfs/dbraw/zinc/59/92/01/361599201.db2.gz	INXNBZVBZYGLRJ-HNNXBMFYSA-N	1	0	288.391	1.744	50	0		CDAARO
C[C@H](O)C(=O)N1CCC[N@H+](Cc2ccccc2)C[C@H]1C	ZINC000270769759	364748617	/nfs/dbraw/zinc/74/86/17/364748617.db2.gz	HNSYUBGJGSYOJN-KGLIPLIRSA-N	1	0	276.380	1.490	50	0		CDAARO
Cc1cnc(C[NH2+][C@H]2CCc3nc(C(C)C)nn3C2)cn1	ZINC000089702257	366915744	/nfs/dbraw/zinc/91/57/44/366915744.db2.gz	PPNLWFUALMPBOP-LBPRGKRZSA-N	1	0	286.383	1.605	50	0		CDAARO
CC(C)n1c2ccc(N)cc2nc1N1CC[NH2+]CC1	ZINC000075951607	366934790	/nfs/dbraw/zinc/93/47/90/366934790.db2.gz	OPYAKCHHVJSUGI-UHFFFAOYSA-N	1	0	259.357	1.609	50	0		CDAARO
C[C@@H](c1cccnc1)N1CC[NH+](CCCCCO)CC1	ZINC000089910020	366966509	/nfs/dbraw/zinc/96/65/09/366966509.db2.gz	XWLWMRYWRVAXRW-HNNXBMFYSA-N	1	0	277.412	1.923	50	0		CDAARO
CS[C@H]1CN(c2nc(C)cc(C)n2)C[C@H]1[NH+](C)C	ZINC000271098643	366967547	/nfs/dbraw/zinc/96/75/47/366967547.db2.gz	MJAXLAINCZCQHO-NEPJUHHUSA-N	1	0	266.414	1.575	50	0		CDAARO
CC1(C)[C@H]([NH2+]CCOC[C@@H]2CCCO2)[C@H]2CCCO[C@H]21	ZINC000252486257	367574552	/nfs/dbraw/zinc/57/45/52/367574552.db2.gz	HHEAYRIWFSXUAZ-GBJTYRQASA-N	1	0	283.412	1.975	50	0		CDAARO
NC(=O)C[C@@H]1CCC[N@H+](C[C@@H](O)CC2CCCC2)C1	ZINC000252538974	367812093	/nfs/dbraw/zinc/81/20/93/367812093.db2.gz	NOVHDYAIMOKXQK-KBPBESRZSA-N	1	0	268.401	1.515	50	0		CDAARO
O=C(NC1CC[NH+](C2CCCC2)CC1)c1ccc(=O)[nH]c1	ZINC000177446097	372102125	/nfs/dbraw/zinc/10/21/25/372102125.db2.gz	XZUITGMOONNQQT-UHFFFAOYSA-N	1	0	289.379	1.924	50	0		CDAARO
C[NH2+][C@@H](C)C(=O)N1CCC(c2ncncc2C)CC1	ZINC000299769750	372750605	/nfs/dbraw/zinc/75/06/05/372750605.db2.gz	PQKVKQVSSYIGMD-NSHDSACASA-N	1	0	262.357	1.099	50	0		CDAARO
COCCN1C[C@H](C[NH+]2CC(c3nccs3)C2)CC1=O	ZINC000299788447	372761376	/nfs/dbraw/zinc/76/13/76/372761376.db2.gz	SOOJOLOUGAZCLX-NSHDSACASA-N	1	0	295.408	1.037	50	0		CDAARO
CCc1[nH]nc(C(=O)N[C@H]2C[N@@H+](C(C)C)C[C@@H]2OC)c1C	ZINC000299786185	372761642	/nfs/dbraw/zinc/76/16/42/372761642.db2.gz	UERUSXSPRMOWHK-STQMWFEESA-N	1	0	294.399	1.118	50	0		CDAARO
NC(=O)c1cncc(-c2cc3c(c(F)c2)O[C@@H](C[NH3+])C3)c1	ZINC000299794968	372766775	/nfs/dbraw/zinc/76/67/75/372766775.db2.gz	LCMUEBXJGZNRBM-GFCCVEGCSA-N	1	0	287.294	1.249	50	0		CDAARO
CN(CC1([NH+](C)C)CCC1)C(=O)NCCn1ccnc1	ZINC000187818815	372819745	/nfs/dbraw/zinc/81/97/45/372819745.db2.gz	LLYBKBWVODTOED-UHFFFAOYSA-N	1	0	279.388	1.009	50	0		CDAARO
CN(CCc1cccc2ccccc21)C(=O)[C@@H]1C[C@@H](O)C[NH2+]1	ZINC000239722536	189902179	/nfs/dbraw/zinc/90/21/79/189902179.db2.gz	CDDYEFDSBDEFEM-WBVHZDCISA-N	1	0	298.386	1.564	50	0		CDAARO
CCN(CC)S(=O)(=O)c1ccc(N2CC[NH2+]CC2)cc1	ZINC000004245183	373050627	/nfs/dbraw/zinc/05/06/27/373050627.db2.gz	QTZDCDPLNMBSCA-UHFFFAOYSA-N	1	0	297.424	1.127	50	0		CDAARO
Cc1noc(C)c1CN(C)C(=O)[C@H]([NH3+])c1ccccc1	ZINC000037819143	373425559	/nfs/dbraw/zinc/42/55/59/373425559.db2.gz	XBBVVUMRPKEBIV-CQSZACIVSA-N	1	0	273.336	1.950	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)NCC[C@@H]2CC[NH2+]C2)c1	ZINC000104347452	374273826	/nfs/dbraw/zinc/27/38/26/374273826.db2.gz	MAQAUKXRWZFQTH-NSHDSACASA-N	1	0	286.372	1.412	50	0		CDAARO
CC1CC[NH+](CCN(C)C(=O)c2ccnn2C)CC1	ZINC000019795112	374792024	/nfs/dbraw/zinc/79/20/24/374792024.db2.gz	CZDMSUAPQOCARV-UHFFFAOYSA-N	1	0	264.373	1.224	50	0		CDAARO
CS(=O)(=O)Nc1cccc(C[NH+]2CCCC2)c1	ZINC000095348564	374883865	/nfs/dbraw/zinc/88/38/65/374883865.db2.gz	GEFKUXXQQVCOAA-UHFFFAOYSA-N	1	0	254.355	1.654	50	0		CDAARO
c1cnc(N2CCC[N@@H+](Cc3ccncc3)CC2)nc1	ZINC000095431964	374932280	/nfs/dbraw/zinc/93/22/80/374932280.db2.gz	CUKRROBUHYNCIB-UHFFFAOYSA-N	1	0	269.352	1.584	50	0		CDAARO
CC[C@H]([NH2+]C[C@@H]1CC=CCC1)C(=O)N1CCOCC1	ZINC000095434097	374934372	/nfs/dbraw/zinc/93/43/72/374934372.db2.gz	PMHNHCZOSREWDT-KGLIPLIRSA-N	1	0	266.385	1.570	50	0		CDAARO
CC(=O)N1CC[C@@H]([N@@H+]2CCC[C@@H](O)C2)c2ccccc2C1	ZINC000108503521	412832684	/nfs/dbraw/zinc/83/26/84/412832684.db2.gz	VZDSAFWZUINVFB-NVXWUHKLSA-N	1	0	288.391	1.937	50	0		CDAARO
COc1c(CN[C@@H]2CC[N@@H+]3CCCC[C@H]23)c(C)nn1C	ZINC000058297552	375722103	/nfs/dbraw/zinc/72/21/03/375722103.db2.gz	AICHSUINHAWPNB-ZIAGYGMSSA-N	1	0	278.400	1.454	50	0		CDAARO
C[NH+](C)CCNS(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000003442293	375701153	/nfs/dbraw/zinc/70/11/53/375701153.db2.gz	BGANFWHRGUVATE-UHFFFAOYSA-N	1	0	297.207	1.833	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)c1ccncc1Cl	ZINC000122607875	375794218	/nfs/dbraw/zinc/79/42/18/375794218.db2.gz	CYQGMOSGLOZRIW-VIFPVBQESA-N	1	0	253.733	1.559	50	0		CDAARO
C[C@@H]1CCCN(C(=O)/C=C\c2ccccn2)[C@H]1C[NH3+]	ZINC000606441876	375823587	/nfs/dbraw/zinc/82/35/87/375823587.db2.gz	PXLBDFBYEAZJHP-QJPJPVNKSA-N	1	0	259.353	1.681	50	0		CDAARO
O=C(NC[C@]1(O)CCCC[NH2+]C1)OCc1ccccc1	ZINC000261508383	190040252	/nfs/dbraw/zinc/04/02/52/190040252.db2.gz	RVYVRFJILMLBKA-HNNXBMFYSA-N	1	0	278.352	1.417	50	0		CDAARO
C[C@@H]1Cc2ccccc2N(C(=O)[C@@H]2C[NH2+]CCO2)C1	ZINC000105569025	376768586	/nfs/dbraw/zinc/76/85/86/376768586.db2.gz	NLCPQTGQHASCJJ-RISCZKNCSA-N	1	0	260.337	1.200	50	0		CDAARO
CNC(=O)c1cccc(CC[NH2+][C@H]2CCOC[C@H]2C)c1	ZINC000192593826	378208014	/nfs/dbraw/zinc/20/80/14/378208014.db2.gz	PVROWHDGBXUMMR-DOMZBBRYSA-N	1	0	276.380	1.603	50	0		CDAARO
O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)[C@H]1CC[NH2+]C1	ZINC000246498668	379590290	/nfs/dbraw/zinc/59/02/90/379590290.db2.gz	PSAYWRPQHXMARL-RRFJBIMHSA-N	1	0	274.364	1.632	50	0		CDAARO
NC(=O)[C@H]1CCC[N@H+](CCn2ccnc2-c2ccncc2)C1	ZINC000071776772	379635817	/nfs/dbraw/zinc/63/58/17/379635817.db2.gz	ILALBXOWVXCAIK-AWEZNQCLSA-N	1	0	299.378	1.142	50	0		CDAARO
O=C(NCc1ccoc1)[C@H]1CCC[N@@H+](C2CCOCC2)C1	ZINC000097655454	256890153	/nfs/dbraw/zinc/89/01/53/256890153.db2.gz	FYWFMAVFCLTDLE-AWEZNQCLSA-N	1	0	292.379	1.787	50	0		CDAARO
COCC[NH2+][C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000008698509	260032877	/nfs/dbraw/zinc/03/28/77/260032877.db2.gz	KUBIWWTWZPYRIV-LLVKDONJSA-N	1	0	258.362	1.622	50	0		CDAARO
Cn1cc(N2CCC[C@H]([NH2+]C3CCOCC3)C2)cn1	ZINC000095402999	184967584	/nfs/dbraw/zinc/96/75/84/184967584.db2.gz	KPZWDABQOGJIQR-ZDUSSCGKSA-N	1	0	264.373	1.158	50	0		CDAARO
COC(=O)CCCN1CCc2ccccc2[C@H]1C(N)=O	ZINC000096409565	390508130	/nfs/dbraw/zinc/50/81/30/390508130.db2.gz	BSJBZARCDVLPDX-AWEZNQCLSA-N	1	0	276.336	1.024	50	0		CDAARO
COc1c(CN2CCCC[C@@H]2C2OCCO2)c(C)nn1C	ZINC000092937144	390508641	/nfs/dbraw/zinc/50/86/41/390508641.db2.gz	FAODYQCOJMXQTD-CYBMUJFWSA-N	1	0	295.383	1.465	50	0		CDAARO
Oc1cccc(C[N@@H+]2CC[C@H]3OCc4cnnn4[C@H]3C2)c1	ZINC000299772983	285391749	/nfs/dbraw/zinc/39/17/49/285391749.db2.gz	BIMAUWSKPMPVMK-LSDHHAIUSA-N	1	0	286.335	1.330	50	0		CDAARO
COCCN(Cc1ccc(C)s1)C[C@@]1(O)CC[NH2+]C1	ZINC000077407621	390810318	/nfs/dbraw/zinc/81/03/18/390810318.db2.gz	GPNVOLGOMSEJJI-CQSZACIVSA-N	1	0	284.425	1.229	50	0		CDAARO
C[C@H]1CCCN(C(=O)c2ccnc(-n3ccnc3)c2)[C@H]1C[NH3+]	ZINC000179226533	390945844	/nfs/dbraw/zinc/94/58/44/390945844.db2.gz	HARKAPMUXJLUDN-JSGCOSHPSA-N	1	0	299.378	1.467	50	0		CDAARO
COc1cccc(F)c1C(=O)N1C[C@@H]2CC[N@H+](C)[C@@H]2C1	ZINC000222735745	533563636	/nfs/dbraw/zinc/56/36/36/533563636.db2.gz	VITVFAIITAWWTK-CMPLNLGQSA-N	1	0	278.327	1.610	50	0		CDAARO
CC(C)c1n[nH]c2c1CN(C(=O)[C@H](C)[NH+](C)C)CC2	ZINC000426697337	391860060	/nfs/dbraw/zinc/86/00/60/391860060.db2.gz	LZZAKKPIYBCVDN-JTQLQIEISA-N	1	0	264.373	1.368	50	0		CDAARO
COc1ccc(CCC(=O)N2CC[C@H]([NH3+])C2)cc1F	ZINC000257661035	131145667	/nfs/dbraw/zinc/14/56/67/131145667.db2.gz	DGSKKSJGTMUJCT-NSHDSACASA-N	1	0	266.316	1.327	50	0		CDAARO
C[NH2+]C[C@@H](C)C(=O)NC[C@H](O)c1ccccc1C	ZINC000262674924	131249770	/nfs/dbraw/zinc/24/97/70/131249770.db2.gz	TWGKNRHVDBBDJD-YPMHNXCESA-N	1	0	250.342	1.000	50	0		CDAARO
COCCNC(=O)[C@H]1CC[C@@H](C)[N@H+](Cc2cccnc2)C1	ZINC000096403441	393178198	/nfs/dbraw/zinc/17/81/98/393178198.db2.gz	HRAOFMBZFWIFNZ-HIFRSBDPSA-N	1	0	291.395	1.445	50	0		CDAARO
CC[C@@H]1CN(c2nccc(-c3cnn(C)c3)n2)CC[N@@H+]1C	ZINC000082039334	135004765	/nfs/dbraw/zinc/00/47/65/135004765.db2.gz	UOUBWACEMQUPLL-CYBMUJFWSA-N	1	0	286.383	1.408	50	0		CDAARO
COC(=O)c1ccc(N2CC[NH2+]CC2)c(Cl)c1	ZINC000090513330	135063456	/nfs/dbraw/zinc/06/34/56/135063456.db2.gz	YXNWWDUBAHLVBO-UHFFFAOYSA-N	1	0	254.717	1.536	50	0		CDAARO
Cc1c[nH+]ccc1N1CCC[C@H](C(=O)N2CCOCC2)C1	ZINC000195343191	140153806	/nfs/dbraw/zinc/15/38/06/140153806.db2.gz	RXZGBAFVWCCHEU-AWEZNQCLSA-N	1	0	289.379	1.465	50	0		CDAARO
O=c1cc(C[NH+]2CCCC2)[nH]c2nc(-c3ccccc3)nn21	ZINC000101402339	397790778	/nfs/dbraw/zinc/79/07/78/397790778.db2.gz	ZUNPFYWFZLRDPC-UHFFFAOYSA-N	1	0	295.346	1.680	50	0		CDAARO
C[C@@H]1CCC[C@@H](NC(=O)NC(=O)C[NH+]2CCCC2)[C@H]1C	ZINC000102444997	397857326	/nfs/dbraw/zinc/85/73/26/397857326.db2.gz	PGPHIJIVTGBTSX-FRRDWIJNSA-N	1	0	281.400	1.733	50	0		CDAARO
CCOc1ccc(C(=O)NCC[NH+](C)C)cc1OCC	ZINC000004785035	170016929	/nfs/dbraw/zinc/01/69/29/170016929.db2.gz	CBRGTKDEIBVXOX-UHFFFAOYSA-N	1	0	280.368	1.775	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@H]2CO)c(OC)c1	ZINC000005526761	170108639	/nfs/dbraw/zinc/10/86/39/170108639.db2.gz	NNOLFIOQMYOVJX-LBPRGKRZSA-N	1	0	251.326	1.661	50	0		CDAARO
COc1ccc(C(=O)N2CC[N@@H+]3CCC[C@H]3C2)cc1	ZINC000006006303	170167615	/nfs/dbraw/zinc/16/76/15/170167615.db2.gz	RLLOORQJPCSRPE-ZDUSSCGKSA-N	1	0	260.337	1.615	50	0		CDAARO
COc1ccc(CCNC(=S)NCC[NH+](C)C)cc1	ZINC000006544214	170212112	/nfs/dbraw/zinc/21/21/12/170212112.db2.gz	ADRZRBGQTWCRDZ-UHFFFAOYSA-N	1	0	281.425	1.263	50	0		CDAARO
COC[C@H](C)[NH2+]CC(=O)N1CCc2ccccc2C1	ZINC000007141222	170268385	/nfs/dbraw/zinc/26/83/85/170268385.db2.gz	QAXKMFKUBRLHNZ-LBPRGKRZSA-N	1	0	262.353	1.196	50	0		CDAARO
[NH3+]CCS[C@@H]1CC(=O)N(c2ccc(F)cc2)C1=O	ZINC000019093808	170752222	/nfs/dbraw/zinc/75/22/22/170752222.db2.gz	UOOBWGLMALEZNL-SNVBAGLBSA-N	1	0	268.313	1.150	50	0		CDAARO
O=C(CCc1cccc(Cl)c1)N1CC[NH2+]CC1	ZINC000019684125	170839375	/nfs/dbraw/zinc/83/93/75/170839375.db2.gz	KKKGNLIJQJXXEG-UHFFFAOYSA-N	1	0	252.745	1.704	50	0		CDAARO
CC[NH+]1CCN(CCOc2c(OC)cccc2OC)CC1	ZINC000020389973	171178809	/nfs/dbraw/zinc/17/88/09/171178809.db2.gz	TWIUSRSZWFYZPS-UHFFFAOYSA-N	1	0	294.395	1.720	50	0		CDAARO
CCOC(=O)C[C@@H]([NH3+])c1ccc(OC)cc1OC	ZINC000020577691	171256393	/nfs/dbraw/zinc/25/63/93/171256393.db2.gz	YHMYNMWFMVQBGH-LLVKDONJSA-N	1	0	253.298	1.657	50	0		CDAARO
COc1ccc(-c2noc(C3C[NH2+]C3)n2)cc1OC	ZINC000048981069	175457167	/nfs/dbraw/zinc/45/71/67/175457167.db2.gz	DACSZNXCOKUIDS-UHFFFAOYSA-N	1	0	261.281	1.441	50	0		CDAARO
c1c(N2CCC[NH2+]CC2)n[nH]c1-c1ccc2c(c1)OCO2	ZINC000067225300	175771057	/nfs/dbraw/zinc/77/10/57/175771057.db2.gz	LTDXYTMRJAQZIM-UHFFFAOYSA-N	1	0	286.335	1.605	50	0		CDAARO
CCO[C@H]1COC[C@@H]1NC(=O)C1([NH+]2CCCC2)CCCC1	ZINC000067688674	175784167	/nfs/dbraw/zinc/78/41/67/175784167.db2.gz	CECYZJALJJFKIL-KBPBESRZSA-N	1	0	296.411	1.315	50	0		CDAARO
Cc1cnc(C)c(N2CC[C@@](O)(C[NH+]3CCCCC3)C2)n1	ZINC000077338954	177253886	/nfs/dbraw/zinc/25/38/86/177253886.db2.gz	HZTPGULOEUNWBK-MRXNPFEDSA-N	1	0	290.411	1.521	50	0		CDAARO
O[C@]1(C[NH+]2CCCC2)CCCN(Cc2ccncc2)C1	ZINC000077503375	177275919	/nfs/dbraw/zinc/27/59/19/177275919.db2.gz	FFFMWUUHAIPIQT-INIZCTEOSA-N	1	0	275.396	1.504	50	0		CDAARO
CC(=O)c1cccc(C(=O)N2C[C@H]([NH+](C)C)C[C@H]2CO)c1	ZINC000065527719	273497179	/nfs/dbraw/zinc/49/71/79/273497179.db2.gz	DGFZEZYHRSZMIB-CABCVRRESA-N	1	0	290.363	1.026	50	0		CDAARO
CC1(C)CN(c2nc(N)[nH+]c3c2CCC3)CC[C@]1(C)O	ZINC000091518933	276136392	/nfs/dbraw/zinc/13/63/92/276136392.db2.gz	GFRMAPIZTGTXCP-HNNXBMFYSA-N	1	0	276.384	1.535	50	0		CDAARO
CS(=O)(=O)c1ccc(N2CCC[NH2+]CC2)c(Cl)c1	ZINC000015443327	278119713	/nfs/dbraw/zinc/11/97/13/278119713.db2.gz	SBFZEJFDXLDWOL-UHFFFAOYSA-N	1	0	288.800	1.543	50	0		CDAARO
C[C@H](C(=O)NC1CCC(C)CC1)[N@@H+]1C[C@@H](C)[C@H](C(N)=O)C1	ZINC000408046763	278150249	/nfs/dbraw/zinc/15/02/49/278150249.db2.gz	DLRBKIMNHLXFPN-QNOVJUQQSA-N	1	0	295.427	1.123	50	0		CDAARO
Cc1ccc(CN(C)[C@@H]2CCN(c3cnn(C)c3)C2=O)o1	ZINC000111193124	279320788	/nfs/dbraw/zinc/32/07/88/279320788.db2.gz	FORILFBSMYKWBX-CQSZACIVSA-N	1	0	288.351	1.559	50	0		CDAARO
CC(C)N(C)C(=O)[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1CO	ZINC000125117873	279344904	/nfs/dbraw/zinc/34/49/04/279344904.db2.gz	HTSJNNVPSBIAJK-YNEHKIRRSA-N	1	0	256.390	1.382	50	0		CDAARO
Nc1ccc2c(c1)CCC[C@@H]2NC(=O)[C@@H]1CC[C@@H]([NH3+])C1	ZINC000263097172	279700378	/nfs/dbraw/zinc/70/03/78/279700378.db2.gz	NRZSMYVWLJKDBD-JMSVASOKSA-N	1	0	273.380	1.890	50	0		CDAARO
CN(C)CC[NH2+][C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000022798640	289165226	/nfs/dbraw/zinc/16/52/26/289165226.db2.gz	JAPWWRPJNWOXFE-LBPRGKRZSA-N	1	0	271.405	1.537	50	0		CDAARO
C[N@@H+]1CCc2c(sc(N)c2C(=O)N2CCCC2)C1	ZINC000009246204	290252814	/nfs/dbraw/zinc/25/28/14/290252814.db2.gz	SULDGJBEPBCXQB-UHFFFAOYSA-N	1	0	265.382	1.554	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2CC[NH3+])cc1	ZINC000020182095	301663962	/nfs/dbraw/zinc/66/39/62/301663962.db2.gz	MQIWDYXSVKGMOG-CYBMUJFWSA-N	1	0	282.409	1.887	50	0		CDAARO
Cn1cnnc1C1CC[NH+](C[C@@H]2CCCOC2)CC1	ZINC000252510275	328106023	/nfs/dbraw/zinc/10/60/23/328106023.db2.gz	ZFXUVALOFJFEEO-LBPRGKRZSA-N	1	0	264.373	1.421	50	0		CDAARO
C[NH+](C)C[C@H](O)CNc1ccc2cc(Cl)ccc2n1	ZINC000534580335	328311499	/nfs/dbraw/zinc/31/14/99/328311499.db2.gz	AAWSOJWYBMPHMM-GFCCVEGCSA-N	1	0	279.771	1.645	50	0		CDAARO
[NH3+]CC[C@H]1CN(Cc2ccc(C(F)(F)F)nc2)CCO1	ZINC000534591374	328318345	/nfs/dbraw/zinc/31/83/45/328318345.db2.gz	ZRWMUVGQOKYMNO-NSHDSACASA-N	1	0	289.301	1.650	50	0		CDAARO
CCC[C@@H](CNC(=O)c1ccc(O)c(F)c1)[NH+](C)C	ZINC000534641464	328336222	/nfs/dbraw/zinc/33/62/22/328336222.db2.gz	VAFOAITXVSSQPX-NSHDSACASA-N	1	0	268.332	1.991	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1C1CN(C(=O)NCCc2ncc[nH]2)C1	ZINC000534659530	328342215	/nfs/dbraw/zinc/34/22/15/328342215.db2.gz	HOLHRQPAQGHXLL-LBPRGKRZSA-N	1	0	291.399	1.220	50	0		CDAARO
Fc1cnc(NC[C@@H]2CC[N@@H+](C3CCCC3)C2)nc1	ZINC000534648186	328343268	/nfs/dbraw/zinc/34/32/68/328343268.db2.gz	HKAYIDQVMCDHEO-NSHDSACASA-N	1	0	264.348	1.714	50	0		CDAARO
Cc1ccc(C)c(S(=O)(=O)NCC[C@@H]2CC[NH2+]C2)c1	ZINC000110797856	533706784	/nfs/dbraw/zinc/70/67/84/533706784.db2.gz	ZVPVBJSXOWFXDW-ZDUSSCGKSA-N	1	0	282.409	1.581	50	0		CDAARO
Cc1nc(N2C[C@@H]3C[NH2+]C[C@]3(CO)C2)ccc1Cl	ZINC001772703865	1159439337	/nfs/dbraw/zinc/43/93/37/1159439337.db2.gz	KAMZGNHCTSXCMH-GXFFZTMASA-N	1	0	267.760	1.062	50	0		CDAARO
COc1ccc(OCCC[N@H+]2C[C@@H]3[C@H](O)C[C@@H]3C2)cc1	ZINC001772711792	1159445263	/nfs/dbraw/zinc/44/52/63/1159445263.db2.gz	KFIUFLVVAFNNMC-UHOFOFEASA-N	1	0	277.364	1.777	50	0		CDAARO
NC(=O)[C@@H]1C[C@@H](O)C[N@@H+]1CCCc1cccc2ccccc21	ZINC000108083112	482449455	/nfs/dbraw/zinc/44/94/55/482449455.db2.gz	GCVWIEJGEDUPJV-WBVHZDCISA-N	1	0	298.386	1.693	50	0		CDAARO
C[C@H]1OCC[C@H]1[NH2+]Cc1cccc(OCC(F)F)n1	ZINC000090971906	482522392	/nfs/dbraw/zinc/52/23/92/482522392.db2.gz	ZDXAWNDSQMAVNP-MWLCHTKSSA-N	1	0	272.295	1.993	50	0		CDAARO
C[C@H]([NH2+]C[C@H]1CCCC[C@@H]1O)C(=O)NC1CCCC1	ZINC000085986683	482682057	/nfs/dbraw/zinc/68/20/57/482682057.db2.gz	GXSYBPZPJKRURR-SCRDCRAPSA-N	1	0	268.401	1.574	50	0		CDAARO
CCc1nccn1CCC(=O)N[C@@H]1CCc2c[nH]nc2C1	ZINC000670434571	482970703	/nfs/dbraw/zinc/97/07/03/482970703.db2.gz	XMLHMPYHBNTQEH-GFCCVEGCSA-N	1	0	287.367	1.232	50	0		CDAARO
Cc1cc(C)n(-c2ccccc2CN2CCCNC(=O)C2)n1	ZINC000670438009	482980681	/nfs/dbraw/zinc/98/06/81/482980681.db2.gz	PLCFSWAWAAPKHL-UHFFFAOYSA-N	1	0	298.390	1.811	50	0		CDAARO
CN(C)C(=O)c1cncc(NC[C@H]2CCCC[N@@H+]2C)n1	ZINC000670445956	482994684	/nfs/dbraw/zinc/99/46/84/482994684.db2.gz	RBHVIKAZKUQLBR-LLVKDONJSA-N	1	0	277.372	1.075	50	0		CDAARO
CCCOC[C@H]1CC[N@H+](CCN2CCCC2=O)C1	ZINC000670460677	483042282	/nfs/dbraw/zinc/04/22/82/483042282.db2.gz	HMQDHQRUFFZFRN-ZDUSSCGKSA-N	1	0	254.374	1.357	50	0		CDAARO
O=C(N[C@@H]1CC[N@H+](CC2CC2)C1)N1CC[C@@]2(CCOC2)C1	ZINC000674924364	483189075	/nfs/dbraw/zinc/18/90/75/483189075.db2.gz	FOSYVWHOJMLFFT-GDBMZVCRSA-N	1	0	293.411	1.293	50	0		CDAARO
CC(C)(C[NH2+]Cc1cccc2c[nH]nc21)S(C)(=O)=O	ZINC000084050637	483236259	/nfs/dbraw/zinc/23/62/59/483236259.db2.gz	ZVJXZYNNXPXTHU-UHFFFAOYSA-N	1	0	281.381	1.476	50	0		CDAARO
CN1CCC[N@@H+]([C@@H]2CCN(c3ccccc3)C2)CC1	ZINC001506426413	1160723007	/nfs/dbraw/zinc/72/30/07/1160723007.db2.gz	GSNOIJCWWSGGME-MRXNPFEDSA-N	1	0	259.397	1.903	50	0		CDAARO
Cc1nc(CSc2nnc([C@@H]3CCC[NH2+]C3)n2C)co1	ZINC000426668234	534404507	/nfs/dbraw/zinc/40/45/07/534404507.db2.gz	FDNZKMHESAUCOI-SNVBAGLBSA-N	1	0	293.396	1.871	50	0		CDAARO
CC(C)Oc1cccnc1C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179095110	519784868	/nfs/dbraw/zinc/78/48/68/519784868.db2.gz	ICUGBTBNLLCMLG-NSHDSACASA-N	1	0	263.341	1.303	50	0		CDAARO
Cc1ccccc1C1(C(=O)N2CC[C@@H](C[NH3+])C2)CC1	ZINC000178522476	525074171	/nfs/dbraw/zinc/07/41/71/525074171.db2.gz	NCGMJYDZYLEGDQ-ZDUSSCGKSA-N	1	0	258.365	1.834	50	0		CDAARO
O=C(NCCCOC1CCCCC1)[C@H]1CCC[NH2+]C1	ZINC000040829771	527683166	/nfs/dbraw/zinc/68/31/66/527683166.db2.gz	FRCHQWMTPAZAKN-ZDUSSCGKSA-N	1	0	268.401	1.842	50	0		CDAARO
C[N@@H+]1CCO[C@@H]2CCN(c3ccncc3Cl)C[C@@H]21	ZINC000285130100	567905191	/nfs/dbraw/zinc/90/51/91/567905191.db2.gz	SANOBTUFOWEENW-QWHCGFSZSA-N	1	0	267.760	1.644	50	0		CDAARO
CC[C@H](Cn1ccnc1)[NH2+]Cc1ccc(OC)nc1	ZINC000952975513	615751490	/nfs/dbraw/zinc/75/14/90/615751490.db2.gz	FKSHGLICJVCPRG-CYBMUJFWSA-N	1	0	260.341	1.855	50	0		CDAARO
C[NH2+]CC(=O)Nc1cc2sc(N)nc2c(C)c1	ZINC000952982379	616937311	/nfs/dbraw/zinc/93/73/11/616937311.db2.gz	LFZRUTIIUSTIMJ-UHFFFAOYSA-N	1	0	250.327	1.345	50	0		CDAARO
C[NH2+]Cc1nc(COc2cccc(Cl)c2)nn1CCO	ZINC000952969527	617004197	/nfs/dbraw/zinc/00/41/97/617004197.db2.gz	BPAWKUORZIOULV-UHFFFAOYSA-N	1	0	296.758	1.222	50	0		CDAARO
Cc1cc(N)nc(N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)[nH+]1	ZINC000871101503	630805470	/nfs/dbraw/zinc/80/54/70/630805470.db2.gz	QMUKOCGIVORDSO-MVWJERBFSA-N	1	0	260.341	1.737	50	0		CDAARO
O=C(CC[NH2+]C1CC1)NC[C@@H](O)c1ccc(F)cc1	ZINC000848395390	631001830	/nfs/dbraw/zinc/00/18/30/631001830.db2.gz	FOLHXNUWNLWDPB-CYBMUJFWSA-N	1	0	266.316	1.117	50	0		CDAARO
Cc1nc[nH]c1CN(CC[NH+](C)C)C(=O)[C@@H]1CC=CCC1	ZINC001704312299	1177684077	/nfs/dbraw/zinc/68/40/77/1177684077.db2.gz	OYFNXQMOIAZFJQ-CQSZACIVSA-N	1	0	290.411	1.965	50	0		CDAARO
c1ncn(CC[N@@H+]2CCC[C@@H](OCc3ccccn3)C2)n1	ZINC001704355535	1177699128	/nfs/dbraw/zinc/69/91/28/1177699128.db2.gz	PZCXSVRGLMPMIR-OAHLLOKOSA-N	1	0	287.367	1.354	50	0		CDAARO
Cn1cccc1C(=O)N[C@H]1COC[C@@H]1[NH+]1CCCCC1	ZINC001704355176	1177699760	/nfs/dbraw/zinc/69/97/60/1177699760.db2.gz	MOZDARKOYZTYKS-JSGCOSHPSA-N	1	0	277.368	1.008	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](CNC(=O)c2ccn(CC)n2)C1	ZINC000067689296	833218911	/nfs/dbraw/zinc/21/89/11/833218911.db2.gz	WDLIFWIMYSPGKX-ZDUSSCGKSA-N	1	0	278.400	1.755	50	0		CDAARO
C[C@]1(CNC(=O)c2cn[nH]n2)CCC[N@@H+]1Cc1ccccc1	ZINC000188257059	833287953	/nfs/dbraw/zinc/28/79/53/833287953.db2.gz	OXZGTTGRDOCUCC-MRXNPFEDSA-N	1	0	299.378	1.589	50	0		CDAARO
[NH3+]C[C@@H]1CCN(Cc2cnc(-c3ccccn3)nc2)C1	ZINC000067982054	833310069	/nfs/dbraw/zinc/31/00/69/833310069.db2.gz	LIIGSTKTQLUFEX-LBPRGKRZSA-N	1	0	269.352	1.319	50	0		CDAARO
COc1cc(C[NH2+]CC2OCCCO2)cc(OC)c1	ZINC000716403868	828861251	/nfs/dbraw/zinc/86/12/51/828861251.db2.gz	DACTYVWPGRQYLR-UHFFFAOYSA-N	1	0	267.325	1.556	50	0		CDAARO
CN(C)c1ncccc1CNC(=O)C[NH+]1CCCCC1	ZINC000012577698	829402432	/nfs/dbraw/zinc/40/24/32/829402432.db2.gz	RCATVLHEFBOCSG-UHFFFAOYSA-N	1	0	276.384	1.250	50	0		CDAARO
CCCc1nc(C)cc(N2CCOC[C@@H](C[NH+](C)C)C2)n1	ZINC000072140046	829824635	/nfs/dbraw/zinc/82/46/35/829824635.db2.gz	CMYRELXECXRAIA-AWEZNQCLSA-N	1	0	292.427	1.752	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CN(C)CC1(CO)CCCC1	ZINC000092672537	829825157	/nfs/dbraw/zinc/82/51/57/829825157.db2.gz	XYLPKQVYOPPDKW-AWEZNQCLSA-N	1	0	254.418	1.955	50	0		CDAARO
C[C@H]1CCC[C@H]([NH+]2CCN(CCOCCO)CC2)C1	ZINC000019635967	830535585	/nfs/dbraw/zinc/53/55/85/830535585.db2.gz	HZSLFDRTPGGPNO-GJZGRUSLSA-N	1	0	270.417	1.192	50	0		CDAARO
[NH3+]C[C@@H]1CN(C[C@@H](O)C(F)(F)F)C[C@H]1c1ccccc1	ZINC000381295099	830684599	/nfs/dbraw/zinc/68/45/99/830684599.db2.gz	KZHBSTWDZQNFBX-FRRDWIJNSA-N	1	0	288.313	1.584	50	0		CDAARO
C[NH+]1CCC(Nc2ccccc2-n2cnnn2)CC1	ZINC000032592896	830760259	/nfs/dbraw/zinc/76/02/59/830760259.db2.gz	DVOAAIFGSHHRHD-UHFFFAOYSA-N	1	0	258.329	1.168	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1CCNc1ncc(Cl)cn1	ZINC000952968735	833832513	/nfs/dbraw/zinc/83/25/13/833832513.db2.gz	DBJGIJJCNMQRPF-LLVKDONJSA-N	1	0	270.764	1.389	50	0		CDAARO
Cc1nc(CN2CCC[C@@](O)(C[NH+](C)C)CC2)cs1	ZINC000072128069	832812567	/nfs/dbraw/zinc/81/25/67/832812567.db2.gz	CNSAJHZRHXMHPQ-AWEZNQCLSA-N	1	0	283.441	1.730	50	0		CDAARO
CC[N@@H+]1CCC[C@@](C)(C[NH+]2CCC[C@@H](CO)C2)C1	ZINC000020539774	834060741	/nfs/dbraw/zinc/06/07/41/834060741.db2.gz	XJCQVGGYQAVAFX-HUUCEWRRSA-N	1	0	254.418	1.813	50	0		CDAARO
Cc1ncc2c(c1-c1noc(-c3c[nH]cn3)n1)CC[NH2+]C2	ZINC000020202785	834064504	/nfs/dbraw/zinc/06/45/04/834064504.db2.gz	WTHIZEIKTKHONN-UHFFFAOYSA-N	1	0	282.307	1.476	50	0		CDAARO
COC(=O)c1ccc(N2CCO[C@H](CC[NH+](C)C)C2)nc1	ZINC000039460767	834098593	/nfs/dbraw/zinc/09/85/93/834098593.db2.gz	PJPVGYXFEQOKKQ-CYBMUJFWSA-N	1	0	293.367	1.025	50	0		CDAARO
O=C1CC[C@@H](C[N@@H+]2CCCN(c3ccccc3)CC2)O1	ZINC000821363143	834999113	/nfs/dbraw/zinc/99/91/13/834999113.db2.gz	UHURKNWFGNTXBR-HNNXBMFYSA-N	1	0	274.364	1.904	50	0		CDAARO
C[C@@]12C[C@@H](CC(C)(C)C1)[N@H+](CCCn1cnnn1)C2	ZINC000252500699	835609727	/nfs/dbraw/zinc/60/97/27/835609727.db2.gz	TUGLAPPVNUWDOJ-TZMCWYRMSA-N	1	0	263.389	1.964	50	0		CDAARO
Cc1nc(CO[C@H]2CCC[N@@H+](C3CCOCC3)C2)no1	ZINC000675017735	899871092	/nfs/dbraw/zinc/87/10/92/899871092.db2.gz	YKOLODHCQPMEFI-ZDUSSCGKSA-N	1	0	281.356	1.538	50	0		CDAARO
CC[C@H](CO)N(Cc1ccccn1)C(=O)C1([NH3+])CCCC1	ZINC000952869235	910419768	/nfs/dbraw/zinc/41/97/68/910419768.db2.gz	YVPHZGSREINQHT-CQSZACIVSA-N	1	0	291.395	1.453	50	0		CDAARO
CNc1nc(NC[C@H]2CCC[N@H+](C)C2)ncc1F	ZINC000824090552	925799379	/nfs/dbraw/zinc/79/93/79/925799379.db2.gz	YJUSBXSETHPLDN-SECBINFHSA-N	1	0	253.325	1.411	50	0		CDAARO
Cc1noc([C@H]2C[N@@H+](C[C@H]3CCCOCC3)CCN2C)n1	ZINC000585117579	930985691	/nfs/dbraw/zinc/98/56/91/930985691.db2.gz	MADCIYZAVFVIPT-UONOGXRCSA-N	1	0	294.399	1.483	50	0		CDAARO
Cc1nccn1CCC[N@@H+](C)[C@@H](C)Cc1cnccn1	ZINC000243957107	937588809	/nfs/dbraw/zinc/58/88/09/937588809.db2.gz	CFUJSFQODVUYIW-ZDUSSCGKSA-N	1	0	273.384	1.935	50	0		CDAARO
Cn1ccnc1C[NH2+][C@H](Cn1ccnc1)C(C)(C)C	ZINC000051923385	936174872	/nfs/dbraw/zinc/17/48/72/936174872.db2.gz	ZRNYGKGQMUASFR-GFCCVEGCSA-N	1	0	261.373	1.821	50	0		CDAARO
Cc1cnc(C)c(NCC[N@@H+]2CCC[C@H](CO)C2)n1	ZINC001529112899	968983555	/nfs/dbraw/zinc/98/35/55/968983555.db2.gz	VFFZWRJWNKTUBX-ZDUSSCGKSA-N	1	0	264.373	1.210	50	0		CDAARO
CCn1cncc1C[NH2+][C@H](C)Cn1nc(C)cc1C	ZINC001506403342	975150514	/nfs/dbraw/zinc/15/05/14/975150514.db2.gz	TVLPIPNENNKBPS-GFCCVEGCSA-N	1	0	261.373	1.895	50	0		CDAARO
CCC(CC)(CO)C[N@H+](C)Cc1cc(=O)[nH]c(C)n1	ZINC001506410000	975153386	/nfs/dbraw/zinc/15/33/86/975153386.db2.gz	CCZFGWAXAFQFHK-UHFFFAOYSA-N	1	0	267.373	1.721	50	0		CDAARO
C[C@@H](CN(C)C(=O)Cn1ccc(=O)cc1)C[NH+]1CCCC1	ZINC001506414880	975155328	/nfs/dbraw/zinc/15/53/28/975155328.db2.gz	IULMDQCYCVVFJR-AWEZNQCLSA-N	1	0	291.395	1.039	50	0		CDAARO
O=C(NCc1ccccn1)NC1CC[NH+](CC2CC2)CC1	ZINC000193596250	342474477	/nfs/dbraw/zinc/47/44/77/342474477.db2.gz	PKBKVQAYTCQUQZ-UHFFFAOYSA-N	1	0	288.395	1.755	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1n1cnc2cccc(C)c2c1=O	ZINC000584901171	341986729	/nfs/dbraw/zinc/98/67/29/341986729.db2.gz	UMXHCLOEMVZXLD-KBPBESRZSA-N	1	0	287.363	1.597	50	0		CDAARO
c1ccc([C@H](C[NH2+]C2CCOCC2)N2CCOCC2)nc1	ZINC000584902475	341986951	/nfs/dbraw/zinc/98/69/51/341986951.db2.gz	WFIQHEVLQFBEDU-INIZCTEOSA-N	1	0	291.395	1.224	50	0		CDAARO
CCOCC(=O)NCC1([NH+]2CCCC2)CCCC1	ZINC000584890226	341999266	/nfs/dbraw/zinc/99/92/66/341999266.db2.gz	AEOURRBEBHVZSX-UHFFFAOYSA-N	1	0	254.374	1.548	50	0		CDAARO
O=C(N[C@@H]1CCCCC[C@@H]1CO)[C@@H](C1CC1)[NH+]1CCCC1	ZINC000097376493	342002898	/nfs/dbraw/zinc/00/28/98/342002898.db2.gz	CHNYRCKKQZMMEE-BZUAXINKSA-N	1	0	294.439	1.918	50	0		CDAARO
CS(=O)(=O)C[C@@H]([NH2+]C[C@@H]1CCCOC1)c1ccccc1	ZINC000095985960	185056248	/nfs/dbraw/zinc/05/62/48/185056248.db2.gz	XJSGQGLYBXNZDK-DZGCQCFKSA-N	1	0	297.420	1.789	50	0		CDAARO
COc1ccc([C@H](C)[C@H](C)[NH2+]CC(=O)N(C)C)cc1	ZINC000095992478	185059696	/nfs/dbraw/zinc/05/96/96/185059696.db2.gz	RBAYOGULEQENAE-NEPJUHHUSA-N	1	0	264.369	1.865	50	0		CDAARO
CCOCC[NH2+][C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000309737746	342024169	/nfs/dbraw/zinc/02/41/69/342024169.db2.gz	RBLKKLHZIBIXSO-WDEREUQCSA-N	1	0	260.378	1.914	50	0		CDAARO
C[C@@H]1CC[NH2+]C[C@@H]1NS(=O)(=O)CCc1cccs1	ZINC000241277708	361752149	/nfs/dbraw/zinc/75/21/49/361752149.db2.gz	LILLJUFVGRCLPS-PWSUYJOCSA-N	1	0	288.438	1.208	50	0		CDAARO
OCCOCCN1CC[NH+](C2CCCCCC2)CC1	ZINC000022027704	342088855	/nfs/dbraw/zinc/08/88/55/342088855.db2.gz	IXRKNVDPRDERBK-UHFFFAOYSA-N	1	0	270.417	1.336	50	0		CDAARO
COc1ccccc1OCCOCC[N@H+](C)CCO	ZINC000002980683	342089050	/nfs/dbraw/zinc/08/90/50/342089050.db2.gz	CPDCMNPSNSTRST-UHFFFAOYSA-N	1	0	269.341	1.015	50	0		CDAARO
Cc1ccc2c(c1)nc(CN1CC[NH+](C)CC1)n2C	ZINC000023114590	342089151	/nfs/dbraw/zinc/08/91/51/342089151.db2.gz	GCZXKGFOXFJBLN-UHFFFAOYSA-N	1	0	258.369	1.629	50	0		CDAARO
CC(C)COC[C@@H](C)NC(=O)[C@]1(C)CCCC[NH2+]1	ZINC000195556994	342626644	/nfs/dbraw/zinc/62/66/44/342626644.db2.gz	OHLZHJGMGXSHLZ-OCCSQVGLSA-N	1	0	256.390	1.696	50	0		CDAARO
COCCOC1CCN(C(=O)[C@@H]([NH3+])C(C)(C)C)CC1	ZINC000195543457	342626660	/nfs/dbraw/zinc/62/66/60/342626660.db2.gz	TZDYYXBGGXGJSN-GFCCVEGCSA-N	1	0	272.389	1.014	50	0		CDAARO
CC[C@@H](COc1ccccc1)NC(=O)C[C@H]1C[NH2+]CCO1	ZINC000195543512	342626700	/nfs/dbraw/zinc/62/67/00/342626700.db2.gz	GQGBOMLGJNVUAQ-ZFWWWQNUSA-N	1	0	292.379	1.339	50	0		CDAARO
CN(CCN1CCCC1=O)C(=O)C[C@H]([NH3+])c1ccccc1	ZINC000119160263	342147014	/nfs/dbraw/zinc/14/70/14/342147014.db2.gz	BVAPQLAEEGAQIQ-AWEZNQCLSA-N	1	0	289.379	1.157	50	0		CDAARO
Cc1ncccc1C(=O)NCCCOC1CC[NH+](C)CC1	ZINC000243902106	361830809	/nfs/dbraw/zinc/83/08/09/361830809.db2.gz	BGCLJFLRRZSFFK-UHFFFAOYSA-N	1	0	291.395	1.621	50	0		CDAARO
Nc1cc[nH+]cc1-c1cccc(C(=O)N2CCOCC2)c1	ZINC000244817141	361865421	/nfs/dbraw/zinc/86/54/21/361865421.db2.gz	SUVJCCSAWCJKIJ-UHFFFAOYSA-N	1	0	283.331	1.803	50	0		CDAARO
C[C@H](C(=O)N1CCCC1)[N@H+](C)CCCc1nccn1C	ZINC000244858688	361866438	/nfs/dbraw/zinc/86/64/38/361866438.db2.gz	VQJWZODYRRLCSV-CYBMUJFWSA-N	1	0	278.400	1.295	50	0		CDAARO
C[NH+](C)[C@H]1CCN(Cc2cc(-c3ccncc3)no2)C1	ZINC000244723806	361858488	/nfs/dbraw/zinc/85/84/88/361858488.db2.gz	MHQYJNHTUISLNT-ZDUSSCGKSA-N	1	0	272.352	1.873	50	0		CDAARO
C[NH2+][C@H]1CCN(C(=O)Cc2cc(F)ccc2F)C1	ZINC000097019444	185152799	/nfs/dbraw/zinc/15/27/99/185152799.db2.gz	LYRBPFSAQMGQSU-NSHDSACASA-N	1	0	254.280	1.328	50	0		CDAARO
c1csc(N2CC[NH+](C3CCOCC3)CC2)n1	ZINC000097032583	185155601	/nfs/dbraw/zinc/15/56/01/185155601.db2.gz	OTQOIWBZQGFPAW-UHFFFAOYSA-N	1	0	253.371	1.444	50	0		CDAARO
CC(C)[N@@H+]1CC[C@@H](CNC(=O)N(C)CC2CCOCC2)C1	ZINC000097032340	185156312	/nfs/dbraw/zinc/15/63/12/185156312.db2.gz	IILQQJWNQRGIMR-HNNXBMFYSA-N	1	0	297.443	1.785	50	0		CDAARO
COC(=O)c1cc(C[NH2+][C@@H](C)[C@H]2CCOC2)oc1C	ZINC000097034932	185157413	/nfs/dbraw/zinc/15/74/13/185157413.db2.gz	FYZSMVYYYOBMEO-ONGXEEELSA-N	1	0	267.325	1.889	50	0		CDAARO
C[C@@H]([NH2+]C[C@@H](c1ccco1)N1CCCC1)c1cnnn1C	ZINC000585134844	342215637	/nfs/dbraw/zinc/21/56/37/342215637.db2.gz	LVTGDIZJMGHJQX-OCCSQVGLSA-N	1	0	289.383	1.896	50	0		CDAARO
Cc1cccc(NC(=O)NC[C@@H](C)C[NH+](C)C)n1	ZINC000585140007	342218942	/nfs/dbraw/zinc/21/89/42/342218942.db2.gz	UZJCWENAMACNJU-SNVBAGLBSA-N	1	0	250.346	1.709	50	0		CDAARO
C[C@@H]1CN(C(=O)C2CC2)CC[C@@H]1[NH2+]Cc1ccccn1	ZINC000084714958	342267891	/nfs/dbraw/zinc/26/78/91/342267891.db2.gz	NMODUOCAYMNJCQ-DOMZBBRYSA-N	1	0	273.380	1.818	50	0		CDAARO
O=C([C@H]1CCCCO1)N1CCC[C@@H]1C1CC[NH2+]CC1	ZINC000050960575	539160359	/nfs/dbraw/zinc/16/03/59/539160359.db2.gz	VHSOTTABVGCWHU-ZIAGYGMSSA-N	1	0	266.385	1.546	50	0		CDAARO
CCCC[C@@H](NC1CC[NH+]([C@@H]2CCOC2)CC1)C(=O)OC	ZINC000585091310	362020328	/nfs/dbraw/zinc/02/03/28/362020328.db2.gz	CGCCLUWTGJLQQF-HUUCEWRRSA-N	1	0	298.427	1.561	50	0		CDAARO
COc1c(C[NH+]2CCC(c3cc[nH]n3)CC2)c(C)nn1C	ZINC000092810884	362056745	/nfs/dbraw/zinc/05/67/45/362056745.db2.gz	BIGHDVHZMOUDBP-UHFFFAOYSA-N	1	0	289.383	1.840	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNC(=O)N1CCO[C@H](C)C1	ZINC000078926020	362121325	/nfs/dbraw/zinc/12/13/25/362121325.db2.gz	MJCIFVPKLJUACW-CHWSQXEVSA-N	1	0	269.389	1.291	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CN(C(=O)c2coc3ccccc23)CCO1	ZINC000127892721	187338896	/nfs/dbraw/zinc/33/88/96/187338896.db2.gz	VKYPVMHZMBIJJK-QMTHXVAHSA-N	1	0	274.320	1.621	50	0		CDAARO
COc1cc(C)c(C(=O)N2CC[C@H](C[NH3+])C2)cc1OC	ZINC000178573306	362246909	/nfs/dbraw/zinc/24/69/09/362246909.db2.gz	CQOOOVPGEPEKAU-LLVKDONJSA-N	1	0	278.352	1.433	50	0		CDAARO
COc1cc(C)c(C(=O)N(C)[C@H]2CC[NH2+]C2)cc1OC	ZINC000179104999	362252286	/nfs/dbraw/zinc/25/22/86/362252286.db2.gz	SAFZLCBRLFPQAU-NSHDSACASA-N	1	0	278.352	1.446	50	0		CDAARO
O=C1C[C@H]([NH2+]C2CCOCC2)CN1CC1CCCCC1	ZINC000015066192	362253133	/nfs/dbraw/zinc/25/31/33/362253133.db2.gz	YUZGGZSYSMCLHV-HNNXBMFYSA-N	1	0	280.412	1.936	50	0		CDAARO
Cc1ccc(OCC(=O)N(C)[C@@H]2CC[NH2+]C2)c(C)c1	ZINC000179097433	362253473	/nfs/dbraw/zinc/25/34/73/362253473.db2.gz	HUOFNQVXHBTXQU-CYBMUJFWSA-N	1	0	262.353	1.503	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCCNC(=O)c2ccc[nH]2)C[C@H](C)O1	ZINC000084706212	362273145	/nfs/dbraw/zinc/27/31/45/362273145.db2.gz	MREYJXGIKIZAGY-BETUJISGSA-N	1	0	279.384	1.634	50	0		CDAARO
Cc1cc(C(=O)N2CCC[C@@H]([NH3+])C2)nn1C(C)(C)C	ZINC000191342289	362419979	/nfs/dbraw/zinc/41/99/79/362419979.db2.gz	DAJGOYDFOVMDNV-LLVKDONJSA-N	1	0	264.373	1.510	50	0		CDAARO
Cc1cnc(C[NH+]2CCC(c3cc[nH]n3)CC2)cn1	ZINC000332460443	362540957	/nfs/dbraw/zinc/54/09/57/362540957.db2.gz	PYWKCBYEKWMGGC-UHFFFAOYSA-N	1	0	257.341	1.888	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@H](C[NH2+][C@@H]2CCOC2)C1	ZINC000097372193	185590679	/nfs/dbraw/zinc/59/06/79/185590679.db2.gz	XAUVDQSSGQNPCX-VXGBXAGGSA-N	1	0	270.373	1.622	50	0		CDAARO
C[C@@H]1CCC[NH2+][C@H]1CNC(=O)CCC(F)(F)F	ZINC000088833033	346100056	/nfs/dbraw/zinc/10/00/56/346100056.db2.gz	VESGOPWVXBZQEY-BDAKNGLRSA-N	1	0	252.280	1.833	50	0		CDAARO
CN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1CCC[C@@H]1[NH3+]	ZINC000085367100	179036985	/nfs/dbraw/zinc/03/69/85/179036985.db2.gz	PJSQJAKAYULGMC-NEPJUHHUSA-N	1	0	276.336	1.501	50	0		CDAARO
CN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1CCC[C@H]1[NH3+]	ZINC000085367106	179037140	/nfs/dbraw/zinc/03/71/40/179037140.db2.gz	PJSQJAKAYULGMC-VXGBXAGGSA-N	1	0	276.336	1.501	50	0		CDAARO
CC(C)(C[N@@H+]1CC(C)(C)[C@@](C)(O)C1)N1CCOCC1	ZINC000091486890	482568152	/nfs/dbraw/zinc/56/81/52/482568152.db2.gz	KDFRTGCALHAKRO-HNNXBMFYSA-N	1	0	270.417	1.190	50	0		CDAARO
CCOc1ccc(CCNC(=O)[C@H]2[C@@H]3C[NH2+]C[C@@H]32)cc1	ZINC000101775414	185758276	/nfs/dbraw/zinc/75/82/76/185758276.db2.gz	XXVJQIVEVJITIA-FICVDOATSA-N	1	0	274.364	1.209	50	0		CDAARO
CN1C=C(C(=O)NCCC[NH+](C)C)C=C/C1=C\N=O	ZINC000136471126	348750548	/nfs/dbraw/zinc/75/05/48/348750548.db2.gz	GYIDKOGHDPYABU-FMIVXFBMSA-N	1	0	264.329	1.048	50	0		CDAARO
COc1cccc2c1OC[C@H]([NH2+][C@H]1C[C@H](C)N(C)C1)C2	ZINC000089920314	179883099	/nfs/dbraw/zinc/88/30/99/179883099.db2.gz	RMMRYJGOFAFSJB-FPMFFAJLSA-N	1	0	276.380	1.681	50	0		CDAARO
COCCn1cncc1C[NH2+][C@@H](C)CC(F)(F)F	ZINC000584893589	349353241	/nfs/dbraw/zinc/35/32/41/349353241.db2.gz	SPPUBTBUSUGUHN-VIFPVBQESA-N	1	0	265.279	1.960	50	0		CDAARO
C[N@@H+]1CCOC[C@@H](Cn2cnc3ccc(F)cc3c2=O)C1	ZINC000584898000	349359639	/nfs/dbraw/zinc/35/96/39/349359639.db2.gz	OQDSNSSQIRSQBK-LLVKDONJSA-N	1	0	291.326	1.114	50	0		CDAARO
CC(C)OCCNc1nc(CC[NH3+])nc2ccccc21	ZINC000065371700	362947295	/nfs/dbraw/zinc/94/72/95/362947295.db2.gz	VRWPFCPPRBTLBN-UHFFFAOYSA-N	1	0	274.368	1.968	50	0		CDAARO
CC(=O)Nc1cccc([C@H](C)[NH2+]C[C@@]2(O)CCOC2)c1	ZINC000090848886	180045339	/nfs/dbraw/zinc/04/53/39/180045339.db2.gz	QIYOLRHGNGTHNC-NHYWBVRUSA-N	1	0	278.352	1.447	50	0		CDAARO
CC(C)=CCC[N@H+]1CCN(C)[C@]2(C1)CCNC(=O)CC2	ZINC000091526628	180178967	/nfs/dbraw/zinc/17/89/67/180178967.db2.gz	KNEROSVSOIZNAG-INIZCTEOSA-N	1	0	279.428	1.629	50	0		CDAARO
COCC[C@]1(O)CC[N@H+](Cc2cnc(C)n2C)C[C@H]1C	ZINC000091663704	180221254	/nfs/dbraw/zinc/22/12/54/180221254.db2.gz	HEKMMAWJJYZDCM-IUODEOHRSA-N	1	0	281.400	1.338	50	0		CDAARO
CCNc1ccnc(N2C[C@H]([NH+](C)C)[C@@H](C3CC3)C2)n1	ZINC000091830714	180266162	/nfs/dbraw/zinc/26/61/62/180266162.db2.gz	JWCRBQCTONXNCW-OLZOCXBDSA-N	1	0	275.400	1.685	50	0		CDAARO
O[C@H]1CCCC[C@@H]1[NH+]1CCN(c2nnc(C3CC3)o2)CC1	ZINC000091943561	180290005	/nfs/dbraw/zinc/29/00/05/180290005.db2.gz	FDGHOBBPFUCBPO-STQMWFEESA-N	1	0	292.383	1.373	50	0		CDAARO
C[C@@H]1C[N@H+](CC(=O)NCc2ccccc2F)CC[C@]1(C)O	ZINC000091986522	180298852	/nfs/dbraw/zinc/29/88/52/180298852.db2.gz	RQGLYPQKMQKLTN-WBMJQRKESA-N	1	0	294.370	1.535	50	0		CDAARO
CCOCCO[C@@H](C)C(=O)NC[C@@H]1CCC[N@H+](CC)C1	ZINC000106577032	186127004	/nfs/dbraw/zinc/12/70/04/186127004.db2.gz	PRKQURXEGQOXIC-KBPBESRZSA-N	1	0	286.416	1.276	50	0		CDAARO
CC[C@H]1CN([C@H](C)C(=O)N2CCCC2)CC[N@@H+]1CCOC	ZINC000106786689	186135451	/nfs/dbraw/zinc/13/54/51/186135451.db2.gz	LYWRJEMIWXJXTC-CABCVRRESA-N	1	0	297.443	1.040	50	0		CDAARO
[NH3+]Cc1nn(CCc2ccccn2)c(=O)c2ccccc21	ZINC000018193438	366211277	/nfs/dbraw/zinc/21/12/77/366211277.db2.gz	MLZGTFQMDGUXFU-UHFFFAOYSA-N	1	0	280.331	1.493	50	0		CDAARO
O=C(OCC[NH+]1CCCCC1)[C@@H]1COc2ccccc2O1	ZINC000000808180	355922494	/nfs/dbraw/zinc/92/24/94/355922494.db2.gz	KBNXWRKJSDESKZ-HNNXBMFYSA-N	1	0	291.347	1.856	50	0		CDAARO
CCC[NH+]1CCC(N2CCN(C(=O)OCC)CC2)CC1	ZINC000000221471	355897436	/nfs/dbraw/zinc/89/74/36/355897436.db2.gz	BGXUFIKTERNZCJ-UHFFFAOYSA-N	1	0	283.416	1.635	50	0		CDAARO
[NH3+]CCS[C@H]1CC(=O)N(Cc2ccc(F)cc2)C1=O	ZINC000002886650	355986635	/nfs/dbraw/zinc/98/66/35/355986635.db2.gz	MQEKXEWNTNOXOW-NSHDSACASA-N	1	0	282.340	1.145	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)NC2CC[NH2+]CC2)c1	ZINC000036286092	356110991	/nfs/dbraw/zinc/11/09/91/356110991.db2.gz	ZMNMIIQIIULOEY-UHFFFAOYSA-N	1	0	272.345	1.164	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@H](C[NH2+]Cc2csnn2)C1	ZINC000097373160	356093596	/nfs/dbraw/zinc/09/35/96/356093596.db2.gz	XOBLGUSZCPMHFI-SNVBAGLBSA-N	1	0	298.412	1.885	50	0		CDAARO
CN1CCN(C(=O)C2CCN(C(=O)C(C)(C)C)CC2)CC1	ZINC000012864955	356328187	/nfs/dbraw/zinc/32/81/87/356328187.db2.gz	WQDRJDWNNYCOJR-UHFFFAOYSA-N	1	0	295.427	1.045	50	0		CDAARO
CC(C)OCC[NH+]1CCN(c2ccccc2O)CC1	ZINC000032753245	356362512	/nfs/dbraw/zinc/36/25/12/356362512.db2.gz	IYFMIISEJOEVDD-UHFFFAOYSA-N	1	0	264.369	1.939	50	0		CDAARO
COc1cc2c(cc1OC)CN([C@@H]1CCC[NH2+]C1)CC2	ZINC000037246711	356375652	/nfs/dbraw/zinc/37/56/52/356375652.db2.gz	DKRPVLVHNHDGIM-CQSZACIVSA-N	1	0	276.380	1.814	50	0		CDAARO
COc1ccc(OCC[N@H+](C)[C@@H](C)C(=O)NC(C)C)cc1	ZINC000014184283	356377912	/nfs/dbraw/zinc/37/79/12/356377912.db2.gz	NFMGGCPCNBKPFO-ZDUSSCGKSA-N	1	0	294.395	1.919	50	0		CDAARO
CC(C)[NH2+][C@@H]1CC(=O)N(Cc2cccc(F)c2)C1	ZINC000015074771	356405184	/nfs/dbraw/zinc/40/51/84/356405184.db2.gz	WFWCOQGIRJBFBR-CYBMUJFWSA-N	1	0	250.317	1.925	50	0		CDAARO
Cc1cccc(NC(=O)C(=O)NCCC[NH+](C)C)c1C	ZINC000004583740	356432952	/nfs/dbraw/zinc/43/29/52/356432952.db2.gz	MRCOLGJMQWWVRJ-UHFFFAOYSA-N	1	0	277.368	1.310	50	0		CDAARO
COC(=O)CCN1CC[NH+](Cc2ccccc2)CC1	ZINC000019721403	356497031	/nfs/dbraw/zinc/49/70/31/356497031.db2.gz	MACUIBICNXRCEN-UHFFFAOYSA-N	1	0	262.353	1.367	50	0		CDAARO
CC[N@H+](CCNC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C)C1CC1	ZINC000246967870	356562754	/nfs/dbraw/zinc/56/27/54/356562754.db2.gz	OORQDLFNZISJDB-MCIONIFRSA-N	1	0	295.427	1.583	50	0		CDAARO
CNc1nc(N2CC[NH+](C(C)C)CC2)ncc1F	ZINC000725272973	538463747	/nfs/dbraw/zinc/46/37/47/538463747.db2.gz	WPKCEKYKRSXBOB-UHFFFAOYSA-N	1	0	253.325	1.188	50	0		CDAARO
Fc1ccccc1-c1cc(CN2CC[NH2+]CC2)on1	ZINC000057548170	363558723	/nfs/dbraw/zinc/55/87/23/363558723.db2.gz	SWSSTTKJAKDOHI-UHFFFAOYSA-N	1	0	261.300	1.886	50	0		CDAARO
Fc1cccc(-c2cc(N3CC[NH2+]CC3)ncn2)c1	ZINC000032918550	356790620	/nfs/dbraw/zinc/79/06/20/356790620.db2.gz	OMMLXHCBIPRWSK-UHFFFAOYSA-N	1	0	258.300	1.692	50	0		CDAARO
CC(C)C[N@@H+]1CCN(Cc2ccco2)[C@H](CCO)C1	ZINC000043016760	357085229	/nfs/dbraw/zinc/08/52/29/357085229.db2.gz	WOIONVULGZVRAJ-CQSZACIVSA-N	1	0	266.385	1.804	50	0		CDAARO
COC(=O)CC(C)(C)CC(=O)N1[C@@H](C)C[NH+](C)C[C@@H]1C	ZINC000096492981	357515728	/nfs/dbraw/zinc/51/57/28/357515728.db2.gz	AQKBDOJZJXOIAK-RYUDHWBXSA-N	1	0	284.400	1.517	50	0		CDAARO
CCc1cc(N2CC[NH+](C(C)C)CC2)nc(N(C)C)n1	ZINC000065381774	357534709	/nfs/dbraw/zinc/53/47/09/357534709.db2.gz	ZCZYQYBDZMKFOQ-UHFFFAOYSA-N	1	0	277.416	1.635	50	0		CDAARO
COc1ccccc1OC[C@H](O)C[NH2+]C(C)(C)C	ZINC000003650389	357657332	/nfs/dbraw/zinc/65/73/32/357657332.db2.gz	MFUFKDHTQHYPJS-LLVKDONJSA-N	1	0	253.342	1.823	50	0		CDAARO
CCN(CC)C(=O)[C@@H]1C[C@H]([NH3+])CN1C(=O)C1=CCCCC1	ZINC000067910367	357637222	/nfs/dbraw/zinc/63/72/22/357637222.db2.gz	AJJVFNHADQJBBE-KBPBESRZSA-N	1	0	293.411	1.283	50	0		CDAARO
CC/C=C/CC(=O)N1CCN(C)C2(CC[NH+](C)CC2)C1	ZINC000067919843	357637564	/nfs/dbraw/zinc/63/75/64/357637564.db2.gz	HPFZNAPUMAESHY-AATRIKPKSA-N	1	0	279.428	1.581	50	0		CDAARO
Cc1cccnc1N1CCN(C(=O)[C@H]([NH3+])CC(C)C)CC1	ZINC000071771597	357780263	/nfs/dbraw/zinc/78/02/63/357780263.db2.gz	IXBNYLMBVLUXDT-CQSZACIVSA-N	1	0	290.411	1.412	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN(C2CC[NH2+]CC2)C1=O	ZINC000071788936	357782268	/nfs/dbraw/zinc/78/22/68/357782268.db2.gz	DUEFQMDXZFHXAA-UHFFFAOYSA-N	1	0	269.345	1.411	50	0		CDAARO
Cc1nccn1-c1ccccc1CNC(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000072431994	357834578	/nfs/dbraw/zinc/83/45/78/357834578.db2.gz	GSYOTJISODSXCB-DZGCQCFKSA-N	1	0	298.390	1.924	50	0		CDAARO
Cc1cccc(NC(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)n1	ZINC000294333271	199002202	/nfs/dbraw/zinc/00/22/02/199002202.db2.gz	WXOQCEFZUAAWOS-TXEJJXNPSA-N	1	0	262.357	1.946	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)[C@@H]1CSc2ccccc21	ZINC000092239297	357944399	/nfs/dbraw/zinc/94/43/99/357944399.db2.gz	GFHPBBMTFUUNDQ-ZYHUDNBSSA-N	1	0	262.378	1.696	50	0		CDAARO
C[C@H]([NH2+]CCNS(=O)(=O)c1ccccc1)[C@H]1CCCO1	ZINC000097108750	357984422	/nfs/dbraw/zinc/98/44/22/357984422.db2.gz	LYQBXOXWASLSHF-GXTWGEPZSA-N	1	0	298.408	1.122	50	0		CDAARO
CC(C)[C@H]1C[N@H+](C)CCN1Cc1cnc2cnccn12	ZINC000097139310	357991623	/nfs/dbraw/zinc/99/16/23/357991623.db2.gz	IORODTOPLZXVDA-CQSZACIVSA-N	1	0	273.384	1.501	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)Cn2c3ccccc3nc2C2CC2)C1	ZINC000097228888	358043781	/nfs/dbraw/zinc/04/37/81/358043781.db2.gz	ZYSRRABDGQQQKN-GFCCVEGCSA-N	1	0	284.363	1.473	50	0		CDAARO
O=C1C[C@@]2(CC[N@@H+](C/C=C/c3ccc(F)cc3)C2)C(=O)N1	ZINC000082107356	358146910	/nfs/dbraw/zinc/14/69/10/358146910.db2.gz	SRBIRIKOXQRXRJ-XGBNDESESA-N	1	0	288.322	1.578	50	0		CDAARO
Cc1oc2c(c1C(=O)NC[C@@H]1C[C@H](F)C[NH2+]1)C(=O)CCC2	ZINC000082125563	358147926	/nfs/dbraw/zinc/14/79/26/358147926.db2.gz	FHIYKSUKQRPUTE-UWVGGRQHSA-N	1	0	294.326	1.537	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1C1CN(C(=O)Cc2cccnc2)C1	ZINC000082166357	358150805	/nfs/dbraw/zinc/15/08/05/358150805.db2.gz	OFNBLDDLZDSUFF-CYBMUJFWSA-N	1	0	273.380	1.709	50	0		CDAARO
Cc1ncccc1C(=O)N1CC[C@H](C[NH+]2CCCC2)C1	ZINC000089540531	358416143	/nfs/dbraw/zinc/41/61/43/358416143.db2.gz	KHCDYPAEIMYETG-CQSZACIVSA-N	1	0	273.380	1.948	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1NCc1cncn1CCOC	ZINC000095364534	358686356	/nfs/dbraw/zinc/68/63/56/358686356.db2.gz	ZWGFGYINOZBNIQ-UHFFFAOYSA-N	1	0	290.371	1.385	50	0		CDAARO
Cc1cc(C)c2c(ncnc2N[C@@H]2CC[C@@H]([NH3+])C2)n1	ZINC000095388272	358691368	/nfs/dbraw/zinc/69/13/68/358691368.db2.gz	VWDJZIVXDSUXDL-GHMZBOCLSA-N	1	0	257.341	1.933	50	0		CDAARO
Cc1cc2cc(C(=O)NC[C@H]3C[NH2+]CCO3)ccc2o1	ZINC000097475046	358778864	/nfs/dbraw/zinc/77/88/64/358778864.db2.gz	MSFKLVWMSLKALD-CYBMUJFWSA-N	1	0	274.320	1.459	50	0		CDAARO
Cc1cncc(-c2cc(N3CC[NH+](C)CC3)nc(N)n2)c1	ZINC000097570967	358786123	/nfs/dbraw/zinc/78/61/23/358786123.db2.gz	AQYIWJRGWDNTSB-UHFFFAOYSA-N	1	0	284.367	1.181	50	0		CDAARO
CC[N@H+](Cc1cc2c(cc1OC)CCC2)[C@H]1COC[C@@H]1O	ZINC000097675278	358793128	/nfs/dbraw/zinc/79/31/28/358793128.db2.gz	QRQJKUQRGZPXOJ-HOTGVXAUSA-N	1	0	291.391	1.766	50	0		CDAARO
C[C@@H](CNC(=O)NC1Cc2ccccc2C1)[N@H+](C)C1CC1	ZINC000186613042	358808192	/nfs/dbraw/zinc/80/81/92/358808192.db2.gz	NEQQNEHLBVEWHR-LBPRGKRZSA-N	1	0	287.407	1.936	50	0		CDAARO
Cc1ccc(C[N@@H+]2CC[C@](O)(CO)C2)c2cccnc12	ZINC000214994459	358867731	/nfs/dbraw/zinc/86/77/31/358867731.db2.gz	QOZDFBUXLSCUFK-MRXNPFEDSA-N	1	0	272.348	1.472	50	0		CDAARO
Cc1n[nH]c(C)c1CN1CCC[C@@H]([NH+](C)C)CC1	ZINC000215075005	358873769	/nfs/dbraw/zinc/87/37/69/358873769.db2.gz	CPVYGNODEQXLCN-CYBMUJFWSA-N	1	0	250.390	1.943	50	0		CDAARO
O=C(NCCc1c[nH]cn1)c1ccc([C@H]2CCC[NH2+]C2)cc1	ZINC000215305839	358882891	/nfs/dbraw/zinc/88/28/91/358882891.db2.gz	OSXNOLGTCPJOIE-HNNXBMFYSA-N	1	0	298.390	1.849	50	0		CDAARO
Cc1ccc(C(=O)N2CCC(OCC[NH+](C)C)CC2)n1C	ZINC000215365217	358886479	/nfs/dbraw/zinc/88/64/79/358886479.db2.gz	FSZPOEIJGVEANQ-UHFFFAOYSA-N	1	0	293.411	1.516	50	0		CDAARO
C[C@@H](Cc1cnccn1)[N@H+](C)Cc1cccnc1N	ZINC000215653349	358897484	/nfs/dbraw/zinc/89/74/84/358897484.db2.gz	SVWOJTSJZVXJKH-NSHDSACASA-N	1	0	257.341	1.517	50	0		CDAARO
C[N@H+](Cc1ccccc1OCCO)C1CCOCC1	ZINC000216161161	358929599	/nfs/dbraw/zinc/92/95/99/358929599.db2.gz	BJDTXTGGOZSDOY-UHFFFAOYSA-N	1	0	265.353	1.669	50	0		CDAARO
c1cncc(C[N@@H+]2CCC[C@H](Nc3ncncn3)C2)c1	ZINC000219076272	359077279	/nfs/dbraw/zinc/07/72/79/359077279.db2.gz	HKVFWWGBCXRYOW-ZDUSSCGKSA-N	1	0	270.340	1.343	50	0		CDAARO
Cc1noc(C)c1CNc1cc(C2CC([NH3+])C2)nc(N)n1	ZINC000219364148	359092545	/nfs/dbraw/zinc/09/25/45/359092545.db2.gz	QBBSHJSPTBEMPX-UHFFFAOYSA-N	1	0	288.355	1.480	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2COC[C@@H]2[NH+]2CCCC2)c(C)o1	ZINC000219390913	359093915	/nfs/dbraw/zinc/09/39/15/359093915.db2.gz	HCVFNZRAMVTLKW-KBPBESRZSA-N	1	0	278.352	1.489	50	0		CDAARO
C[NH2+][C@H](C(=O)NCCc1cn[nH]c1)c1ccccc1	ZINC000221195802	359215685	/nfs/dbraw/zinc/21/56/85/359215685.db2.gz	XSWHLJWRIHLCOW-ZDUSSCGKSA-N	1	0	258.325	1.029	50	0		CDAARO
[NH3+]C1CC(c2cc(NCCc3c[nH]cn3)nc(C3CC3)n2)C1	ZINC000222716790	359367876	/nfs/dbraw/zinc/36/78/76/359367876.db2.gz	IFMKAJCSNYNRFR-UHFFFAOYSA-N	1	0	298.394	1.936	50	0		CDAARO
COCc1nc(C)cc(N2CC[NH+](CCCF)CC2)n1	ZINC000521398614	359970359	/nfs/dbraw/zinc/97/03/59/359970359.db2.gz	UNAAHGWINVKOAZ-UHFFFAOYSA-N	1	0	282.363	1.413	50	0		CDAARO
[NH3+]CCc1n[nH]c(=O)n1-c1ccc(C(F)(F)F)cc1	ZINC000065488968	360094361	/nfs/dbraw/zinc/09/43/61/360094361.db2.gz	YIHVJOIVDLGUGM-UHFFFAOYSA-N	1	0	272.230	1.081	50	0		CDAARO
Cc1[nH]ccc1C(=O)N1CCC[C@H](C[NH+]2CCOCC2)C1	ZINC000176466990	360328385	/nfs/dbraw/zinc/32/83/85/360328385.db2.gz	PPNAMIMMNUAJNH-CQSZACIVSA-N	1	0	291.395	1.508	50	0		CDAARO
C[C@@H](C(=O)N(C)CC[NH+](C)C)n1cnc2ccccc21	ZINC000267089499	363730520	/nfs/dbraw/zinc/73/05/20/363730520.db2.gz	ICKSFZTUEQGUQL-LBPRGKRZSA-N	1	0	274.368	1.617	50	0		CDAARO
CC[NH+](CC)CCNC(=O)NC[C@H](O)c1ccc(O)cc1	ZINC000426618398	360689490	/nfs/dbraw/zinc/68/94/90/360689490.db2.gz	UIJLTKBKIABKPI-AWEZNQCLSA-N	1	0	295.383	1.067	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)/C=C/c2ccc(-n3ccnc3)cc2)C1	ZINC000178547331	189125883	/nfs/dbraw/zinc/12/58/83/189125883.db2.gz	MLWYFTSHBBNXSJ-VFQAQYNWSA-N	1	0	296.374	1.693	50	0		CDAARO
COCCOc1ccccc1C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178583484	189128741	/nfs/dbraw/zinc/12/87/41/189128741.db2.gz	OHUVLXCYHNDYPW-LBPRGKRZSA-N	1	0	278.352	1.133	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cc(C(C)C)n(C)n2)C1	ZINC000178984916	189159606	/nfs/dbraw/zinc/15/96/06/189159606.db2.gz	ZTEIEIHXCDEDRQ-LLVKDONJSA-N	1	0	264.373	1.225	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2c(Cl)nc3ccccn32)C1	ZINC000178990129	189159838	/nfs/dbraw/zinc/15/98/38/189159838.db2.gz	LZKGKDLBBOUHQE-JTQLQIEISA-N	1	0	292.770	1.669	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)c2ccnc(-n3ccnc3)c2)C1	ZINC000179220568	189178944	/nfs/dbraw/zinc/17/89/44/189178944.db2.gz	RMRZSEOCIVCHFB-TZMCWYRMSA-N	1	0	299.378	1.467	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCN(C(=O)c2ccnc(-n3ccnc3)c2)C1	ZINC000179220589	189179076	/nfs/dbraw/zinc/17/90/76/189179076.db2.gz	RMRZSEOCIVCHFB-OCCSQVGLSA-N	1	0	299.378	1.467	50	0		CDAARO
C[C@@H]1c2ccccc2O[C@H]1C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000246572168	360884125	/nfs/dbraw/zinc/88/41/25/360884125.db2.gz	BTSHEEACKOTCNJ-UHIISALHSA-N	1	0	260.337	1.371	50	0		CDAARO
COCC[N@@H+](Cc1ccco1)C[C@@H](O)COC(C)C	ZINC000036096397	360911426	/nfs/dbraw/zinc/91/14/26/360911426.db2.gz	HNWVNBURWGDPOM-CYBMUJFWSA-N	1	0	271.357	1.514	50	0		CDAARO
Cc1cc(C)cc(NC(=O)NC[C@]2(O)CC[NH2+]C2)c1	ZINC000299774101	200866997	/nfs/dbraw/zinc/86/69/97/200866997.db2.gz	AFSKKXNPLRFAEG-AWEZNQCLSA-N	1	0	263.341	1.149	50	0		CDAARO
COc1ccccc1S(=O)(=O)N(C)C1CC[NH2+]CC1	ZINC000036300196	361491405	/nfs/dbraw/zinc/49/14/05/361491405.db2.gz	GYZSPJJWALJJLM-UHFFFAOYSA-N	1	0	284.381	1.068	50	0		CDAARO
CNC(=O)CN1CCC([NH2+][C@@H]2CC(C)(C)C[C@@H]2C)CC1	ZINC000192390571	361658598	/nfs/dbraw/zinc/65/85/98/361658598.db2.gz	HSMCYSGKMPADFU-GXTWGEPZSA-N	1	0	281.444	1.611	50	0		CDAARO
C[C@@H]1C[C@H](NC(=O)CC[NH3+])C[N@@H+]1Cc1ccccc1	ZINC000200644398	364918667	/nfs/dbraw/zinc/91/86/67/364918667.db2.gz	OYLLMQUUEAKRES-OCCSQVGLSA-N	1	0	261.369	1.114	50	0		CDAARO
O=C([C@@H]1CC=CCC1)N1CC[NH+](C[C@H]2CCOC2)CC1	ZINC000098018730	364972803	/nfs/dbraw/zinc/97/28/03/364972803.db2.gz	JUZYFJBEPNTDDF-HUUCEWRRSA-N	1	0	278.396	1.523	50	0		CDAARO
C1CC1c1noc(N2C[C@H]3[C@@H](C2)C[N@@H+]2CCCC[C@@H]32)n1	ZINC000089819175	366941053	/nfs/dbraw/zinc/94/10/53/366941053.db2.gz	WEKSKOIGLMVQFK-AGIUHOORSA-N	1	0	274.368	1.868	50	0		CDAARO
CC(C)(C[NH2+]Cc1ccc(F)cc1)S(C)(=O)=O	ZINC000089761798	366928906	/nfs/dbraw/zinc/92/89/06/366928906.db2.gz	PQJSTJNOKZVBRX-UHFFFAOYSA-N	1	0	259.346	1.739	50	0		CDAARO
CC1(C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)OCCO1	ZINC000089920643	366969278	/nfs/dbraw/zinc/96/92/78/366969278.db2.gz	YMUXLZNBGWONJL-KBPBESRZSA-N	1	0	269.385	1.765	50	0		CDAARO
CC[C@@H](C(=O)NCc1cnn(C)c1)[NH+](CC)CC	ZINC000089941888	366974504	/nfs/dbraw/zinc/97/45/04/366974504.db2.gz	JBCGNLNWXLEJRF-LBPRGKRZSA-N	1	0	252.362	1.157	50	0		CDAARO
CC[C@@H]1CN(C(=O)C2CC2)CC[C@@H]1[NH2+]Cc1c[nH]nc1C	ZINC000089948805	366977879	/nfs/dbraw/zinc/97/78/79/366977879.db2.gz	MTGFFYDXOHGZJP-DOMZBBRYSA-N	1	0	290.411	1.845	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1c(N)cccc1Cl	ZINC000089968988	366986950	/nfs/dbraw/zinc/98/69/50/366986950.db2.gz	VRLWUMSIQUQSRK-UHFFFAOYSA-N	1	0	269.776	1.994	50	0		CDAARO
Cn1c(CO)cnc1SCC[C@H]1CCCC[N@@H+]1C	ZINC000090243490	367027479	/nfs/dbraw/zinc/02/74/79/367027479.db2.gz	SFHBSSJGVJAFAO-LLVKDONJSA-N	1	0	269.414	1.879	50	0		CDAARO
C[C@@H]1OCC[C@H]1[N@H+](CCO)CCSC(C)(C)C	ZINC000252493989	367640757	/nfs/dbraw/zinc/64/07/57/367640757.db2.gz	NIAQGSIKTZYRIL-NWDGAFQWSA-N	1	0	261.431	1.990	50	0		CDAARO
C[C@@H]1C[N@H+](CCSC(C)(C)C)CCN1CCO	ZINC000252507665	367651600	/nfs/dbraw/zinc/65/16/00/367651600.db2.gz	WRBIHINILLPTTF-GFCCVEGCSA-N	1	0	260.447	1.517	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCCC[C@@H]2C[NH3+])s1	ZINC000089107945	368997320	/nfs/dbraw/zinc/99/73/20/368997320.db2.gz	OKPKJKRHOAZBCS-MNOVXSKESA-N	1	0	288.438	1.852	50	0		CDAARO
CCN(CCC[NH+]1CCCC1)C(=O)c1cc[nH]c(=O)c1	ZINC000276386748	193310195	/nfs/dbraw/zinc/31/01/95/193310195.db2.gz	DYYSGGGNSYWUOI-UHFFFAOYSA-N	1	0	277.368	1.735	50	0		CDAARO
COc1nnc(NC(=O)N2C[C@@H]3CCC[N@@H+]3C[C@@H]2C)s1	ZINC000276557550	193379731	/nfs/dbraw/zinc/37/97/31/193379731.db2.gz	PBRNOIJIFIGOPT-IUCAKERBSA-N	1	0	297.384	1.247	50	0		CDAARO
Cc1cc(C)n(CCC[N@@H+](C)CCn2cnnc2)n1	ZINC000670444718	482990978	/nfs/dbraw/zinc/99/09/78/482990978.db2.gz	INCRKDWOQNPXAM-UHFFFAOYSA-N	1	0	262.361	1.114	50	0		CDAARO
CC(C)c1nccn1CCCNC(=O)c1ccc(=O)[nH]c1	ZINC000299801476	372771077	/nfs/dbraw/zinc/77/10/77/372771077.db2.gz	ZBFZIUGAYMWOED-UHFFFAOYSA-N	1	0	288.351	1.927	50	0		CDAARO
COc1cc(CN2C[C@@H](C)O[C@]3(CCOC3)C2)ccc1O	ZINC000253426126	373734883	/nfs/dbraw/zinc/73/48/83/373734883.db2.gz	FUIGFZQMSNWVRF-MLGOLLRUSA-N	1	0	293.363	1.781	50	0		CDAARO
C[C@H](COCC(F)(F)F)NC(=O)[C@@H]1CCCC[NH2+]1	ZINC000253430207	373736209	/nfs/dbraw/zinc/73/62/09/373736209.db2.gz	DWRFNVPSEMBMAU-BDAKNGLRSA-N	1	0	268.279	1.212	50	0		CDAARO
CCC[NH+]1CCC(N2CCN(C(C)=O)CC2)CC1	ZINC000032509018	374522838	/nfs/dbraw/zinc/52/28/38/374522838.db2.gz	OYKVLECUPBMSAV-UHFFFAOYSA-N	1	0	253.390	1.025	50	0		CDAARO
CC(C)Oc1ccc(CCNC(=O)[C@H](C)[NH3+])cc1	ZINC000019781980	374787303	/nfs/dbraw/zinc/78/73/03/374787303.db2.gz	SUSCQRPURDWEMX-NSHDSACASA-N	1	0	250.342	1.480	50	0		CDAARO
COC(=O)CCC[N@@H+]1C[C@H](O)C[C@@H]1C1CCCCC1	ZINC000095397896	374902112	/nfs/dbraw/zinc/90/21/12/374902112.db2.gz	LHOMIELMWPRDIO-ZIAGYGMSSA-N	1	0	269.385	1.955	50	0		CDAARO
Cc1ccc2nc(Cn3cc([C@@H]4CCC[NH2+]C4)nn3)cn2c1	ZINC000095387135	374897764	/nfs/dbraw/zinc/89/77/64/374897764.db2.gz	SFSXMACYCYNECO-CYBMUJFWSA-N	1	0	296.378	1.750	50	0		CDAARO
C[C@@H](CS(C)(=O)=O)[NH2+]Cc1cc(F)cc2cccnc21	ZINC000095415482	374917957	/nfs/dbraw/zinc/91/79/57/374917957.db2.gz	QHKWQVMUBHLZCB-JTQLQIEISA-N	1	0	296.367	1.897	50	0		CDAARO
COC[C@@H]([NH2+]CCc1ccc2c(c1)OCO2)C1CC1	ZINC000095419498	374919819	/nfs/dbraw/zinc/91/98/19/374919819.db2.gz	NRCMVBWXMTUURX-CYBMUJFWSA-N	1	0	263.337	1.972	50	0		CDAARO
CC(C)[C@H]1C[C@@H](C[NH2+]C2(CCO)CCOCC2)CCO1	ZINC000095466064	374962118	/nfs/dbraw/zinc/96/21/18/374962118.db2.gz	BSEYEURYJSZODZ-LSDHHAIUSA-N	1	0	285.428	1.959	50	0		CDAARO
C[S@@](=O)C1(C[NH2+]Cc2ccc3c(c2)OCCO3)CCC1	ZINC000280618622	375007938	/nfs/dbraw/zinc/00/79/38/375007938.db2.gz	KSVOZIQQPCZBDT-HXUWFJFHSA-N	1	0	295.404	1.849	50	0		CDAARO
COc1cccc([C@@H](C)[NH2+]CC(=O)NC(C)C)c1	ZINC000096286621	375073560	/nfs/dbraw/zinc/07/35/60/375073560.db2.gz	MSINFEMHRLURQS-LLVKDONJSA-N	1	0	250.342	1.870	50	0		CDAARO
NC(=O)c1ccc(N2CC[NH+](CCCCCO)CC2)cc1	ZINC000096410580	375097101	/nfs/dbraw/zinc/09/71/01/375097101.db2.gz	VMVXFHFZQAOGQW-UHFFFAOYSA-N	1	0	291.395	1.070	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1cc(F)cc(F)c1	ZINC000095972665	375044190	/nfs/dbraw/zinc/04/41/90/375044190.db2.gz	PWSAMIMKZOTVOY-JTQLQIEISA-N	1	0	278.324	1.371	50	0		CDAARO
COC[C@H](C)[NH2+][C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000095968486	375044537	/nfs/dbraw/zinc/04/45/37/375044537.db2.gz	XQHITRLHDYTTOL-CVEARBPZSA-N	1	0	291.439	1.822	50	0		CDAARO
C[C@H]1OCC[C@@H]1[NH2+]C(C)(C)C(=O)NCC1CCCC1	ZINC000097038415	375139081	/nfs/dbraw/zinc/13/90/81/375139081.db2.gz	FQAWYFXJPXQMLB-YPMHNXCESA-N	1	0	268.401	1.838	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNC(=O)N1CCO[C@@H](C)C1	ZINC000227158515	375453997	/nfs/dbraw/zinc/45/39/97/375453997.db2.gz	MJCIFVPKLJUACW-STQMWFEESA-N	1	0	269.389	1.291	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1ccc(OC)c(OC)c1	ZINC000003193300	375582588	/nfs/dbraw/zinc/58/25/88/375582588.db2.gz	NCLJLGQESKCKAG-UHFFFAOYSA-N	1	0	280.368	1.775	50	0		CDAARO
CNC(=S)NC1CC[NH+](Cc2ccccc2)CC1	ZINC000003332629	375651632	/nfs/dbraw/zinc/65/16/32/375651632.db2.gz	SDUQMQDOBZPFIU-UHFFFAOYSA-N	1	0	263.410	1.745	50	0		CDAARO
C[C@@H](O)C[N@H+](C)[C@H](C)C(=O)Nc1ccc(Cl)cc1	ZINC000241157321	376016488	/nfs/dbraw/zinc/01/64/88/376016488.db2.gz	JWTWRELNIWYJIX-NXEZZACHSA-N	1	0	270.760	1.980	50	0		CDAARO
Cn1ncc2c1ncnc2N1CCC[N@@H+]2CCC[C@H]2C1	ZINC000241897125	376019729	/nfs/dbraw/zinc/01/97/29/376019729.db2.gz	TVUQPHFMSMWJKO-NSHDSACASA-N	1	0	272.356	1.038	50	0		CDAARO
O=C(NCC1CC1)c1ccc(C2CC[NH2+]CC2)nc1	ZINC000242687953	376021916	/nfs/dbraw/zinc/02/19/16/376021916.db2.gz	VAXWPGTVRLIKLC-UHFFFAOYSA-N	1	0	259.353	1.688	50	0		CDAARO
CCc1ccc(C[N@@H+]2CC[C@H](CNC(C)=O)C2)nc1	ZINC000067804820	377240081	/nfs/dbraw/zinc/24/00/81/377240081.db2.gz	JNIKSZJXEVYCCE-CQSZACIVSA-N	1	0	261.369	1.602	50	0		CDAARO
Cc1nonc1C(=O)NC[C@@H](c1ccc(C)cc1)[NH+](C)C	ZINC000265077891	190156344	/nfs/dbraw/zinc/15/63/44/190156344.db2.gz	ZAQDBIAHAWCMTM-ZDUSSCGKSA-N	1	0	288.351	1.719	50	0		CDAARO
CN(C)C(=O)[C@H]1CCCN1CC(=O)Nc1cccc(F)c1	ZINC000012744338	377999849	/nfs/dbraw/zinc/99/98/49/377999849.db2.gz	UCCSGQKKUVXAOS-CYBMUJFWSA-N	1	0	293.342	1.317	50	0		CDAARO
CC[NH+]1CCN(c2nc3ccccc3c(=O)[nH]2)CC1	ZINC000041603477	379405184	/nfs/dbraw/zinc/40/51/84/379405184.db2.gz	MHLATGLXVDZDFO-UHFFFAOYSA-N	1	0	258.325	1.065	50	0		CDAARO
O=C1NC2(CC[NH2+]CC2)N=C1c1ccc(Cl)cc1	ZINC000005043409	284872251	/nfs/dbraw/zinc/87/22/51/284872251.db2.gz	HMUISDLOWZZRNR-UHFFFAOYSA-N	1	0	263.728	1.339	50	0		CDAARO
Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H]([NH3+])CC3)no1	ZINC000261627534	291784452	/nfs/dbraw/zinc/78/44/52/291784452.db2.gz	VMJWIWKQUUWCJG-ZETCQYMHSA-N	1	0	278.337	1.508	50	0		CDAARO
O=C1[C@@H]2CC=C(Cl)C[C@@H]2C(=O)N1CC[NH+]1CCCCC1	ZINC000000139734	284982718	/nfs/dbraw/zinc/98/27/18/284982718.db2.gz	SHZOHIJTDOCLRY-OLZOCXBDSA-N	1	0	296.798	1.990	50	0		CDAARO
COc1nc2c(cc1C(=O)N1CC[C@H]3C[NH2+]C[C@H]31)CCC2	ZINC000077438158	256880066	/nfs/dbraw/zinc/88/00/66/256880066.db2.gz	QHTUTXBIXXBLFV-SMDDNHRTSA-N	1	0	287.363	1.013	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@@H]1NC(=O)c1cc(F)ccc1F	ZINC000094345384	184785554	/nfs/dbraw/zinc/78/55/54/184785554.db2.gz	TXMKFQLMJRWGAD-UFBFGSQYSA-N	1	0	254.280	1.693	50	0		CDAARO
CC1(C[NH2+]Cc2cc(=O)c3cccc(F)c3[nH]2)COC1	ZINC000095362555	184953561	/nfs/dbraw/zinc/95/35/61/184953561.db2.gz	GOGXPIDBWPMDMM-UHFFFAOYSA-N	1	0	276.311	1.793	50	0		CDAARO
Cc1cc(NN)[nH+]c(N2CCc3ccccc3C2)n1	ZINC000032951450	390249745	/nfs/dbraw/zinc/24/97/45/390249745.db2.gz	SHQPHBVUEKASFM-UHFFFAOYSA-N	1	0	255.325	1.633	50	0		CDAARO
C[N@@H+](Cc1c[nH]nc1-c1ccc(F)cc1)C[C@H](O)CO	ZINC000067847356	390575336	/nfs/dbraw/zinc/57/53/36/390575336.db2.gz	MQOQIOOUKCWGGQ-ZDUSSCGKSA-N	1	0	279.315	1.001	50	0		CDAARO
CN(Cc1[nH]nc2c1CCCCC2)[C@@H]1CCC[NH2+]C1	ZINC000067741070	390575788	/nfs/dbraw/zinc/57/57/88/390575788.db2.gz	GXPDMXUQHHSRIQ-GFCCVEGCSA-N	1	0	262.401	1.862	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2cccc(F)c2)CC[NH2+]1	ZINC000299742097	390596792	/nfs/dbraw/zinc/59/67/92/390596792.db2.gz	GVJDAUJOQUUOPJ-DDTOSNHZSA-N	1	0	262.328	1.750	50	0		CDAARO
Cc1ncc(C(=O)N2CCCC[C@@H]2CC[NH+](C)C)cn1	ZINC000072419912	390615773	/nfs/dbraw/zinc/61/57/73/390615773.db2.gz	QXNNPLJYOSKWTQ-CQSZACIVSA-N	1	0	276.384	1.731	50	0		CDAARO
Cc1cn[nH]c1C[NH2+]C[C@H]1CC(=O)Nc2ccccc21	ZINC000368233313	391019758	/nfs/dbraw/zinc/01/97/58/391019758.db2.gz	XIQIKGVIKFALAP-LLVKDONJSA-N	1	0	270.336	1.934	50	0		CDAARO
CC(C)c1nccc(CN2CCN3CC[N@H+](C)C[C@H]3C2)n1	ZINC000106257250	391040182	/nfs/dbraw/zinc/04/01/82/391040182.db2.gz	SKSYINIXXZUMKC-HNNXBMFYSA-N	1	0	289.427	1.032	50	0		CDAARO
CC(C)c1nn(C)c(N(C)C)c1C[NH2+]C[C@@H]1CCCN1C	ZINC000065478070	391072549	/nfs/dbraw/zinc/07/25/49/391072549.db2.gz	KFKGIDAXZWPMBO-ZDUSSCGKSA-N	1	0	293.459	1.793	50	0		CDAARO
C[C@@H]([NH2+]Cc1cnn(C)c1)[C@@H](O)c1ccc(F)c(F)c1	ZINC000096452789	533468106	/nfs/dbraw/zinc/46/81/06/533468106.db2.gz	UGYCVKWRRINOCN-YMTOWFKASA-N	1	0	281.306	1.910	50	0		CDAARO
CCOc1c(F)cccc1C(=O)NC[C@H]1CCC[NH2+]1	ZINC000178723812	391359432	/nfs/dbraw/zinc/35/94/32/391359432.db2.gz	LLGSONCZWQXAES-SNVBAGLBSA-N	1	0	266.316	1.706	50	0		CDAARO
CCC[C@H](C)[N@@H+]1CCN(CCC(=O)OC)C[C@@H]1C	ZINC000192790730	391816716	/nfs/dbraw/zinc/81/67/16/391816716.db2.gz	DPBHWENEIQLIHP-STQMWFEESA-N	1	0	256.390	1.744	50	0		CDAARO
C[C@@H](C[NH+]1CCCCC1)NC(=O)c1cnn2c1CCCC2	ZINC000126913767	392598808	/nfs/dbraw/zinc/59/88/08/392598808.db2.gz	PBSADFBYAFOBBZ-ZDUSSCGKSA-N	1	0	290.411	1.824	50	0		CDAARO
CCOC(=O)[C@H](C)N1CCC2(CCC[N@@H+]2C)CC1	ZINC000253392561	392716327	/nfs/dbraw/zinc/71/63/27/392716327.db2.gz	GERAJLFMMCNBSM-LBPRGKRZSA-N	1	0	254.374	1.498	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC000269152584	132121364	/nfs/dbraw/zinc/12/13/64/132121364.db2.gz	CCFXRXNBDGFPNN-LEWSCRJBSA-N	1	0	262.328	1.736	50	0		CDAARO
CCN1CC[NH+](C[C@H](C)CNc2cncc(C)n2)CC1	ZINC000195575063	393305230	/nfs/dbraw/zinc/30/52/30/393305230.db2.gz	AINGXCDZXHOCFO-CYBMUJFWSA-N	1	0	277.416	1.471	50	0		CDAARO
C[C@H]([NH2+]C[C@H]1CC[C@H](C(=O)N(C)C)O1)C(C)(C)C(F)F	ZINC000657939243	413100217	/nfs/dbraw/zinc/10/02/17/413100217.db2.gz	WGPMUWNCNGBYGI-HBNTYKKESA-N	1	0	292.370	1.892	50	0		CDAARO
CCC[NH2+]Cc1cc(=O)n2nc(-c3ccccc3)nc2[nH]1	ZINC000101747127	397817564	/nfs/dbraw/zinc/81/75/64/397817564.db2.gz	YGLYXSDXUZEWNK-UHFFFAOYSA-N	1	0	283.335	1.584	50	0		CDAARO
Cc1cccc(OC[C@H](O)C[NH2+]C(C)(C)CO)c1C	ZINC000002851458	169836900	/nfs/dbraw/zinc/83/69/00/169836900.db2.gz	AOEIEHYJEGXZOI-CYBMUJFWSA-N	1	0	267.369	1.404	50	0		CDAARO
C[NH+](C)CC[C@H](O)c1ccc2c(c1)OCCCO2	ZINC000005912598	170154067	/nfs/dbraw/zinc/15/40/67/170154067.db2.gz	LXSZCLMWICQPOO-LBPRGKRZSA-N	1	0	251.326	1.833	50	0		CDAARO
COC(=O)[C@@H]1[C@H](C(=O)OC)[C@H]2CCC[N@@H+]2C12CCCCC2	ZINC000006657988	170222806	/nfs/dbraw/zinc/22/28/06/170222806.db2.gz	YLAUEXHRCZFZSL-UPJWGTAASA-N	1	0	295.379	1.746	50	0		CDAARO
C[C@@H](CCc1ccccc1)NC(=O)CSC(N)=[NH2+]	ZINC000007987495	170312110	/nfs/dbraw/zinc/31/21/10/170312110.db2.gz	GSGYBQPZCDWFJJ-JTQLQIEISA-N	1	0	265.382	1.751	50	0		CDAARO
NC(=O)C1CC[NH+](CCCOc2ccc(F)cc2)CC1	ZINC000008317425	170330643	/nfs/dbraw/zinc/33/06/43/170330643.db2.gz	PQDFLUWXZZCVLP-UHFFFAOYSA-N	1	0	280.343	1.792	50	0		CDAARO
Cc1ccc(NC(=O)[C@H](C)[NH+]2CCC(C(N)=O)CC2)cc1	ZINC000009908732	170389239	/nfs/dbraw/zinc/38/92/39/170389239.db2.gz	QDHVDXMVFFKVSV-LBPRGKRZSA-N	1	0	289.379	1.519	50	0		CDAARO
C[C@H](Oc1ccc(Cl)cc1)C(=O)NCC[NH+](C)C	ZINC000010111690	170397642	/nfs/dbraw/zinc/39/76/42/170397642.db2.gz	OHVNMUXPEOJAAV-JTQLQIEISA-N	1	0	270.760	1.785	50	0		CDAARO
C[NH+](C)CC[C@H]1CN(C(=O)COc2ccccc2)CCO1	ZINC000011934235	170459294	/nfs/dbraw/zinc/45/92/94/170459294.db2.gz	BTBBPBYMGHFYCJ-HNNXBMFYSA-N	1	0	292.379	1.245	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCCN(Cc2cccc(F)c2F)C1=O	ZINC000012588772	170498914	/nfs/dbraw/zinc/49/89/14/170498914.db2.gz	YOOXFCFUFPEXRA-HNNXBMFYSA-N	1	0	298.333	1.380	50	0		CDAARO
Cc1ocnc1C(=O)NCC[N@@H+](C)CCc1ccccc1	ZINC000020726662	171270989	/nfs/dbraw/zinc/27/09/89/171270989.db2.gz	IUOYQWDJMZXYPG-UHFFFAOYSA-N	1	0	287.363	1.887	50	0		CDAARO
[NH3+]CCNCCOCCOc1ccccc1Cl	ZINC000022034195	171350312	/nfs/dbraw/zinc/35/03/12/171350312.db2.gz	CEZKXZPAPCQFGW-UHFFFAOYSA-N	1	0	258.749	1.284	50	0		CDAARO
C[C@@H](C1CC1)[N@H+](C)CCOc1ccc(S(N)(=O)=O)cc1	ZINC000030971164	171627564	/nfs/dbraw/zinc/62/75/64/171627564.db2.gz	NTDQGGSMLKUEJS-NSHDSACASA-N	1	0	298.408	1.443	50	0		CDAARO
C[C@H](NC(=O)[C@@H]1Cc2ccccc2C[NH2+]1)[C@H]1CCCO1	ZINC000035734938	172386580	/nfs/dbraw/zinc/38/65/80/172386580.db2.gz	AMTYGMXBAPDJML-TUKIKUTGSA-N	1	0	274.364	1.385	50	0		CDAARO
CCOc1ccccc1CN1CC[NH2+]C[C@@H]1CCO	ZINC000038534367	174144724	/nfs/dbraw/zinc/14/47/24/174144724.db2.gz	YEGMTPFFDQKLQF-AWEZNQCLSA-N	1	0	264.369	1.242	50	0		CDAARO
CCC[N@@H+]1CCN(Cc2cccc(OC)c2)[C@H](CCO)C1	ZINC000039557782	174170001	/nfs/dbraw/zinc/17/00/01/174170001.db2.gz	FIYXUWWHSRIBDO-MRXNPFEDSA-N	1	0	292.423	1.974	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1cc(-c2ccco2)n[nH]1	ZINC000040497900	174295480	/nfs/dbraw/zinc/29/54/80/174295480.db2.gz	SVXUKEQHXLHQAS-LLVKDONJSA-N	1	0	288.351	1.884	50	0		CDAARO
O=C1N(Cc2ccc(F)c(F)c2)CCN1C1CC[NH2+]CC1	ZINC000045796167	175383917	/nfs/dbraw/zinc/38/39/17/175383917.db2.gz	OQOZQFYKYOKEAW-UHFFFAOYSA-N	1	0	295.333	1.954	50	0		CDAARO
Cc1cc(-n2cnnc2[C@@H]2CCC[N@H+](C)C2)n(C)n1	ZINC000067965996	175804872	/nfs/dbraw/zinc/80/48/72/175804872.db2.gz	CPSLZPBQSYZRKK-LLVKDONJSA-N	1	0	260.345	1.118	50	0		CDAARO
O[C@@H]1CC[N@H+](Cc2cnc3c(-c4ccccc4)cnn3c2)C1	ZINC000067965936	175804895	/nfs/dbraw/zinc/80/48/95/175804895.db2.gz	UXORTRCOZHHLHD-OAHLLOKOSA-N	1	0	294.358	1.963	50	0		CDAARO
FC(F)(F)CCc1ccnc(N2C[C@H]3C[NH2+]C[C@H]3C2)n1	ZINC000071682081	176245471	/nfs/dbraw/zinc/24/54/71/176245471.db2.gz	OKQWYLKVAGLKBK-AOOOYVTPSA-N	1	0	286.301	1.627	50	0		CDAARO
NC(=O)[C@@]1(Cc2cccc(-c3cncnc3)c2)CCC[NH2+]1	ZINC000072352827	176374475	/nfs/dbraw/zinc/37/44/75/176374475.db2.gz	IELUHLCPYPVFIQ-INIZCTEOSA-N	1	0	282.347	1.294	50	0		CDAARO
CCc1ccccc1CN1C(=O)NC2(CC[NH2+]CC2)C1=O	ZINC000077452802	177270673	/nfs/dbraw/zinc/27/06/73/177270673.db2.gz	GHFVMFVCTPKYBG-UHFFFAOYSA-N	1	0	287.363	1.423	50	0		CDAARO
CS(=O)(=O)NC1CC[NH+](C[C@H]2CC=CCC2)CC1	ZINC000077554469	177280872	/nfs/dbraw/zinc/28/08/72/177280872.db2.gz	HOJRFIATRBGGDR-LBPRGKRZSA-N	1	0	272.414	1.356	50	0		CDAARO
[NH3+][C@H]1CCOc2c(Br)cccc2[C@@H]1O	ZINC000062626553	274963141	/nfs/dbraw/zinc/96/31/41/274963141.db2.gz	VDUBMHPWJFWWTE-IUCAKERBSA-N	1	0	258.115	1.592	50	0		CDAARO
c1cnn(Cc2ccccc2[C@@H]2[NH2+]CCc3nc[nH]c32)c1	ZINC000065409508	275074372	/nfs/dbraw/zinc/07/43/72/275074372.db2.gz	PDMSTCKGCOTDJV-HNNXBMFYSA-N	1	0	279.347	1.890	50	0		CDAARO
COC[C@@H]([NH2+]Cc1nnc2n1CCCCC2)C1CC1	ZINC000095419401	277248412	/nfs/dbraw/zinc/24/84/12/277248412.db2.gz	AJMFQSIGOPVUHA-GFCCVEGCSA-N	1	0	264.373	1.519	50	0		CDAARO
CC(C)CCN1CC2(CC[NH+]([C@H](C)CO)CC2)OC1=O	ZINC000072433626	277353959	/nfs/dbraw/zinc/35/39/59/277353959.db2.gz	KUFVQLKTZNFMKJ-CYBMUJFWSA-N	1	0	284.400	1.700	50	0		CDAARO
COc1ccc(OC[C@@H](O)C[NH+]2CCCCC2)cc1	ZINC000000189907	277922224	/nfs/dbraw/zinc/92/22/24/277922224.db2.gz	RDFFRMBMQFHLKQ-ZDUSSCGKSA-N	1	0	265.353	1.921	50	0	aggregator	CDAARO
COc1nccnc1N1CC([N@@H+]2CCCC[C@H]2C)C1	ZINC000096138473	278098257	/nfs/dbraw/zinc/09/82/57/278098257.db2.gz	NYIHCTMWRCCUKH-LLVKDONJSA-N	1	0	262.357	1.548	50	0		CDAARO
C[C@H]1CCCN(S(=O)(=O)c2ccccc2F)[C@H]1C[NH3+]	ZINC000251602259	278343531	/nfs/dbraw/zinc/34/35/31/278343531.db2.gz	BTLLAKFYSIOQLD-JQWIXIFHSA-N	1	0	286.372	1.574	50	0		CDAARO
Cc1cc(C(=O)N2CCOC[C@H]2C[NH+](C)C)c(C)o1	ZINC000085470085	278637053	/nfs/dbraw/zinc/63/70/53/278637053.db2.gz	MHGIBKAKGZCRRP-GFCCVEGCSA-N	1	0	266.341	1.299	50	0		CDAARO
C[C@@H](C(=O)NC1CC1)[NH+]1CCc2ccccc2CC1	ZINC000071909402	279210139	/nfs/dbraw/zinc/21/01/39/279210139.db2.gz	RAIKGELZAJBXQM-LBPRGKRZSA-N	1	0	258.365	1.754	50	0		CDAARO
[NH3+][C@@H]1CCCC[C@H]1NC(=O)c1cc(-c2ccncc2)on1	ZINC000128865490	279581035	/nfs/dbraw/zinc/58/10/35/279581035.db2.gz	QUUWUKPVYLTBKH-VXGBXAGGSA-N	1	0	286.335	1.736	50	0		CDAARO
[NH3+]C[C@H]1CN(c2nc3cc(Cl)ccc3o2)CCO1	ZINC000022637904	279657369	/nfs/dbraw/zinc/65/73/69/279657369.db2.gz	XWNXQWYCGICPDT-VIFPVBQESA-N	1	0	267.716	1.645	50	0		CDAARO
Cc1ccc(C(=O)N2CCN(C)C[C@H]2C[NH3+])cc1Cl	ZINC000095411888	280766984	/nfs/dbraw/zinc/76/69/84/280766984.db2.gz	IVONJGKURCRQST-GFCCVEGCSA-N	1	0	281.787	1.363	50	0		CDAARO
Cc1ccc(C(N)=O)cc1NC(=O)NCC[C@H]1CCC[NH2+]1	ZINC000097572372	280794236	/nfs/dbraw/zinc/79/42/36/280794236.db2.gz	JVRSUTNXDPSMHB-GFCCVEGCSA-N	1	0	290.367	1.358	50	0		CDAARO
CC[C@H]1CN(S(C)(=O)=O)CC[C@H]1[NH2+]CC1CC1	ZINC000240626755	288296640	/nfs/dbraw/zinc/29/66/40/288296640.db2.gz	HJAPPOWOESWXFX-NWDGAFQWSA-N	1	0	260.403	1.046	50	0		CDAARO
CCC(=O)N1CC[C@H]([NH2+][C@@H]2CC(C)(C)OC2(C)C)C1	ZINC000095969367	289062651	/nfs/dbraw/zinc/06/26/51/289062651.db2.gz	JYZPMUUASFCKPX-NWDGAFQWSA-N	1	0	268.401	1.933	50	0		CDAARO
Cn1c(CN2CCCCC2)nnc1[C@H]1CCC[N@H+](C)C1	ZINC000072436302	294152745	/nfs/dbraw/zinc/15/27/45/294152745.db2.gz	SLHAOCNIJZVKKP-ZDUSSCGKSA-N	1	0	277.416	1.610	50	0		CDAARO
O=C(C[NH+]1CCCC1)N1CCC2(CCOCC2)CC1	ZINC000071735878	295498520	/nfs/dbraw/zinc/49/85/20/295498520.db2.gz	ZNHMBWYPXWZIHV-UHFFFAOYSA-N	1	0	266.385	1.501	50	0		CDAARO
CSCC(=O)NC[C@@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534586678	328315557	/nfs/dbraw/zinc/31/55/57/328315557.db2.gz	VVCPBPOEEOHBTG-NSHDSACASA-N	1	0	256.415	1.730	50	0		CDAARO
Cc1ccc(C2([NH2+][C@@H](C)CN(C)CCO)CC2)cc1	ZINC000534588338	328316431	/nfs/dbraw/zinc/31/64/31/328316431.db2.gz	JWQSLEAMAYYIQZ-AWEZNQCLSA-N	1	0	262.397	1.886	50	0		CDAARO
CC(C)[N@H+](C)CCNC(=O)NC[C@@H](O)c1cccc(O)c1	ZINC000534646493	328329761	/nfs/dbraw/zinc/32/97/61/328329761.db2.gz	JLYUBAFUZLNLBH-CQSZACIVSA-N	1	0	295.383	1.065	50	0		CDAARO
O=C([C@H]1C=CC[NH2+]1)N1CCC(c2ccncc2)CC1	ZINC000534638593	328334933	/nfs/dbraw/zinc/33/49/33/328334933.db2.gz	PTGHJRPUTSRRAX-CQSZACIVSA-N	1	0	257.337	1.316	50	0		CDAARO
O=C([C@H]1C=CC[NH2+]1)N1CCCN(Cc2cccs2)CC1	ZINC000534641512	328336380	/nfs/dbraw/zinc/33/63/80/328336380.db2.gz	GLAJLHBTXSWEOO-CQSZACIVSA-N	1	0	291.420	1.310	50	0		CDAARO
COc1cc2c(cc1OC)CN(C(=O)[C@H]1C=CC[NH2+]1)CC2	ZINC000534655921	328339658	/nfs/dbraw/zinc/33/96/58/328339658.db2.gz	SSEBTVFZOPWRIM-CYBMUJFWSA-N	1	0	288.347	1.117	50	0		CDAARO
O=C(c1cncc(Cl)c1)N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000534670170	328346929	/nfs/dbraw/zinc/34/69/29/328346929.db2.gz	YAGCUZRHRCOHHP-MPZDIEGVSA-N	1	0	277.755	1.557	50	0		CDAARO
C[NH+](C)C1(CNC(=O)CCN2CCCCC2=O)CCCC1	ZINC000534671602	328347882	/nfs/dbraw/zinc/34/78/82/328347882.db2.gz	ORMUCPZEASXAHI-UHFFFAOYSA-N	1	0	295.427	1.380	50	0		CDAARO
O=S(=O)(Cc1ccc(Cl)cc1)NC[C@@H]1CCC[NH2+]1	ZINC000534672288	328348116	/nfs/dbraw/zinc/34/81/16/328348116.db2.gz	FPAXZSIKDRXJQU-LBPRGKRZSA-N	1	0	288.800	1.511	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@@H](C)[C@@H]2CCOC2)cc1	ZINC000095988355	328524515	/nfs/dbraw/zinc/52/45/15/328524515.db2.gz	NMWJCNOCOSBYLI-SMDDNHRTSA-N	1	0	263.337	1.988	50	0		CDAARO
COc1ccc2c(c1)c1c3n2CC[NH+]=C3N(C)CC1	ZINC000004959854	326813556	/nfs/dbraw/zinc/81/35/56/326813556.db2.gz	FPVFIBNGMCUWPM-UHFFFAOYSA-N	1	0	255.321	1.898	50	0		CDAARO
CSC[C@H](C)CNC(=O)N(C)[C@H]1CC[N@H+](C)C[C@H]1C	ZINC000085404569	482581357	/nfs/dbraw/zinc/58/13/57/482581357.db2.gz	KHKSNNYKWADIFF-UPJWGTAASA-N	1	0	287.473	1.967	50	0		CDAARO
COCc1cc(N2C[C@H]([NH3+])[C@@H](C(C)C)C2)ncn1	ZINC000091915152	482592152	/nfs/dbraw/zinc/59/21/52/482592152.db2.gz	RDXUTNMQJYJNBK-NEPJUHHUSA-N	1	0	250.346	1.043	50	0		CDAARO
CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1C[C@H]1CNC(=O)C1	ZINC000585094338	482828744	/nfs/dbraw/zinc/82/87/44/482828744.db2.gz	LAQZRBYQEKJSNF-RKDXNWHRSA-N	1	0	264.291	1.785	50	0		CDAARO
Cc1csc(C[N@@H+](C)[C@H]2CCNC(=O)CC2)n1	ZINC000670438678	482981884	/nfs/dbraw/zinc/98/18/84/482981884.db2.gz	KIPXBBCSWHAFDL-SNVBAGLBSA-N	1	0	253.371	1.552	50	0		CDAARO
CCN1C[C@H](C[N@H+](C)C2CSCCSC2)CC1=O	ZINC000670453873	483023842	/nfs/dbraw/zinc/02/38/42/483023842.db2.gz	GETFFFKBSYWUPB-NSHDSACASA-N	1	0	288.482	1.635	50	0		CDAARO
O=C1CN(CC[C@@H]2CCOC2)CCN1C1CCCCC1	ZINC000670454102	483026017	/nfs/dbraw/zinc/02/60/17/483026017.db2.gz	HQWGZSSWWZYMDW-CQSZACIVSA-N	1	0	280.412	1.890	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(C(=O)CCC2CCCC2)C[C@H]1O	ZINC000670457703	483038266	/nfs/dbraw/zinc/03/82/66/483038266.db2.gz	MENRWFLDSVMQFB-LSDHHAIUSA-N	1	0	282.428	1.728	50	0		CDAARO
Cc1nc2c([nH]1)C[N@H+](CCCn1ccnc1C)CC2	ZINC000670462536	483050251	/nfs/dbraw/zinc/05/02/51/483050251.db2.gz	HAZRWVGBIGZGPL-UHFFFAOYSA-N	1	0	259.357	1.671	50	0		CDAARO
CCn1ccc(C[N@@H+]2CC[C@H](O)CC(C)(C)C2)n1	ZINC000670469208	483063229	/nfs/dbraw/zinc/06/32/29/483063229.db2.gz	BSOYRSRWRXFQSU-ZDUSSCGKSA-N	1	0	251.374	1.886	50	0		CDAARO
C[C@H]([NH2+]CC(=O)NCc1cccs1)C1CCOCC1	ZINC000096492030	533825253	/nfs/dbraw/zinc/82/52/53/533825253.db2.gz	SQVWIMIXMJAPKF-NSHDSACASA-N	1	0	282.409	1.769	50	0		CDAARO
COC(=O)c1ccc(NC(=O)C[NH2+]Cc2cccnc2)cc1	ZINC000012602481	534201868	/nfs/dbraw/zinc/20/18/68/534201868.db2.gz	SXMPVJOKFDSIEO-UHFFFAOYSA-N	1	0	299.330	1.597	50	0		CDAARO
CC(C)COC[C@H](O)C[N@@H+]1CC[C@]2(O)CCCC[C@H]2C1	ZINC000241338526	519757966	/nfs/dbraw/zinc/75/79/66/519757966.db2.gz	MBLHMTWGCQWAGG-ARFHVFGLSA-N	1	0	285.428	1.647	50	0		CDAARO
COc1cc(C)ccc1OCC(=O)N1CC[C@H](C[NH3+])C1	ZINC000178567292	522275734	/nfs/dbraw/zinc/27/57/34/522275734.db2.gz	CBQXRSLRVWTHOH-GFCCVEGCSA-N	1	0	278.352	1.190	50	0		CDAARO
CC[NH+](CC)[C@@H]1CCN(C(=O)N[C@@H](C)CSC)C1	ZINC000096440479	528252990	/nfs/dbraw/zinc/25/29/90/528252990.db2.gz	JAVJKSZHPJTCGK-NWDGAFQWSA-N	1	0	273.446	1.864	50	0		CDAARO
CC(C)n1ccc(C(=O)N2CCCC[C@@H]2[C@@H](C)[NH3+])n1	ZINC000269188269	535082701	/nfs/dbraw/zinc/08/27/01/535082701.db2.gz	NYVYOWMQKYUZQK-DGCLKSJQSA-N	1	0	264.373	1.806	50	0		CDAARO
Cc1cccc(NC(=O)NCC[NH+]2CCCCC2)n1	ZINC000097142797	567905123	/nfs/dbraw/zinc/90/51/23/567905123.db2.gz	LBWVQTADPQKRDE-UHFFFAOYSA-N	1	0	262.357	1.997	50	0		CDAARO
CCCN1C[C@H]([NH2+]Cc2cccc3nonc32)CC1=O	ZINC000952978599	614812939	/nfs/dbraw/zinc/81/29/39/614812939.db2.gz	RCFRLRGYRSBTNQ-LLVKDONJSA-N	1	0	274.324	1.323	50	0		CDAARO
[NH3+][C@H]1CCCCCC[C@@H]1C(=O)N1CCC(O)CC1	ZINC000888096027	617757871	/nfs/dbraw/zinc/75/78/71/617757871.db2.gz	HPJWYAXGCHUHCP-STQMWFEESA-N	1	0	254.374	1.267	50	0		CDAARO
Cc1nc(/C=C/C(=O)N2CC[NH2+]C[C@@H]2C)cs1	ZINC000126382853	617956800	/nfs/dbraw/zinc/95/68/00/617956800.db2.gz	BXLMSQYLSJBVON-NWALNABHSA-N	1	0	251.355	1.285	50	0		CDAARO
c1ccc(N2CCN([C@H]3C[NH+]4CCC3CC4)CC2)cc1	ZINC000022454662	1158794107	/nfs/dbraw/zinc/79/41/07/1158794107.db2.gz	YSSWNPOYPNFUGE-KRWDZBQOSA-N	1	0	271.408	1.903	50	0		CDAARO
CCc1cc(N2C[C@@H]3[C@H](O)C[C@@H]3C2)nc(N2CCCC2)[nH+]1	ZINC001772710863	1159445118	/nfs/dbraw/zinc/44/51/18/1159445118.db2.gz	SUCIWEIHZAGWOO-KWCYVHTRSA-N	1	0	288.395	1.456	50	0		CDAARO
CC(=O)c1cnc(N(C)C[C@]2(C)CC[N@H+](C)C2)nc1C	ZINC001704306022	1177682361	/nfs/dbraw/zinc/68/23/61/1177682361.db2.gz	ZKRTWJLJCWENTF-OAHLLOKOSA-N	1	0	276.384	1.766	50	0		CDAARO
CSc1nc(N)cc(N(C)C[C@@H]2CCC[N@@H+]2C)n1	ZINC000156843325	1178194555	/nfs/dbraw/zinc/19/45/55/1178194555.db2.gz	ICAUVDLFUMYZOA-VIFPVBQESA-N	1	0	267.402	1.311	50	0		CDAARO
Cc1ccc(O)cc1C(=O)N1C[C@H](C)[N@@H+](C)C[C@H]1C	ZINC000585135287	1164216905	/nfs/dbraw/zinc/21/69/05/1164216905.db2.gz	AGBYZSGOMGHARG-NWDGAFQWSA-N	1	0	262.353	1.865	50	0		CDAARO
[NH3+]C[C@@H](C(=O)N1CC(OCC(F)F)C1)c1ccccc1	ZINC000707215324	835862059	/nfs/dbraw/zinc/86/20/59/835862059.db2.gz	JSODIVCYZBPTGY-GFCCVEGCSA-N	1	0	284.306	1.221	50	0		CDAARO
C[C@@H](C(=O)OC(C)(C)C)N1[C@@H]2CC[C@H]1C[N@H+](C)CC2	ZINC000717402984	836748827	/nfs/dbraw/zinc/74/88/27/836748827.db2.gz	ACYQPSHXFNUULM-XQQFMLRXSA-N	1	0	268.401	1.885	50	0		CDAARO
CCc1nccn1CC[N@@H+]1CCC[C@H](NC(C)=O)C1	ZINC000244695652	837278464	/nfs/dbraw/zinc/27/84/64/837278464.db2.gz	JPVMULNGNBTVJK-ZDUSSCGKSA-N	1	0	264.373	1.046	50	0		CDAARO
Cc1cccc(C[NH2+]CCNc2cc[nH+]cc2C)n1	ZINC000952990291	837372347	/nfs/dbraw/zinc/37/23/47/837372347.db2.gz	HTAFLWGXNCYWQT-UHFFFAOYSA-N	1	0	256.353	1.717	50	0		CDAARO
COC[C@@H]([NH3+])C(=O)N1CCC(Oc2ccccc2C)CC1	ZINC000082092213	840890502	/nfs/dbraw/zinc/89/05/02/840890502.db2.gz	VAGLGYGNZIRNFT-CQSZACIVSA-N	1	0	292.379	1.339	50	0		CDAARO
Cc1ncoc1C[NH2+]CCNC(=O)c1ccccc1F	ZINC000864087945	841058385	/nfs/dbraw/zinc/05/83/85/841058385.db2.gz	UQRCTPWMNGPIMI-UHFFFAOYSA-N	1	0	277.299	1.642	50	0		CDAARO
CC(C)(CN1CC[C@]([NH3+])(C(=O)[O-])C1)C[NH+]1CCCCCC1	ZINC000067955750	841556893	/nfs/dbraw/zinc/55/68/93/841556893.db2.gz	RTFSQEVYUXQMPM-MRXNPFEDSA-N	1	0	297.443	1.376	50	0		CDAARO
Cc1ncc(C(=O)N(C)C2CC[NH+](C)CC2)s1	ZINC000195456340	842845826	/nfs/dbraw/zinc/84/58/26/842845826.db2.gz	LCQJTOFZHKRJKS-UHFFFAOYSA-N	1	0	253.371	1.618	50	0		CDAARO
C[C@@H](C[NH+]1CCCCC1)NCc1cc(=O)[nH]cn1	ZINC000023312253	842834884	/nfs/dbraw/zinc/83/48/84/842834884.db2.gz	CQCFAVQNMMXFOQ-NSHDSACASA-N	1	0	250.346	1.146	50	0		CDAARO
O=C1C[C@@H]([NH2+]Cc2cnc[nH]2)CN1C1Cc2ccccc2C1	ZINC000012196528	921395023	/nfs/dbraw/zinc/39/50/23/921395023.db2.gz	WQYXTPJCDNZXCL-CQSZACIVSA-N	1	0	296.374	1.268	50	0		CDAARO
Cc1nc(CN(C(=O)[C@@H]2CCC[N@@H+]2C)C(C)C)no1	ZINC000952862958	910416544	/nfs/dbraw/zinc/41/65/44/910416544.db2.gz	SWUFJWOZTMDQFB-NSHDSACASA-N	1	0	266.345	1.209	50	0		CDAARO
CCCNC(=O)C[NH2+][C@@H]1CCCO[C@H]1c1cnn(CC)c1	ZINC000952877469	910434419	/nfs/dbraw/zinc/43/44/19/910434419.db2.gz	QGVJMLUACZXPDB-HIFRSBDPSA-N	1	0	294.399	1.239	50	0		CDAARO
NS(=O)(=O)CCC[N@@H+]1CCC[C@@H](c2ccncc2)CC1	ZINC000952879630	910439064	/nfs/dbraw/zinc/43/90/64/910439064.db2.gz	FYUXMSPZTOMRDL-CYBMUJFWSA-N	1	0	297.424	1.330	50	0		CDAARO
CC(C)=CC[NH+]1CCC(CNC(=O)c2ccnnc2)CC1	ZINC000952961866	910471058	/nfs/dbraw/zinc/47/10/58/910471058.db2.gz	DXTNMKJTMMIUAQ-UHFFFAOYSA-N	1	0	288.395	1.885	50	0		CDAARO
C[C@@H](CN1CCN(C)CC1)[NH+]1CCC(c2cc[nH]n2)CC1	ZINC000821746002	925595752	/nfs/dbraw/zinc/59/57/52/925595752.db2.gz	GBVFYVYSWHFHSF-AWEZNQCLSA-N	1	0	291.443	1.225	50	0		CDAARO
CCC1(CC)CC[N@@H+]([C@H](C)CNS(=O)(=O)CC)C1	ZINC000822677177	925645621	/nfs/dbraw/zinc/64/56/21/925645621.db2.gz	HMOQBGUPMHIWCY-GFCCVEGCSA-N	1	0	276.446	1.826	50	0		CDAARO
CC[N@@H+]1CC[C@@H](CN(C)S(=O)(=O)CC2CCCC2)C1	ZINC000823104882	925672797	/nfs/dbraw/zinc/67/27/97/925672797.db2.gz	AMRPGXFNRSPXAO-AWEZNQCLSA-N	1	0	288.457	1.780	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CCNS(=O)(=O)CC1CCCC1	ZINC000823778011	925730189	/nfs/dbraw/zinc/73/01/89/925730189.db2.gz	YPQGNSVAYZIYBF-CQSZACIVSA-N	1	0	288.457	1.970	50	0		CDAARO
CC(C)[C@H](O)C(=O)N(C)Cc1ccc2c(c1)C[N@@H+](C)C2	ZINC000823806405	925730200	/nfs/dbraw/zinc/73/02/00/925730200.db2.gz	RPWNDIPJBWOZIC-HNNXBMFYSA-N	1	0	276.380	1.607	50	0		CDAARO
CNc1nc(N2CC[NH+](CC3CC3)CC2)ncc1F	ZINC000824091039	925800017	/nfs/dbraw/zinc/80/00/17/925800017.db2.gz	KONTYEROUMGYGG-UHFFFAOYSA-N	1	0	265.336	1.189	50	0		CDAARO
COCC1(CNC(=O)C[N@@H+]2C[C@@H]3CC[C@H]2C3)CCC1	ZINC000824347294	925817853	/nfs/dbraw/zinc/81/78/53/925817853.db2.gz	VKXHRFUNLUVHQI-OLZOCXBDSA-N	1	0	266.385	1.404	50	0		CDAARO
CCN1CCCn2ccnc2[C@H]1C1CC[NH+](CCO)CC1	ZINC000581814676	927207627	/nfs/dbraw/zinc/20/76/27/927207627.db2.gz	WTQRAYNDLYINDR-OAHLLOKOSA-N	1	0	292.427	1.354	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1nc(SC)ncc1CO	ZINC000585092499	930921347	/nfs/dbraw/zinc/92/13/47/930921347.db2.gz	AXTRESMNYFTWPN-GFCCVEGCSA-N	1	0	296.440	1.399	50	0		CDAARO
COc1ccccc1C[NH2+][C@H](C)[C@@H]1CN(C)CCN1C	ZINC000585117531	930984991	/nfs/dbraw/zinc/98/49/91/930984991.db2.gz	JRCYAESXUDYRND-HIFRSBDPSA-N	1	0	277.412	1.419	50	0		CDAARO
Cn1ccc(C(=O)N[C@@H]2C[C@@H]([NH+](C)C)C23CCC3)n1	ZINC000585127620	931011554	/nfs/dbraw/zinc/01/15/54/931011554.db2.gz	FMEVUGRAGYXFMJ-VXGBXAGGSA-N	1	0	262.357	1.023	50	0		CDAARO
C[C@@H]1CCC[C@@H](CC[NH+](C)C)N1C(=O)c1ccn(C)n1	ZINC000585128241	931013524	/nfs/dbraw/zinc/01/35/24/931013524.db2.gz	WVCHUCQJWSTTIS-OLZOCXBDSA-N	1	0	278.400	1.755	50	0		CDAARO
C=CC(=O)N1CCO[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]21	ZINC000404184070	940956329	/nfs/dbraw/zinc/95/63/29/940956329.db2.gz	ACFWICWWQPPDNO-CVEARBPZSA-N	1	0	286.375	1.674	50	0		CDAARO
O[C@H]1C[N@H+](CCCn2cccn2)C[C@H]1Cc1ccncc1	ZINC001529151252	968994155	/nfs/dbraw/zinc/99/41/55/968994155.db2.gz	IZVZGLOERQPQBV-CVEARBPZSA-N	1	0	286.379	1.204	50	0		CDAARO
Cn1ccnc1CC[N@@H+]1CCCN(Cc2cccnc2)CC1	ZINC001529173700	969005518	/nfs/dbraw/zinc/00/55/18/969005518.db2.gz	OLFBTTKHYUWXHV-UHFFFAOYSA-N	1	0	299.422	1.566	50	0		CDAARO
Cc1ncccc1CN(C)C[C@H]1CCC[N@H+](CCO)C1	ZINC001529191360	969009873	/nfs/dbraw/zinc/00/98/73/969009873.db2.gz	XJAYMIQEUXRRMP-OAHLLOKOSA-N	1	0	277.412	1.526	50	0		CDAARO
Cc1nc(N2CC[C@H]([NH+]3CCN(C)CC3)C2)ccc1Cl	ZINC001506404422	975151939	/nfs/dbraw/zinc/15/19/39/975151939.db2.gz	HNZAMZKTCVTEHS-ZDUSSCGKSA-N	1	0	294.830	1.870	50	0		CDAARO
Cc1cnc(C)c(N2CCOC[C@@H](C[NH+](C)C)C2)n1	ZINC001506419043	975156792	/nfs/dbraw/zinc/15/67/92/975156792.db2.gz	MKCGDUKKQDTXIT-ZDUSSCGKSA-N	1	0	264.373	1.108	50	0		CDAARO
Cn1ccnc1CCN1CC[NH+](CCc2ccccc2)CC1	ZINC001506419399	975156884	/nfs/dbraw/zinc/15/68/84/975156884.db2.gz	ZXSAZJSYJCMDMH-UHFFFAOYSA-N	1	0	298.434	1.823	50	0		CDAARO
Cc1cc(C)n2c(C[NH2+]CCOCC3CC3)cnc2n1	ZINC000096483137	230380571	/nfs/dbraw/zinc/38/05/71/230380571.db2.gz	LQTZVQHCVKTOEK-UHFFFAOYSA-N	1	0	274.368	1.862	50	0		CDAARO
Cn1nccc1CNc1cnn(CC[NH+]2CCCCC2)c1	ZINC000096502785	230385400	/nfs/dbraw/zinc/38/54/00/230385400.db2.gz	UGJOIOCXKUQVHU-UHFFFAOYSA-N	1	0	288.399	1.715	50	0		CDAARO
O=C(NC[C@@]1(O)CC[NH2+]C1)Nc1cccc2ccccc21	ZINC000097910776	230387677	/nfs/dbraw/zinc/38/76/77/230387677.db2.gz	JSRGSWLXBLTFAC-MRXNPFEDSA-N	1	0	285.347	1.686	50	0		CDAARO
Cc1nc2ccccc2nc1CN1C[C@@H]2CC[C@H](CC1=O)[NH2+]2	ZINC000095526909	282085436	/nfs/dbraw/zinc/08/54/36/282085436.db2.gz	HRTMOUZHGHZIQO-OLZOCXBDSA-N	1	0	296.374	1.791	50	0		CDAARO
COc1ccc2nc(C(=O)N3CC[NH2+]C[C@H]3C)ccc2c1	ZINC000124461348	187138436	/nfs/dbraw/zinc/13/84/36/187138436.db2.gz	IFSDIMUQELVTFC-LLVKDONJSA-N	1	0	285.347	1.677	50	0		CDAARO
Cc1csc(C[NH2+][C@H]2CCCCC[C@H]2C(N)=O)n1	ZINC000097375078	342002747	/nfs/dbraw/zinc/00/27/47/342002747.db2.gz	WJNJEGXBLSJXOI-MNOVXSKESA-N	1	0	267.398	1.975	50	0		CDAARO
CC[C@]([NH2+]CC(=O)Nc1cccc(F)c1)(C(N)=O)C(C)C	ZINC000096006556	185063128	/nfs/dbraw/zinc/06/31/28/185063128.db2.gz	IEOSPBDADOLIOY-OAHLLOKOSA-N	1	0	295.358	1.644	50	0		CDAARO
CC[C@@H](O)C[NH2+]C(C)(C)c1cn(-c2ccccc2)nn1	ZINC000096014143	185066941	/nfs/dbraw/zinc/06/69/41/185066941.db2.gz	NZPGSGRVNXXXHF-CYBMUJFWSA-N	1	0	274.368	1.863	50	0		CDAARO
O=c1c2ccc[nH]c-2nc(=S)n1CC[NH+]1CCCC1	ZINC000020618246	342048799	/nfs/dbraw/zinc/04/87/99/342048799.db2.gz	NGOQNUHFWDYSGW-UHFFFAOYSA-N	1	0	276.365	1.176	50	0		CDAARO
C[C@H](C[NH3+])N(C)S(=O)(=O)N1CCC(C(C)(C)C)CC1	ZINC000195555251	342626270	/nfs/dbraw/zinc/62/62/70/342626270.db2.gz	AUTJDLLCAARGGM-LLVKDONJSA-N	1	0	291.461	1.268	50	0		CDAARO
C[C@@H]1C[C@H](C)CN(C(=O)C[N@@H+]2CCC[C@H]2CCCO)C1	ZINC000252202062	361832053	/nfs/dbraw/zinc/83/20/53/361832053.db2.gz	WLVUVMARFFCQBE-ZNMIVQPWSA-N	1	0	282.428	1.728	50	0		CDAARO
C[C@@H]1C[C@@H](C)CN(C(=O)C[N@@H+]2CCC[C@H]2CCCO)C1	ZINC000252202061	361832115	/nfs/dbraw/zinc/83/21/15/361832115.db2.gz	WLVUVMARFFCQBE-KFWWJZLASA-N	1	0	282.428	1.728	50	0		CDAARO
CC(C)NC(=O)C[C@H](C)[NH2+][C@@H]1CN(C(C)C)C[C@H]1C	ZINC000252477639	361840108	/nfs/dbraw/zinc/84/01/08/361840108.db2.gz	RVLZQKRZMPYGSR-HZSPNIEDSA-N	1	0	269.433	1.608	50	0		CDAARO
C[C@@H](Cc1cnccn1)[N@H+](C)CCC(=O)Nc1cccnc1	ZINC000244787686	361863281	/nfs/dbraw/zinc/86/32/81/361863281.db2.gz	QBPVXGSAGFYYKF-ZDUSSCGKSA-N	1	0	299.378	1.763	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1C1CN(CCCn2cccn2)C1	ZINC000244778697	361863352	/nfs/dbraw/zinc/86/33/52/361863352.db2.gz	PUYQKWKPJDVYMA-AWEZNQCLSA-N	1	0	262.401	1.832	50	0		CDAARO
CNC(=O)C[C@@H](C)[N@H+](C)Cc1cc(OC)ccn1	ZINC000244852885	361866576	/nfs/dbraw/zinc/86/65/76/361866576.db2.gz	VBCOOGOAIBOXRL-SNVBAGLBSA-N	1	0	251.330	1.047	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1CCN1CCN(c2ccccc2)C(=O)C1	ZINC000244866468	361866627	/nfs/dbraw/zinc/86/66/27/361866627.db2.gz	VWRNFKSDXOXYBT-OAHLLOKOSA-N	1	0	287.407	1.820	50	0		CDAARO
Cc1cc(S(=O)(=O)NC[C@@H]2CCCC[NH2+]2)c(C)o1	ZINC000097235004	342205604	/nfs/dbraw/zinc/20/56/04/342205604.db2.gz	MAJXISLAJUKTQP-NSHDSACASA-N	1	0	272.370	1.317	50	0		CDAARO
C[C@H]([NH2+]CC(=O)NC1CC1)c1ccc(-n2ccnn2)cc1	ZINC000097033688	185156197	/nfs/dbraw/zinc/15/61/97/185156197.db2.gz	BTZRALRLAOMUDT-NSHDSACASA-N	1	0	285.351	1.197	50	0		CDAARO
CON1CCC(CC(=O)N[C@H]2[C@@H](C)[NH2+]CC[C@@H]2C)CC1	ZINC000585136383	342216064	/nfs/dbraw/zinc/21/60/64/342216064.db2.gz	CXXPKADGVQXVNS-YWPYICTPSA-N	1	0	283.416	1.153	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@H]1NC(=O)C[C@H](O)c1cccc(F)c1	ZINC000585136914	342216105	/nfs/dbraw/zinc/21/61/05/342216105.db2.gz	YLIFJFXVUZISMR-XYJYNPGVSA-N	1	0	294.370	1.752	50	0		CDAARO
O=C(C[N@@H+]1CC[C@H]2CCCC[C@H]2C1)N1CCNC1=O	ZINC000685945175	539046122	/nfs/dbraw/zinc/04/61/22/539046122.db2.gz	BYPICHFBSHCXNV-NEPJUHHUSA-N	1	0	265.357	1.050	50	0		CDAARO
C[C@@H]1C[N@H+](C)C[C@H]1NS(=O)(=O)Cc1ccc(F)cc1	ZINC000257366126	539096157	/nfs/dbraw/zinc/09/61/57/539096157.db2.gz	KOLRNSALKIOEPA-ZWNOBZJWSA-N	1	0	286.372	1.195	50	0		CDAARO
CSC[C@H](C)C(=O)N[C@@H]1C[C@H]([NH+](C)C)C1(C)C	ZINC000600841140	342252500	/nfs/dbraw/zinc/25/25/00/342252500.db2.gz	AHQZSXZSJBIOTG-AXFHLTTASA-N	1	0	258.431	1.830	50	0		CDAARO
CC[C@@H](O)C[NH2+][C@@H](C)C1(N2CCOCC2)CCCC1	ZINC000125845746	187202510	/nfs/dbraw/zinc/20/25/10/187202510.db2.gz	UMMFRXUHMMWUAD-UONOGXRCSA-N	1	0	270.417	1.380	50	0		CDAARO
c1cn([C@H]2CCC[N@@H+](CCO[C@@H]3CCCCO3)CC2)nn1	ZINC000585116341	362043345	/nfs/dbraw/zinc/04/33/45/362043345.db2.gz	RBLIVZWAXAORLQ-LSDHHAIUSA-N	1	0	294.399	1.848	50	0		CDAARO
CCn1cc(C(=O)Nc2ccc3c(c2)C[NH2+]CC3)cn1	ZINC000095971609	342431781	/nfs/dbraw/zinc/43/17/81/342431781.db2.gz	ZRJSNXCQPLXYSV-UHFFFAOYSA-N	1	0	270.336	1.801	50	0		CDAARO
Cn1nncc1C[NH2+]Cc1ccc([Si](C)(C)C)cc1	ZINC000290124044	362193500	/nfs/dbraw/zinc/19/35/00/362193500.db2.gz	PIDRULSTYCGLBI-UHFFFAOYSA-N	1	0	274.444	1.650	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2ccc(-n3cc(C)cn3)cc2)C1	ZINC000178982056	362251424	/nfs/dbraw/zinc/25/14/24/362251424.db2.gz	DJCXWAORGDAWSU-AWEZNQCLSA-N	1	0	298.390	1.862	50	0		CDAARO
CC(C)(C)CC(C)(C)[NH2+]CCNS(C)(=O)=O	ZINC000084169679	362260002	/nfs/dbraw/zinc/26/00/02/362260002.db2.gz	NPJUHJFFFQYTNK-UHFFFAOYSA-N	1	0	250.408	1.340	50	0		CDAARO
COCCN(CC[NH+](C)C)C(=O)c1cnn(C(C)(C)C)c1	ZINC000084325789	362261919	/nfs/dbraw/zinc/26/19/19/362261919.db2.gz	HTQWRIMWARLGPL-UHFFFAOYSA-N	1	0	296.415	1.288	50	0		CDAARO
COC[C@@H](c1ccccn1)[N@H+](C)CCc1cn[nH]c1	ZINC000252499169	362388883	/nfs/dbraw/zinc/38/88/83/362388883.db2.gz	RWNGRKOVDDNREV-AWEZNQCLSA-N	1	0	260.341	1.667	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1C(=O)NCCc1nc2ccccc2[nH]1	ZINC000097743531	530052669	/nfs/dbraw/zinc/05/26/69/530052669.db2.gz	IYMFAXLMBNQXCC-AWEZNQCLSA-N	1	0	286.379	1.706	50	0		CDAARO
O[C@]12CC[NH2+]C[C@H]1CN(c1ncccc1Cl)CC2	ZINC000095385103	136516451	/nfs/dbraw/zinc/51/64/51/136516451.db2.gz	JUKGWUHRTQYETC-GWCFXTLKSA-N	1	0	267.760	1.286	50	0		CDAARO
[NH3+]C1(CO)CCN(c2ccnc(Cc3ccccc3)n2)CC1	ZINC000097379201	136522631	/nfs/dbraw/zinc/52/26/31/136522631.db2.gz	VXODSEXBRHGXRJ-UHFFFAOYSA-N	1	0	298.390	1.357	50	0		CDAARO
C[NH+](C)CCNC(=O)c1ccc(Br)nc1	ZINC000085703319	179119028	/nfs/dbraw/zinc/11/90/28/179119028.db2.gz	VNEIXBYAXGOJFE-UHFFFAOYSA-N	1	0	272.146	1.136	50	0		CDAARO
CCCCC(=O)NCCNc1cc(N(C)C)nc(C)[nH+]1	ZINC000036708041	362834963	/nfs/dbraw/zinc/83/49/63/362834963.db2.gz	MLCMCQJMNHAJPS-UHFFFAOYSA-N	1	0	279.388	1.569	50	0		CDAARO
CCNc1cc(NCCNC(=O)CC(C)C)nc(C)[nH+]1	ZINC000036708070	362836353	/nfs/dbraw/zinc/83/63/53/362836353.db2.gz	MXIIDYCPQRFNLM-UHFFFAOYSA-N	1	0	279.388	1.791	50	0		CDAARO
Nc1c[nH+]ccc1NC[C@@H]1CCN(C(=O)C2CC2)C1	ZINC000095642834	348749019	/nfs/dbraw/zinc/74/90/19/348749019.db2.gz	LYCNQLHWMJDNNO-JTQLQIEISA-N	1	0	260.341	1.334	50	0		CDAARO
CC(=O)c1c(C=CN(C)C)n(O)c2ccccc2[n+]1=O	ZINC000137346473	348750792	/nfs/dbraw/zinc/75/07/92/348750792.db2.gz	CXVOFWGVIPJYGA-CMDGGOBGSA-N	1	0	274.300	1.528	50	0		CDAARO
Cc1nonc1CNC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000584891043	349350484	/nfs/dbraw/zinc/35/04/84/349350484.db2.gz	SHIPJLRKFZKKBZ-UHFFFAOYSA-N	1	0	252.362	1.777	50	0		CDAARO
CCOCCC(=O)NC(C)(C)C[NH+]1CCCCC1	ZINC000584895660	349355900	/nfs/dbraw/zinc/35/59/00/349355900.db2.gz	JHMFLDOJVDOGLW-UHFFFAOYSA-N	1	0	256.390	1.794	50	0		CDAARO
CC(C)[C@H]1CN(C(=O)CCC(F)(F)F)C[C@@H]1[NH3+]	ZINC000091351284	180137841	/nfs/dbraw/zinc/13/78/41/180137841.db2.gz	VCESBYQMWQBTJK-BDAKNGLRSA-N	1	0	252.280	1.771	50	0		CDAARO
Cc1cnn(CCCNC(=O)CC[C@@H]2CCC[N@@H+](C)C2)c1	ZINC000091486640	180167372	/nfs/dbraw/zinc/16/73/72/180167372.db2.gz	BACXTGBTJKXDGF-HNNXBMFYSA-N	1	0	292.427	1.820	50	0		CDAARO
C[C@@H]1C[N@H+](CCC(=O)NC2CCCC2)CC[C@]1(C)O	ZINC000091563073	180192860	/nfs/dbraw/zinc/19/28/60/180192860.db2.gz	FLLFHJUEPXJYNK-DOMZBBRYSA-N	1	0	268.401	1.528	50	0		CDAARO
CC[N@H+](C)C[C@@H]1CN(Cc2ccc(F)cc2)C[C@@H]1CO	ZINC000091620597	180208781	/nfs/dbraw/zinc/20/87/81/180208781.db2.gz	UYFMXIKXTNPNIW-HUUCEWRRSA-N	1	0	280.387	1.818	50	0		CDAARO
Nc1nc(NCCCn2ccnc2)c2c([nH+]1)CCCC2	ZINC000091643910	180214362	/nfs/dbraw/zinc/21/43/62/180214362.db2.gz	ZBCQJFKPRKBJLZ-UHFFFAOYSA-N	1	0	272.356	1.636	50	0		CDAARO
C[C@H](CNC(=O)c1ccoc1)N1C[C@@H](C)O[C@@H](C)C1	ZINC000105632551	186066144	/nfs/dbraw/zinc/06/61/44/186066144.db2.gz	SPIIHKBYVMSHON-UTUOFQBUSA-N	1	0	266.341	1.507	50	0		CDAARO
CNc1nc(C)c(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)s1	ZINC000091988400	180299537	/nfs/dbraw/zinc/29/95/37/180299537.db2.gz	HABRMPKVUGUTOZ-ZJUUUORDSA-N	1	0	280.397	1.303	50	0		CDAARO
COCC[C@@]1(CO)CCC[N@H+](Cc2cc(C)n[nH]2)C1	ZINC000092064753	180316227	/nfs/dbraw/zinc/31/62/27/180316227.db2.gz	WCRJFRYHMHFJEQ-AWEZNQCLSA-N	1	0	267.373	1.329	50	0		CDAARO
C[C@@H]1C[C@@H]1C(=O)NC[C@H](Cc1ccccc1)[NH+](C)C	ZINC000105884190	186082798	/nfs/dbraw/zinc/08/27/98/186082798.db2.gz	JCSYCQLPDLIYJS-SNPRPXQTSA-N	1	0	260.381	1.932	50	0		CDAARO
CC(C)(C)C(=O)Nc1ccc(C(=O)NCC[NH3+])cc1	ZINC000061966076	362958591	/nfs/dbraw/zinc/95/85/91/362958591.db2.gz	UTINLDCDLLYPFM-UHFFFAOYSA-N	1	0	263.341	1.360	50	0		CDAARO
CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)NC[C@H]1CCOC1	ZINC000106847945	186141141	/nfs/dbraw/zinc/14/11/41/186141141.db2.gz	CHYJKRZWTAWBNW-HUUCEWRRSA-N	1	0	297.443	1.977	50	0		CDAARO
CC[N@H+](C)C[C@H]1CCN(C(=O)N[C@H](C)COC)C1	ZINC000106922883	186150777	/nfs/dbraw/zinc/15/07/77/186150777.db2.gz	ZMQHXJFWNZINSS-VXGBXAGGSA-N	1	0	257.378	1.005	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H](OC)CN1Cc1ccc(C)cc1	ZINC000108322641	186210455	/nfs/dbraw/zinc/21/04/55/186210455.db2.gz	JPATTXATSVWMLD-KGLIPLIRSA-N	1	0	263.337	1.757	50	0		CDAARO
COC[C@@H]1CCN(C(=O)[C@H]2CCCC[N@@H+]2C(C)C)C1	ZINC000110618624	186305636	/nfs/dbraw/zinc/30/56/36/186305636.db2.gz	TYLQKQOETFMNHF-ZIAGYGMSSA-N	1	0	268.401	1.744	50	0		CDAARO
CS(=O)(=O)CC[N@@H+]1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000110642308	186308715	/nfs/dbraw/zinc/30/87/15/186308715.db2.gz	UHLAUJUTUFGHET-HUUCEWRRSA-N	1	0	297.420	1.619	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H]1C(=O)N1CCC[C@H]1Cn1cccn1	ZINC000257365832	350963255	/nfs/dbraw/zinc/96/32/55/350963255.db2.gz	SVNKQGKCNOSRKQ-LSDHHAIUSA-N	1	0	290.411	1.749	50	0		CDAARO
CNC(=O)CN1CCC([NH2+]Cc2cc(F)ccc2F)CC1	ZINC000036990257	363312450	/nfs/dbraw/zinc/31/24/50/363312450.db2.gz	MGATZBWZIVEJAN-UHFFFAOYSA-N	1	0	297.349	1.265	50	0		CDAARO
C[C@@H](O)C[NH2+]C[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000002639612	355977987	/nfs/dbraw/zinc/97/79/87/355977987.db2.gz	ZYCUQNVZGLYZEI-SCZZXKLOSA-N	1	0	294.178	1.704	50	0		CDAARO
[NH3+]CCS[C@H]1CC(=O)N(Cc2cccs2)C1=O	ZINC000002887268	355986197	/nfs/dbraw/zinc/98/61/97/355986197.db2.gz	ZFHMDDMFWUYZPV-VIFPVBQESA-N	1	0	270.379	1.068	50	0		CDAARO
C[NH+](C)CCNC(=O)NC(=O)c1ccc(Cl)cc1	ZINC000001891142	355954750	/nfs/dbraw/zinc/95/47/50/355954750.db2.gz	IVHTWBWKCJSRNF-UHFFFAOYSA-N	1	0	269.732	1.341	50	0		CDAARO
C[NH2+][C@H]1c2cc(Br)ccc2OC[C@@H]1CO	ZINC000003912785	356013015	/nfs/dbraw/zinc/01/30/15/356013015.db2.gz	GRTHRMQDCVCQBA-WRWORJQWSA-N	1	0	272.142	1.711	50	0		CDAARO
COc1ccc(S(=O)(=O)NCC[C@@H]2CCC[N@@H+]2C)cc1	ZINC000004165602	356020852	/nfs/dbraw/zinc/02/08/52/356020852.db2.gz	MYGXMEUQXVICEI-LBPRGKRZSA-N	1	0	298.408	1.458	50	0		CDAARO
C[C@H](NC(=O)CN(C)C1CC[NH+](C)CC1)c1ccccc1	ZINC000002638906	356091815	/nfs/dbraw/zinc/09/18/15/356091815.db2.gz	TVNZOLPLPLJKFC-AWEZNQCLSA-N	1	0	289.423	1.890	50	0		CDAARO
COc1cc(C[C@@H]2CC(C[NH3+])=NO2)c(OC)c2c1OCO2	ZINC000015081273	356406348	/nfs/dbraw/zinc/40/63/48/356406348.db2.gz	ZOPXUQFOIQVMSK-SNVBAGLBSA-N	1	0	294.307	1.079	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)/C=C\c2ccc3c(c2)OCCO3)C1	ZINC000255431475	356407049	/nfs/dbraw/zinc/40/70/49/356407049.db2.gz	OHOGREPVMOYWDX-AGLBCWCQSA-N	1	0	288.347	1.421	50	0		CDAARO
COc1cc(OC)cc(C(=O)NC2CC[NH+](C)CC2)c1	ZINC000016604073	356442973	/nfs/dbraw/zinc/44/29/73/356442973.db2.gz	HZDQOEKUIKFBPD-UHFFFAOYSA-N	1	0	278.352	1.528	50	0		CDAARO
CC[NH+]1CCN(Cc2ccc(OC)c(OC)c2OC)CC1	ZINC000019536740	356491452	/nfs/dbraw/zinc/49/14/52/356491452.db2.gz	KGXHBWFPAYRTST-UHFFFAOYSA-N	1	0	294.395	1.850	50	0		CDAARO
COc1ccccc1N1CCN(C(=O)[C@H]2CCC[NH2+]2)CC1	ZINC000019509533	356488631	/nfs/dbraw/zinc/48/86/31/356488631.db2.gz	PIXDZRAFDOBLOC-CYBMUJFWSA-N	1	0	289.379	1.096	50	0		CDAARO
Cc1cccc(NC(=O)CC[NH+]2CCN(C)CC2)c1	ZINC000019235131	356477946	/nfs/dbraw/zinc/47/79/46/356477946.db2.gz	PBICKOCCTDLLGT-UHFFFAOYSA-N	1	0	261.369	1.571	50	0		CDAARO
CCNC(=O)NCC1(C(F)(F)F)CC[NH2+]CC1	ZINC000725264786	538455727	/nfs/dbraw/zinc/45/57/27/538455727.db2.gz	XAYVCYUSAPCTSZ-UHFFFAOYSA-N	1	0	253.268	1.238	50	0		CDAARO
C[C@H]1CCC[N@H+](CCOc2ccc(S(N)(=O)=O)cc2)C1	ZINC000027342107	356706010	/nfs/dbraw/zinc/70/60/10/356706010.db2.gz	UWXWPPFNGMCMRF-LBPRGKRZSA-N	1	0	298.408	1.445	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2cn[nH]c2)CCCCC1	ZINC000040809355	357009940	/nfs/dbraw/zinc/00/99/40/357009940.db2.gz	AAMHKHXRJYCHID-UHFFFAOYSA-N	1	0	250.346	1.404	50	0		CDAARO
Cc1cc[nH+]c(NCCNC(=O)CCN2CCCCO2)c1	ZINC000055369725	357332122	/nfs/dbraw/zinc/33/21/22/357332122.db2.gz	AQONCUSWOYPYNO-UHFFFAOYSA-N	1	0	292.383	1.336	50	0		CDAARO
CCS(=O)(=O)CCN(C)CC[C@H]1CCCC[N@@H+]1C	ZINC000096441543	357473028	/nfs/dbraw/zinc/47/30/28/357473028.db2.gz	YLPOLZUUKUGTKY-CYBMUJFWSA-N	1	0	276.446	1.227	50	0		CDAARO
C[N@@H+]1CCN2CCN(C(=O)C/C=C/c3ccccc3)C[C@@H]2C1	ZINC000065490870	357544187	/nfs/dbraw/zinc/54/41/87/357544187.db2.gz	XENJWNKWNLJGSA-JZLODUJNSA-N	1	0	299.418	1.548	50	0		CDAARO
Cc1cc2c(c(-c3ccc(N(C)C)nn3)c1)O[C@H](C[NH3+])C2	ZINC000067673618	357617749	/nfs/dbraw/zinc/61/77/49/357617749.db2.gz	QNGDRJITMUWNTL-LBPRGKRZSA-N	1	0	284.363	1.780	50	0		CDAARO
CC[N@@H+](Cc1c(CO)cnc(C)c1O)C[C@H]1CCCO1	ZINC000067673685	357617820	/nfs/dbraw/zinc/61/78/20/357617820.db2.gz	IUHILNMXOOHCEY-CYBMUJFWSA-N	1	0	280.368	1.589	50	0		CDAARO
Cc1nc(C[NH3+])cc(NC[C@H](O)c2ccccc2)n1	ZINC000067934213	357638758	/nfs/dbraw/zinc/63/87/58/357638758.db2.gz	XJEOGOGECMSSRO-ZDUSSCGKSA-N	1	0	258.325	1.389	50	0		CDAARO
COc1cc(CCC(=O)N2CC[NH2+][C@H](C)C2)cc(OC)c1	ZINC000188449801	357687601	/nfs/dbraw/zinc/68/76/01/357687601.db2.gz	IILSFOKACUONCK-GFCCVEGCSA-N	1	0	292.379	1.457	50	0		CDAARO
CCOC(=O)C[C@H]1CCCC[N@@H+]1Cc1cccnc1N	ZINC000072481593	357838687	/nfs/dbraw/zinc/83/86/87/357838687.db2.gz	NTWZJNIMDHOETP-CYBMUJFWSA-N	1	0	277.368	1.972	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2ccc(F)c(F)c2)CCOCC1	ZINC000073322683	357875727	/nfs/dbraw/zinc/87/57/27/357875727.db2.gz	SNEWNVUROYEMCD-UHFFFAOYSA-N	1	0	298.333	1.805	50	0		CDAARO
CCc1c(NC(=O)N2CC([NH+](C)C)C2)cnn1CC(C)C	ZINC000097113491	357983077	/nfs/dbraw/zinc/98/30/77/357983077.db2.gz	GEOFWCJIFDPMQX-UHFFFAOYSA-N	1	0	293.415	1.879	50	0		CDAARO
Cc1nnc([C@@H](C)N[C@H](CC(N)=O)C2CCCCC2)o1	ZINC000097111051	357986719	/nfs/dbraw/zinc/98/67/19/357986719.db2.gz	TYLRWECEAZAHFL-BXKDBHETSA-N	1	0	280.372	1.853	50	0		CDAARO
C[NH2+][C@@H]1CCN(Cc2ccc(OC)c(OC)c2OC)C1	ZINC000097229210	358043766	/nfs/dbraw/zinc/04/37/66/358043766.db2.gz	MYKHCWVGADUJSP-GFCCVEGCSA-N	1	0	280.368	1.506	50	0		CDAARO
Cc1ccc(C)c(S(=O)(=O)NC[C@@H]2C[C@H](F)C[NH2+]2)c1	ZINC000082091247	358145831	/nfs/dbraw/zinc/14/58/31/358145831.db2.gz	WNNSXOYSNWWJIP-RYUDHWBXSA-N	1	0	286.372	1.282	50	0		CDAARO
CC(C)[C@@H](O)CC[NH2+][C@H]1CCN(CC(F)(F)F)C1	ZINC000088734834	366429376	/nfs/dbraw/zinc/42/93/76/366429376.db2.gz	NIZGLMBHXWHSKZ-QWRGUYRKSA-N	1	0	268.323	1.620	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2cc(C(F)(F)F)n[nH]2)C[C@@H]1C1CC1	ZINC000091616409	358519714	/nfs/dbraw/zinc/51/97/14/358519714.db2.gz	CAWIJYZJPODXDN-SFYZADRCSA-N	1	0	288.273	1.238	50	0		CDAARO
CC[N@H+](C[C@@H]1CCOC1)[C@@H]1CCN(C(C)C)C1=O	ZINC000095442082	358438120	/nfs/dbraw/zinc/43/81/20/358438120.db2.gz	SBWYTIXEQAKAIP-QWHCGFSZSA-N	1	0	254.374	1.354	50	0		CDAARO
CCS(=O)(=O)N1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1	ZINC000004746103	358626900	/nfs/dbraw/zinc/62/69/00/358626900.db2.gz	OBHKVFLZCBWBCG-STQMWFEESA-N	1	0	274.430	1.532	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CCn1ncn2cccc2c1=O	ZINC000095355946	358683979	/nfs/dbraw/zinc/68/39/79/358683979.db2.gz	WZAPDBIBAFYJKG-LBPRGKRZSA-N	1	0	260.341	1.370	50	0		CDAARO
Cc1cnc(NCC[C@H]2CCC(=O)N2CC[NH+](C)C)nc1	ZINC000095365596	358686760	/nfs/dbraw/zinc/68/67/60/358686760.db2.gz	JQZGNMPPGJXFEW-CYBMUJFWSA-N	1	0	291.399	1.140	50	0		CDAARO
Cc1nnc(CCNC(=O)CC[C@H]2CCC[N@@H+](C)C2)s1	ZINC000095371979	358687531	/nfs/dbraw/zinc/68/75/31/358687531.db2.gz	XLPUHCZSMQTJAD-GFCCVEGCSA-N	1	0	296.440	1.627	50	0		CDAARO
COc1ccc2c(ccn(C[C@@H]3CC[NH2+]C3)c2=O)c1OC	ZINC000095376594	358689760	/nfs/dbraw/zinc/68/97/60/358689760.db2.gz	BYMDBZALTOSWBE-LLVKDONJSA-N	1	0	288.347	1.628	50	0		CDAARO
CCCc1nnc(N2CCC[C@H]([NH+](C)C)CC2)o1	ZINC000095383595	358690290	/nfs/dbraw/zinc/69/02/90/358690290.db2.gz	FCUOJITZKYEBKB-NSHDSACASA-N	1	0	252.362	1.943	50	0		CDAARO
CC(=O)c1cnc(N2CC[C@@H]3CC[C@H](C2)[N@@H+]3C)nc1C	ZINC000095382551	358690455	/nfs/dbraw/zinc/69/04/55/358690455.db2.gz	PSRHYGMVDMFCGG-QWHCGFSZSA-N	1	0	274.368	1.661	50	0		CDAARO
Cc1nnc([C@H]2CCC[N@H+](CCCn3ccnc3C)C2)[nH]1	ZINC000244858594	358724407	/nfs/dbraw/zinc/72/44/07/358724407.db2.gz	VOBSXJJZTPALNA-AWEZNQCLSA-N	1	0	288.399	1.888	50	0		CDAARO
COC[C@H](O)C[NH+]1CCN([C@H](C)c2ccsc2)CC1	ZINC000185477605	358782280	/nfs/dbraw/zinc/78/22/80/358782280.db2.gz	GLGABHAQZMKIBU-TZMCWYRMSA-N	1	0	284.425	1.434	50	0		CDAARO
Cc1cc(C(=O)NCC[C@@H]2CCC[N@H+]2C)cnc1C	ZINC000097641784	358789228	/nfs/dbraw/zinc/78/92/28/358789228.db2.gz	WQVITJBOCUHSIM-AWEZNQCLSA-N	1	0	261.369	1.913	50	0		CDAARO
O=C(CCOc1ccccc1)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000215266431	358882003	/nfs/dbraw/zinc/88/20/03/358882003.db2.gz	ASNZJIMHGNIBIC-AWEZNQCLSA-N	1	0	274.364	1.762	50	0		CDAARO
Cc1c(F)cccc1C[N@H+](C)C[C@H]1COCCO1	ZINC000215523608	358893409	/nfs/dbraw/zinc/89/34/09/358893409.db2.gz	ZLXABZLDDDWMFC-ZDUSSCGKSA-N	1	0	253.317	1.981	50	0		CDAARO
O=C(N[C@@H]1C[NH+]2CCC1CC2)c1cccn1C1CC1	ZINC000216130040	358926922	/nfs/dbraw/zinc/92/69/22/358926922.db2.gz	CXJLGNRDXHZQIB-CYBMUJFWSA-N	1	0	259.353	1.647	50	0		CDAARO
Cc1cccc(S(=O)(=O)N[C@H]2CC[NH2+]C2)c1Cl	ZINC000095467165	358928262	/nfs/dbraw/zinc/92/82/62/358928262.db2.gz	OATRODNOJKRHHO-VIFPVBQESA-N	1	0	274.773	1.289	50	0		CDAARO
CC(C)=CCO[C@H]1CCOC[C@H]1[NH2+]C1CCOCC1	ZINC000219141212	359079787	/nfs/dbraw/zinc/07/97/87/359079787.db2.gz	YFHICYVKVYYTAM-CABCVRRESA-N	1	0	269.385	1.895	50	0		CDAARO
Cc1c[nH+]ccc1N1CCN(C(=O)Cc2ccncc2)CC1	ZINC000222418491	359340590	/nfs/dbraw/zinc/34/05/90/359340590.db2.gz	HRIMJFQONIDXNJ-UHFFFAOYSA-N	1	0	296.374	1.676	50	0		CDAARO
[NH3+][C@H]1CCCN(S(=O)(=O)c2cccc3cnccc32)C1	ZINC000034274097	359391515	/nfs/dbraw/zinc/39/15/15/359391515.db2.gz	QFYDIQKQRVDWLJ-LBPRGKRZSA-N	1	0	291.376	1.347	50	0		CDAARO
CN1CC[N@H+](C)[C@H](Cc2nc(-c3ccccc3)no2)C1	ZINC000039387736	359527325	/nfs/dbraw/zinc/52/73/25/359527325.db2.gz	AEVNSFRXEFATKO-CYBMUJFWSA-N	1	0	272.352	1.525	50	0		CDAARO
CCOC[C@H]1CCN(C(=O)C[N@@H+]2CC[C@H](C)C2)C1	ZINC000408517905	359902675	/nfs/dbraw/zinc/90/26/75/359902675.db2.gz	OOVDAYPLLGRWBJ-STQMWFEESA-N	1	0	254.374	1.213	50	0		CDAARO
CCc1cnc(N2CC[NH+](CCC3OCCO3)CC2)s1	ZINC000408514106	359896515	/nfs/dbraw/zinc/89/65/15/359896515.db2.gz	UISBXUHFPPJLCL-UHFFFAOYSA-N	1	0	297.424	1.591	50	0		CDAARO
COC1(C(=O)N(C)Cc2ccccc2F)CC[NH2+]CC1	ZINC000178329645	189107705	/nfs/dbraw/zinc/10/77/05/189107705.db2.gz	MQKWNFZKXCNTLH-UHFFFAOYSA-N	1	0	280.343	1.553	50	0		CDAARO
Cc1nc([C@@H]2CCOC2)cc(N2CCC[NH2+]CC2)n1	ZINC000426531828	360681510	/nfs/dbraw/zinc/68/15/10/360681510.db2.gz	ROZYFGQUVHMFDW-GFCCVEGCSA-N	1	0	262.357	1.089	50	0		CDAARO
CC[NH+](CC)CCNC(=O)NC[C@@H](O)c1ccc(O)cc1	ZINC000426618399	360689554	/nfs/dbraw/zinc/68/95/54/360689554.db2.gz	UIJLTKBKIABKPI-CQSZACIVSA-N	1	0	295.383	1.067	50	0		CDAARO
O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)[C@@H]1CC[NH2+]C1	ZINC000178471200	189119078	/nfs/dbraw/zinc/11/90/78/189119078.db2.gz	PSAYWRPQHXMARL-RBSFLKMASA-N	1	0	274.364	1.632	50	0		CDAARO
COc1ccc(Cl)cc1CC(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178514075	189122521	/nfs/dbraw/zinc/12/25/21/189122521.db2.gz	CIARSUCSXIWIIF-JTQLQIEISA-N	1	0	282.771	1.698	50	0		CDAARO
O=C(NCCc1cc[nH]n1)[C@@H]1CCC[N@@H+]2CCCC[C@H]12	ZINC000426438916	360670902	/nfs/dbraw/zinc/67/09/02/360670902.db2.gz	RCXXNOBRHCUNPJ-ZIAGYGMSSA-N	1	0	276.384	1.333	50	0		CDAARO
C[C@H](Cc1ccccc1F)C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178582128	189128437	/nfs/dbraw/zinc/12/84/37/189128437.db2.gz	DTCIBEQBEKYTLQ-VXGBXAGGSA-N	1	0	264.344	1.812	50	0		CDAARO
c1cc(C[N@@H+]2CC[C@@H](N3CCOCC3)C2)cs1	ZINC000121084013	360792015	/nfs/dbraw/zinc/79/20/15/360792015.db2.gz	AIIFNEPVKVWJHU-CYBMUJFWSA-N	1	0	252.383	1.655	50	0		CDAARO
C[N@H+](CCOc1ccc(Cl)cc1)CCC(N)=O	ZINC000032514488	360969216	/nfs/dbraw/zinc/96/92/16/360969216.db2.gz	XSQYULFFVRSXCP-UHFFFAOYSA-N	1	0	256.733	1.526	50	0		CDAARO
CC[C@@H]1C[N@H+](C[C@H]2CCC=CO2)C[C@@]2(CCOC2)O1	ZINC000370210041	360975330	/nfs/dbraw/zinc/97/53/30/360975330.db2.gz	MZDBLLRGRBFFPK-RBSFLKMASA-N	1	0	267.369	1.949	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N[C@H]2CCCCNC2=O)c1C	ZINC000032529752	360997624	/nfs/dbraw/zinc/99/76/24/360997624.db2.gz	UYBNJUPGUYXOCY-NSHDSACASA-N	1	0	277.372	1.240	50	0		CDAARO
COc1ncnc(C)c1-c1ccc(N2CC[NH2+]CC2)cc1	ZINC000426521166	360984876	/nfs/dbraw/zinc/98/48/76/360984876.db2.gz	FFFMPMANIFCRJH-UHFFFAOYSA-N	1	0	284.363	1.870	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCN(C(=O)COc2cccc(F)c2)C1	ZINC000299740345	200851699	/nfs/dbraw/zinc/85/16/99/200851699.db2.gz	YQPZBWGYRSSJEO-RYUDHWBXSA-N	1	0	280.343	1.790	50	0		CDAARO
CC(C)(C)C[C@H](O)C[NH2+][C@H]1CCC[C@@H]1S(C)(=O)=O	ZINC000182987945	189341507	/nfs/dbraw/zinc/34/15/07/189341507.db2.gz	UCCVEVHHQNXZPN-SRVKXCTJSA-N	1	0	277.430	1.339	50	0		CDAARO
Cc1cc(CNC(=O)N2CC[C@H]([NH3+])C2)ccc1F	ZINC000335616692	361593195	/nfs/dbraw/zinc/59/31/95/361593195.db2.gz	IPTZWGWBBOFBJH-NSHDSACASA-N	1	0	251.305	1.377	50	0		CDAARO
O=C(NCC1CC[NH+]([C@@H]2CCOC2)CC1)C1CCOCC1	ZINC000618256537	364037729	/nfs/dbraw/zinc/03/77/29/364037729.db2.gz	UCZSUAKXTRPUEB-OAHLLOKOSA-N	1	0	296.411	1.030	50	0		CDAARO
Nc1ccccc1C(=O)NCCC[NH+]1CCCCC1	ZINC000002162734	364528485	/nfs/dbraw/zinc/52/84/85/364528485.db2.gz	YMQPRKLPQDMEAZ-UHFFFAOYSA-N	1	0	261.369	1.875	50	0		CDAARO
Cc1c([C@H](C)NC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3[NH2+]2)cnn1C	ZINC000249332397	364537468	/nfs/dbraw/zinc/53/74/68/364537468.db2.gz	XAPHCLGEBSWALL-FATJJJSSSA-N	1	0	290.411	1.826	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@H](c2ccccc2)[C@H](C)[C@@]12NC(=O)NC2=O	ZINC000102055977	364955612	/nfs/dbraw/zinc/95/56/12/364955612.db2.gz	MMSXRWNFSXWXPU-IZBNFRDHSA-N	1	0	287.363	1.524	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)[C@@H]1CCOC1	ZINC000249693588	365191727	/nfs/dbraw/zinc/19/17/27/365191727.db2.gz	ODFDPLPWLPUJLF-MGPQQGTHSA-N	1	0	266.385	1.498	50	0		CDAARO
CC(C)C[NH+]1CCN(c2nc(C(C)C)no2)CC1	ZINC000089840193	366944034	/nfs/dbraw/zinc/94/40/34/366944034.db2.gz	NVMDCVNEMHQPEZ-UHFFFAOYSA-N	1	0	252.362	1.971	50	0		CDAARO
O[C@@H]1CCCC[C@H]1[NH+]1CCN(Cc2cscn2)CC1	ZINC000089764776	366931147	/nfs/dbraw/zinc/93/11/47/366931147.db2.gz	CXDOATPSQASQCR-ZIAGYGMSSA-N	1	0	281.425	1.564	50	0		CDAARO
CCOc1cc(C[NH2+][C@@H](C)CC(N)=O)ccc1OC	ZINC000089990985	367005451	/nfs/dbraw/zinc/00/54/51/367005451.db2.gz	LSKNZUQSTHKHOL-JTQLQIEISA-N	1	0	266.341	1.447	50	0		CDAARO
CCOCC[N@@H+]1CCN([C@H](C)C(=O)NC2CC2)C[C@H]1CC	ZINC000252474891	367540082	/nfs/dbraw/zinc/54/00/82/367540082.db2.gz	OBPMBUCLZIIYDH-UKRRQHHQSA-N	1	0	297.443	1.086	50	0		CDAARO
C[C@H](C(=O)[O-])[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1	ZINC000252539136	367811783	/nfs/dbraw/zinc/81/17/83/367811783.db2.gz	NTYPKJXETYHLKQ-UKRRQHHQSA-N	1	0	276.380	1.913	50	0		CDAARO
O=C(NCc1cc[nH]n1)N1CC[C@@H]([NH+]2CCCCC2)C1	ZINC000336240131	284003895	/nfs/dbraw/zinc/00/38/95/284003895.db2.gz	QMSMHHWKJABDKM-CYBMUJFWSA-N	1	0	277.372	1.180	50	0		CDAARO
Cc1ccc(Cl)cc1S(=O)(=O)N1CCC[NH2+]CC1	ZINC000037463914	368649528	/nfs/dbraw/zinc/64/95/28/368649528.db2.gz	XYMMSRSERVMKEY-UHFFFAOYSA-N	1	0	288.800	1.632	50	0		CDAARO
CCN1C[C@@H](C[N@H+](C)CCC(N)=O)Oc2ccccc21	ZINC000012550696	369126722	/nfs/dbraw/zinc/12/67/22/369126722.db2.gz	VGBHQLGKEZCOTR-GFCCVEGCSA-N	1	0	277.368	1.081	50	0		CDAARO
C[C@]([NH3+])(C(=O)N1CCN(c2ccc(F)cc2)CC1)C1CC1	ZINC000037614276	369353642	/nfs/dbraw/zinc/35/36/42/369353642.db2.gz	PJJSYTMGXHKTHH-MRXNPFEDSA-N	1	0	291.370	1.602	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccccc2C(F)(F)F)C[C@H]1CO	ZINC000225318725	373039738	/nfs/dbraw/zinc/03/97/38/373039738.db2.gz	ILQKVDRJXPZOOJ-LBPRGKRZSA-N	1	0	288.313	1.814	50	0		CDAARO
Cc1ccc(C[N@@H+]2C[C@@H](CO)[C@H](c3nc(C)no3)C2)o1	ZINC000253405775	373695741	/nfs/dbraw/zinc/69/57/41/373695741.db2.gz	IMEZOLHAYMVELZ-WCQYABFASA-N	1	0	277.324	1.487	50	0		CDAARO
COC[C@@H]1C[N@H+](Cc2ccccn2)C[C@H]1C(=O)NC1CC1	ZINC000253415195	373723312	/nfs/dbraw/zinc/72/33/12/373723312.db2.gz	ZYFLKSKSHMVIKL-SWLSCSKDSA-N	1	0	289.379	1.055	50	0		CDAARO
COc1ncccc1C(=O)N1CC[C@@H](Oc2ccncc2)C1	ZINC000120931005	374166837	/nfs/dbraw/zinc/16/68/37/374166837.db2.gz	OKQKGKKLNHTQAW-CYBMUJFWSA-N	1	0	299.330	1.779	50	0		CDAARO
C[C@@H]1OCC[C@H]1[NH2+]C[C@H](Cc1ccc(F)cc1)C(N)=O	ZINC000108470569	412828959	/nfs/dbraw/zinc/82/89/59/412828959.db2.gz	ZNBZYMSYQCWOQK-VHRBIJSZSA-N	1	0	280.343	1.237	50	0		CDAARO
Cc1cc(C)nc(CNC(=O)C2CC[NH+](C(C)C)CC2)n1	ZINC000095355871	374888005	/nfs/dbraw/zinc/88/80/05/374888005.db2.gz	RFKMKCKJVZOXCD-UHFFFAOYSA-N	1	0	290.411	1.830	50	0		CDAARO
C[C@@H](c1ccc(S(N)(=O)=O)cc1)[N@H+](C)[C@@H]1CCO[C@H]1C	ZINC000095457010	374954079	/nfs/dbraw/zinc/95/40/79/374954079.db2.gz	MNSWCOFXSXDSFR-COPLHBTASA-N	1	0	298.408	1.504	50	0		CDAARO
CCOC(=O)C[C@@H](C)SCC[N@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000095460231	374958016	/nfs/dbraw/zinc/95/80/16/374958016.db2.gz	WMIKAZSACAITDJ-UPJWGTAASA-N	1	0	287.425	1.925	50	0		CDAARO
Cn1ccnc1C(=O)N1CCCC[C@H]1C[NH+]1CCCC1	ZINC000215695401	375278889	/nfs/dbraw/zinc/27/88/89/375278889.db2.gz	UAVVQYHULSTLNB-ZDUSSCGKSA-N	1	0	276.384	1.511	50	0		CDAARO
COCc1nc2n(n1)C[C@@H](Nc1cc[nH+]c(C)c1)CC2	ZINC000253428447	189992103	/nfs/dbraw/zinc/99/21/03/189992103.db2.gz	DELHSRYISRWSKS-LBPRGKRZSA-N	1	0	273.340	1.555	50	0		CDAARO
CCC[C@@H]([NH2+]CCCn1cc(CO)nn1)[C@H]1CC1(C)C	ZINC000417324564	375781335	/nfs/dbraw/zinc/78/13/35/375781335.db2.gz	ALXARJJPRNBFAO-ZIAGYGMSSA-N	1	0	280.416	1.965	50	0		CDAARO
CCOc1ccccc1/C=C\C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000606441569	375823592	/nfs/dbraw/zinc/82/35/92/375823592.db2.gz	OTDOUANNIWPCGD-WSROAFLRSA-N	1	0	274.364	1.906	50	0		CDAARO
C[C@H](OC[C@@H]1CCCCO1)C(=O)NC[C@H]1[NH2+]CCC[C@@H]1C	ZINC000390834584	375873936	/nfs/dbraw/zinc/87/39/36/375873936.db2.gz	GEVSSWVQKSDKBC-ZQDZILKHSA-N	1	0	298.427	1.465	50	0		CDAARO
CNC(=O)[C@H](C[NH3+])Cc1ccc(OC(F)(F)F)cc1	ZINC000050303846	376058800	/nfs/dbraw/zinc/05/88/00/376058800.db2.gz	SLRRUDOVAFEXFK-VIFPVBQESA-N	1	0	276.258	1.449	50	0		CDAARO
CN1CCC([NH2+][C@H]2CC(=O)N(C3CCCCCC3)C2)CC1	ZINC000012704188	376478644	/nfs/dbraw/zinc/47/86/44/376478644.db2.gz	OGMSHHZXRPJFSN-HNNXBMFYSA-N	1	0	293.455	1.994	50	0		CDAARO
CCNc1nc(C)c(C(=O)N2CC[NH2+][C@H](CC)C2)s1	ZINC000067908763	377295385	/nfs/dbraw/zinc/29/53/85/377295385.db2.gz	XWMYNEHJOWSLIG-SNVBAGLBSA-N	1	0	282.413	1.707	50	0		CDAARO
Cc1nonc1C(=O)NC[C@H](c1ccc(C)cc1)[NH+](C)C	ZINC000265077888	190156360	/nfs/dbraw/zinc/15/63/60/190156360.db2.gz	ZAQDBIAHAWCMTM-CYBMUJFWSA-N	1	0	288.351	1.719	50	0		CDAARO
Cc1nc(-c2cccc(C(=O)N3CC[C@@H](C[NH3+])C3)c2)n[nH]1	ZINC000429022819	377785627	/nfs/dbraw/zinc/78/56/27/377785627.db2.gz	CQKGKPLLTOCBMM-NSHDSACASA-N	1	0	285.351	1.201	50	0		CDAARO
COCCC1(CNC(=O)NC[C@H]2CCC[N@H+](C)C2)CCC1	ZINC000089375293	377847105	/nfs/dbraw/zinc/84/71/05/377847105.db2.gz	LSRINMGTNZZBEC-CQSZACIVSA-N	1	0	297.443	1.834	50	0		CDAARO
CC[NH+](CC)CCn1c2ccccc2n2nc(C)c(=O)nc12	ZINC000001408826	377919850	/nfs/dbraw/zinc/91/98/50/377919850.db2.gz	DDWLHWKMLPRQKS-UHFFFAOYSA-N	1	0	299.378	1.694	50	0		CDAARO
Cc1nc(CNC(=O)C[NH+](C)C)sc1Br	ZINC000452400503	252053174	/nfs/dbraw/zinc/05/31/74/252053174.db2.gz	UVIPSXRIMCZUMD-UHFFFAOYSA-N	1	0	292.202	1.392	50	0		CDAARO
C[C@@H]1C[C@H]([NH3+])CCN1C(=O)/C=C\C1CCOCC1	ZINC000492995500	253343073	/nfs/dbraw/zinc/34/30/73/253343073.db2.gz	UTFKZWRPCSKAND-XFKWNRGUSA-N	1	0	252.358	1.307	50	0		CDAARO
CCc1cnc(NCC2CC[NH+](CCO)CC2)nc1	ZINC000095360483	184953507	/nfs/dbraw/zinc/95/35/07/184953507.db2.gz	FDFBXBMHOVXBMC-UHFFFAOYSA-N	1	0	264.373	1.155	50	0		CDAARO
CC[C@@H](O)C[NH2+][C@H](C)c1cn(-c2ccccc2)nn1	ZINC000097112555	390796282	/nfs/dbraw/zinc/79/62/82/390796282.db2.gz	TXCQIZNVYFKSLV-DGCLKSJQSA-N	1	0	260.341	1.689	50	0		CDAARO
O=C(Nc1cnn(Cc2ccccn2)c1)[C@@H]1CCC[NH2+]C1	ZINC000178750189	390901867	/nfs/dbraw/zinc/90/18/67/390901867.db2.gz	WKCYQUUFGYQDPH-GFCCVEGCSA-N	1	0	285.351	1.265	50	0		CDAARO
CC(C)[NH2+]C[C@@]1(O)CCCN(Cc2ccc(F)cc2)C1=O	ZINC000011879738	390915806	/nfs/dbraw/zinc/91/58/06/390915806.db2.gz	PZLMEMMAJILFCE-INIZCTEOSA-N	1	0	294.370	1.677	50	0		CDAARO
Cc1cnc(C(=O)NC[C@H](c2cccs2)[NH+](C)C)cn1	ZINC000022687765	391060496	/nfs/dbraw/zinc/06/04/96/391060496.db2.gz	NYACTXKHDYMVEH-GFCCVEGCSA-N	1	0	290.392	1.879	50	0		CDAARO
COC[C@H](Cc1ccccc1)N(C)CC(=O)NCC1CC1	ZINC000239722337	391328585	/nfs/dbraw/zinc/32/85/85/391328585.db2.gz	CCFTYFPUTZRWPJ-INIZCTEOSA-N	1	0	290.407	1.702	50	0		CDAARO
C[N@H+](CCCn1cnnn1)Cc1cc(-c2ccccc2)n[nH]1	ZINC000244594323	391343614	/nfs/dbraw/zinc/34/36/14/391343614.db2.gz	DKYUGVDXKVICHC-UHFFFAOYSA-N	1	0	297.366	1.585	50	0		CDAARO
CCCCSCCC(=O)NC[C@H]1CC[N@H+](C)C1	ZINC000096416922	393183576	/nfs/dbraw/zinc/18/35/76/393183576.db2.gz	QUPXVMPSOMIACF-GFCCVEGCSA-N	1	0	258.431	1.978	50	0		CDAARO
COc1ccc([C@H]2CCCN2CC[NH3+])c(OC)c1	ZINC000084101840	139658027	/nfs/dbraw/zinc/65/80/27/139658027.db2.gz	KNEVEPQXCAPAKZ-CYBMUJFWSA-N	1	0	250.342	1.799	50	0		CDAARO
Cc1cccc(CS(=O)(=O)NC[C@H]2CCC[NH2+]2)c1	ZINC000178917420	140009567	/nfs/dbraw/zinc/00/95/67/140009567.db2.gz	PQPDVJUTLNRIGI-CYBMUJFWSA-N	1	0	268.382	1.166	50	0		CDAARO
Cc1n[nH]cc1CCCNC(=O)[C@@H]1CCC[NH2+][C@H]1C	ZINC000384239296	397926608	/nfs/dbraw/zinc/92/66/08/397926608.db2.gz	IODIJLYYWVUYRL-WCQYABFASA-N	1	0	264.373	1.155	50	0		CDAARO
C[C@]1([NH3+])CCCC[C@H]1C(=O)NCc1ccc(F)cn1	ZINC000263222614	149124144	/nfs/dbraw/zinc/12/41/44/149124144.db2.gz	MERXFJOGQNIJHV-JSGCOSHPSA-N	1	0	265.332	1.745	50	0		CDAARO
COc1cc2c(cc1OC)[C@H](C)[N@H+](CCC(N)=O)CC2	ZINC000000620574	286260476	/nfs/dbraw/zinc/26/04/76/286260476.db2.gz	MIAYHTHDFIRHNM-JTQLQIEISA-N	1	0	278.352	1.498	50	0	biogenic	CDAARO
C[C@@H]([NH3+])C(=O)N1[C@H](C)CO[C@H](c2ccccc2)[C@H]1C	ZINC000246466994	286906472	/nfs/dbraw/zinc/90/64/72/286906472.db2.gz	COFJXYQBTCAEFS-BYNQJWBRSA-N	1	0	262.353	1.711	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)c1ccc(-n2cncn2)cc1	ZINC000408519108	286923195	/nfs/dbraw/zinc/92/31/95/286923195.db2.gz	LUUBELYAWLAXTP-IUODEOHRSA-N	1	0	299.378	1.609	50	0		CDAARO
CC(=O)CCc1ccc(OCC[NH2+]C[C@@H](C)O)cc1	ZINC000002879641	169840451	/nfs/dbraw/zinc/84/04/51/169840451.db2.gz	FKSROGUMHIKTCL-CYBMUJFWSA-N	1	0	265.353	1.557	50	0		CDAARO
O=c1c2[nH]c3ccccc3c2ncn1CC[NH+]1CCCC1	ZINC000004808740	170020455	/nfs/dbraw/zinc/02/04/55/170020455.db2.gz	CJAUPZBHASOCCT-UHFFFAOYSA-N	1	0	282.347	1.974	50	0		CDAARO
CCOC(=O)C[C@]1(C)OC[C@H](C[NH+]2CCCCC2)O1	ZINC000004811441	170021397	/nfs/dbraw/zinc/02/13/97/170021397.db2.gz	UZULUDFGYFDQFW-GXTWGEPZSA-N	1	0	271.357	1.557	50	0		CDAARO
COc1ccc(C(=O)NCC[NH+]2CCCCC2)c(O)c1	ZINC000004951416	170044682	/nfs/dbraw/zinc/04/46/82/170044682.db2.gz	NBQIRCNPOKFXGA-UHFFFAOYSA-N	1	0	278.352	1.617	50	0		CDAARO
COCC[NH2+]CCOCCOc1ccc(C)cc1	ZINC000005042794	170059950	/nfs/dbraw/zinc/05/99/50/170059950.db2.gz	LDAHEWXEMWTZOO-UHFFFAOYSA-N	1	0	253.342	1.626	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1ccccc1OC	ZINC000005453463	170100647	/nfs/dbraw/zinc/10/06/47/170100647.db2.gz	GZBDYGCFOHQJEG-UHFFFAOYSA-N	1	0	250.342	1.767	50	0		CDAARO
C[C@H](O)C[NH2+]Cc1ccc(OCC(=O)NC(C)(C)C)cc1	ZINC000005911925	170154347	/nfs/dbraw/zinc/15/43/47/170154347.db2.gz	JFIOTSHSMHDRTO-LBPRGKRZSA-N	1	0	294.395	1.451	50	0		CDAARO
Cc1cc(C)c(S(=O)(=O)NC2CC[NH+](C)CC2)c(C)c1	ZINC000006699294	170228046	/nfs/dbraw/zinc/22/80/46/170228046.db2.gz	ADABUHYHNQDLQT-UHFFFAOYSA-N	1	0	296.436	1.984	50	0		CDAARO
CCCOc1ccc(C(=O)NCC[NH+](C)C)cc1	ZINC000006728893	170234066	/nfs/dbraw/zinc/23/40/66/170234066.db2.gz	GJHNOCQSUMVYFI-UHFFFAOYSA-N	1	0	250.342	1.767	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)Cc2ccc(F)cc2)CC1	ZINC000006730785	170235178	/nfs/dbraw/zinc/23/51/78/170235178.db2.gz	CEXHBANJWVJQNP-UHFFFAOYSA-N	1	0	250.317	1.532	50	0		CDAARO
CNC(=O)c1cccc(NC(=O)C[N@@H+]2CCCC[C@@H]2C)c1	ZINC000007525260	170288937	/nfs/dbraw/zinc/28/89/37/170288937.db2.gz	IDMHMLJQYDULMC-LBPRGKRZSA-N	1	0	289.379	1.859	50	0		CDAARO
C[C@H](CCc1ccccc1)NC(=O)CSC(N)=[NH2+]	ZINC000007987496	170312106	/nfs/dbraw/zinc/31/21/06/170312106.db2.gz	GSGYBQPZCDWFJJ-SNVBAGLBSA-N	1	0	265.382	1.751	50	0		CDAARO
COCCCNC(=O)C1CC[NH+](Cc2ccccn2)CC1	ZINC000009849577	170386816	/nfs/dbraw/zinc/38/68/16/170386816.db2.gz	AADMBGNSPFTKEV-UHFFFAOYSA-N	1	0	291.395	1.446	50	0		CDAARO
OCC[C@@H]1C[NH2+]CCN1Cc1cccc(F)c1F	ZINC000019368001	170777510	/nfs/dbraw/zinc/77/75/10/170777510.db2.gz	DIGXPLSBVULGPI-LLVKDONJSA-N	1	0	256.296	1.121	50	0		CDAARO
COc1cc(C[NH+]2CCC(C(N)=O)CC2)cc(OC)c1	ZINC000019634728	170832724	/nfs/dbraw/zinc/83/27/24/170832724.db2.gz	NVYTVMXKJKNBOT-UHFFFAOYSA-N	1	0	278.352	1.401	50	0		CDAARO
[NH3+]CCc1ccc(F)c(S(=O)(=O)NCc2ccco2)c1	ZINC000020190224	171056938	/nfs/dbraw/zinc/05/69/38/171056938.db2.gz	VGRQARNEXGEJTG-UHFFFAOYSA-N	1	0	298.339	1.398	50	0		CDAARO
CC[NH+](CC)CCCNCC(=O)N[C@H]1CCOC(C)(C)C1	ZINC000021149442	171298626	/nfs/dbraw/zinc/29/86/26/171298626.db2.gz	BKDYMPBZNFRLRW-AWEZNQCLSA-N	1	0	299.459	1.382	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN(C(=O)C2CC[NH2+]CC2)CC1	ZINC000022015111	171349129	/nfs/dbraw/zinc/34/91/29/171349129.db2.gz	HUBWQZRKRPUKNT-UHFFFAOYSA-N	1	0	297.399	1.065	50	0		CDAARO
CS(=O)(=O)N1CCC([NH2+]Cc2ccsc2)CC1	ZINC000030656721	171620674	/nfs/dbraw/zinc/62/06/74/171620674.db2.gz	UXLGIEIQJZIXCI-UHFFFAOYSA-N	1	0	274.411	1.262	50	0		CDAARO
O=C(c1ccccn1)N1CC[NH+](C2CCCC2)CC1	ZINC000032787910	171751349	/nfs/dbraw/zinc/75/13/49/171751349.db2.gz	SNBABKBRSVDMHT-UHFFFAOYSA-N	1	0	259.353	1.782	50	0		CDAARO
CC[NH+](CC)CCN(CC(C)C)C(=O)c1ccc(=O)[nH]c1	ZINC000037506127	173241377	/nfs/dbraw/zinc/24/13/77/173241377.db2.gz	XMGFTYQAFALTAF-UHFFFAOYSA-N	1	0	293.411	1.815	50	0		CDAARO
CCCN(C(=O)c1ccccc1OC)[C@@H]1CC[NH2+]C1	ZINC000037540149	173261866	/nfs/dbraw/zinc/26/18/66/173261866.db2.gz	ZFDSDOSLQSWXHR-GFCCVEGCSA-N	1	0	262.353	1.909	50	0		CDAARO
c1[nH]nc(-c2cccnc2)c1C[NH2+]C[C@@H]1CCCOC1	ZINC000038045062	174053500	/nfs/dbraw/zinc/05/35/00/174053500.db2.gz	SUNMOVCPRCPIEM-LBPRGKRZSA-N	1	0	272.352	1.988	50	0		CDAARO
CCOC(=O)C[C@H]1[NH2+]CCc2cc(OC)c(OC)cc21	ZINC000038285810	174138634	/nfs/dbraw/zinc/13/86/34/174138634.db2.gz	RLUWHGCQILMZMC-GFCCVEGCSA-N	1	0	279.336	1.844	50	0		CDAARO
CCCCc1ncc(S(C)(=O)=O)c([C@@H]2CCC[NH2+]C2)n1	ZINC000071439342	176169430	/nfs/dbraw/zinc/16/94/30/176169430.db2.gz	GBYCCXJIEUFNOW-LLVKDONJSA-N	1	0	297.424	1.690	50	0		CDAARO
Cc1ccc(NC(=O)NC[C@H]2C[NH2+]CCOC2)cc1	ZINC000072144585	176323892	/nfs/dbraw/zinc/32/38/92/176323892.db2.gz	BRQYJZYYGVCAPU-GFCCVEGCSA-N	1	0	263.341	1.353	50	0		CDAARO
Cc1cnccc1CN(C)Cc1cc2n(n1)CCC[NH2+]C2	ZINC000072150620	176326736	/nfs/dbraw/zinc/32/67/36/176326736.db2.gz	SDHQNYCXOUSYRX-UHFFFAOYSA-N	1	0	285.395	1.712	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(C(=O)c2ccc(N)nc2)CC1	ZINC000072151560	176327331	/nfs/dbraw/zinc/32/73/31/176327331.db2.gz	BFHFZUGNSCTNME-GFCCVEGCSA-N	1	0	262.357	1.220	50	0		CDAARO
O=C(NCc1ncc[nH]1)c1ccccc1[C@H]1CC[NH2+]C1	ZINC000072157630	176329594	/nfs/dbraw/zinc/32/95/94/176329594.db2.gz	LSRDZABNYZTHPH-NSHDSACASA-N	1	0	270.336	1.417	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)CCc2nc3ccccc3[nH]2)CC1	ZINC000072171139	176333061	/nfs/dbraw/zinc/33/30/61/176333061.db2.gz	LYZXTVMAUVKFRK-GFCCVEGCSA-N	1	0	286.379	1.835	50	0		CDAARO
CCc1cc(N2C[C@H]3C[NH2+]C[C@H]3C2)n2nc(C)c(C)c2n1	ZINC000072463626	176405548	/nfs/dbraw/zinc/40/55/48/176405548.db2.gz	VKPBLVJEQIKDSR-BETUJISGSA-N	1	0	285.395	1.564	50	0		CDAARO
O=C1NC2(CC[NH2+]CC2)C(=O)N1CCc1cccc(F)c1	ZINC000076536461	177034825	/nfs/dbraw/zinc/03/48/25/177034825.db2.gz	MHXGCOPCNSTKFO-UHFFFAOYSA-N	1	0	291.326	1.042	50	0		CDAARO
CN(Cc1cc(-c2ccccc2)n[nH]1)C[C@]1(O)CC[NH2+]C1	ZINC000077287789	177249369	/nfs/dbraw/zinc/24/93/69/177249369.db2.gz	IRNXIMXMHGBMGD-INIZCTEOSA-N	1	0	286.379	1.233	50	0		CDAARO
O=C1CCCN1CCC1CCN(Cc2ncc[nH]2)CC1	ZINC000077342800	177254619	/nfs/dbraw/zinc/25/46/19/177254619.db2.gz	MKZDUBHWRNEAAF-UHFFFAOYSA-N	1	0	276.384	1.634	50	0		CDAARO
COc1ccc2[nH]nc(CN3CC[C@H]4C[NH2+]C[C@H]43)c2c1	ZINC000077503969	177276412	/nfs/dbraw/zinc/27/64/12/177276412.db2.gz	KWQQEDNEPURUJE-ZUZCIYMTSA-N	1	0	272.352	1.365	50	0		CDAARO
CC(C)COC(=O)N1CCC([NH2+]C[C@H]2CCC[C@@H]2O)CC1	ZINC000089157737	260113027	/nfs/dbraw/zinc/11/30/27/260113027.db2.gz	IHEXHGMUIZGZMD-HIFRSBDPSA-N	1	0	298.427	1.994	50	0		CDAARO
CCN1CCC[C@@H]1C[NH2+]C[C@H](O)COc1cccc(C)c1	ZINC000022029645	262343984	/nfs/dbraw/zinc/34/39/84/262343984.db2.gz	IMTNEWYWNBRNEN-CVEARBPZSA-N	1	0	292.423	1.809	50	0		CDAARO
Cc1noc(CN(C)C(=O)NCCC[NH+]2CCCC2)n1	ZINC000426589906	424428071	/nfs/dbraw/zinc/42/80/71/424428071.db2.gz	CJFBEEDWXMNUIE-UHFFFAOYSA-N	1	0	281.360	1.005	50	0		CDAARO
Cc1nc(N2CCC([NH3+])CC2)cc(C(F)(F)F)n1	ZINC000035681053	274840636	/nfs/dbraw/zinc/84/06/36/274840636.db2.gz	FXLLXKRPHJIGMY-UHFFFAOYSA-N	1	0	260.263	1.731	50	0		CDAARO
c1cn(CCC[N@@H+]2CCCN(c3ncccn3)CC2)cn1	ZINC000096493104	275072693	/nfs/dbraw/zinc/07/26/93/275072693.db2.gz	VREQWJQYHBGYHV-UHFFFAOYSA-N	1	0	286.383	1.276	50	0		CDAARO
C[NH+]1CCC(NC(=O)[C@@]2(C)CC2(Cl)Cl)CC1	ZINC000002872595	277030296	/nfs/dbraw/zinc/03/02/96/277030296.db2.gz	SRRVBVOXXYADTJ-SNVBAGLBSA-N	1	0	265.184	1.781	50	0		CDAARO
C[NH+]1CCC2(CC1)NC(=S)N(c1ccccc1)N2	ZINC000009189424	277036433	/nfs/dbraw/zinc/03/64/33/277036433.db2.gz	IAWRKEYDPMPOST-UHFFFAOYSA-N	1	0	262.382	1.308	50	0		CDAARO
COc1ccc2c(c1)C[C@H]([NH2+][C@H]1CCC(=O)N(C)C1)CC2	ZINC000095973400	277439383	/nfs/dbraw/zinc/43/93/83/277439383.db2.gz	LNDSQGSRLYSFMA-CABCVRRESA-N	1	0	288.391	1.763	50	0		CDAARO
CC(C)(C)OC(=O)N[C@@H]1C[C@H]2COC[C@@H](C1)[C@@H]2[NH3+]	ZINC000238855427	278441148	/nfs/dbraw/zinc/44/11/48/278441148.db2.gz	RSUOYMZSXZUASP-FAUIJHMISA-N	1	0	256.346	1.263	50	0		CDAARO
NNc1[nH+]cc(I)cc1Cl	ZINC000169799448	279660479	/nfs/dbraw/zinc/66/04/79/279660479.db2.gz	BBIXKSCXBRKAFZ-UHFFFAOYSA-N	1	0	269.473	1.625	50	0		CDAARO
C[N@H+]1C[C@@H]2C[NH+](Cc3ccc(C(=O)[O-])cc3)C[C@@H]2C1	ZINC000215613944	290288611	/nfs/dbraw/zinc/28/86/11/290288611.db2.gz	FWFOLFUELXWVPE-OKILXGFUSA-N	1	0	260.337	1.378	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N2[C@@H]3CC[C@H]2C[C@@H](O)C3)c1C	ZINC000102684025	293289861	/nfs/dbraw/zinc/28/98/61/293289861.db2.gz	QLXZULWMDJTOTQ-ITGUQSILSA-N	1	0	276.384	1.652	50	0		CDAARO
Cc1cccc2c1ncnc2N1CCO[C@@H]2CC[N@@H+](C)C[C@H]21	ZINC000242263390	302068369	/nfs/dbraw/zinc/06/83/69/302068369.db2.gz	XYPKNWLFYIBACQ-HUUCEWRRSA-N	1	0	298.390	1.848	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)N2CCCC3(CCOCC3)C2)C1	ZINC000361723186	303472605	/nfs/dbraw/zinc/47/26/05/303472605.db2.gz	LWPICDKONWVFRJ-QWHCGFSZSA-N	1	0	266.385	1.533	50	0		CDAARO
C[NH+](C)C1CCN(S(=O)(=O)CC2CCCC2)CC1	ZINC000178295206	315951786	/nfs/dbraw/zinc/95/17/86/315951786.db2.gz	LEMIZKPMQZDQMA-UHFFFAOYSA-N	1	0	274.430	1.532	50	0		CDAARO
CC(=O)NC(C)(C)C[C@@H](C)[NH2+]Cc1cscn1	ZINC000534645907	328331026	/nfs/dbraw/zinc/33/10/26/328331026.db2.gz	QLMQVZREQWMBKI-SECBINFHSA-N	1	0	255.387	1.926	50	0		CDAARO
Cc1cccnc1[C@H](C)NC(=O)CN(C)C1CC[NH2+]CC1	ZINC000534647819	328343048	/nfs/dbraw/zinc/34/30/48/328343048.db2.gz	HNHHGXMDIWNSLO-ZDUSSCGKSA-N	1	0	290.411	1.251	50	0		CDAARO
Cc1ncncc1C(=O)NC[C@@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534658246	328341448	/nfs/dbraw/zinc/34/14/48/328341448.db2.gz	QEJMMPHMUOKUOW-ZDUSSCGKSA-N	1	0	288.395	1.779	50	0		CDAARO
CN(Cc1ccc2nsnc2c1)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000534663501	328351485	/nfs/dbraw/zinc/35/14/85/328351485.db2.gz	XNPOXEWJTBDGRK-NSHDSACASA-N	1	0	274.349	1.178	50	0		CDAARO
Cc1ccccc1OC1CCN(C(=O)[C@@H]([NH3+])[C@@H](C)O)CC1	ZINC000077436442	327132565	/nfs/dbraw/zinc/13/25/65/327132565.db2.gz	QTKMAPMPHQFKFG-DOMZBBRYSA-N	1	0	292.379	1.073	50	0		CDAARO
FC(F)(F)[C@@]1(c2nc(-c3ccccn3)no2)CC[NH2+]C1	ZINC000111240722	330381672	/nfs/dbraw/zinc/38/16/72/330381672.db2.gz	OFKVXWJVHOBEGA-NSHDSACASA-N	1	0	284.241	1.925	50	0		CDAARO
CC[C@@H]1CN(CCn2ccnc2C)CC[N@@H+]1C(C)C	ZINC000244796030	1159707939	/nfs/dbraw/zinc/70/79/39/1159707939.db2.gz	RRSHDOSXWAJZGY-OAHLLOKOSA-N	1	0	264.417	1.996	50	0		CDAARO
Cc1ncn(C)c1C(=O)N1CCC[C@@]2(CC[N@H+](C)C2)C1	ZINC000670441092	482985813	/nfs/dbraw/zinc/98/58/13/482985813.db2.gz	VSJGYUUPKSIBNM-HNNXBMFYSA-N	1	0	276.384	1.286	50	0		CDAARO
COc1cc(C)c(C[N@@H+]2C[C@H](O)[C@@H](OC)C2)c(C)c1C	ZINC000670448394	483004654	/nfs/dbraw/zinc/00/46/54/483004654.db2.gz	CZBSCCSHZUXRAK-HOCLYGCPSA-N	1	0	279.380	1.812	50	0		CDAARO
Cc1cccc(N2CCC(NC(=O)[C@H]3C=CC[NH2+]3)CC2)c1	ZINC000670452444	483020785	/nfs/dbraw/zinc/02/07/85/483020785.db2.gz	ZLHIIWGOPCQKCT-MRXNPFEDSA-N	1	0	285.391	1.608	50	0		CDAARO
CN(C[C@@H]1CCOC1)C(=O)C1([NH+]2CCCC2)CCCC1	ZINC000670453180	483022323	/nfs/dbraw/zinc/02/23/23/483022323.db2.gz	XJJDAIGFLQMOKC-AWEZNQCLSA-N	1	0	280.412	1.890	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]CCCn1ccccc1=O	ZINC000670455473	483032315	/nfs/dbraw/zinc/03/23/15/483032315.db2.gz	TZDIYDAAZCOEHC-CQSZACIVSA-N	1	0	288.395	1.676	50	0		CDAARO
CC(C)n1cnnc1CN1CC[C@H](O)CC(C)(C)C1	ZINC000670466140	483057118	/nfs/dbraw/zinc/05/71/18/483057118.db2.gz	MVQPKRZDQXEVSG-LBPRGKRZSA-N	1	0	266.389	1.842	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1n1cnc2cnccc2c1=O	ZINC000670468619	483062195	/nfs/dbraw/zinc/06/21/95/483062195.db2.gz	OIEUPFKYSMJGMV-KBPBESRZSA-N	1	0	288.351	1.072	50	0		CDAARO
C[C@@H]1CN(C(=O)COc2ccc(F)cc2F)CC[NH2+]1	ZINC000188474964	524787059	/nfs/dbraw/zinc/78/70/59/524787059.db2.gz	BMQHAHXTFLGTCW-SECBINFHSA-N	1	0	270.279	1.164	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)C2(c3ccccc3F)CC2)C1	ZINC000269188334	536467549	/nfs/dbraw/zinc/46/75/49/536467549.db2.gz	UVHKUNGUJMVYAN-GFCCVEGCSA-N	1	0	276.355	1.925	50	0		CDAARO
CC[C@@H](C(N)=O)N1CCN(c2cc[nH+]c3ccccc32)CC1	ZINC000289288897	535453645	/nfs/dbraw/zinc/45/36/45/535453645.db2.gz	GZDGKVLWIOBIPU-HNNXBMFYSA-N	1	0	298.390	1.621	50	0		CDAARO
C[C@H]1C[NH2+]C[C@@H](c2ccc(NS(C)(=O)=O)cc2)C1	ZINC000757214591	574907497	/nfs/dbraw/zinc/90/74/97/574907497.db2.gz	UDJLLEPNTOVNCJ-PWSUYJOCSA-N	1	0	268.382	1.771	50	0		CDAARO
C[C@H]1C[NH2+]C[C@H](c2ccc(NS(C)(=O)=O)cc2)C1	ZINC000757214623	574907702	/nfs/dbraw/zinc/90/77/02/574907702.db2.gz	UDJLLEPNTOVNCJ-ZYHUDNBSSA-N	1	0	268.382	1.771	50	0		CDAARO
Fc1ccc(CC[NH2+][C@@H]2CCc3ncnn3C2)cc1F	ZINC000768534163	576294447	/nfs/dbraw/zinc/29/44/47/576294447.db2.gz	QYLZYKMSGOGPLN-LLVKDONJSA-N	1	0	278.306	1.703	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@@](O)([C@@H]([NH3+])C2CC2)C1	ZINC000958528665	613975108	/nfs/dbraw/zinc/97/51/08/613975108.db2.gz	YNRQQSMQLYYSCJ-FZMZJTMJSA-N	1	0	270.373	1.486	50	0		CDAARO
CC(=O)c1ccc(NCC[N@@H+]2CCC[C@@H](CO)C2)nc1	ZINC000952984431	614254132	/nfs/dbraw/zinc/25/41/32/614254132.db2.gz	VGZYQPIALCMRDS-CYBMUJFWSA-N	1	0	277.368	1.400	50	0		CDAARO
CC1=C(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)OCCO1	ZINC000952987279	614947740	/nfs/dbraw/zinc/94/77/40/614947740.db2.gz	LCTBIFOOBFBPCX-UHFFFAOYSA-N	1	0	282.384	1.690	50	0		CDAARO
OCCC1CCN(C[NH+]2CCC(CCO)CC2)CC1	ZINC000019333166	1165654733	/nfs/dbraw/zinc/65/47/33/1165654733.db2.gz	CQBCWWSCRPUMQK-UHFFFAOYSA-N	1	0	270.417	1.133	50	0		CDAARO
Cc1ccc(F)c(NC(=O)CN2CC[C@@H]([NH+](C)C)C2)c1	ZINC001704353411	1177699739	/nfs/dbraw/zinc/69/97/39/1177699739.db2.gz	WFOVYFGSCJPFNS-GFCCVEGCSA-N	1	0	279.359	1.709	50	0		CDAARO
CN(C)C(=O)c1ccc(N2CCC[C@@H]([NH+](C)C)C2)nc1	ZINC000264898357	721889719	/nfs/dbraw/zinc/88/97/19/721889719.db2.gz	VOCJVHGRAUKEMT-CYBMUJFWSA-N	1	0	276.384	1.314	50	0		CDAARO
c1nc2ccnc(N3CC[N@H+]4CCCC[C@@H]4C3)c2[nH]1	ZINC000863982502	844012953	/nfs/dbraw/zinc/01/29/53/844012953.db2.gz	PSSNTYWPGZYJOB-LLVKDONJSA-N	1	0	257.341	1.632	50	0		CDAARO
Cc1cc(F)cc(N2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)n1	ZINC000952992846	844030361	/nfs/dbraw/zinc/03/03/61/844030361.db2.gz	SIRQJNBZEMRSSZ-KBPBESRZSA-N	1	0	279.359	1.565	50	0		CDAARO
C[N@@H+](Cc1ccccc1-c1nn[nH]n1)C[C@@H]1CCCCO1	ZINC000019743596	843544122	/nfs/dbraw/zinc/54/41/22/843544122.db2.gz	YHQICHCNMHNRBB-ZDUSSCGKSA-N	1	0	287.367	1.868	50	0		CDAARO
CC[NH+]1CCC(C(=O)N2CC(C)(C)[C@](O)(C3CC3)C2)CC1	ZINC000092028253	843849171	/nfs/dbraw/zinc/84/91/71/843849171.db2.gz	JPEJRBZCAHBVPC-QGZVFWFLSA-N	1	0	294.439	1.728	50	0		CDAARO
Cc1[nH]c2ccccc2c1C[NH+]1CCN(CCO)CC1	ZINC000022455448	844982820	/nfs/dbraw/zinc/98/28/20/844982820.db2.gz	YECRSKFZGDWCEY-UHFFFAOYSA-N	1	0	273.380	1.586	50	0		CDAARO
CCO[C@@H]1C[C@@](CO)([NH2+]Cc2nn(C)cc2C)C1(C)C	ZINC000877871577	845276227	/nfs/dbraw/zinc/27/62/27/845276227.db2.gz	SEDAGQCHAUSKJI-HIFRSBDPSA-N	1	0	281.400	1.384	50	0		CDAARO
OCC[NH2+]CCOCCOc1cccc2ccccc21	ZINC000002980675	846249019	/nfs/dbraw/zinc/24/90/19/846249019.db2.gz	KFDVXAWXEOAZTM-UHFFFAOYSA-N	1	0	275.348	1.817	50	0		CDAARO
COc1ccccc1OCCN1CC[N@H+](C)[C@@H](CCO)C1	ZINC000020109468	846288205	/nfs/dbraw/zinc/28/82/05/846288205.db2.gz	ZFHHHXDNKGDIGU-AWEZNQCLSA-N	1	0	294.395	1.072	50	0		CDAARO
C[C@H](O)C[NH+]1CCC(CNC(=O)c2ccc(F)cc2)CC1	ZINC001001136843	847362731	/nfs/dbraw/zinc/36/27/31/847362731.db2.gz	BDIAKYIEFHXZIN-LBPRGKRZSA-N	1	0	294.370	1.648	50	0		CDAARO
COc1cccc(C[N@H+]2C[C@H]3[C@@H](C2)CCC[C@H]3O)n1	ZINC000675010845	899865552	/nfs/dbraw/zinc/86/55/52/899865552.db2.gz	KCLMPVSEXSRPBO-KWCYVHTRSA-N	1	0	262.353	1.683	50	0		CDAARO
CC[C@@H](CO)N(Cc1ccccn1)C(=O)C1([NH3+])CCCC1	ZINC000952869232	910420092	/nfs/dbraw/zinc/42/00/92/910420092.db2.gz	YVPHZGSREINQHT-AWEZNQCLSA-N	1	0	291.395	1.453	50	0		CDAARO
C[NH+](C)CCOc1cccc(-c2nc3ncccn3n2)c1	ZINC000952882364	910449353	/nfs/dbraw/zinc/44/93/53/910449353.db2.gz	PXYIWONBVGYQQM-UHFFFAOYSA-N	1	0	283.335	1.732	50	0		CDAARO
CC[N@@H+]1C[C@H](Nc2ncccc2-c2ncon2)[C@@H](OC)C1	ZINC000824504704	925829576	/nfs/dbraw/zinc/82/95/76/925829576.db2.gz	FWKWSAKBSAHNOD-RYUDHWBXSA-N	1	0	289.339	1.263	50	0		CDAARO
Cc1nc(N)sc1CC(=O)N1CC[N@@H+](C(C)C)[C@@H](C)C1	ZINC000827945756	925999659	/nfs/dbraw/zinc/99/96/59/925999659.db2.gz	JXTGDAACJSGWSM-JTQLQIEISA-N	1	0	296.440	1.517	50	0		CDAARO
O=C(NCC[N@H+]1CCCC[C@@H]1CO)NCC1CCCCC1	ZINC000828710750	926168938	/nfs/dbraw/zinc/16/89/38/926168938.db2.gz	ACNCTIGBPKGVTO-OAHLLOKOSA-N	1	0	297.443	1.713	50	0		CDAARO
C[C@H]([NH2+]CCCNc1ccccc1)c1cn(C)nn1	ZINC000863982477	934381389	/nfs/dbraw/zinc/38/13/89/934381389.db2.gz	OMZURAIFOYXPLJ-LBPRGKRZSA-N	1	0	259.357	1.968	50	0		CDAARO
C[C@H](O)C[NH+](Cc1ccc(F)c(F)c1)C[C@H](C)O	ZINC000000757414	935323001	/nfs/dbraw/zinc/32/30/01/935323001.db2.gz	VTCDSSQEVGFXPI-UWVGGRQHSA-N	1	0	259.296	1.528	50	0		CDAARO
C[C@@H](CN(C)C(=O)c1cnc(N)s1)C[NH+]1CCCC1	ZINC001506406793	975151642	/nfs/dbraw/zinc/15/16/42/975151642.db2.gz	ORIZPRCJXYPNNJ-JTQLQIEISA-N	1	0	282.413	1.529	50	0		CDAARO
Cc1cnc(C[N@H+](C)CCCCN2CCOCC2)cn1	ZINC001506408245	975153360	/nfs/dbraw/zinc/15/33/60/975153360.db2.gz	CSMLNMJBFUPKMC-UHFFFAOYSA-N	1	0	278.400	1.329	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]Cc2cnc(C)cn2)n1	ZINC001506411634	975154442	/nfs/dbraw/zinc/15/44/42/975154442.db2.gz	SHULQSZBTREGEX-LBPRGKRZSA-N	1	0	259.357	1.777	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1cnc(-c2ccccn2)s1	ZINC000124323898	187132741	/nfs/dbraw/zinc/13/27/41/187132741.db2.gz	ZRVHQJKMXOQBGR-SNVBAGLBSA-N	1	0	288.376	1.639	50	0		CDAARO
C[C@H](Cc1cccs1)[N@H+](C)CC(=O)N1CCOCC1	ZINC000096448428	230375289	/nfs/dbraw/zinc/37/52/89/230375289.db2.gz	QRANLSJDONHBKN-GFCCVEGCSA-N	1	0	282.409	1.470	50	0		CDAARO
CS[C@@H]1CCCC[N@@H+]([C@H](C)C(=O)NC2CC2)C1	ZINC000107367202	398140610	/nfs/dbraw/zinc/14/06/10/398140610.db2.gz	FIYBELUNFNBLBI-ZYHUDNBSSA-N	1	0	256.415	1.871	50	0		CDAARO
Cc1nonc1CNC(=O)C1([NH+]2CCCC2)CCCCC1	ZINC000584904113	341994173	/nfs/dbraw/zinc/99/41/73/341994173.db2.gz	GUGRVDDNEDWCHL-UHFFFAOYSA-N	1	0	292.383	1.793	50	0		CDAARO
C[C@@H]1CCCC[C@@H]1[NH2+]Cc1nc(CS(C)(=O)=O)no1	ZINC000095941191	185036646	/nfs/dbraw/zinc/03/66/46/185036646.db2.gz	PRVSBVVGGMHJEF-ZJUUUORDSA-N	1	0	287.385	1.283	50	0		CDAARO
COCc1nc(C)cc(N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)n1	ZINC000095962819	185044350	/nfs/dbraw/zinc/04/43/50/185044350.db2.gz	GWQJRYQPRPJXTE-QWHCGFSZSA-N	1	0	276.384	1.970	50	0		CDAARO
COC[C@H](O)C[NH2+]Cc1ccc(C)cc1Br	ZINC000095973527	185049386	/nfs/dbraw/zinc/04/93/86/185049386.db2.gz	NCTRAQHFKXWXHQ-LLVKDONJSA-N	1	0	288.185	1.854	50	0		CDAARO
C[C@@H](c1cccnc1)[N@H+](C)CCC(=O)N1CCOCC1	ZINC000095977289	185051850	/nfs/dbraw/zinc/05/18/50/185051850.db2.gz	CBCASCFUKXKQHZ-ZDUSSCGKSA-N	1	0	277.368	1.323	50	0		CDAARO
CSC[C@H](C)NC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2[NH2+]1	ZINC000239359504	361745353	/nfs/dbraw/zinc/74/53/53/361745353.db2.gz	AEHVWHCDSNMYCY-USZNOCQGSA-N	1	0	256.415	1.775	50	0		CDAARO
CO[C@@H]1C[NH2+][C@@H](C(=O)NCCCSc2ccccc2)C1	ZINC000239637083	361746607	/nfs/dbraw/zinc/74/66/07/361746607.db2.gz	BISPDVWDOLRTQL-GXTWGEPZSA-N	1	0	294.420	1.662	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)COc1ccc(F)c(Cl)c1	ZINC000124784817	187154347	/nfs/dbraw/zinc/15/43/47/187154347.db2.gz	ZKHKJUVPRWJLPQ-SECBINFHSA-N	1	0	286.734	1.678	50	0		CDAARO
C[NH+](C)C[C@@H]1CSCC[C@@]1(O)c1cccc(O)c1	ZINC000000347733	282128847	/nfs/dbraw/zinc/12/88/47/282128847.db2.gz	OXSWTJCCCLUDOE-TZMCWYRMSA-N	1	0	267.394	1.895	50	0		CDAARO
[NH3+][C@H](C(=O)N1CCO[C@@H](c2ccco2)C1)c1ccccc1	ZINC000195554328	342625969	/nfs/dbraw/zinc/62/59/69/342625969.db2.gz	VXYWCOPAKANRIG-CABCVRRESA-N	1	0	286.331	1.880	50	0		CDAARO
O=C(NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(Cl)n1	ZINC000195542792	342626693	/nfs/dbraw/zinc/62/66/93/342626693.db2.gz	ALPZRJRLNJDXKC-ULKQDVFKSA-N	1	0	265.744	1.748	50	0		CDAARO
COCC[NH2+]CC(=O)N1CC[C@H](C)CC[C@H]1C(C)C	ZINC000195543557	342626704	/nfs/dbraw/zinc/62/67/04/342626704.db2.gz	YZJAPHCEABGTRI-KGLIPLIRSA-N	1	0	270.417	1.896	50	0		CDAARO
Nc1nc(N[C@H]2CC[C@H](O)CC2)cc(C2CC(O)C2)[nH+]1	ZINC000243919592	361830873	/nfs/dbraw/zinc/83/08/73/361830873.db2.gz	BPKQMKZAQVKDPE-NEFMJNTKSA-N	1	0	278.356	1.013	50	0		CDAARO
[NH3+]CC1(COc2ncnc3cc(F)c(F)cc32)COC1	ZINC000252487220	361845014	/nfs/dbraw/zinc/84/50/14/361845014.db2.gz	HTAIYEBPBXNFGK-UHFFFAOYSA-N	1	0	281.262	1.262	50	0		CDAARO
CCN(C(=O)CC[N@H+](C)C[C@H](O)CO)c1ccccc1C	ZINC000244858622	361866454	/nfs/dbraw/zinc/86/64/54/361866454.db2.gz	VORJSFGCIKNZFO-AWEZNQCLSA-N	1	0	294.395	1.023	50	0		CDAARO
CC[N@@H+]1CCCN(C(=O)C(=O)Nc2ccccc2)CC1	ZINC000097001809	185150988	/nfs/dbraw/zinc/15/09/88/185150988.db2.gz	PAOYIKNAHFLJPP-UHFFFAOYSA-N	1	0	275.352	1.179	50	0		CDAARO
COCC[N@H+](C)CCNC(=O)N1CCC[C@H](C)[C@@H]1C	ZINC000097010474	185151834	/nfs/dbraw/zinc/15/18/34/185151834.db2.gz	FZZCPJYZNVCULW-STQMWFEESA-N	1	0	271.405	1.395	50	0		CDAARO
CC(C)c1nc(C2(NC(=O)[C@H](C)C[NH3+])CCCC2)no1	ZINC000585136423	342216076	/nfs/dbraw/zinc/21/60/76/342216076.db2.gz	FMQPPIUQJDHEDA-SNVBAGLBSA-N	1	0	280.372	1.673	50	0		CDAARO
CSC[C@H](C)NC(=O)N1C[C@@H]2C[N@@H+]3CCCC[C@H]3[C@H]2C1	ZINC000245343997	539041481	/nfs/dbraw/zinc/04/14/81/539041481.db2.gz	WWTWCMKWMPGOFA-XUXIUFHCSA-N	1	0	297.468	1.864	50	0		CDAARO
CNS(=O)(=O)[C@@H]1CC[N@H+](Cc2ccccc2C2CC2)C1	ZINC000584908345	539102417	/nfs/dbraw/zinc/10/24/17/539102417.db2.gz	LBYRSFXOFQXINH-CQSZACIVSA-N	1	0	294.420	1.688	50	0		CDAARO
CCOc1cc(N2CC[C@@H]([NH+]3CC=CC3)C2)ncn1	ZINC000125650725	187194658	/nfs/dbraw/zinc/19/46/58/187194658.db2.gz	AQOHXTXEQUVYBZ-GFCCVEGCSA-N	1	0	260.341	1.326	50	0		CDAARO
O=C(N[C@@H]1CCCCC[C@H]1CO)[C@H](C1CC1)[NH+]1CCCC1	ZINC000253369419	342416101	/nfs/dbraw/zinc/41/61/01/342416101.db2.gz	CHNYRCKKQZMMEE-XHSDSOJGSA-N	1	0	294.439	1.918	50	0		CDAARO
C[C@H](Oc1ccccc1Cl)C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178546969	362246640	/nfs/dbraw/zinc/24/66/40/362246640.db2.gz	AHHAHBNKYVELPQ-QWRGUYRKSA-N	1	0	282.771	1.915	50	0		CDAARO
CCC(CC)n1ncc(C)c1NC(=O)C[C@H]1C[NH2+]CCO1	ZINC000055385630	282303426	/nfs/dbraw/zinc/30/34/26/282303426.db2.gz	JXUIGYYLYRYUMC-ZDUSSCGKSA-N	1	0	294.399	1.870	50	0		CDAARO
Cc1ncc(C(=O)N(C)[C@@H]2CC[NH2+]C2)c(C(C)C)n1	ZINC000179114719	362252034	/nfs/dbraw/zinc/25/20/34/362252034.db2.gz	DZEDVMBEONTSML-LLVKDONJSA-N	1	0	262.357	1.342	50	0		CDAARO
C[N@H+](CCNC(=O)N1CCSC(C)(C)C1)C1CC1	ZINC000083722640	362253395	/nfs/dbraw/zinc/25/33/95/362253395.db2.gz	HILVCRSDZFRBTP-UHFFFAOYSA-N	1	0	271.430	1.618	50	0		CDAARO
C[NH2+]C1CCN(S(=O)(=O)c2ccccc2OC)CC1	ZINC000084684606	362268905	/nfs/dbraw/zinc/26/89/05/362268905.db2.gz	UEBSYKXISVSYCO-UHFFFAOYSA-N	1	0	284.381	1.068	50	0		CDAARO
O=C(OCc1ccccc1)N1CCC2(CC1)C[NH2+]CCO2	ZINC000602993680	344682904	/nfs/dbraw/zinc/68/29/04/344682904.db2.gz	MNAIZRFWAMYJPL-UHFFFAOYSA-N	1	0	290.363	1.778	50	0		CDAARO
Cc1ccc(C(=O)N2CCC([NH2+]CC3CC3)CC2)n1C	ZINC000127531326	187313431	/nfs/dbraw/zinc/31/34/31/187313431.db2.gz	OKPGSHCDENGYNO-UHFFFAOYSA-N	1	0	275.396	1.938	50	0		CDAARO
C[C@H]([NH2+]CCn1cnc2c1ncnc2N)c1ccccc1	ZINC000000158690	346183476	/nfs/dbraw/zinc/18/34/76/346183476.db2.gz	KTAJYCBUOYKCRF-NSHDSACASA-N	1	0	282.351	1.759	50	0		CDAARO
Cc1cccc(OCCN(C)C(=O)[C@@H]2CCC[C@@H]2[NH3+])c1	ZINC000085368782	179038645	/nfs/dbraw/zinc/03/86/45/179038645.db2.gz	CWFWINFXTVDBBD-CABCVRRESA-N	1	0	276.380	1.960	50	0		CDAARO
O[C@H](C[NH+]1CCN(Cc2ccc(F)c(F)c2)CC1)C1CC1	ZINC000085436874	179062969	/nfs/dbraw/zinc/06/29/69/179062969.db2.gz	MONCTYAFIZRLLO-MRXNPFEDSA-N	1	0	296.361	1.853	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)c1ccc2c(c1)CCC2	ZINC000584884727	349342114	/nfs/dbraw/zinc/34/21/14/349342114.db2.gz	KJBRIWKRHHCTCM-HOTGVXAUSA-N	1	0	288.391	1.624	50	0		CDAARO
Cc1ccoc1C(=O)NCC[N@@H+]1CCC[C@H](CO)C1	ZINC000584895212	349355059	/nfs/dbraw/zinc/35/50/59/349355059.db2.gz	CDYDVXWUOFNMSR-LBPRGKRZSA-N	1	0	266.341	1.022	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC([NH3+])CC2)c(Cl)c1	ZINC000036753765	362946012	/nfs/dbraw/zinc/94/60/12/362946012.db2.gz	SAMDRMBOOWUKBO-UHFFFAOYSA-N	1	0	288.800	1.760	50	0		CDAARO
CC1(C)CCC[C@H]1[NH2+]CCNS(=O)(=O)c1cccnc1	ZINC000090585094	180009154	/nfs/dbraw/zinc/00/91/54/180009154.db2.gz	KBQOSOVUPFQHBN-CYBMUJFWSA-N	1	0	297.424	1.528	50	0		CDAARO
COc1ccc(C)cc1[C@H](C)[NH2+]C[C@]1(O)CCOC1	ZINC000090849773	180046092	/nfs/dbraw/zinc/04/60/92/180046092.db2.gz	AQLJOPHKDKBOMC-SWLSCSKDSA-N	1	0	265.353	1.806	50	0		CDAARO
O=C(C[C@@H]1C[NH2+]CCO1)N1CC=C(c2ccccc2)CC1	ZINC000091300722	180127932	/nfs/dbraw/zinc/12/79/32/180127932.db2.gz	CHRZWUWMVXDPRY-MRXNPFEDSA-N	1	0	286.375	1.681	50	0		CDAARO
CC(C)Oc1cc(N2C[C@H]([NH3+])[C@@H](C3CC3)C2)nc(N)n1	ZINC000091526523	180178660	/nfs/dbraw/zinc/17/86/60/180178660.db2.gz	UQRHYKNBPVLNEG-MNOVXSKESA-N	1	0	277.372	1.020	50	0		CDAARO
COCCN(Cc1ccccc1)C(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000091548215	180188405	/nfs/dbraw/zinc/18/84/05/180188405.db2.gz	PJGJGMMSMAHYCM-LSDHHAIUSA-N	1	0	276.380	1.789	50	0		CDAARO
CC(=O)N1CC[N@H+](CCSc2ccccc2)C[C@@H](O)C1	ZINC000091665367	180220736	/nfs/dbraw/zinc/22/07/36/180220736.db2.gz	HSSNEPLIBQAZGY-CQSZACIVSA-N	1	0	294.420	1.304	50	0		CDAARO
Cc1ccc(-c2noc([C@@H]3CCC[N@@H+](C)C3)n2)nn1	ZINC000091665523	180221275	/nfs/dbraw/zinc/22/12/75/180221275.db2.gz	SLQDMHYSMLODEG-SNVBAGLBSA-N	1	0	259.313	1.644	50	0		CDAARO
COc1ccccc1CN1C[C@H](CO)[C@H](C[NH+](C)C)C1	ZINC000091745330	180244300	/nfs/dbraw/zinc/24/43/00/180244300.db2.gz	KHNWJXZVBYPHFS-HUUCEWRRSA-N	1	0	278.396	1.297	50	0		CDAARO
CC(C)(C)OC(=O)NCCCCC[N@@H+]1CC[C@@H](C(N)=O)C1	ZINC000583651344	366010029	/nfs/dbraw/zinc/01/00/29/366010029.db2.gz	LFWQHWHANVRHHV-GFCCVEGCSA-N	1	0	299.415	1.489	50	0		CDAARO
C[C@@H]1O[C@@H](C(Cl)(Cl)Cl)N(CC[NH+](C)C)C1=O	ZINC000096026575	351474007	/nfs/dbraw/zinc/47/40/07/351474007.db2.gz	BCBYNSIATNYIDO-XPUUQOCRSA-N	1	0	289.590	1.492	50	0		CDAARO
Cc1ccc(C(=O)N2CCO[C@@H]([C@@H](C)[NH3+])C2)c(F)c1	ZINC000122866436	187056284	/nfs/dbraw/zinc/05/62/84/187056284.db2.gz	WHDSFAOILQHEJM-ZWNOBZJWSA-N	1	0	266.316	1.322	50	0		CDAARO
CC(C)([NH3+])CN1CCC[C@H](Oc2ncccc2F)C1	ZINC000261646222	535199362	/nfs/dbraw/zinc/19/93/62/535199362.db2.gz	AQZBBQWZQCZDNT-NSHDSACASA-N	1	0	267.348	1.801	50	0		CDAARO
O=c1oc2ccccc2c2c1nnn2CC[NH+]1CCCC1	ZINC000004902852	363265094	/nfs/dbraw/zinc/26/50/94/363265094.db2.gz	OCVSVJQERLUEEF-UHFFFAOYSA-N	1	0	284.319	1.634	50	0		CDAARO
C[NH2+]Cc1nnc(SCC[C@@H](O)c2ccccc2)n1C	ZINC000426370835	358482561	/nfs/dbraw/zinc/48/25/61/358482561.db2.gz	UKGCQTWWEMSJSR-GFCCVEGCSA-N	1	0	292.408	1.750	50	0		CDAARO
CO[C@@H](C)CS(=O)(=O)N[C@H](C)C[NH+]1CCCCCC1	ZINC000195459993	363435343	/nfs/dbraw/zinc/43/53/43/363435343.db2.gz	WPUIUKMKEUJBBT-OLZOCXBDSA-N	1	0	292.445	1.205	50	0		CDAARO
[NH3+]CCN1C(=O)S/C(=C\c2ccc3c(c2)OCO3)C1=O	ZINC000000969000	355925975	/nfs/dbraw/zinc/92/59/75/355925975.db2.gz	ZAWGHGDNVXQOKU-WDZFZDKYSA-N	1	0	292.316	1.410	50	0		CDAARO
COC(=O)CC[NH+](CCC(=O)OC)Cc1ccccc1	ZINC000001685520	355947274	/nfs/dbraw/zinc/94/72/74/355947274.db2.gz	KPRYGTMLHJYBFC-UHFFFAOYSA-N	1	0	279.336	1.615	50	0		CDAARO
CCOC(=O)CC[NH2+][C@H](C)[C@H]1COc2ccccc2O1	ZINC000004104219	356019334	/nfs/dbraw/zinc/01/93/34/356019334.db2.gz	VPEJVSUDRBRPKB-BXUZGUMPSA-N	1	0	279.336	1.758	50	0		CDAARO
COc1ccc(C)nc1NC(=O)N1CC[C@@H]([NH+](C)C)C1	ZINC000097378681	356103963	/nfs/dbraw/zinc/10/39/63/356103963.db2.gz	SIJYUKLXINHGLK-LLVKDONJSA-N	1	0	278.356	1.566	50	0		CDAARO
C[NH+]1CCC(N2CCC[C@H](NC(=O)c3ccco3)C2)CC1	ZINC000011842607	356281002	/nfs/dbraw/zinc/28/10/02/356281002.db2.gz	MOPMUDJVYWNDED-ZDUSSCGKSA-N	1	0	291.395	1.568	50	0		CDAARO
Cc1cccc(N2CCN(C(=O)[C@@H]3CCC[NH2+]3)CC2)c1	ZINC000011754488	356279308	/nfs/dbraw/zinc/27/93/08/356279308.db2.gz	LHVIIXYSYOYUAV-HNNXBMFYSA-N	1	0	273.380	1.396	50	0		CDAARO
CC[NH+]1CCN(Cc2ccc(OC)c(OC)c2)CC1	ZINC000019536232	356490695	/nfs/dbraw/zinc/49/06/95/356490695.db2.gz	WYLZOUBUHIQPMT-UHFFFAOYSA-N	1	0	264.369	1.841	50	0		CDAARO
Cc1ccc(NC(=O)CC[NH+]2CCN(C)CC2)cc1	ZINC000019210637	356477161	/nfs/dbraw/zinc/47/71/61/356477161.db2.gz	AMDXYLUUAPFSBY-UHFFFAOYSA-N	1	0	261.369	1.571	50	0		CDAARO
CCCNC(=O)c1cnc(N2CC[NH+](CC)CC2)nc1C	ZINC000021930877	356592072	/nfs/dbraw/zinc/59/20/72/356592072.db2.gz	FFVFBJWJLZAHAV-UHFFFAOYSA-N	1	0	291.399	1.067	50	0		CDAARO
COc1ccc(C[NH+]2CCC(C(N)=O)CC2)c(OC)c1C	ZINC000023282124	356638676	/nfs/dbraw/zinc/63/86/76/356638676.db2.gz	SYLSXFBZKLBFHH-UHFFFAOYSA-N	1	0	292.379	1.710	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCN(C(=O)[C@H](C)Oc2cccnc2)C1	ZINC000247116498	356661685	/nfs/dbraw/zinc/66/16/85/356661685.db2.gz	LYTVFLHLPODGPA-AVGNSLFASA-N	1	0	277.368	1.435	50	0		CDAARO
CC(C)[NH+]1CCC(N(C)C(=O)c2cnn(C)c2)CC1	ZINC000032908352	356789751	/nfs/dbraw/zinc/78/97/51/356789751.db2.gz	BAXOHNGAWBOBOW-UHFFFAOYSA-N	1	0	264.373	1.365	50	0		CDAARO
C[NH+](C)CCN1C(=O)[C@@H]2CC=C(Cl)C[C@H]2C1=O	ZINC000100709712	356807452	/nfs/dbraw/zinc/80/74/52/356807452.db2.gz	ZDJWLMQGBPGACF-NXEZZACHSA-N	1	0	256.733	1.066	50	0		CDAARO
COC(=O)[C@@H]1C[NH+](Cc2ccccc2)C[C@H]1C(=O)OC	ZINC000026896673	356830624	/nfs/dbraw/zinc/83/06/24/356830624.db2.gz	JSRVVUSBZJFOJO-CHWSQXEVSA-N	1	0	277.320	1.081	50	0		CDAARO
[NH3+]CCn1cnc2scc(-c3ccco3)c2c1=O	ZINC000043073369	357085920	/nfs/dbraw/zinc/08/59/20/357085920.db2.gz	AKQQKLHZBKQWIC-UHFFFAOYSA-N	1	0	261.306	1.677	50	0		CDAARO
Cc1ccc(C)c([C@H]2CN(C(=O)[C@H](C)[NH3+])[C@H](C)CO2)c1	ZINC000119065554	357252177	/nfs/dbraw/zinc/25/21/77/357252177.db2.gz	FUKXZIYTYDHLJE-VNHYZAJKSA-N	1	0	276.380	1.939	50	0		CDAARO
CCCN(Cc1cccnc1)C(=O)C[C@H]1C[NH2+]CCO1	ZINC000055310185	357331612	/nfs/dbraw/zinc/33/16/12/357331612.db2.gz	OTHSOCWNPCXNEY-AWEZNQCLSA-N	1	0	277.368	1.199	50	0		CDAARO
[NH3+]Cc1nnnn1-c1ccc(OC(F)(F)F)cc1	ZINC000061957969	357466490	/nfs/dbraw/zinc/46/64/90/357466490.db2.gz	VUMWETUVPQUDAS-UHFFFAOYSA-N	1	0	259.191	1.020	50	0		CDAARO
O=C(CCn1nnc2ccccc21)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065372837	357533553	/nfs/dbraw/zinc/53/35/53/357533553.db2.gz	DAXZFMWFCQXHLJ-OLZOCXBDSA-N	1	0	299.378	1.174	50	0		CDAARO
CCOc1ccccc1OCC[N@@H+]1CCC[C@H](C(N)=O)C1	ZINC000065397650	357536456	/nfs/dbraw/zinc/53/64/56/357536456.db2.gz	XQELXAHXPMFDAM-ZDUSSCGKSA-N	1	0	292.379	1.661	50	0		CDAARO
Cc1nc(C)n(CCNC(=O)CC[C@H]2CCCC[N@H+]2C)n1	ZINC000065406350	357538909	/nfs/dbraw/zinc/53/89/09/357538909.db2.gz	BPKPDOHUTKQNPZ-CQSZACIVSA-N	1	0	293.415	1.276	50	0		CDAARO
[NH3+]CCc1n[nH]c(=O)n1-c1cccc(Cl)c1Cl	ZINC000065426259	357539866	/nfs/dbraw/zinc/53/98/66/357539866.db2.gz	AKYOHDWBBSXUJF-UHFFFAOYSA-N	1	0	273.123	1.369	50	0		CDAARO
COc1ccccc1CC(=O)NC[C@@H]1CC[N@H+](C)C1	ZINC000066652583	357576427	/nfs/dbraw/zinc/57/64/27/357576427.db2.gz	ULIXRAHICVYATP-LBPRGKRZSA-N	1	0	262.353	1.306	50	0		CDAARO
Cn1c(CC2CC[NH2+]CC2)nnc1SC[C@@H]1CCCO1	ZINC000065526327	357546543	/nfs/dbraw/zinc/54/65/43/357546543.db2.gz	LFNKEOSQQHJHKC-LBPRGKRZSA-N	1	0	296.440	1.628	50	0		CDAARO
CC(C)NC(=O)c1ccc(OC[C@H]2CCC[NH2+]2)cc1	ZINC000066323499	357562097	/nfs/dbraw/zinc/56/20/97/357562097.db2.gz	YIUPUTILHKMYEB-CYBMUJFWSA-N	1	0	262.353	1.956	50	0		CDAARO
Cc1nc(NC[C@H]2COCCO2)cc(C2CC[NH2+]CC2)n1	ZINC000067755548	357625378	/nfs/dbraw/zinc/62/53/78/357625378.db2.gz	IXLSXWMUUHWCJJ-ZDUSSCGKSA-N	1	0	292.383	1.079	50	0		CDAARO
COc1ccc(CCCC(=O)N2CC[C@@H](C[NH3+])C2)cc1	ZINC000067514984	357611567	/nfs/dbraw/zinc/61/15/67/357611567.db2.gz	GVMOMCUMFNQYAY-AWEZNQCLSA-N	1	0	276.380	1.825	50	0		CDAARO
C[NH+](C)CC(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000067726544	357621259	/nfs/dbraw/zinc/62/12/59/357621259.db2.gz	BRUBBEKXHNFSJG-CYBMUJFWSA-N	1	0	282.771	1.802	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCNC(=O)COc2cccnc2)C1	ZINC000067982158	357641819	/nfs/dbraw/zinc/64/18/19/357641819.db2.gz	BGBCJNLAOOXKBI-CYBMUJFWSA-N	1	0	277.368	1.309	50	0		CDAARO
COc1ccc(Cl)cc1CC(=O)N1CC[NH2+][C@H](C)C1	ZINC000188389284	357657507	/nfs/dbraw/zinc/65/75/07/357657507.db2.gz	UDKPMPUMVKZLIK-SNVBAGLBSA-N	1	0	282.771	1.711	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]Cc1ccc(N2CCOC2=O)cc1	ZINC000097084778	357945040	/nfs/dbraw/zinc/94/50/40/357945040.db2.gz	MCZFZJMFPJPXLL-FZMZJTMJSA-N	1	0	276.336	1.910	50	0		CDAARO
CN(C)C(=O)c1cccc(C[NH2+]C(C)(C)CC(N)=O)c1	ZINC000097112801	357983043	/nfs/dbraw/zinc/98/30/43/357983043.db2.gz	FZIFLXMTPOZHRX-UHFFFAOYSA-N	1	0	277.368	1.132	50	0		CDAARO
Cc1nnc([C@H](C)N[C@@H](CC(N)=O)C2CCCCC2)o1	ZINC000097111050	357986573	/nfs/dbraw/zinc/98/65/73/357986573.db2.gz	TYLRWECEAZAHFL-CABZTGNLSA-N	1	0	280.372	1.853	50	0		CDAARO
CCNC(=O)NC(=O)C[NH2+][C@@H](C)c1ccc(Cl)s1	ZINC000097111508	357987032	/nfs/dbraw/zinc/98/70/32/357987032.db2.gz	SUYOPVFXXSETTQ-ZETCQYMHSA-N	1	0	289.788	1.898	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C[C@@H](O)COc1ccccc1	ZINC000097159273	357998914	/nfs/dbraw/zinc/99/89/14/357998914.db2.gz	QQFJHTKDCFPCJO-CYBMUJFWSA-N	1	0	275.352	1.556	50	0		CDAARO
COC[C@H]1CCC[N@H+](CC(=O)Nc2ccccc2)C1	ZINC000056908321	358022586	/nfs/dbraw/zinc/02/25/86/358022586.db2.gz	DXSKKGRUGZGYAR-ZDUSSCGKSA-N	1	0	262.353	1.984	50	0		CDAARO
CC(C)(C[NH3+])NS(=O)(=O)Cc1cccc2cccnc21	ZINC000097229437	358043151	/nfs/dbraw/zinc/04/31/51/358043151.db2.gz	RSSTZTJQZUWKJH-UHFFFAOYSA-N	1	0	293.392	1.392	50	0		CDAARO
Cc1cc(S(=O)(=O)N(C)CC[C@@H]([NH3+])C(C)C)c(C)o1	ZINC000097234927	358050524	/nfs/dbraw/zinc/05/05/24/358050524.db2.gz	ZTHLXSHMGRHWFJ-GFCCVEGCSA-N	1	0	288.413	1.890	50	0		CDAARO
C[C@@H]1C[NH+](C[C@H](O)COCc2ccccc2)C[C@@H](C)O1	ZINC000019594719	358107238	/nfs/dbraw/zinc/10/72/38/358107238.db2.gz	YTWHNHAFBLEEKO-FMKPAKJESA-N	1	0	279.380	1.673	50	0		CDAARO
c1cc(-c2ccc(CN3CC[C@H]4C[NH2+]C[C@H]43)o2)n[nH]1	ZINC000082156155	358149767	/nfs/dbraw/zinc/14/97/67/358149767.db2.gz	HUKNSJWNFUDYDG-GXFFZTMASA-N	1	0	258.325	1.463	50	0		CDAARO
CCOC(=O)CCN1CC[NH+](Cc2ccccc2)CC1	ZINC000019851428	358175581	/nfs/dbraw/zinc/17/55/81/358175581.db2.gz	LIOVOGRQHDNEKX-UHFFFAOYSA-N	1	0	276.380	1.757	50	0		CDAARO
O=C(C[C@H]1CC[NH2+]C1)NCCOCc1ccccc1	ZINC000129053082	358275642	/nfs/dbraw/zinc/27/56/42/358275642.db2.gz	DMAONXYHKNAZMD-CQSZACIVSA-N	1	0	262.353	1.319	50	0		CDAARO
[NH3+]CCC(=O)N1CCC[C@H]1Cc1cccc(F)c1	ZINC000195542304	358559750	/nfs/dbraw/zinc/55/97/50/358559750.db2.gz	TUZWVDKEMLLRQE-ZDUSSCGKSA-N	1	0	250.317	1.708	50	0		CDAARO
Cc1ccc(CCN(CC(F)(F)F)C(=O)C[NH3+])cc1	ZINC000195542446	358559849	/nfs/dbraw/zinc/55/98/49/358559849.db2.gz	QYJQSNKZDXPFLO-UHFFFAOYSA-N	1	0	274.286	1.887	50	0		CDAARO
CCc1cc(CNC(=O)[C@]2(CC)CCC[NH2+]2)on1	ZINC000195566044	358565590	/nfs/dbraw/zinc/56/55/90/358565590.db2.gz	MSZYQNGBMDEQAV-ZDUSSCGKSA-N	1	0	251.330	1.385	50	0		CDAARO
COc1nccnc1N1CCC([C@H](C)[NH+](C)C)CC1	ZINC000096133652	358708298	/nfs/dbraw/zinc/70/82/98/358708298.db2.gz	TWCOYRSOJVOOKT-NSHDSACASA-N	1	0	264.373	1.652	50	0		CDAARO
Nc1ccnc(N2CCC[C@@H](C[NH+]3CCCCC3)C2)n1	ZINC000096163593	358712365	/nfs/dbraw/zinc/71/23/65/358712365.db2.gz	FWSQLYGTTBMKCU-ZDUSSCGKSA-N	1	0	275.400	1.761	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](OC(=O)[C@@H](O)c1ccccc1)C2	ZINC000100016396	358818125	/nfs/dbraw/zinc/81/81/25/358818125.db2.gz	ZTVIKZXZYLEVOL-YJNKXOJESA-N	1	0	275.348	1.888	50	0	world	CDAARO
O=C1[C@H]2CC=C(Cl)C[C@@H]2C(=O)N1CC[NH+]1CCCCC1	ZINC000100104590	358820820	/nfs/dbraw/zinc/82/08/20/358820820.db2.gz	SHZOHIJTDOCLRY-STQMWFEESA-N	1	0	296.798	1.990	50	0		CDAARO
Cc1ncc(C[N@H+](C)C[C@H]2CC(=O)N(C3CCCC3)C2)[nH]1	ZINC000097610067	358787328	/nfs/dbraw/zinc/78/73/28/358787328.db2.gz	IZPFAOLZAXVHMK-CYBMUJFWSA-N	1	0	290.411	1.941	50	0		CDAARO
CN(CC[NH+](C)C)C(=O)c1cnc(-c2cccnc2)nc1	ZINC000097775972	358798919	/nfs/dbraw/zinc/79/89/19/358798919.db2.gz	HJUFORFAMCOORN-UHFFFAOYSA-N	1	0	285.351	1.172	50	0		CDAARO
[NH3+][C@H]1CCCCN(C(=O)CC2=CSC3=NCCCN23)C1	ZINC000102476173	358880004	/nfs/dbraw/zinc/88/00/04/358880004.db2.gz	LVLANBREJUCKLV-NSHDSACASA-N	1	0	294.424	1.366	50	0		CDAARO
Cc1nn(CC(=O)NCC[C@@H]2CCC[N@H+]2C)c(C)c1C	ZINC000216447415	358945844	/nfs/dbraw/zinc/94/58/44/358945844.db2.gz	CRQSWYRWDPBYEM-AWEZNQCLSA-N	1	0	278.400	1.409	50	0		CDAARO
CCN(C[C@@H]1C[N@H+](CC2CCC2)CCO1)c1cccnn1	ZINC000084774593	358997463	/nfs/dbraw/zinc/99/74/63/358997463.db2.gz	UHNLDWGOXXTYNE-HNNXBMFYSA-N	1	0	290.411	1.804	50	0		CDAARO
CC[N@@H+]1C[C@H](NC(=O)c2ccc(CSC)o2)[C@@H](OC)C1	ZINC000220246061	359160173	/nfs/dbraw/zinc/16/01/73/359160173.db2.gz	DDQBGAWWKMOXNT-AAEUAGOBSA-N	1	0	298.408	1.592	50	0		CDAARO
CSCCC[N@@H+]1CCCn2nc([C@@H](C)O)cc2C1	ZINC000221419332	359247459	/nfs/dbraw/zinc/24/74/59/359247459.db2.gz	ZWRWQZXEZRJPDV-LLVKDONJSA-N	1	0	269.414	1.895	50	0		CDAARO
COc1ccc(C(=O)N(C)C[C@H]2CC[N@H+](C)C2)c(OC)n1	ZINC000222643998	359361291	/nfs/dbraw/zinc/36/12/91/359361291.db2.gz	CLLQUYXCEWWTOJ-NSHDSACASA-N	1	0	293.367	1.123	50	0		CDAARO
CC(C)CN1C(=O)C[C@H](Nc2ccc(N(C)C)cc2)C1=O	ZINC000101145028	359514946	/nfs/dbraw/zinc/51/49/46/359514946.db2.gz	JCQMMDMNSXCBKT-AWEZNQCLSA-N	1	0	289.379	1.948	50	0		CDAARO
CN1CC[N@@H+](C2C3CC4CC(C3)CC2C4)CCC1=O	ZINC000014982009	359517578	/nfs/dbraw/zinc/51/75/78/359517578.db2.gz	SMXLUZHJGJMYRD-UHFFFAOYSA-N	1	0	262.397	1.975	50	0		CDAARO
CCNC(=O)[C@@]1(CCO)CC[N@H+](Cc2ccccc2)C1	ZINC000257191259	359588211	/nfs/dbraw/zinc/58/82/11/359588211.db2.gz	PQTVWXUPFRFBLC-MRXNPFEDSA-N	1	0	276.380	1.397	50	0		CDAARO
Cc1ccc(C[NH2+]C[C@@H]2CCCS2(=O)=O)s1	ZINC000087970523	363685261	/nfs/dbraw/zinc/68/52/61/363685261.db2.gz	YIGKTRYFVTYXKU-NSHDSACASA-N	1	0	259.396	1.723	50	0		CDAARO
COc1ccccc1OCCNC1=[NH+]CCCCN1	ZINC000521396947	359970381	/nfs/dbraw/zinc/97/03/81/359970381.db2.gz	ODJDGBZTJNUHBE-UHFFFAOYSA-N	1	0	263.341	1.403	50	0		CDAARO
CC(=O)NC1(C(=O)N2C[C@H](C)[C@H]([NH+](C)C)C2)CCCCC1	ZINC000089937152	360197461	/nfs/dbraw/zinc/19/74/61/360197461.db2.gz	WCOWEQKCLIFFPR-GXTWGEPZSA-N	1	0	295.427	1.234	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)CCCn1cccn1	ZINC000248108564	360362398	/nfs/dbraw/zinc/36/23/98/360362398.db2.gz	GNRQTBWMOVYMMJ-HUUCEWRRSA-N	1	0	290.411	1.749	50	0		CDAARO
CC[NH+](CC)C[C@H](O)COc1ccccc1C(C)=O	ZINC000004320468	360546665	/nfs/dbraw/zinc/54/66/65/360546665.db2.gz	CSNITBQQXAQVFX-ZDUSSCGKSA-N	1	0	265.353	1.971	50	0		CDAARO
CC(C)C[N@@H+]1CCCC[C@H]1CCNC(=O)Cn1ccnn1	ZINC000426508181	360677526	/nfs/dbraw/zinc/67/75/26/360677526.db2.gz	ZXPZYHGKFVVQHF-AWEZNQCLSA-N	1	0	293.415	1.295	50	0		CDAARO
Cc1ccc(C(=O)NC2(CO)CCCC2)cc1OCC[NH3+]	ZINC000426514907	360678852	/nfs/dbraw/zinc/67/88/52/360678852.db2.gz	SUZWCBCWDGTCBX-UHFFFAOYSA-N	1	0	292.379	1.367	50	0		CDAARO
Cc1nonc1CSc1nnc([C@H]2CCC[NH2+]C2)n1C	ZINC000426513745	360679046	/nfs/dbraw/zinc/67/90/46/360679046.db2.gz	RVBSFHRJDBJIAI-VIFPVBQESA-N	1	0	294.384	1.266	50	0		CDAARO
Cc1n[nH]c(C)c1CCN1CCN(c2nonc2C)CC1	ZINC000426615194	360689798	/nfs/dbraw/zinc/68/97/98/360689798.db2.gz	RKAPLILTUJROER-UHFFFAOYSA-N	1	0	290.371	1.083	50	0		CDAARO
CCOc1ccc(/C=C/C(=O)N2CC[C@@H](C[NH3+])C2)cc1	ZINC000178555502	189126775	/nfs/dbraw/zinc/12/67/75/189126775.db2.gz	YKOHHEYTEIWHCJ-GPAKFWEMSA-N	1	0	274.364	1.906	50	0		CDAARO
CCOc1ccc(C(=O)N2CC[C@H](C[NH2+]C)C2)cc1OC	ZINC000178986099	189159280	/nfs/dbraw/zinc/15/92/80/189159280.db2.gz	UKAMCOGCLALGBK-GFCCVEGCSA-N	1	0	292.379	1.775	50	0		CDAARO
COc1ccc(CC(=O)NC[C@@H]2CCC[NH2+]C2)cc1F	ZINC000129746335	360878239	/nfs/dbraw/zinc/87/82/39/360878239.db2.gz	IBBRXIFGGMJKNR-GFCCVEGCSA-N	1	0	280.343	1.493	50	0		CDAARO
CCn1cncc1CNC(=O)c1cccc(C[NH+](C)C)c1	ZINC000426503745	360933739	/nfs/dbraw/zinc/93/37/39/360933739.db2.gz	XBIRYRLEHKQNEW-UHFFFAOYSA-N	1	0	286.379	1.895	50	0		CDAARO
C[C@@]1(C2CC[NH2+]CC2)NC(=O)N(Cc2ccsc2)C1=O	ZINC000299801079	200879323	/nfs/dbraw/zinc/87/93/23/200879323.db2.gz	XQGGMTLSNNGEPK-AWEZNQCLSA-N	1	0	293.392	1.558	50	0		CDAARO
COC[C@@H](O)C[N@@H+]1CCC[C@@H](C(=O)c2ccc(F)cc2)C1	ZINC000180737759	189272368	/nfs/dbraw/zinc/27/23/68/189272368.db2.gz	IHYGCNDBKHHEPY-HIFRSBDPSA-N	1	0	295.354	1.728	50	0		CDAARO
COC(=O)[C@H]1CCN(Cc2ncc(C)o2)C[C@H]1C	ZINC000191799500	361321469	/nfs/dbraw/zinc/32/14/69/361321469.db2.gz	QXPDCAIHWBUQQB-KOLCDFICSA-N	1	0	252.314	1.614	50	0		CDAARO
C[C@H]([NH2+][C@@H]1C=C[C@H](CO)C1)c1ccc(-n2cncn2)cc1	ZINC000183570784	189362333	/nfs/dbraw/zinc/36/23/33/189362333.db2.gz	VZNBBQNTYQYUMH-KCQAQPDRSA-N	1	0	284.363	1.855	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2cncc(F)c2)CCOCC1	ZINC000130118719	361596346	/nfs/dbraw/zinc/59/63/46/361596346.db2.gz	LAFUOWHSNGYMES-UHFFFAOYSA-N	1	0	281.331	1.061	50	0		CDAARO
O=C(NCCCc1ccccc1)NC[C@@H]1CCC[NH2+]1	ZINC000416803536	364337145	/nfs/dbraw/zinc/33/71/45/364337145.db2.gz	YFAIENWCWIDRIT-AWEZNQCLSA-N	1	0	261.369	1.670	50	0		CDAARO
CN(C(=O)Cc1ccccc1F)C1CC[NH+](C)CC1	ZINC000012976596	364738867	/nfs/dbraw/zinc/73/88/67/364738867.db2.gz	QXOGIAYIBUNHHA-UHFFFAOYSA-N	1	0	264.344	1.921	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1C(=O)N1CCC[C@H]1Cn1cccn1	ZINC000249693951	365193011	/nfs/dbraw/zinc/19/30/11/365193011.db2.gz	OHQGVEMGBMLXNX-LSDHHAIUSA-N	1	0	290.411	1.749	50	0		CDAARO
CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)NCCCC(C)(C)CO	ZINC000089802086	366936871	/nfs/dbraw/zinc/93/68/71/366936871.db2.gz	RULTUGPBEUXBAU-AWEZNQCLSA-N	1	0	299.459	1.767	50	0		CDAARO
CCCCOC(=O)CC[N@@H+]1CCCN(CC(F)F)CC1	ZINC000089954773	366981853	/nfs/dbraw/zinc/98/18/53/366981853.db2.gz	SPEYQJJWMMKJTI-UHFFFAOYSA-N	1	0	292.370	1.993	50	0		CDAARO
CO[C@@H]1CC[C@H]2OCC[N@H+](CCCCCO)[C@H]2C1	ZINC000252486078	367573713	/nfs/dbraw/zinc/57/37/13/367573713.db2.gz	DSRCOAFQYOTZAX-HZSPNIEDSA-N	1	0	257.374	1.417	50	0		CDAARO
Cn1cncc1C[N@@H+]1CCC[C@@H](c2ccncn2)C1	ZINC000370236511	369989007	/nfs/dbraw/zinc/98/90/07/369989007.db2.gz	PGMPDZQKBDLZSY-GFCCVEGCSA-N	1	0	257.341	1.590	50	0		CDAARO
O=C(NC1CCN(c2ccc(F)cc2)CC1)[C@H]1C=CC[NH2+]1	ZINC000299787473	372762909	/nfs/dbraw/zinc/76/29/09/372762909.db2.gz	OCKWVPSHSVICHD-OAHLLOKOSA-N	1	0	289.354	1.439	50	0		CDAARO
CN(C(=O)Nc1cccc2n[nH]cc21)[C@H]1CC[N@H+](C)C1	ZINC000299802895	372773102	/nfs/dbraw/zinc/77/31/02/372773102.db2.gz	XUWTYLVIMTUUHR-JTQLQIEISA-N	1	0	273.340	1.731	50	0		CDAARO
CCCn1cnnc1CN(C)C[C@H](C)[NH+]1CCCC1	ZINC000244652047	189908083	/nfs/dbraw/zinc/90/80/83/189908083.db2.gz	GYTLCWCAPWPURW-ZDUSSCGKSA-N	1	0	265.405	1.604	50	0		CDAARO
CCN(Cc1ccccc1Cl)C(=O)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000037808797	373376662	/nfs/dbraw/zinc/37/66/62/373376662.db2.gz	AHFSARJUDKKQTB-AAEUAGOBSA-N	1	0	282.771	1.411	50	0		CDAARO
C[C@@H]([NH3+])C(=O)N(Cc1cccs1)C[C@@H]1CCCO1	ZINC000037801385	373348667	/nfs/dbraw/zinc/34/86/67/373348667.db2.gz	HLFAVMHTEDFRFB-MNOVXSKESA-N	1	0	268.382	1.603	50	0		CDAARO
CC(C)(O)C[NH2+]Cc1ccccc1N1CCOCC1	ZINC000111385699	374186166	/nfs/dbraw/zinc/18/61/66/374186166.db2.gz	ZFCFIUWGUUYNGU-UHFFFAOYSA-N	1	0	264.369	1.384	50	0		CDAARO
C[C@@H]1CN(Cc2cnc(N3CCOCC3)s2)C[C@H](C)O1	ZINC000012857826	374595825	/nfs/dbraw/zinc/59/58/25/374595825.db2.gz	LPQSAAHZYCBFHK-TXEJJXNPSA-N	1	0	297.424	1.589	50	0		CDAARO
CC[C@@H](CO)[NH+]1CCN(Cc2c(F)cccc2F)CC1	ZINC000093740397	374782743	/nfs/dbraw/zinc/78/27/43/374782743.db2.gz	GFQQHRNTKSQJCK-LBPRGKRZSA-N	1	0	284.350	1.853	50	0		CDAARO
CCCc1nnc(N2CCC[C@]3(CC[N@H+](C)C3)C2)o1	ZINC000095358076	374890130	/nfs/dbraw/zinc/89/01/30/374890130.db2.gz	SPZRHEXAGYFMJL-CQSZACIVSA-N	1	0	264.373	1.944	50	0		CDAARO
C[C@@](CO)(NC(=O)NC1CC[NH+](C2CC2)CC1)C1CC1	ZINC000095417080	374918487	/nfs/dbraw/zinc/91/84/87/374918487.db2.gz	MGIBLWZQRCRNOE-HNNXBMFYSA-N	1	0	281.400	1.073	50	0		CDAARO
CCOC(=O)[C@@H]1CCC[N@H+](CCC(=O)C2CC2)C1	ZINC000095453381	374951713	/nfs/dbraw/zinc/95/17/13/374951713.db2.gz	AIZAKOCTQPFBGE-GFCCVEGCSA-N	1	0	253.342	1.631	50	0		CDAARO
c1ccc(-n2nnnc2N2CC[C@H]([NH+]3CCCC3)C2)cc1	ZINC000095469697	374966130	/nfs/dbraw/zinc/96/61/30/374966130.db2.gz	YJLDJWGRDSEPFU-AWEZNQCLSA-N	1	0	284.367	1.337	50	0		CDAARO
CC(C)S(=O)(=O)NC[C@@H]1CCC[N@H+](CC2CCC2)C1	ZINC000095405116	374909418	/nfs/dbraw/zinc/90/94/18/374909418.db2.gz	MOVIOWNWWNGVMR-AWEZNQCLSA-N	1	0	288.457	1.826	50	0		CDAARO
COC(=O)[C@@]12CCC[C@@H]1C[N@H+](Cc1cccn1C)C2	ZINC000108496709	412831317	/nfs/dbraw/zinc/83/13/17/412831317.db2.gz	LRHCXIUSZNDQPC-IUODEOHRSA-N	1	0	262.353	1.800	50	0		CDAARO
NC(=O)[C@@H]1CCC[N@@H+]1C1CCN(c2ncccc2F)CC1	ZINC000095981619	375047389	/nfs/dbraw/zinc/04/73/89/375047389.db2.gz	NBEYJSXUOUSGNN-ZDUSSCGKSA-N	1	0	292.358	1.139	50	0		CDAARO
Cc1ccc(C[NH2+][C@@H](CC(N)=O)C2CCOCC2)nc1	ZINC000097037628	375138847	/nfs/dbraw/zinc/13/88/47/375138847.db2.gz	GYFFHOLBOXGNHV-AWEZNQCLSA-N	1	0	277.368	1.150	50	0		CDAARO
COc1cccc([C@@H]2C[NH2+]C[C@@H]2C(=O)NC(C)C)c1	ZINC000035847953	542014506	/nfs/dbraw/zinc/01/45/06/542014506.db2.gz	CYLJKHHBRBRCRL-KBPBESRZSA-N	1	0	262.353	1.523	50	0		CDAARO
CN(C)c1ncc(C[N@@H+]2C[C@@H](O)C3(CC3)C2)s1	ZINC000428378216	247289631	/nfs/dbraw/zinc/28/96/31/247289631.db2.gz	UEDVLJDIBAPKQN-SNVBAGLBSA-N	1	0	253.371	1.166	50	0		CDAARO
COc1ccc(OCC[NH+]2CCC(O)CC2)cc1	ZINC000032106453	375801231	/nfs/dbraw/zinc/80/12/31/375801231.db2.gz	NJXCANIUTMUXQJ-UHFFFAOYSA-N	1	0	251.326	1.531	50	0		CDAARO
Cc1nn(C)c(C)c1/C=C\C(=O)N1CC[N@@H+](C)C[C@H]1C	ZINC000254897789	375855461	/nfs/dbraw/zinc/85/54/61/375855461.db2.gz	OULHUDVALSPHSW-JMEBYUIHSA-N	1	0	276.384	1.213	50	0		CDAARO
COc1cccc(/C(C)=C\C(=O)N2CC[NH2+]C[C@@H]2C)c1	ZINC000254949898	375925519	/nfs/dbraw/zinc/92/55/19/375925519.db2.gz	BUNCVYBLLOPZKN-SUIFULHWSA-N	1	0	274.364	1.919	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ncoc2[C@H]2CCCO2)C[C@H]1[NH+](C)C	ZINC000257366340	190038364	/nfs/dbraw/zinc/03/83/64/190038364.db2.gz	SRANYZXXULKDGX-IJLUTSLNSA-N	1	0	293.367	1.548	50	0		CDAARO
[NH3+][C@H]1CCN(S(=O)(=O)c2ccc(F)cc2Cl)C1	ZINC000050242064	376058293	/nfs/dbraw/zinc/05/82/93/376058293.db2.gz	ZPYGTWZGQPKRPU-QMMMGPOBSA-N	1	0	278.736	1.201	50	0		CDAARO
Cc1nc(C[NH3+])cc(NCc2ccccc2-n2cncn2)n1	ZINC000067849907	377259819	/nfs/dbraw/zinc/25/98/19/377259819.db2.gz	LRSAGRLSEJXGNL-UHFFFAOYSA-N	1	0	295.350	1.437	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2cnc3c(-c4ccccc4)cnn3c2)C1	ZINC000067881395	377279125	/nfs/dbraw/zinc/27/91/25/377279125.db2.gz	JKCQQDRSHAJKIY-OAHLLOKOSA-N	1	0	293.374	1.929	50	0		CDAARO
O=C([C@H]1CCCO1)N1CCCN(Cc2ccncc2)CC1	ZINC000077440015	377573443	/nfs/dbraw/zinc/57/34/43/377573443.db2.gz	ODPUNVBOVSYZIS-OAHLLOKOSA-N	1	0	289.379	1.295	50	0		CDAARO
O=C(C[NH+]1CCCC1)NC[C@H]1OCCc2ccccc21	ZINC000001421844	378463426	/nfs/dbraw/zinc/46/34/26/378463426.db2.gz	GDXVMGULELNRNO-OAHLLOKOSA-N	1	0	274.364	1.512	50	0		CDAARO
O=C1CNC(=O)N1CC[NH2+][C@@H]1CCCNc2ccccc21	ZINC000193286483	296338872	/nfs/dbraw/zinc/33/88/72/296338872.db2.gz	QRDTUFYAVDAYMV-CYBMUJFWSA-N	1	0	288.351	1.075	50	0		CDAARO
COCCN1CCC[C@](O)(C[N@H+](C)C2CCCCC2)C1=O	ZINC000011880115	285039342	/nfs/dbraw/zinc/03/93/42/285039342.db2.gz	IKBVHWKEXYIARN-INIZCTEOSA-N	1	0	298.427	1.251	50	0		CDAARO
C[NH2+]Cc1cccc(N2C[C@H](C)CS2(=O)=O)c1	ZINC000093640864	184699466	/nfs/dbraw/zinc/69/94/66/184699466.db2.gz	OJQNACRHAPGOEA-JTQLQIEISA-N	1	0	254.355	1.192	50	0		CDAARO
CC(C)c1ncncc1C(=O)N1CCC[C@@H]([C@H](C)[NH3+])C1	ZINC000269297199	390416148	/nfs/dbraw/zinc/41/61/48/390416148.db2.gz	WHURRLBBLNNPOI-NWDGAFQWSA-N	1	0	276.384	1.799	50	0		CDAARO
CCC(CC)(CO)[NH2+]CCn1cc(Br)cn1	ZINC000096424685	390516152	/nfs/dbraw/zinc/51/61/52/390516152.db2.gz	BBWWRUBENFFACU-UHFFFAOYSA-N	1	0	290.205	1.786	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](CNc2nc(C)cc(C)n2)C1	ZINC000065382307	390550936	/nfs/dbraw/zinc/55/09/36/390550936.db2.gz	NHZSDBUWNHSRHG-CQSZACIVSA-N	1	0	278.400	1.864	50	0		CDAARO
[NH3+][C@H]1CCN(c2nccn3nc(-c4ccccc4)cc23)C1	ZINC000070458574	390606525	/nfs/dbraw/zinc/60/65/25/390606525.db2.gz	FNVPVFCDGNSYPZ-ZDUSSCGKSA-N	1	0	279.347	1.934	50	0		CDAARO
COC[C@H](O)C[NH2+][C@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000107515588	390904153	/nfs/dbraw/zinc/90/41/53/390904153.db2.gz	ZCHUYHRRODXDLS-VNQPRFMTSA-N	1	0	278.396	1.419	50	0		CDAARO
CCCC[C@H](C[NH3+])NS(=O)(=O)N1CCCCCC1	ZINC000130508019	390926985	/nfs/dbraw/zinc/92/69/85/390926985.db2.gz	YVGHMYYLVQDWME-GFCCVEGCSA-N	1	0	277.434	1.214	50	0		CDAARO
C[C@@H](CCC(=O)N(C)Cc1cnn(C)c1)[NH+]1CCCC1	ZINC000426393088	533514560	/nfs/dbraw/zinc/51/45/60/533514560.db2.gz	UXXMKPFOYRGEJQ-ZDUSSCGKSA-N	1	0	278.400	1.643	50	0		CDAARO
C[C@@H]([NH3+])C1CCN(C(=O)c2cccc(NC(N)=O)c2)CC1	ZINC000262501610	131227081	/nfs/dbraw/zinc/22/70/81/131227081.db2.gz	HGVGOULMKUESNM-SNVBAGLBSA-N	1	0	290.367	1.377	50	0		CDAARO
Cc1cccc(N(CCC(N)=O)C(=O)C[NH2+]CC2CC2)c1	ZINC000262600652	131238612	/nfs/dbraw/zinc/23/86/12/131238612.db2.gz	CBYXEVSZMQHXDO-UHFFFAOYSA-N	1	0	289.379	1.203	50	0		CDAARO
CS[C@@H]1CCC[C@@H]1[N@H+](C)CC(=O)NC[C@@H]1CCCO1	ZINC000110642434	392786462	/nfs/dbraw/zinc/78/64/62/392786462.db2.gz	SXSUQYSCSBPSDK-RWMBFGLXSA-N	1	0	286.441	1.498	50	0		CDAARO
COc1coc(C[N@H+](C)C[C@H]2CCOC2)cc1=O	ZINC000268490587	132017585	/nfs/dbraw/zinc/01/75/85/132017585.db2.gz	RHRPYDDLFJZHCQ-SNVBAGLBSA-N	1	0	253.298	1.117	50	0		CDAARO
Cc1nn(C)c(C)c1OCC(=O)N1CCC[C@H]([C@@H](C)[NH3+])C1	ZINC000269231432	132137186	/nfs/dbraw/zinc/13/71/86/132137186.db2.gz	AOQWCKFXIRHPJK-MFKMUULPSA-N	1	0	294.399	1.002	50	0		CDAARO
[NH3+][C@@H]1CCC[C@H](C(=O)N2CCO[C@H](c3nccs3)C2)C1	ZINC000269235341	132138626	/nfs/dbraw/zinc/13/86/26/132138626.db2.gz	GGQFUTAIAOWQKH-TUAOUCFPSA-N	1	0	295.408	1.561	50	0		CDAARO
CC[C@H](CO)[NH+]1CCN([C@H]2Cc3ccccc3[C@@H]2O)CC1	ZINC000095451582	393148524	/nfs/dbraw/zinc/14/85/24/393148524.db2.gz	XIIZVMWTCZSXIW-PVAVHDDUSA-N	1	0	290.407	1.033	50	0		CDAARO
CCOC(=O)[C@H]1CCCCN1c1cc(CC[NH3+])nc(C)n1	ZINC000067490187	134939425	/nfs/dbraw/zinc/93/94/25/134939425.db2.gz	FGCKHPNHVHESBP-CYBMUJFWSA-N	1	0	292.383	1.208	50	0		CDAARO
Cc1n[nH]c([C@@H]2CCCN(c3nc(N)[nH+]c(C)c3C)C2)n1	ZINC000091782499	135073863	/nfs/dbraw/zinc/07/38/63/135073863.db2.gz	SMWUECAYUABQLQ-LLVKDONJSA-N	1	0	287.371	1.486	50	0		CDAARO
O=C(Nc1nc2c(cccc2Cl)[nH]1)[C@H]1CCC[NH2+]1	ZINC000261702937	140378035	/nfs/dbraw/zinc/37/80/35/140378035.db2.gz	LSCRKCHYSJTLAP-SECBINFHSA-N	1	0	264.716	1.907	50	0		CDAARO
Cc1ccc(C2=NC3(CC[NH2+]CC3)NC2=S)cc1	ZINC000006817087	292090295	/nfs/dbraw/zinc/09/02/95/292090295.db2.gz	CYZUOGBZWMPFHM-UHFFFAOYSA-N	1	0	259.378	1.794	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1ccc2nnc(C)n2c1	ZINC000033261862	397925420	/nfs/dbraw/zinc/92/54/20/397925420.db2.gz	FIQVPYVASPCXTI-ZDUSSCGKSA-N	1	0	287.367	1.252	50	0		CDAARO
CCOC(=O)[C@@H]1CC[C@H]([NH3+])[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000095743173	285874181	/nfs/dbraw/zinc/87/41/81/285874181.db2.gz	STWAQGKVYHZJCJ-VWYCJHECSA-N	1	0	286.372	1.570	50	0		CDAARO
C[C@H](O)C1CC[NH+](CC(=O)N2CCCC[C@@H]2C)CC1	ZINC000095395337	147114026	/nfs/dbraw/zinc/11/40/26/147114026.db2.gz	BOHGLRUBKNUXRI-STQMWFEESA-N	1	0	268.401	1.480	50	0		CDAARO
CNC(=O)c1ccc(NCc2ccc3c(c2)C[NH2+]C3)nn1	ZINC000097829911	147126944	/nfs/dbraw/zinc/12/69/44/147126944.db2.gz	MYNATEGFYHWHHV-UHFFFAOYSA-N	1	0	283.335	1.052	50	0		CDAARO
CO[C@@H]1CCN(C(=O)C2CC[NH+](C(C)C)CC2)C1	ZINC000335291463	150504059	/nfs/dbraw/zinc/50/40/59/150504059.db2.gz	DYNBYPJXWBVHAY-CYBMUJFWSA-N	1	0	254.374	1.354	50	0		CDAARO
CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)C1([NH3+])CCCC1)CC2	ZINC000262477395	286293939	/nfs/dbraw/zinc/29/39/39/286293939.db2.gz	QKNQMCAIJVEOQQ-CHWSQXEVSA-N	1	0	296.411	1.036	50	0		CDAARO
Cc1c(F)cccc1S(=O)(=O)N(C)[C@@H](C[NH3+])C1CC1	ZINC000360000061	158437316	/nfs/dbraw/zinc/43/73/16/158437316.db2.gz	JZBPZYSJSZEABU-LBPRGKRZSA-N	1	0	286.372	1.492	50	0		CDAARO
CC[NH+](CC)CC(=O)Nc1cccc2c1OCO2	ZINC000004826034	170024714	/nfs/dbraw/zinc/02/47/14/170024714.db2.gz	WPDJOOLQUKQIMI-UHFFFAOYSA-N	1	0	250.298	1.696	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1cc2cc(F)ccc2[nH]1	ZINC000005271858	170081504	/nfs/dbraw/zinc/08/15/04/170081504.db2.gz	JHRWUWRHPCXRQH-UHFFFAOYSA-N	1	0	263.316	1.989	50	0		CDAARO
CCNC(=S)NC[C@H](c1ccccc1)[NH+](C)C	ZINC000006612587	170219077	/nfs/dbraw/zinc/21/90/77/170219077.db2.gz	VYECNTXGRKHEDW-GFCCVEGCSA-N	1	0	251.399	1.773	50	0		CDAARO
C[C@@H]1C[C@@H](C)C[NH+](CC(=O)NC(=O)NCc2ccco2)C1	ZINC000007788243	170303002	/nfs/dbraw/zinc/30/30/02/170303002.db2.gz	ZWSQIZUDLPKUPB-VXGBXAGGSA-N	1	0	293.367	1.583	50	0		CDAARO
C[N@@H+]1CCCN(c2nc3ccccc3cc2CO)CC1	ZINC000020468244	171210058	/nfs/dbraw/zinc/21/00/58/171210058.db2.gz	YMTPCEDQQBSKGJ-UHFFFAOYSA-N	1	0	271.364	1.869	50	0		CDAARO
CC(C)c1nc(C(=O)NC2CC[NH2+]CC2)cs1	ZINC000020539226	171241532	/nfs/dbraw/zinc/24/15/32/171241532.db2.gz	XEXALAWHWOBUEB-UHFFFAOYSA-N	1	0	253.371	1.748	50	0		CDAARO
CCN(CCOC)c1cc(C2CC[NH2+]CC2)ncn1	ZINC000071278959	176108175	/nfs/dbraw/zinc/10/81/75/176108175.db2.gz	XLKQXEBIWCIALK-UHFFFAOYSA-N	1	0	264.373	1.416	50	0		CDAARO
C[NH2+]CC(=O)N[C@H](C)c1cnn(-c2ccccc2OC)c1	ZINC000071681527	176245519	/nfs/dbraw/zinc/24/55/19/176245519.db2.gz	DWQONKLKBNPIRA-LLVKDONJSA-N	1	0	288.351	1.278	50	0		CDAARO
Cc1ccc(C)c(O[C@H](C)C(=O)NCC[NH+](C)C)c1	ZINC000072117342	176319198	/nfs/dbraw/zinc/31/91/98/176319198.db2.gz	DFULERRZJVFIBU-CYBMUJFWSA-N	1	0	264.369	1.749	50	0		CDAARO
Cc1noc(C)c1CN(C)Cc1cc2n(n1)CCC[NH2+]C2	ZINC000072140456	176323419	/nfs/dbraw/zinc/32/34/19/176323419.db2.gz	ADUNLZRDNBPBBT-UHFFFAOYSA-N	1	0	289.383	1.613	50	0		CDAARO
CCCc1nc(C(=O)NC[C@]2(O)CCC[NH2+]CC2)cs1	ZINC000072148543	176325665	/nfs/dbraw/zinc/32/56/65/176325665.db2.gz	FAQGIECMPCTHAK-AWEZNQCLSA-N	1	0	297.424	1.330	50	0		CDAARO
Nc1cc(-c2cccc3c2CC[NH2+]C3)nc(N2CCCC2)n1	ZINC000072150748	176326261	/nfs/dbraw/zinc/32/62/61/176326261.db2.gz	YHCIUUFGJYOXRD-UHFFFAOYSA-N	1	0	295.390	1.972	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]1NC(=O)c1cnc(Nc2ccccc2)nc1	ZINC000072159152	176329217	/nfs/dbraw/zinc/32/92/17/176329217.db2.gz	IJSMKYNHQBTZKU-OLZOCXBDSA-N	1	0	283.335	1.440	50	0		CDAARO
OC1(c2cncnc2)CC[NH+](Cc2ccccc2)CC1	ZINC000072233550	176344611	/nfs/dbraw/zinc/34/46/11/176344611.db2.gz	DJISRRXRUXQLAV-UHFFFAOYSA-N	1	0	269.348	1.960	50	0		CDAARO
Nc1nc2c(c(NC3Cc4ccccc4C3)n1)CC[NH2+]CC2	ZINC000072407080	176397727	/nfs/dbraw/zinc/39/77/27/176397727.db2.gz	HYUPEEXLQIGTLQ-UHFFFAOYSA-N	1	0	295.390	1.326	50	0		CDAARO
CCCc1cc(N2CC[C@@H](C[NH3+])C2)n2nccc2n1	ZINC000072409135	176398229	/nfs/dbraw/zinc/39/82/29/176398229.db2.gz	BLRQQTJIBPYHNT-NSHDSACASA-N	1	0	259.357	1.467	50	0		CDAARO
c1ccc2c(c1)oc1c2ncnc1N1CC[NH2+]CC1	ZINC000003251587	275071784	/nfs/dbraw/zinc/07/17/84/275071784.db2.gz	QWQBHCFTLXGCEJ-UHFFFAOYSA-N	1	0	254.293	1.786	50	0		CDAARO
CC(C)(C)CN1CCC[C@](O)(C[NH2+]C2CCC2)C1=O	ZINC000015073782	275511176	/nfs/dbraw/zinc/51/11/76/275511176.db2.gz	FSEHGXFNIAPKFP-HNNXBMFYSA-N	1	0	268.401	1.528	50	0		CDAARO
CCN1CC2(CC1=O)CC[NH+](C[C@@H]1CCCCO1)CC2	ZINC000095513018	276358249	/nfs/dbraw/zinc/35/82/49/276358249.db2.gz	QKONRWPYBHWAKS-AWEZNQCLSA-N	1	0	280.412	1.890	50	0		CDAARO
CCc1cnc(N2CCN(c3cc[nH+]cc3)CC2)nc1	ZINC000095387532	276682682	/nfs/dbraw/zinc/68/26/82/276682682.db2.gz	HFTMKPQPWLEGKP-UHFFFAOYSA-N	1	0	269.352	1.761	50	0		CDAARO
CC(C)c1cncnc1N1CCN2CC[N@H+](C)C[C@H]2C1	ZINC000106261922	278066763	/nfs/dbraw/zinc/06/67/63/278066763.db2.gz	QTHDFYJBHSEOSE-ZDUSSCGKSA-N	1	0	275.400	1.036	50	0		CDAARO
C[C@@H]([NH2+]CCOc1ccc2c(c1)OCO2)c1nccn1C	ZINC000096491593	278348129	/nfs/dbraw/zinc/34/81/29/278348129.db2.gz	NEGRFEZWOCOZLX-LLVKDONJSA-N	1	0	289.335	1.878	50	0		CDAARO
C[C@@H]1CC[NH2+][C@@H](C(=O)N[C@@H]2COc3ccccc32)C1	ZINC000127258946	278567885	/nfs/dbraw/zinc/56/78/85/278567885.db2.gz	DKYQLPWUCFUVGM-RAIGVLPGSA-N	1	0	260.337	1.624	50	0		CDAARO
Cn1c2ccccc2c(C(=O)N2CCCC[C@@H]([NH3+])C2)cc1=O	ZINC000082107192	279320399	/nfs/dbraw/zinc/32/03/99/279320399.db2.gz	OOBULCZDXFOWQN-GFCCVEGCSA-N	1	0	299.374	1.492	50	0		CDAARO
C[C@@H]1COc2ccccc2C[N@@H+]1CCN1CCNC1=O	ZINC000289953556	288399516	/nfs/dbraw/zinc/39/95/16/288399516.db2.gz	PIKZBVYCWXAJCU-GFCCVEGCSA-N	1	0	275.352	1.295	50	0		CDAARO
C[C@H](C(N)=O)[N@H+]1CC=C(CCNC(=O)C(C)(C)C)CC1	ZINC000065424609	289393029	/nfs/dbraw/zinc/39/30/29/289393029.db2.gz	DMZMJCYKGQTFLW-LLVKDONJSA-N	1	0	281.400	1.045	50	0		CDAARO
C[C@H](c1ccccc1)N1C(=[NH2+])S[C@H]2CS(=O)(=O)C[C@@H]21	ZINC000102774209	290254590	/nfs/dbraw/zinc/25/45/90/290254590.db2.gz	VPTURGDGEBLVCX-USWWRNFRSA-N	1	0	296.417	1.897	50	0		CDAARO
C[N@@H+]1C[C@H](NC(=O)CC(C)(C)c2ccccc2)C[C@H]1CO	ZINC000426503524	290304056	/nfs/dbraw/zinc/30/40/56/290304056.db2.gz	OFNIVMPOBKUQKQ-CABCVRRESA-N	1	0	290.407	1.536	50	0		CDAARO
[NH3+][C@@H]1CCCC[C@H]1NS(=O)(=O)Cc1ccccc1F	ZINC000178898080	315962250	/nfs/dbraw/zinc/96/22/50/315962250.db2.gz	JWOMJZOSVNLILH-CHWSQXEVSA-N	1	0	286.372	1.515	50	0		CDAARO
Cc1nn[nH]c1C(=O)NC[C@H](c1cccc(C)c1)[NH+](C)C	ZINC000534582603	328312620	/nfs/dbraw/zinc/31/26/20/328312620.db2.gz	RWDZNPHNHIQBDA-CYBMUJFWSA-N	1	0	287.367	1.454	50	0		CDAARO
O=C(C[C@@H]1CCCOC1)NCC1(C[NH+]2CCCC2)CC1	ZINC000534584951	328314943	/nfs/dbraw/zinc/31/49/43/328314943.db2.gz	WXOISIRIOHDZOG-AWEZNQCLSA-N	1	0	280.412	1.795	50	0		CDAARO
CC1(C(=O)NC2(C[NH+]3CCCCC3)CC2)COC1	ZINC000534590669	328317757	/nfs/dbraw/zinc/31/77/57/328317757.db2.gz	WZCQFBOJQLTTOR-UHFFFAOYSA-N	1	0	252.358	1.158	50	0		CDAARO
O=C1NCC[C@H]1[NH2+]C1CCN(c2ccccc2Cl)CC1	ZINC000534590837	328318043	/nfs/dbraw/zinc/31/80/43/328318043.db2.gz	GJLKCVRSWNXJEP-CYBMUJFWSA-N	1	0	293.798	1.787	50	0		CDAARO
CC(C)[C@@H](NC(=O)C[NH+]1CCCCCC1)c1ncnn1C	ZINC000534642713	328329087	/nfs/dbraw/zinc/32/90/87/328329087.db2.gz	QWTHHRHFJLXVKJ-CQSZACIVSA-N	1	0	293.415	1.504	50	0		CDAARO
CN(Cc1nc2cc(Cl)ccc2[nH]1)C(=O)[C@H]1C=CC[NH2+]1	ZINC000534646567	328330058	/nfs/dbraw/zinc/33/00/58/328330058.db2.gz	GTAOZGYHMCQWME-LLVKDONJSA-N	1	0	290.754	1.703	50	0		CDAARO
CC[N@H+](C)C1(CNC(=O)c2ccc(CO)o2)CCCC1	ZINC000534646740	328330876	/nfs/dbraw/zinc/33/08/76/328330876.db2.gz	ZQNQLYXXOINGJE-UHFFFAOYSA-N	1	0	280.368	1.766	50	0		CDAARO
C[C@H](C(=O)NCc1cccnc1N)[N@H+](C)C1CCCCC1	ZINC000534652474	328338012	/nfs/dbraw/zinc/33/80/12/328338012.db2.gz	ULSFBEMLLSLRIP-GFCCVEGCSA-N	1	0	290.411	1.933	50	0		CDAARO
COc1cc2c(cc1CNC(=O)[C@@H]1C=CC[NH2+]1)CCC2	ZINC000534673905	328348992	/nfs/dbraw/zinc/34/89/92/328348992.db2.gz	GEXJOOMYADTTIP-AWEZNQCLSA-N	1	0	272.348	1.328	50	0		CDAARO
NC(=O)c1cncc(NC[C@H]2CC[N@@H+](C3CCCC3)C2)n1	ZINC000534662690	328350443	/nfs/dbraw/zinc/35/04/43/328350443.db2.gz	ATZAZCMAUXHGQT-LLVKDONJSA-N	1	0	289.383	1.252	50	0		CDAARO
CCS(=O)(=O)NC[C@@H](C)[NH2+]C1(Cc2ccccc2)CC1	ZINC000534663388	328351165	/nfs/dbraw/zinc/35/11/65/328351165.db2.gz	WZMLXZGRLZWSAK-CYBMUJFWSA-N	1	0	296.436	1.679	50	0		CDAARO
CCC[C@H]1CN(C(=O)[C@H]([NH3+])c2ccccc2)CCO1	ZINC000182850694	323304498	/nfs/dbraw/zinc/30/44/98/323304498.db2.gz	VQVKFKIGNXCKNL-UONOGXRCSA-N	1	0	262.353	1.714	50	0		CDAARO
Fc1ccc(Cc2nsc(N3CC[NH2+]CC3)n2)cc1	ZINC000006225596	326817708	/nfs/dbraw/zinc/81/77/08/326817708.db2.gz	LHRLXWNAZAZANY-UHFFFAOYSA-N	1	0	278.356	1.678	50	0		CDAARO
CC(C)(C)SCC(=O)NC[C@H](O)C[NH+]1CCCCC1	ZINC000521396396	326841960	/nfs/dbraw/zinc/84/19/60/326841960.db2.gz	UOBMYDZHVDXGFU-LBPRGKRZSA-N	1	0	288.457	1.481	50	0		CDAARO
CC(C)CN(CC(C)C)C(=O)C[N@H+]1C[C@@H]2[C@H](O)C[C@@H]2C1	ZINC001772711231	1159445269	/nfs/dbraw/zinc/44/52/69/1159445269.db2.gz	WYVYPQLWMSGTPT-QLFBSQMISA-N	1	0	282.428	1.440	50	0		CDAARO
C[NH+](C)[C@H]1CC[C@@H](NC(=O)Cc2noc3ccccc23)C1	ZINC000092473142	482623491	/nfs/dbraw/zinc/62/34/91/482623491.db2.gz	RMSXXYQVXKDJNY-NEPJUHHUSA-N	1	0	287.363	1.969	50	0		CDAARO
CCc1ccc(C[NH+]2CCC3(CNC(=O)O3)CC2)nc1	ZINC000670434034	482967331	/nfs/dbraw/zinc/96/73/31/482967331.db2.gz	CVYSLCOLNPKZPC-UHFFFAOYSA-N	1	0	275.352	1.718	50	0		CDAARO
Cc1cccc(F)c1C(=O)NCC[N@@H+]1CCCC[C@H]1CO	ZINC000670445485	482993175	/nfs/dbraw/zinc/99/31/75/482993175.db2.gz	JFQLBDBCVADWTK-ZDUSSCGKSA-N	1	0	294.370	1.711	50	0		CDAARO
CCCn1nccc1C(=O)N1[C@@H]2CC[C@H]1C[N@H+](C)CC2	ZINC000670457696	483038281	/nfs/dbraw/zinc/03/82/81/483038281.db2.gz	WISHKOOXCLQRHT-OLZOCXBDSA-N	1	0	276.384	1.602	50	0		CDAARO
CN(C[C@H]1CC[N@H+](C)C1(C)C)c1ncccc1C(N)=O	ZINC000670459240	483041028	/nfs/dbraw/zinc/04/10/28/483041028.db2.gz	KTVXTVSANMOVIG-LLVKDONJSA-N	1	0	276.384	1.347	50	0		CDAARO
CC(=O)N[C@@H](CC(C)C)C(=O)NCc1cnc(C)c(C)c1	ZINC000670461428	483044967	/nfs/dbraw/zinc/04/49/67/483044967.db2.gz	JRFHJZQDSOELCS-HNNXBMFYSA-N	1	0	291.395	1.865	50	0		CDAARO
COC[C@H](C)NC(=O)C1CC[NH+](CC=C(C)C)CC1	ZINC000670468174	483059431	/nfs/dbraw/zinc/05/94/31/483059431.db2.gz	IPSJWIDXTLFUGD-ZDUSSCGKSA-N	1	0	268.401	1.816	50	0		CDAARO
O=C(NC[C@H]1CCC[NH2+]1)c1cccnc1N1CCCCC1	ZINC000178755016	483158877	/nfs/dbraw/zinc/15/88/77/483158877.db2.gz	VIDRTAKECKVIFO-CYBMUJFWSA-N	1	0	288.395	1.554	50	0		CDAARO
CC[S@@](=O)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(CO)o1	ZINC000083477152	483173845	/nfs/dbraw/zinc/17/38/45/483173845.db2.gz	OXGRAOFNVSCIEB-KSMMKXTCSA-N	1	0	285.409	1.941	50	0		CDAARO
C[C@H](CNC(=O)[C@@H]1C[C@@H]1c1ccccc1F)[NH+](C)C	ZINC000084638295	483304452	/nfs/dbraw/zinc/30/44/52/483304452.db2.gz	AQMPYSMONIEUKG-RAIGVLPGSA-N	1	0	264.344	1.996	50	0		CDAARO
CC[C@H]1CN(C(=O)c2nc(C)ncc2Cl)C[C@H]1[NH+](C)C	ZINC000084735550	483320214	/nfs/dbraw/zinc/32/02/14/483320214.db2.gz	BZQMGPDBQLHRLG-CMPLNLGQSA-N	1	0	296.802	1.851	50	0		CDAARO
O=S(=O)(c1ccccc1)N1CCC[N@@H+](C2CCC2)CC1	ZINC000179563056	1161917381	/nfs/dbraw/zinc/91/73/81/1161917381.db2.gz	JCCRFTSKWCFVRD-UHFFFAOYSA-N	1	0	294.420	1.936	50	0		CDAARO
Cc1cc(C(=O)N2CCC([NH3+])CC2)c(F)cc1F	ZINC000096482454	534039976	/nfs/dbraw/zinc/03/99/76/534039976.db2.gz	HGHSKBMOMAJMDR-UHFFFAOYSA-N	1	0	254.280	1.837	50	0		CDAARO
CCO[C@@H]1C[C@@H](O)C12CC[NH+](CC[C@H]1CCCO1)CC2	ZINC000248941688	520378979	/nfs/dbraw/zinc/37/89/79/520378979.db2.gz	CUDRZJMQHPIHLO-RBSFLKMASA-N	1	0	283.412	1.807	50	0		CDAARO
COc1ccc(CNC(=O)[C@H]2CCC[N@@H+]2C)cc1OC	ZINC000005171215	524064620	/nfs/dbraw/zinc/06/46/20/524064620.db2.gz	XDICPEWCQDSCJS-GFCCVEGCSA-N	1	0	278.352	1.414	50	0		CDAARO
C[C@@]1(CNS(C)(=O)=O)CCC[N@@H+]1Cc1ccccc1	ZINC000097165461	567905497	/nfs/dbraw/zinc/90/54/97/567905497.db2.gz	VISWRJGICLJNME-AWEZNQCLSA-N	1	0	282.409	1.590	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@](O)([C@H]([NH3+])C2CCCC2)C1	ZINC000958528824	613978742	/nfs/dbraw/zinc/97/87/42/613978742.db2.gz	WBHHXFZINGEEKD-DOMZBBRYSA-N	1	0	284.400	1.876	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](CNC(=O)C2CCC2)C1	ZINC000952978972	616341625	/nfs/dbraw/zinc/34/16/25/616341625.db2.gz	GIIGTZUKLYRPKA-LBPRGKRZSA-N	1	0	254.374	1.261	50	0		CDAARO
CNC(=O)C[NH+]1CCC(CNC(=O)CC2CCCC2)CC1	ZINC000952969893	616600345	/nfs/dbraw/zinc/60/03/45/616600345.db2.gz	KQMBGRKVIUEEPV-UHFFFAOYSA-N	1	0	295.427	1.141	50	0		CDAARO
COCCC[NH+]1CCC(CNC(=O)[C@H]2CC23CC3)CC1	ZINC000952982266	616884085	/nfs/dbraw/zinc/88/40/85/616884085.db2.gz	QYJJICNYLBNOGM-CQSZACIVSA-N	1	0	280.412	1.651	50	0		CDAARO
COC[C@@]1([NH2+]Cc2cnn(C(C)(C)C)c2)CCOC1	ZINC000888093699	617753052	/nfs/dbraw/zinc/75/30/52/617753052.db2.gz	VEFPKIIYJUXJKP-AWEZNQCLSA-N	1	0	267.373	1.533	50	0		CDAARO
Cc1cc(OC(F)F)c(C(=O)NOC[C@@H](C)[NH3+])s1	ZINC000888094405	617754032	/nfs/dbraw/zinc/75/40/32/617754032.db2.gz	XFLVBDRFENNPTH-RXMQYKEDSA-N	1	0	280.296	1.667	50	0		CDAARO
O=C1NCC2(CC[NH+](CCc3ccccn3)CC2)O1	ZINC000031572135	631374446	/nfs/dbraw/zinc/37/44/46/631374446.db2.gz	VOHHDIWNVKPOJT-UHFFFAOYSA-N	1	0	261.325	1.199	50	0		CDAARO
OC[C@H](O)C1CC[NH+](Cc2ccc3c(c2)CCO3)CC1	ZINC001772704463	1159439764	/nfs/dbraw/zinc/43/97/64/1159439764.db2.gz	GMODFYSWMNGORP-HNNXBMFYSA-N	1	0	277.364	1.187	50	0		CDAARO
O[C@@H]1C[N@H+](CCCn2ccnc2)C[C@H]1Cc1ccncc1	ZINC001704345241	1177697323	/nfs/dbraw/zinc/69/73/23/1177697323.db2.gz	ULGBJBLBAXAFSQ-HZPDHXFCSA-N	1	0	286.379	1.204	50	0		CDAARO
CCc1nccc(C[N@@H+]2CCC[C@@H](c3cc(=O)[nH]cn3)C2)n1	ZINC001704349066	1177697818	/nfs/dbraw/zinc/69/78/18/1177697818.db2.gz	IROFDEQHKBDBPP-GFCCVEGCSA-N	1	0	299.378	1.914	50	0		CDAARO
CCN(C)C(=O)[C@H](C)[N@H+](C)CCc1c(C)n[nH]c1C	ZINC001704351432	1177698535	/nfs/dbraw/zinc/69/85/35/1177698535.db2.gz	IKIUKWZMDKHQHM-LBPRGKRZSA-N	1	0	266.389	1.368	50	0		CDAARO
CCn1cnnc1C1CC[NH+](CC(=O)N(C)C2CC2)CC1	ZINC000105928283	698029070	/nfs/dbraw/zinc/02/90/70/698029070.db2.gz	UTPQJFZCJFADAK-UHFFFAOYSA-N	1	0	291.399	1.098	50	0		CDAARO
Cc1cnccc1CNC(=O)[C@H](C)[NH+]1CCCCC1	ZINC000426487567	698114652	/nfs/dbraw/zinc/11/46/52/698114652.db2.gz	SJJSDTDCOPHZJK-ZDUSSCGKSA-N	1	0	261.369	1.881	50	0		CDAARO
CCn1c(CC2CC[NH2+]CC2)nn(CCC=C(C)C)c1=O	ZINC000065417240	698234786	/nfs/dbraw/zinc/23/47/86/698234786.db2.gz	FGRCZVQWORUKDK-UHFFFAOYSA-N	1	0	292.427	1.963	50	0		CDAARO
COc1ccccc1[C@H](O)C[NH2+][C@@H]1CCC1(OC)OC	ZINC000864097177	698391682	/nfs/dbraw/zinc/39/16/82/698391682.db2.gz	POWLMUVYIKQHMG-TZMCWYRMSA-N	1	0	281.352	1.470	50	0		CDAARO
[NH3+][C@H](c1ccsc1)C1(O)C[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000958528226	849321450	/nfs/dbraw/zinc/32/14/50/849321450.db2.gz	OWVUDIFGWLPAJX-FBTJUVTCSA-N	1	0	287.406	1.219	50	0		CDAARO
CSCC[C@H](C)[NH2+]CCn1c(C)cc(C)nc1=O	ZINC000065386422	849799284	/nfs/dbraw/zinc/79/92/84/849799284.db2.gz	KFRWUVQPINAMSM-JTQLQIEISA-N	1	0	269.414	1.591	50	0		CDAARO
Cc1nnc(CN2CCC([NH+]3CCSCC3)CC2)o1	ZINC000244884382	849878960	/nfs/dbraw/zinc/87/89/60/849878960.db2.gz	YLKMRSOFWONFIT-UHFFFAOYSA-N	1	0	282.413	1.391	50	0		CDAARO
C[NH+]1CCC(O)(c2ncnn2-c2cccc(F)c2)CC1	ZINC000091769257	850056406	/nfs/dbraw/zinc/05/64/06/850056406.db2.gz	NPHUACRKUCKSEC-UHFFFAOYSA-N	1	0	276.315	1.320	50	0		CDAARO
[NH3+]CCN(C(=O)NCCc1ccccc1)C1CCOCC1	ZINC000675019672	899873739	/nfs/dbraw/zinc/87/37/39/899873739.db2.gz	PCBKYWCWWBQVNR-UHFFFAOYSA-N	1	0	291.395	1.378	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CCCN2CCOCC2)n1	ZINC001506424701	909186935	/nfs/dbraw/zinc/18/69/35/909186935.db2.gz	LCUBIYCOMWNJGR-AWEZNQCLSA-N	1	0	280.416	1.200	50	0		CDAARO
CC(C)Nc1cc(NCc2csc(N)n2)ncn1	ZINC001506428398	909195146	/nfs/dbraw/zinc/19/51/46/909195146.db2.gz	OUIJHFFMFWVNPV-UHFFFAOYSA-N	1	0	264.358	1.948	50	0		CDAARO
O=C(/C=C\c1c(F)cccc1F)N[C@@H]1COC2(C[NH2+]C2)C1	ZINC000952832843	910401866	/nfs/dbraw/zinc/40/18/66/910401866.db2.gz	SNXALYQQXVZJFH-LWTINBJPSA-N	1	0	294.301	1.225	50	0		CDAARO
COc1ccc2c(c1)C=C(CN1C[C@@H](O)[C@H](F)C1)CO2	ZINC000952868983	910415271	/nfs/dbraw/zinc/41/52/71/910415271.db2.gz	FTRYAFFFOCZLJG-ZIAGYGMSSA-N	1	0	279.311	1.486	50	0		CDAARO
CC(C)C[N@@H+]1CCCN(C(=O)[C@@H]2CC(C(C)C)=NO2)CC1	ZINC000952863265	910417380	/nfs/dbraw/zinc/41/73/80/910417380.db2.gz	DDWPWPJPPWKRDO-HNNXBMFYSA-N	1	0	295.427	1.978	50	0		CDAARO
Cc1n[nH]c(C)c1CC[NH2+][C@@H](C)Cn1ccnc1C	ZINC000821495619	925587747	/nfs/dbraw/zinc/58/77/47/925587747.db2.gz	OTMSUZDXUBZLGS-JTQLQIEISA-N	1	0	261.373	1.752	50	0		CDAARO
CCCOC[C@@H]1CC[N@H+](CCN2CCOCC2)C1	ZINC000822973946	925663886	/nfs/dbraw/zinc/66/38/86/925663886.db2.gz	KLEVYNMSXYQALD-CQSZACIVSA-N	1	0	256.390	1.067	50	0		CDAARO
CCCOC[C@H]1CC[N@H+](CCN2CCOCC2)C1	ZINC000822973945	925664029	/nfs/dbraw/zinc/66/40/29/925664029.db2.gz	KLEVYNMSXYQALD-AWEZNQCLSA-N	1	0	256.390	1.067	50	0		CDAARO
C[NH+](C)CCCN1CCN(C(=O)[C@H]2CC2(C)C)CC1	ZINC000823693103	925722010	/nfs/dbraw/zinc/72/20/10/925722010.db2.gz	XPDKONMAXTZMBX-CYBMUJFWSA-N	1	0	267.417	1.128	50	0		CDAARO
CN(C[C@@H]1CCCC[N@@H+]1C)c1ccc(C(N)=O)cn1	ZINC000823777545	925728383	/nfs/dbraw/zinc/72/83/83/925728383.db2.gz	GIOWZZMMZSXQCC-LBPRGKRZSA-N	1	0	262.357	1.101	50	0		CDAARO
COCCCC1CC[NH+](C[C@@H]2COCCO2)CC1	ZINC000824385253	925819612	/nfs/dbraw/zinc/81/96/12/925819612.db2.gz	XBOAFEXIWXGZPC-CQSZACIVSA-N	1	0	257.374	1.540	50	0		CDAARO
CC(C)n1ccnc1CNC(=O)N1C[C@H]2CC[C@@H](C1)[NH2+]C2	ZINC000827977167	926009489	/nfs/dbraw/zinc/00/94/89/926009489.db2.gz	MGCCNEIIJAYNTG-STQMWFEESA-N	1	0	291.399	1.357	50	0		CDAARO
OC[C@H]1CCC[N@H+](CCCNc2ncccc2F)C1	ZINC000828711277	926168711	/nfs/dbraw/zinc/16/87/11/926168711.db2.gz	XUEFSSQPLIOVGI-LBPRGKRZSA-N	1	0	267.348	1.727	50	0		CDAARO
CN1CCC[N@H+](CC2Cc3ccccc3C2)CC1=O	ZINC000585085028	930884490	/nfs/dbraw/zinc/88/44/90/930884490.db2.gz	MNGKINCWUQLTEH-UHFFFAOYSA-N	1	0	258.365	1.566	50	0		CDAARO
CC[N@@H+]1CCCN(C(=O)c2ccc(C(N)=O)cc2)[C@@H](C)C1	ZINC000585088108	930905006	/nfs/dbraw/zinc/90/50/06/930905006.db2.gz	KEYHIRWXFAIRDQ-LBPRGKRZSA-N	1	0	289.379	1.342	50	0		CDAARO
Cc1nc([C@H](C)OC(=O)C[C@@H](C[NH3+])CC(C)C)no1	ZINC000585138378	931032044	/nfs/dbraw/zinc/03/20/44/931032044.db2.gz	LQLTUYXRGOFKSS-ONGXEEELSA-N	1	0	269.345	1.993	50	0		CDAARO
O=C(c1ccccn1)[C@H]1CCC[N@H+](CCn2cnnc2)C1	ZINC001529162114	968999544	/nfs/dbraw/zinc/99/95/44/968999544.db2.gz	WFWRMUZWEAEZFK-ZDUSSCGKSA-N	1	0	285.351	1.268	50	0		CDAARO
COc1cc(OC)nc(NC[C@@H]2CCC[N@@H+]2C(C)C)n1	ZINC001506396454	975147763	/nfs/dbraw/zinc/14/77/63/975147763.db2.gz	GUIPDGUJYRJOSJ-NSHDSACASA-N	1	0	280.372	1.779	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(C(=O)/C=C/c2cnc(N)nc2)CC1	ZINC001506398874	975149283	/nfs/dbraw/zinc/14/92/83/975149283.db2.gz	YPROELPUGKSDNV-GFUIURDCSA-N	1	0	289.383	1.015	50	0		CDAARO
CNC(=O)c1ccc(C[NH2+]C2CSCCSC2)o1	ZINC001506409987	975152909	/nfs/dbraw/zinc/15/29/09/975152909.db2.gz	QFLJGIWRTRTDGU-UHFFFAOYSA-N	1	0	286.422	1.577	50	0		CDAARO
Cc1nncn1CC[N@@H+](C)C[C@H](O)c1ccccc1	ZINC001506415377	975155322	/nfs/dbraw/zinc/15/53/22/975155322.db2.gz	XGSDYWNFQGNZMN-AWEZNQCLSA-N	1	0	260.341	1.252	50	0		CDAARO
CC(=O)NC(C)(C)C[C@@H](C)[NH2+]CCCn1nc(C)nc1C	ZINC001506417860	975157466	/nfs/dbraw/zinc/15/74/66/975157466.db2.gz	BZBDRSYINDTKML-LLVKDONJSA-N	1	0	295.431	1.568	50	0		CDAARO
c1coc(CN2CCC([NH2+]CCc3c[nH]cn3)CC2)c1	ZINC001506423871	975159222	/nfs/dbraw/zinc/15/92/22/975159222.db2.gz	YFENELANPNPHFW-UHFFFAOYSA-N	1	0	274.368	1.799	50	0		CDAARO
COC[C@@H]([NH2+][C@H]1CCN(CC(F)(F)F)C1)C1CC1	ZINC000096476826	230379804	/nfs/dbraw/zinc/37/98/04/230379804.db2.gz	CPRZCLYNHPUKMN-WDEREUQCSA-N	1	0	266.307	1.638	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C(=O)[C@H]1CC[C@@H](O)CC1	ZINC000584903220	341986700	/nfs/dbraw/zinc/98/67/00/341986700.db2.gz	YAKNCTNZTHQYJQ-OTVXOJSOSA-N	1	0	282.428	1.870	50	0		CDAARO
CSCC(=O)N(C)C[C@@H]1CC[N@H+](CC(C)C)C1	ZINC000584902932	341986926	/nfs/dbraw/zinc/98/69/26/341986926.db2.gz	JGBJWMWMNUIUAH-LBPRGKRZSA-N	1	0	258.431	1.786	50	0		CDAARO
Cn1c(SCC[C@H]2CCOC2)nnc1C1CC[NH2+]CC1	ZINC000426633866	230424841	/nfs/dbraw/zinc/42/48/41/230424841.db2.gz	JYDKIGNQKFANMN-LLVKDONJSA-N	1	0	296.440	1.801	50	0		CDAARO
C(CN1CC[NH+](CC2CCCCC2)CC1)N1CCOCC1	ZINC000095957550	185042479	/nfs/dbraw/zinc/04/24/79/185042479.db2.gz	RQYKBTCSHNUFKO-UHFFFAOYSA-N	1	0	295.471	1.517	50	0		CDAARO
CN(C)c1nccc(N(C)C[C@@H]2CCC[N@H+](C)C2)n1	ZINC000095960971	185043369	/nfs/dbraw/zinc/04/33/69/185043369.db2.gz	CCVUINKXRBNBAB-GFCCVEGCSA-N	1	0	263.389	1.321	50	0		CDAARO
COC[C@H](Cc1ccccc1)[NH2+][C@@H](C)CN1CCOCC1	ZINC000095967310	185046196	/nfs/dbraw/zinc/04/61/96/185046196.db2.gz	QCZNLCHEZHZMMF-RDJZCZTQSA-N	1	0	292.423	1.554	50	0		CDAARO
CC(C)C(=O)c1ccc(S(=O)(=O)N2CC[C@@H]([NH3+])C2)cc1	ZINC000095972600	185049312	/nfs/dbraw/zinc/04/93/12/185049312.db2.gz	OHBPXURHQMXNGM-GFCCVEGCSA-N	1	0	296.392	1.247	50	0		CDAARO
C[NH+]1CCC(C)(CNC(=O)C(=O)Nc2ccccc2)CC1	ZINC000096002249	185062180	/nfs/dbraw/zinc/06/21/80/185062180.db2.gz	BYVLSRNPSMFUAK-UHFFFAOYSA-N	1	0	289.379	1.473	50	0		CDAARO
Cc1nc(CC[N@H+]2C[C@H]3CC[C@@H](C2)[C@H]3O)cs1	ZINC000240971733	361750708	/nfs/dbraw/zinc/75/07/08/361750708.db2.gz	UBYOQQBHBYFVAL-PJXYFTJBSA-N	1	0	252.383	1.697	50	0		CDAARO
CC(C)(C)[C@H](O)C[C@H](CO)[NH2+]Cc1cnn2ccccc12	ZINC000241301043	361752169	/nfs/dbraw/zinc/75/21/69/361752169.db2.gz	LPXKIEWONAQRQE-UKRRQHHQSA-N	1	0	291.395	1.582	50	0		CDAARO
C[C@H]1[C@@H](Cc2ccccc2)CC[N@@H+]1CCC(=O)NC(N)=O	ZINC000242288033	361755734	/nfs/dbraw/zinc/75/57/34/361755734.db2.gz	YKNNNHLOOXBZQG-GXTWGEPZSA-N	1	0	289.379	1.525	50	0		CDAARO
Cc1nc(C)c(C(=O)N2CCC([C@H]3CC[NH2+]C3)CC2)o1	ZINC000290141193	197609092	/nfs/dbraw/zinc/60/90/92/197609092.db2.gz	MMWGSOIIEOXISI-ZDUSSCGKSA-N	1	0	277.368	1.753	50	0		CDAARO
CCOc1ccc(CC(=O)N2CC[NH2+]C[C@H]2C)cc1	ZINC000125136206	187171066	/nfs/dbraw/zinc/17/10/66/187171066.db2.gz	GETJMMSZFHWTAW-GFCCVEGCSA-N	1	0	262.353	1.448	50	0		CDAARO
COc1c[nH]c(CN2CC([N@@H+]3CCCC[C@H]3C)C2)cc1=O	ZINC000244700916	361856265	/nfs/dbraw/zinc/85/62/65/361856265.db2.gz	JWENPQXHSDDDPN-GFCCVEGCSA-N	1	0	291.395	1.854	50	0		CDAARO
CCN(CCn1cccn1)C[C@H](C)[NH+]1CCCC1	ZINC000244724064	361860241	/nfs/dbraw/zinc/86/02/41/361860241.db2.gz	MMXMDEGHALFZHC-AWEZNQCLSA-N	1	0	250.390	1.689	50	0		CDAARO
CN(C)C[C@H](O)C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1	ZINC000252586182	361863924	/nfs/dbraw/zinc/86/39/24/361863924.db2.gz	OAGBLHRSQXVBCI-BBWFWOEESA-N	1	0	276.424	1.910	50	0		CDAARO
CCC[C@H]([NH3+])C(=O)N1CCC(c2ccnc(C)n2)CC1	ZINC000244874783	361867087	/nfs/dbraw/zinc/86/70/87/361867087.db2.gz	XHFZWNIVBUPTNA-ZDUSSCGKSA-N	1	0	276.384	1.618	50	0		CDAARO
[NH3+]CC1CCN(C(=O)c2ccccc2-c2cncnc2)CC1	ZINC000097019489	185152806	/nfs/dbraw/zinc/15/28/06/185152806.db2.gz	XJGSRNQLGZECEQ-UHFFFAOYSA-N	1	0	296.374	1.955	50	0		CDAARO
C[N@H+]([C@@H]1CCC[C@H]1S(C)(=O)=O)[C@@H]1C=CCCC1	ZINC000245312370	539041230	/nfs/dbraw/zinc/04/12/30/539041230.db2.gz	ITBGSKFSEXMHMF-JHJVBQTASA-N	1	0	257.399	1.993	50	0		CDAARO
[NH3+][C@@H]1CCc2cc(Br)ccc2NC1=O	ZINC000118537344	539063932	/nfs/dbraw/zinc/06/39/32/539063932.db2.gz	MLCIKXLZQSZZQS-MRVPVSSYSA-N	1	0	255.115	1.661	50	0		CDAARO
COc1cccc(/C(C)=C/C(=O)N2CC[NH2+]C[C@@H]2C)c1	ZINC000125731912	187197606	/nfs/dbraw/zinc/19/76/06/187197606.db2.gz	BUNCVYBLLOPZKN-SRXBQZRASA-N	1	0	274.364	1.919	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1cc(-c2ccncc2)on1	ZINC000125979337	187208434	/nfs/dbraw/zinc/20/84/34/187208434.db2.gz	KZSXORZRLMOCQF-JTQLQIEISA-N	1	0	272.308	1.171	50	0		CDAARO
Cc1ncsc1C(=O)N1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1	ZINC000248561166	282230127	/nfs/dbraw/zinc/23/01/27/282230127.db2.gz	AXEQUSCPSYJJOK-LPEHRKFASA-N	1	0	251.355	1.261	50	0		CDAARO
C[NH+]1CCC(NC(=O)c2cccn3ccnc23)CC1	ZINC000169931350	362202940	/nfs/dbraw/zinc/20/29/40/362202940.db2.gz	KGXWTMWRLUKKIC-UHFFFAOYSA-N	1	0	258.325	1.158	50	0		CDAARO
COC(=O)[C@@H]1[C@H]2CCC[N@@H+]2C[C@@]12c1ccccc1NC2=O	ZINC000036584757	362195558	/nfs/dbraw/zinc/19/55/58/362195558.db2.gz	SACUHBGXWYEFEY-DVOMOZLQSA-N	1	0	286.331	1.144	50	0		CDAARO
c1c[nH]c(C[NH2+]CC2(CN3CCOCC3)CCCCC2)n1	ZINC000083476654	362248011	/nfs/dbraw/zinc/24/80/11/362248011.db2.gz	VHKSTLPPHXCMRV-UHFFFAOYSA-N	1	0	292.427	1.782	50	0		CDAARO
C[N@H+](CCOc1cccc(Cl)c1)CCn1cnnc1	ZINC000096466305	529926373	/nfs/dbraw/zinc/92/63/73/529926373.db2.gz	MDSCMIPNNMDOQS-UHFFFAOYSA-N	1	0	280.759	1.942	50	0		CDAARO
CN(C[C@@H]1CCC[N@H+](C)C1)c1nc2ccccc2c(=O)[nH]1	ZINC000083877720	362254521	/nfs/dbraw/zinc/25/45/21/362254521.db2.gz	FQNKZYMEOLPWDP-GFCCVEGCSA-N	1	0	286.379	1.701	50	0		CDAARO
CN(C1CC[NH2+]CC1)S(=O)(=O)c1ccccc1Cl	ZINC000036300038	282337792	/nfs/dbraw/zinc/33/77/92/282337792.db2.gz	CBDOHDZOXKNFAR-UHFFFAOYSA-N	1	0	288.800	1.713	50	0		CDAARO
C[C@@H]1CC(=O)N(CC[N@H+](C)Cc2ccc(F)cc2)C1=O	ZINC000189313454	345604673	/nfs/dbraw/zinc/60/46/73/345604673.db2.gz	DEDSZEREHKYRAL-LLVKDONJSA-N	1	0	278.327	1.653	50	0		CDAARO
O[C@H]1CN(C/C=C/c2ccc(F)cc2)C[C@@H]1[NH+]1CCCC1	ZINC000097243653	185572211	/nfs/dbraw/zinc/57/22/11/185572211.db2.gz	DJPBOLSTDUZNQW-RYTMFUSVSA-N	1	0	290.382	1.980	50	0		CDAARO
OC[C@H]1C[NH2+]CCC12CCN(c1ncccc1Cl)CC2	ZINC000097499432	136522604	/nfs/dbraw/zinc/52/26/04/136522604.db2.gz	SIOOSWKVSWKJOO-GFCCVEGCSA-N	1	0	295.814	1.923	50	0		CDAARO
C[NH+](C)Cc1ccc(-c2nc([C@@H]3CCOC3)no2)o1	ZINC000096161844	362704351	/nfs/dbraw/zinc/70/43/51/362704351.db2.gz	GQDSJLCMEVPULA-SECBINFHSA-N	1	0	263.297	1.895	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNC(=O)c1c(C)cc(C)[nH]c1=O	ZINC000073555705	349170026	/nfs/dbraw/zinc/17/00/26/349170026.db2.gz	RVUFXLSTCCLTNI-CYBMUJFWSA-N	1	0	291.395	1.596	50	0		CDAARO
O=C(NCCC[NH+]1CCC(O)CC1)[C@H]1CC12CCC2	ZINC000584896005	349357281	/nfs/dbraw/zinc/35/72/81/349357281.db2.gz	RMUJRJJRJVSHCJ-CYBMUJFWSA-N	1	0	266.385	1.140	50	0		CDAARO
O=C(CC1CCCC1)NCC[N@H+]1CCC[C@@H](CO)C1	ZINC000584884669	349342242	/nfs/dbraw/zinc/34/22/42/349342242.db2.gz	OYMTYQFQYNVDHO-CQSZACIVSA-N	1	0	268.401	1.387	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)c1ccncc1Cl	ZINC000584889783	349348746	/nfs/dbraw/zinc/34/87/46/349348746.db2.gz	PQVHOPPDZOZDPF-RYUDHWBXSA-N	1	0	283.759	1.184	50	0		CDAARO
Cc1nc(CN(C)C[C@@H]2CCCC[N@@H+]2C)n(C)c1C	ZINC000584891858	349351070	/nfs/dbraw/zinc/35/10/70/349351070.db2.gz	WKCDJQUETCEADX-AWEZNQCLSA-N	1	0	264.417	1.953	50	0		CDAARO
C[C@@H](CCC(=O)N(C)CC1(CO)CCC1)[NH+]1CCCC1	ZINC000584893338	349353387	/nfs/dbraw/zinc/35/33/87/349353387.db2.gz	LHLZBMXSSXSIFF-AWEZNQCLSA-N	1	0	282.428	1.872	50	0		CDAARO
COCCCC[NH+]1CCN(C(=O)Cc2ccsc2)CC1	ZINC000584895792	349356493	/nfs/dbraw/zinc/35/64/93/349356493.db2.gz	LOGZOCUWQUPMJP-UHFFFAOYSA-N	1	0	296.436	1.861	50	0		CDAARO
CCOC(=O)N1CC[C@@H]([NH2+]Cc2cc(C3CC3)n[nH]2)C1	ZINC000584895922	349356511	/nfs/dbraw/zinc/35/65/11/349356511.db2.gz	OEIGVMAGPTWDJP-LLVKDONJSA-N	1	0	278.356	1.608	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2csc(CC[NH3+])n2)[C@@H]1C	ZINC000090953599	180073770	/nfs/dbraw/zinc/07/37/70/180073770.db2.gz	JLHLPFLQXGVFJT-NXEZZACHSA-N	1	0	267.398	1.905	50	0		CDAARO
Cc1cccc(C)c1C[NH2+]C[C@@](C)(O)CN1CCOCC1	ZINC000091061101	180093341	/nfs/dbraw/zinc/09/33/41/180093341.db2.gz	ATVGXXUTFFBCRV-QGZVFWFLSA-N	1	0	292.423	1.476	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@H]1NC(=O)Cc1ccccc1F	ZINC000091496332	180171964	/nfs/dbraw/zinc/17/19/64/180171964.db2.gz	SCCIZZOGZJVCDA-ZWNOBZJWSA-N	1	0	250.317	1.625	50	0		CDAARO
CCC[C@H]1CN(C(=O)CCn2ccnc2CC)C[C@@H]1[NH3+]	ZINC000091380930	180144113	/nfs/dbraw/zinc/14/41/13/180144113.db2.gz	DAHWPHUKJYHEPP-STQMWFEESA-N	1	0	278.400	1.421	50	0		CDAARO
C[N@@H+]1CCN(Cc2cnc3ccccc3c2)C[C@H]1CCO	ZINC000105112303	186042719	/nfs/dbraw/zinc/04/27/19/186042719.db2.gz	MVEZTQYXRCNDJW-MRXNPFEDSA-N	1	0	285.391	1.733	50	0		CDAARO
c1nc2ccccn2c1C[NH2+]C[C@@H]1CN(C2CC2)CCO1	ZINC000106379552	186112313	/nfs/dbraw/zinc/11/23/13/186112313.db2.gz	YFHPHDIFDKMFDB-OAHLLOKOSA-N	1	0	286.379	1.287	50	0		CDAARO
O=C(NCC[C@@H]1CC[NH2+]C1)C1(c2ccccc2)CC1	ZINC000110796279	186325592	/nfs/dbraw/zinc/32/55/92/186325592.db2.gz	DMEQNQUPXVJGDF-ZDUSSCGKSA-N	1	0	258.365	1.834	50	0		CDAARO
C[NH+](C)[C@@H]1CCN(C(=O)c2cc(Br)no2)C1	ZINC000583652065	366019477	/nfs/dbraw/zinc/01/94/77/366019477.db2.gz	ZEIADSCQKZGJJO-SSDOTTSWSA-N	1	0	288.145	1.213	50	0		CDAARO
COc1cccc(C[NH2+]CC2(O)CCOCC2)c1	ZINC000112717039	186524652	/nfs/dbraw/zinc/52/46/52/186524652.db2.gz	BAYOQVKAJQPBBT-UHFFFAOYSA-N	1	0	251.326	1.326	50	0		CDAARO
OCc1ccc(C[NH2+][C@@H]2CCCN(c3ncccn3)C2)o1	ZINC000012304131	366045376	/nfs/dbraw/zinc/04/53/76/366045376.db2.gz	ISSUTJKGDMACAM-GFCCVEGCSA-N	1	0	288.351	1.321	50	0		CDAARO
[NH3+]Cc1n[nH]c(=O)n1-c1cccc(Cl)c1Cl	ZINC000065469264	363284624	/nfs/dbraw/zinc/28/46/24/363284624.db2.gz	PPTKYIMMOYNOCG-UHFFFAOYSA-N	1	0	259.096	1.326	50	0		CDAARO
c1cn(CCNc2cc(N3CCCCC3)ncn2)nn1	ZINC000065490360	363288419	/nfs/dbraw/zinc/28/84/19/363288419.db2.gz	OSUDUVKGGRHCSU-UHFFFAOYSA-N	1	0	273.344	1.171	50	0		CDAARO
CN1CCC[C@@H]([NH2+][C@@H]2CCN(CC(F)(F)F)C2)C1	ZINC000088687421	366153412	/nfs/dbraw/zinc/15/34/12/366153412.db2.gz	HULNCOUMAWUBCT-GHMZBOCLSA-N	1	0	265.323	1.307	50	0		CDAARO
CCc1cccc(NC(=O)CN2CCN(C3CC3)CC2)c1	ZINC000299366663	363435205	/nfs/dbraw/zinc/43/52/05/363435205.db2.gz	XHTXMKBGCTXBAH-UHFFFAOYSA-N	1	0	287.407	1.968	50	0		CDAARO
COc1ccc(C2(C[NH3+])CCOCC2)cc1OC	ZINC000000295384	355902259	/nfs/dbraw/zinc/90/22/59/355902259.db2.gz	XKGLKVXUDBRVKN-UHFFFAOYSA-N	1	0	251.326	1.711	50	0		CDAARO
O=C(c1ccncc1)N1CC[NH+](C2CCCC2)CC1	ZINC000000317045	355904752	/nfs/dbraw/zinc/90/47/52/355904752.db2.gz	XRVMTNYFUMUUTF-UHFFFAOYSA-N	1	0	259.353	1.782	50	0		CDAARO
c1cc(-c2noc(C3CC[NH2+]CC3)n2)cc2c1OCO2	ZINC000000154386	355891661	/nfs/dbraw/zinc/89/16/61/355891661.db2.gz	WJLRNCOTWSCIOZ-UHFFFAOYSA-N	1	0	273.292	1.932	50	0		CDAARO
CCOC(=O)[C@H]1CCC[N@@H+](C2CCN(CC)CC2)C1	ZINC000000221285	355897402	/nfs/dbraw/zinc/89/74/02/355897402.db2.gz	PUIJDEPPTRRDJD-ZDUSSCGKSA-N	1	0	268.401	1.746	50	0		CDAARO
NC(=[NH2+])C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000002547902	355974600	/nfs/dbraw/zinc/97/46/00/355974600.db2.gz	ZTXCTYJVTHUYGK-UHFFFAOYSA-N	1	0	261.325	1.971	50	0		CDAARO
C[N@H+](CCO)CCOCCOc1ccc(Cl)cc1	ZINC000002981016	355990037	/nfs/dbraw/zinc/99/00/37/355990037.db2.gz	HTDLAFCJXYPTLP-UHFFFAOYSA-N	1	0	273.760	1.660	50	0		CDAARO
O=C(NCCC[NH2+]Cc1ccccc1)c1ccncc1	ZINC000001902962	355954317	/nfs/dbraw/zinc/95/43/17/355954317.db2.gz	OGTYBPYVHPQGCG-UHFFFAOYSA-N	1	0	269.348	1.991	50	0		CDAARO
CCc1nc(C)ccc1OCC(=O)NCCC[NH+](C)C	ZINC000002024793	355957931	/nfs/dbraw/zinc/95/79/31/355957931.db2.gz	XICCHOGVPNYPFH-UHFFFAOYSA-N	1	0	279.384	1.399	50	0		CDAARO
C[N@@H+]1CC[C@@]23c4c5c(O)ccc4C[C@@H]1[C@@H]2C=C[C@H](O)[C@@H]3O5	ZINC000003812983	356009849	/nfs/dbraw/zinc/00/98/49/356009849.db2.gz	BQJCRHHNABKAKU-KBQPJGBKSA-N	1	0	285.343	1.198	50	0	biogenic,fda	CDAARO
CNC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]([NH3+])C2)cc1	ZINC000255230333	356024182	/nfs/dbraw/zinc/02/41/82/356024182.db2.gz	PWRWNYJOKIGDOH-PIZKADEWSA-N	1	0	287.363	1.009	50	0		CDAARO
COc1ccccc1O[C@@H](C)C(=O)NC1CC[NH+](C)CC1	ZINC000012380627	356296152	/nfs/dbraw/zinc/29/61/52/356296152.db2.gz	NGJKADAQUYRZHE-LBPRGKRZSA-N	1	0	292.379	1.673	50	0		CDAARO
CCC[NH2+]C[C@]1(O)CCCN(Cc2ccccc2F)C1=O	ZINC000012714991	356320957	/nfs/dbraw/zinc/32/09/57/356320957.db2.gz	WJSJBBPDBUORSF-MRXNPFEDSA-N	1	0	294.370	1.679	50	0		CDAARO
C[NH+]1CCC(NC(=O)COc2ccc(F)cc2F)CC1	ZINC000016580051	356442029	/nfs/dbraw/zinc/44/20/29/356442029.db2.gz	QWBNACRFSJQPAI-UHFFFAOYSA-N	1	0	284.306	1.554	50	0		CDAARO
CC[NH+]1CCC(NC(=O)c2cccc(OC)c2)CC1	ZINC000016580069	356442186	/nfs/dbraw/zinc/44/21/86/356442186.db2.gz	XQPGBVDYZHPHAW-UHFFFAOYSA-N	1	0	262.353	1.909	50	0		CDAARO
COc1ccc(CN2CC[NH+](C)CC2)c(OC)c1OC	ZINC000019536593	356491659	/nfs/dbraw/zinc/49/16/59/356491659.db2.gz	SQQDLCAQLUXIPC-UHFFFAOYSA-N	1	0	280.368	1.460	50	0	in-vitro	CDAARO
Cc1ccc(OCCOCCNCC[NH3+])cc1C	ZINC000019772573	356500772	/nfs/dbraw/zinc/50/07/72/356500772.db2.gz	GCEFUYDRUZRNJG-UHFFFAOYSA-N	1	0	252.358	1.247	50	0		CDAARO
CNc1nc(N2CCC[C@H]([NH+](C)C)C2)ncc1F	ZINC000725272738	538463405	/nfs/dbraw/zinc/46/34/05/538463405.db2.gz	UKQGPBLESOYXMB-VIFPVBQESA-N	1	0	253.325	1.188	50	0		CDAARO
COC(=O)c1ccc(C[N@@H+]2CCC[C@@H](CO)C2)cc1	ZINC000023280672	356638343	/nfs/dbraw/zinc/63/83/43/356638343.db2.gz	HLIDJWDAXLUQKV-CYBMUJFWSA-N	1	0	263.337	1.678	50	0		CDAARO
NC(=O)[C@@H]1C[N@@H+]([C@@H]2CCCCc3ccccc32)CCO1	ZINC000078972623	538520748	/nfs/dbraw/zinc/52/07/48/538520748.db2.gz	WTVCQOLEZGUJIU-CABCVRRESA-N	1	0	274.364	1.640	50	0		CDAARO
Cc1cc2ncn(CC(=O)NC[C@H]3CCCO3)c2cc1C	ZINC000032497901	356780767	/nfs/dbraw/zinc/78/07/67/356780767.db2.gz	GGKGUDNMARMHGK-CYBMUJFWSA-N	1	0	287.363	1.948	50	0		CDAARO
C[C@@H](O)C[NH+](CCCc1ccccc1)C[C@@H](C)O	ZINC000000214302	356812229	/nfs/dbraw/zinc/81/22/29/356812229.db2.gz	ADYPLABQYHBYFG-ZIAGYGMSSA-N	1	0	251.370	1.683	50	0		CDAARO
C[N@@H+]1CCN(Cc2cnc3ccccc3c2)C[C@@H]1CCO	ZINC000032577742	356782837	/nfs/dbraw/zinc/78/28/37/356782837.db2.gz	MVEZTQYXRCNDJW-INIZCTEOSA-N	1	0	285.391	1.733	50	0		CDAARO
CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000035993531	356854261	/nfs/dbraw/zinc/85/42/61/356854261.db2.gz	ZUXUYFMPBGKBRB-UHFFFAOYSA-N	1	0	284.381	1.021	50	0		CDAARO
c1ccc(OCCN2CC[NH+](C[C@H]3CCOC3)CC2)cc1	ZINC000047707361	357163627	/nfs/dbraw/zinc/16/36/27/357163627.db2.gz	CFJPNRMYYHXODX-MRXNPFEDSA-N	1	0	290.407	1.720	50	0		CDAARO
c1ccc(OCCN2CC[NH+](C[C@@H]3CCOC3)CC2)cc1	ZINC000047707359	357164012	/nfs/dbraw/zinc/16/40/12/357164012.db2.gz	CFJPNRMYYHXODX-INIZCTEOSA-N	1	0	290.407	1.720	50	0		CDAARO
Cc1cnc(CNC[C@]2(O)CCC[N@@H+]3CCCC[C@@H]32)cn1	ZINC000063856792	357517267	/nfs/dbraw/zinc/51/72/67/357517267.db2.gz	PNSHZOGYSWKVPY-HZPDHXFCSA-N	1	0	290.411	1.254	50	0		CDAARO
CCCn1ncc(C(=O)N2CC[C@@]3(C2)CCC[NH2+]C3)c1C	ZINC000067740217	357622728	/nfs/dbraw/zinc/62/27/28/357622728.db2.gz	ADXMOESCLQTITC-INIZCTEOSA-N	1	0	290.411	1.817	50	0		CDAARO
CN(C)c1ccc(-c2nccn2CCC[NH+](C)C)cn1	ZINC000067803843	357629084	/nfs/dbraw/zinc/62/90/84/357629084.db2.gz	GAAYLRGKAAJAOR-UHFFFAOYSA-N	1	0	273.384	1.963	50	0		CDAARO
C[C@@H](Cn1ccnc1)[NH2+]Cc1ccc(-n2cncn2)cc1	ZINC000067563276	357612439	/nfs/dbraw/zinc/61/24/39/357612439.db2.gz	YLEUQNYPIMEHJU-ZDUSSCGKSA-N	1	0	282.351	1.642	50	0		CDAARO
O=C(CCc1nc2ccccc2[nH]1)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000067714358	357620185	/nfs/dbraw/zinc/62/01/85/357620185.db2.gz	ZMGNVNRVTGKYBS-OLZOCXBDSA-N	1	0	298.390	1.848	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCN(C(=O)Cc2cccs2)C1	ZINC000070172266	357712440	/nfs/dbraw/zinc/71/24/40/357712440.db2.gz	CRYPLHDLLGYSBZ-MNOVXSKESA-N	1	0	252.383	1.876	50	0		CDAARO
Cc1cccc(O[C@@H](C)C(=O)NC2CC[NH+](C)CC2)c1	ZINC000071754587	357778941	/nfs/dbraw/zinc/77/89/41/357778941.db2.gz	DNPZROHPRPUEDV-ZDUSSCGKSA-N	1	0	276.380	1.973	50	0		CDAARO
CCCCOC[C@@H](O)C[NH+]1CCN(c2ccccc2)CC1	ZINC000023118544	358043916	/nfs/dbraw/zinc/04/39/16/358043916.db2.gz	RDSWFKWPVIMBSW-KRWDZBQOSA-N	1	0	292.423	1.986	50	0		CDAARO
CC[C@@H]1CN(C(=O)c2cnc(C)cn2)CC[N@@H+]1C(C)C	ZINC000082116527	358148061	/nfs/dbraw/zinc/14/80/61/358148061.db2.gz	QAFWBGJJWMGLKG-CYBMUJFWSA-N	1	0	276.384	1.730	50	0		CDAARO
Cc1cccc(NC[C@H]2CCN(CCS(C)(=O)=O)C2)[nH+]1	ZINC000097203979	358191566	/nfs/dbraw/zinc/19/15/66/358191566.db2.gz	PKOLPDFDTNTVDV-CYBMUJFWSA-N	1	0	297.424	1.168	50	0		CDAARO
C[C@]1(C(=O)NCCOCc2ccccc2)CCCC[NH2+]1	ZINC000195556991	358559766	/nfs/dbraw/zinc/55/97/66/358559766.db2.gz	VPACKNOHURWHIS-MRXNPFEDSA-N	1	0	276.380	1.852	50	0		CDAARO
O=C1NCCC[C@@]12CC[N@@H+](C1Cc3ccccc3C1)C2	ZINC000091713419	358523596	/nfs/dbraw/zinc/52/35/96/358523596.db2.gz	ZSEBFXMVGPVQJN-KRWDZBQOSA-N	1	0	270.376	1.756	50	0		CDAARO
C[N@@H+](Cc1cccc(-c2nn[nH]n2)c1)C[C@@H]1CCOC1	ZINC000095193334	358680728	/nfs/dbraw/zinc/68/07/28/358680728.db2.gz	XVGCSAUJPCEPDH-LBPRGKRZSA-N	1	0	273.340	1.335	50	0		CDAARO
O=C(NCC[C@@H]1CCC[NH2+]1)c1ccccc1-n1cnnc1	ZINC000097776213	358798819	/nfs/dbraw/zinc/79/88/19/358798819.db2.gz	SESWBACKFWBCJB-LBPRGKRZSA-N	1	0	285.351	1.139	50	0		CDAARO
Cc1nc(C)n(C[C@@H]2CCCN2[C@H]2C[C@H](C)OC2=O)n1	ZINC000247838503	358971653	/nfs/dbraw/zinc/97/16/53/358971653.db2.gz	OMOJYMRVMFWECF-XDTLVQLUSA-N	1	0	278.356	1.063	50	0		CDAARO
Nc1ncccc1CN1CCCO[C@H](C[NH+]2CCCC2)C1	ZINC000216115381	358926160	/nfs/dbraw/zinc/92/61/60/358926160.db2.gz	QRADBTFICCGRAI-OAHLLOKOSA-N	1	0	290.411	1.351	50	0		CDAARO
CC[C@H]1CN(Cc2ccccc2OCCO)CCO1	ZINC000216367010	358941216	/nfs/dbraw/zinc/94/12/16/358941216.db2.gz	YUVJLAFLGXAQFY-AWEZNQCLSA-N	1	0	265.353	1.669	50	0		CDAARO
CNC(=O)C1CC[NH+](CCOc2ccc(OC)cc2)CC1	ZINC000012333624	359009645	/nfs/dbraw/zinc/00/96/45/359009645.db2.gz	JMQAOEOPNHZABS-UHFFFAOYSA-N	1	0	292.379	1.532	50	0		CDAARO
C[NH+](C)[C@H]1[C@@H]2CC[C@H]1CN(C(=O)c1cncc(F)c1)C2	ZINC000218934051	359071246	/nfs/dbraw/zinc/07/12/46/359071246.db2.gz	GYXOAAPFXUSFDR-YABSGUDNSA-N	1	0	277.343	1.633	50	0		CDAARO
Cc1cccc(CCNc2cc(C3CC(O)C3)[nH+]c(N)n2)n1	ZINC000219294848	359086515	/nfs/dbraw/zinc/08/65/15/359086515.db2.gz	NKXBVVJXBNNQLE-UHFFFAOYSA-N	1	0	299.378	1.655	50	0		CDAARO
CCC[C@H](NC(=O)c1ncccc1O)c1nccn1C	ZINC000220358197	359167879	/nfs/dbraw/zinc/16/78/79/359167879.db2.gz	AHPNNYADLSEJBJ-JTQLQIEISA-N	1	0	274.324	1.792	50	0		CDAARO
CN(Cc1cc[nH]n1)c1cc(C2CC([NH3+])C2)nc(C2CC2)n1	ZINC000222452760	359344832	/nfs/dbraw/zinc/34/48/32/359344832.db2.gz	SUULQXCPDAXEDZ-UHFFFAOYSA-N	1	0	298.394	1.918	50	0		CDAARO
CCn1cc(C[NH+]2CCC3(CC2)C[C@H](O)CCO3)c(C)n1	ZINC000257191251	359588231	/nfs/dbraw/zinc/58/82/31/359588231.db2.gz	PPSULUXDRPXSPX-OAHLLOKOSA-N	1	0	293.411	1.717	50	0		CDAARO
CN(Cc1cn2c(n1)CCCC2)C[C@H]1CCC[NH2+]C1	ZINC000261966943	359591214	/nfs/dbraw/zinc/59/12/14/359591214.db2.gz	PZBQJXUIEWJRLH-ZDUSSCGKSA-N	1	0	262.401	1.651	50	0		CDAARO
[NH3+]CCCOC1CCN(C(=O)Cc2ccc(F)cc2)CC1	ZINC000094071162	359664526	/nfs/dbraw/zinc/66/45/26/359664526.db2.gz	KZILDXNNNNOKAV-UHFFFAOYSA-N	1	0	294.370	1.725	50	0		CDAARO
NC(=O)c1ccc(-c2cccc3c2O[C@H](C[NH3+])C3)cc1	ZINC000067771801	283488380	/nfs/dbraw/zinc/48/83/80/283488380.db2.gz	CKYWBSRDPWTMLJ-ZDUSSCGKSA-N	1	0	268.316	1.715	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](C(=O)NC[C@H](O)c2ccccc2F)C1	ZINC000408519318	359911731	/nfs/dbraw/zinc/91/17/31/359911731.db2.gz	VVRVRGFMAZSQDT-BREBYQMCSA-N	1	0	266.316	1.103	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)NC[C@H](O)c2ccccc2F)C1	ZINC000408519319	359911880	/nfs/dbraw/zinc/91/18/80/359911880.db2.gz	VVRVRGFMAZSQDT-CWSCBRNRSA-N	1	0	266.316	1.103	50	0		CDAARO
C[C@@H]1CCC[C@H](OCC(=O)N2CC[C@H]([NH3+])C[C@@H]2C)C1	ZINC000408519194	359911967	/nfs/dbraw/zinc/91/19/67/359911967.db2.gz	QAECIQOSFMQBCA-RFGFWPKPSA-N	1	0	268.401	1.920	50	0		CDAARO
CCn1cnc2c1ncnc2N1CC[C@H]([NH+](C)C)[C@@H]1C	ZINC000408518611	359909375	/nfs/dbraw/zinc/90/93/75/359909375.db2.gz	PWMDKAWYBNWBHF-QWRGUYRKSA-N	1	0	274.372	1.375	50	0		CDAARO
COc1cc(C)ccc1OCCC(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000521394617	359966661	/nfs/dbraw/zinc/96/66/61/359966661.db2.gz	MBHUTRAHQDYAQA-ZDUSSCGKSA-N	1	0	292.379	1.593	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1CC(=O)N1CCc2sccc2C1	ZINC000089938930	360198613	/nfs/dbraw/zinc/19/86/13/360198613.db2.gz	DHRCGWMSTZSWLN-LBPRGKRZSA-N	1	0	293.436	1.269	50	0		CDAARO
COC(C)(C)C(=O)Nc1cc(C[NH+](C)C)ccn1	ZINC000176928173	189015326	/nfs/dbraw/zinc/01/53/26/189015326.db2.gz	LESCJSNPCDCDPF-UHFFFAOYSA-N	1	0	251.330	1.507	50	0		CDAARO
Cc1ccc(OC2CN(C(=O)N[C@H](C)C[NH+](C)C)C2)cc1	ZINC000426647865	360692072	/nfs/dbraw/zinc/69/20/72/360692072.db2.gz	DCTQBCFAIHSTPM-CYBMUJFWSA-N	1	0	291.395	1.718	50	0		CDAARO
COc1ccc(CCC(=O)N2CC[C@@H](C[NH3+])C2)cc1OC	ZINC000178584226	189128873	/nfs/dbraw/zinc/12/88/73/189128873.db2.gz	ZBGWCCPDFOBXMG-ZDUSSCGKSA-N	1	0	292.379	1.444	50	0		CDAARO
CC(=O)Nc1ccc(C(=O)c2cc[n+](C)cc2)cc1	ZINC000226795128	360745375	/nfs/dbraw/zinc/74/53/75/360745375.db2.gz	SRGLXPFWWFKJLU-UHFFFAOYSA-O	1	0	255.297	1.701	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)c2cnc3ccccc3n2)C1	ZINC000179213784	189178278	/nfs/dbraw/zinc/17/82/78/189178278.db2.gz	BDNGGPIKORYWLT-VXGBXAGGSA-N	1	0	284.363	1.829	50	0		CDAARO
O=S1(=O)CCNCC[C@@H]1c1ccccc1Cl	ZINC000618254151	364031812	/nfs/dbraw/zinc/03/18/12/364031812.db2.gz	AWQPWTCTWFOPFT-LLVKDONJSA-N	1	0	259.758	1.789	50	0		CDAARO
Cc1ccccc1OCC[N@@H+]1CCC[C@@H]1CS(N)(=O)=O	ZINC000089696781	366912638	/nfs/dbraw/zinc/91/26/38/366912638.db2.gz	RWSXOZUUTRFJBQ-CYBMUJFWSA-N	1	0	298.408	1.127	50	0		CDAARO
C[N@H+](CCN1C(=O)c2ccccc2C1=O)[C@@H]1CCSC1	ZINC000089935913	366970831	/nfs/dbraw/zinc/97/08/31/366970831.db2.gz	VVZDKJOYWFGOGT-LLVKDONJSA-N	1	0	290.388	1.720	50	0		CDAARO
COc1csc(C(=O)N2CC[C@@H]([NH3+])C[C@@H]2C)c1	ZINC000124749526	367266909	/nfs/dbraw/zinc/26/69/09/367266909.db2.gz	DMHRNJCIUZIWTM-DTWKUNHWSA-N	1	0	254.355	1.709	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@H]1NC(=O)c1ccc(F)cc1F	ZINC000094345162	367418035	/nfs/dbraw/zinc/41/80/35/367418035.db2.gz	MDYHBLIXGBISPW-QPUJVOFHSA-N	1	0	254.280	1.693	50	0		CDAARO
C[C@@H]1C[C@@H]([NH3+])CCN1C(=O)[C@H]1CCOc2ccccc21	ZINC000252209118	367371744	/nfs/dbraw/zinc/37/17/44/367371744.db2.gz	XSEXYPWORYSNMO-DYEKYZERSA-N	1	0	274.364	1.891	50	0		CDAARO
CCn1ccc(C(=O)NCCn2c(C)c[nH+]c2C2CC2)n1	ZINC000575554835	369133243	/nfs/dbraw/zinc/13/32/43/369133243.db2.gz	WKYRYXYVFRGBEB-UHFFFAOYSA-N	1	0	287.367	1.715	50	0		CDAARO
C[N@@H+]1CCC[C@H](CNC(=O)N2CCSC(C)(C)C2)C1	ZINC000089919594	370196317	/nfs/dbraw/zinc/19/63/17/370196317.db2.gz	BZUVBSKWFOCHOI-GFCCVEGCSA-N	1	0	285.457	1.865	50	0		CDAARO
CC(C)[C@H](O)C[N@@H+]1CCCN(c2cccnn2)CC1	ZINC000292774731	370386032	/nfs/dbraw/zinc/38/60/32/370386032.db2.gz	YRHIKDWWWDBONI-CYBMUJFWSA-N	1	0	264.373	1.006	50	0		CDAARO
CO[C@@H]1CC[N@@H+](C2CCN(C(=O)C(C)(C)C)CC2)C1	ZINC000575605353	370604398	/nfs/dbraw/zinc/60/43/98/370604398.db2.gz	JXBVTQPSVFJWOC-CYBMUJFWSA-N	1	0	268.401	1.744	50	0		CDAARO
COc1ccccc1C(=O)NCCOCCn1ccnc1	ZINC000575620850	372056760	/nfs/dbraw/zinc/05/67/60/372056760.db2.gz	VORNLEDJJZOACO-UHFFFAOYSA-N	1	0	289.335	1.338	50	0		CDAARO
COC(=O)c1cccc(C(=O)N2CCC([NH3+])CC2)c1	ZINC000067801003	372359109	/nfs/dbraw/zinc/35/91/09/372359109.db2.gz	WJBZPNYRQCCAEE-UHFFFAOYSA-N	1	0	262.309	1.037	50	0		CDAARO
Cc1cc(C[C@@H](C)NC(=O)Nc2cccc(C[NH3+])c2)[nH]n1	ZINC000299760557	372747336	/nfs/dbraw/zinc/74/73/36/372747336.db2.gz	HPXBREMWLHOSPU-SNVBAGLBSA-N	1	0	287.367	1.930	50	0		CDAARO
COCc1cc(CNC(=O)C[C@@H](C)n2ccnc2C)[nH]n1	ZINC000299776872	372753935	/nfs/dbraw/zinc/75/39/35/372753935.db2.gz	MQCXSYYIEKVZAU-SNVBAGLBSA-N	1	0	291.355	1.329	50	0		CDAARO
CC(C)N1C[C@H]([NH3+])C[C@H]1C(=O)NCCc1ccccc1F	ZINC000299777454	372754193	/nfs/dbraw/zinc/75/41/93/372754193.db2.gz	NXGPZNWQZXXVSD-HIFRSBDPSA-N	1	0	293.386	1.294	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1NC(=O)c1cc(C)oc1C	ZINC000299783475	372759022	/nfs/dbraw/zinc/75/90/22/372759022.db2.gz	ZOYBLFWCOSVDLF-KBPBESRZSA-N	1	0	280.368	1.734	50	0		CDAARO
c1nc(CN2CC[NH+]([C@@H]3CCc4ccccc4C3)CC2)no1	ZINC000299785466	372761855	/nfs/dbraw/zinc/76/18/55/372761855.db2.gz	RNHMXWWIHRQDKG-MRXNPFEDSA-N	1	0	298.390	1.745	50	0		CDAARO
CSc1ccc(NC(=O)NC[C@@]2(O)CC[NH2+]C2)cc1	ZINC000299801214	372771214	/nfs/dbraw/zinc/77/12/14/372771214.db2.gz	WJRFIZLJRPEGQV-CYBMUJFWSA-N	1	0	281.381	1.254	50	0		CDAARO
C[NH+](C)[C@@H]1CCN(C(=O)c2cccc(-c3cnccn3)c2)C1	ZINC000299802372	372773456	/nfs/dbraw/zinc/77/34/56/372773456.db2.gz	YXSCDXDGOVUJFX-OAHLLOKOSA-N	1	0	296.374	1.920	50	0		CDAARO
OC[C@@H]1C[N@H+](Cc2cccnc2)C[C@H]1c1ccncc1	ZINC000253413872	373723253	/nfs/dbraw/zinc/72/32/53/373723253.db2.gz	VWWDIJKGXDWWCR-HOTGVXAUSA-N	1	0	269.348	1.685	50	0		CDAARO
C[C@H](c1nc(N)nc(N(C)C)n1)N1C[C@H](C)C[C@H](C)C1	ZINC000103447448	373984392	/nfs/dbraw/zinc/98/43/92/373984392.db2.gz	KQYBCAZZTNCKJS-OUAUKWLOSA-N	1	0	278.404	1.559	50	0		CDAARO
CN(CC1CCOCC1)C(=O)c1ccc(C[NH3+])cc1	ZINC000104186748	374163284	/nfs/dbraw/zinc/16/32/84/374163284.db2.gz	DCVGOUSKNMVEGS-UHFFFAOYSA-N	1	0	262.353	1.644	50	0		CDAARO
CN1CCN(S(=O)(=O)C2CC2)C[C@H]1Cc1ccccc1	ZINC000252571754	374249093	/nfs/dbraw/zinc/24/90/93/374249093.db2.gz	YNDFWPNZUYGGSF-CQSZACIVSA-N	1	0	294.420	1.337	50	0		CDAARO
O=C(NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(CO)c(F)c1	ZINC000252481769	189975008	/nfs/dbraw/zinc/97/50/08/189975008.db2.gz	CROOXCWKLANVES-LLVKDONJSA-N	1	0	292.354	1.532	50	0		CDAARO
C[NH+](C)[C@H]1CCN(C(=O)CC2Cc3ccccc3C2)C1	ZINC000252485236	189976232	/nfs/dbraw/zinc/97/62/32/189976232.db2.gz	GPIHHNCRPFJACM-INIZCTEOSA-N	1	0	272.392	1.954	50	0		CDAARO
CCCn1nc(C)c(C[NH2+][C@@H]2CCN(C(=O)OC)C2)c1C	ZINC000095414141	374916895	/nfs/dbraw/zinc/91/68/95/374916895.db2.gz	ISDKNFMNHBWZKM-CYBMUJFWSA-N	1	0	294.399	1.840	50	0		CDAARO
OCCC1([NH2+]CCc2cccs2)CCOCC1	ZINC000095443098	374937221	/nfs/dbraw/zinc/93/72/21/374937221.db2.gz	KIMSLQPWKYILJD-UHFFFAOYSA-N	1	0	255.383	1.812	50	0		CDAARO
Cc1cccc(OCCCC(=O)N2CC([NH+](C)C)C2)c1	ZINC000095448391	374948699	/nfs/dbraw/zinc/94/86/99/374948699.db2.gz	XZFAPTYHQVBIKB-UHFFFAOYSA-N	1	0	276.380	1.926	50	0		CDAARO
Cc1cccc(N2CCC[C@H]2C[N@@H+]2CCC[C@H]2CO)n1	ZINC000108478932	412831153	/nfs/dbraw/zinc/83/11/53/412831153.db2.gz	ZCNNQUNJOGHLHP-GJZGRUSLSA-N	1	0	275.396	1.816	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCN(c2cc(C)ccc2C)CC1	ZINC000095466852	374961169	/nfs/dbraw/zinc/96/11/69/374961169.db2.gz	OLLKBBSQTMTCOE-CQSZACIVSA-N	1	0	275.396	1.689	50	0		CDAARO
Cc1ccc(NC(=O)NCCCN2CC[NH+](C)CC2)cn1	ZINC000095501587	374976008	/nfs/dbraw/zinc/97/60/08/374976008.db2.gz	IWLDDBOTTYZZOK-UHFFFAOYSA-N	1	0	291.399	1.149	50	0		CDAARO
COc1cncc(N2CC[NH+]([C@@H]3C=CCCC3)CC2)n1	ZINC000096406666	375097178	/nfs/dbraw/zinc/09/71/78/375097178.db2.gz	HNMMBHMPTLZZDP-CYBMUJFWSA-N	1	0	274.368	1.716	50	0		CDAARO
CC(C)(C)OC(=O)N1CC2(C1)C[NH2+]CC(C)(C)O2	ZINC000253388076	189987544	/nfs/dbraw/zinc/98/75/44/189987544.db2.gz	BBHDSFHBVLRZHG-UHFFFAOYSA-N	1	0	256.346	1.374	50	0		CDAARO
CCn1cc(NC(=O)[C@H](C2CC2)[NH+]2CCCC2)ccc1=O	ZINC000097115143	375148636	/nfs/dbraw/zinc/14/86/36/375148636.db2.gz	JKENJDLDDQYYGA-HNNXBMFYSA-N	1	0	289.379	1.681	50	0		CDAARO
FC(F)(F)c1cccnc1NC[C@@H]1C[NH2+]CCO1	ZINC000134267188	375826250	/nfs/dbraw/zinc/82/62/50/375826250.db2.gz	OIFSUYTTWVCGAJ-QMMMGPOBSA-N	1	0	261.247	1.501	50	0		CDAARO
C[N@@H+]1CCC[C@H]1C(=O)N1CCC(C(F)(F)F)CC1	ZINC000334607504	376597785	/nfs/dbraw/zinc/59/77/85/376597785.db2.gz	NGSVHTBGHWUKCZ-JTQLQIEISA-N	1	0	264.291	1.882	50	0		CDAARO
C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1CCN1CCOCC1	ZINC000075838150	377133048	/nfs/dbraw/zinc/13/30/48/377133048.db2.gz	LLBNVFZMNNUFBF-ILXRZTDVSA-N	1	0	252.402	1.972	50	0		CDAARO
O=c1c2ccccc2ncn1CC[n+]1ccccc1	ZINC000000389296	169627249	/nfs/dbraw/zinc/62/72/49/169627249.db2.gz	IDTGSDITMJCSRH-UHFFFAOYSA-N	1	0	252.297	1.384	50	0		CDAARO
O=C1[C@@H]2CC=C(Cl)C[C@H]2C(=O)N1CC[n+]1ccccc1	ZINC000000105262	284983067	/nfs/dbraw/zinc/98/30/67/284983067.db2.gz	MKYMTEZDKHZESB-CHWSQXEVSA-N	1	0	291.758	1.492	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1C(=O)/C=C\c1cncc(F)c1	ZINC000493153300	253384516	/nfs/dbraw/zinc/38/45/16/253384516.db2.gz	LFPOISWNWCYEKS-DSYXLKISSA-N	1	0	263.316	1.574	50	0		CDAARO
CCN1C(=O)OC2(CC(C)(C)[NH2+]C(C)(C)C2)[C@]1(C)O	ZINC000000036919	285173963	/nfs/dbraw/zinc/17/39/63/285173963.db2.gz	PWMMQYFWZDAZKR-ZDUSSCGKSA-N	1	0	270.373	1.846	50	0		CDAARO
Cc1ccc(CS(=O)(=O)N(C)C[C@@H]2CC[N@H+](C)C2)cc1	ZINC000288180718	197020573	/nfs/dbraw/zinc/02/05/73/197020573.db2.gz	ARYDTZFPLXQHLQ-OAHLLOKOSA-N	1	0	296.436	1.708	50	0		CDAARO
OCC[C@H]1CSCC[N@@H+]1CCO[C@H]1CCCCO1	ZINC000408514854	285267222	/nfs/dbraw/zinc/26/72/22/285267222.db2.gz	MWMBXNBOYZLUKN-STQMWFEESA-N	1	0	275.414	1.329	50	0		CDAARO
OC[C@@]12C[N@H+](CC3CC3)C[C@@H]1c1ccccc1OC2	ZINC000095512186	285284784	/nfs/dbraw/zinc/28/47/84/285284784.db2.gz	DJHKFQWRIFBLEZ-GDBMZVCRSA-N	1	0	259.349	1.867	50	0		CDAARO
CCOC(=O)[C@@H]1[C@@H](C(=O)OCC)C(C)(C)[C@@H]1[NH+]1CCCC1	ZINC000005796535	390164939	/nfs/dbraw/zinc/16/49/39/390164939.db2.gz	RJAIFMNTFDYYIO-FRRDWIJNSA-N	1	0	297.395	1.849	50	0		CDAARO
Cc1ccccc1CS(=O)(=O)N[C@@H](C[NH3+])CC(C)C	ZINC000095432094	184981601	/nfs/dbraw/zinc/98/16/01/184981601.db2.gz	VCTUFYCJGLUATH-CQSZACIVSA-N	1	0	284.425	1.788	50	0		CDAARO
c1cn(C[C@@H]2CCC[N@@H+]2Cc2cn3cccnc3n2)cn1	ZINC000291424849	390439154	/nfs/dbraw/zinc/43/91/54/390439154.db2.gz	INAYNIKAUKAWSD-AWEZNQCLSA-N	1	0	282.351	1.590	50	0		CDAARO
CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1Cc1ccc(OC)nn1	ZINC000283223921	390551258	/nfs/dbraw/zinc/55/12/58/390551258.db2.gz	SYDUPZFXXHTSPL-ZIAGYGMSSA-N	1	0	276.384	1.544	50	0		CDAARO
CN(Cc1[nH]nc2c1CCCCC2)[C@H]1CCC[NH2+]C1	ZINC000067741072	390575273	/nfs/dbraw/zinc/57/52/73/390575273.db2.gz	GXPDMXUQHHSRIQ-LBPRGKRZSA-N	1	0	262.401	1.862	50	0		CDAARO
COC(=O)[C@]12CCC[C@H]1C[N@H+](CC(=O)NC(C)(C)C)C2	ZINC000097082983	390672458	/nfs/dbraw/zinc/67/24/58/390672458.db2.gz	VTNIGDBHHYLXSJ-NHYWBVRUSA-N	1	0	282.384	1.176	50	0		CDAARO
C[C@H](O)c1cn(CC2CC[NH+](Cc3ccco3)CC2)nn1	ZINC000023145211	390825679	/nfs/dbraw/zinc/82/56/79/390825679.db2.gz	PNYZJHAKGSBTFX-LBPRGKRZSA-N	1	0	290.367	1.837	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@@H]2CCOc3ccccc32)CC[NH2+]1	ZINC000088059128	390947534	/nfs/dbraw/zinc/94/75/34/390947534.db2.gz	FKNNEELFNGPQKF-DGCLKSJQSA-N	1	0	260.337	1.373	50	0		CDAARO
Cc1ccc(-c2noc([C@H]3CCC[N@@H+](C)C3)n2)nn1	ZINC000091665524	390891331	/nfs/dbraw/zinc/89/13/31/390891331.db2.gz	SLQDMHYSMLODEG-JTQLQIEISA-N	1	0	259.313	1.644	50	0		CDAARO
CC(C)[C@H](O)C[NH2+][C@H](C)c1ccc(-n2cncn2)cc1	ZINC000123923091	390912424	/nfs/dbraw/zinc/91/24/24/390912424.db2.gz	PQFLYWSABRDLHG-IUODEOHRSA-N	1	0	274.368	1.935	50	0		CDAARO
CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CCN(CCO)[C@H](C)C1	ZINC000191124188	391460312	/nfs/dbraw/zinc/46/03/12/391460312.db2.gz	MCBRYWMFVAXSKK-ARFHVFGLSA-N	1	0	266.429	1.977	50	0		CDAARO
Cc1cc2c(s1)n(CC[NH+]1CCCCC1)c(=O)nc2N	ZINC000040288383	391974629	/nfs/dbraw/zinc/97/46/29/391974629.db2.gz	SDNSYYSDFQNGME-UHFFFAOYSA-N	1	0	292.408	1.835	50	0		CDAARO
Cc1cc2c(cc1C)O[C@H](C(=O)N[C@@H]1CCC[C@H]1C[NH3+])C2	ZINC000262653838	131248300	/nfs/dbraw/zinc/24/83/00/131248300.db2.gz	ZCYHQIDXLDANKW-BJJXKVORSA-N	1	0	288.391	1.851	50	0		CDAARO
CC(C)NC(=O)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCN(C3CC3)C2)C1	ZINC000095968093	393156105	/nfs/dbraw/zinc/15/61/05/393156105.db2.gz	PSRNQYBYGGQHTJ-QLFBSQMISA-N	1	0	293.455	1.896	50	0		CDAARO
CCC[C@@]1(CO)CCCN(c2ccc(C[NH3+])cn2)C1	ZINC000091724434	135073390	/nfs/dbraw/zinc/07/33/90/135073390.db2.gz	BPMQKRDDWKAMDG-OAHLLOKOSA-N	1	0	263.385	1.919	50	0		CDAARO
CC(C)c1csc(CN2CCN3CC[N@H+](C)C[C@H]3C2)n1	ZINC000106238255	398094784	/nfs/dbraw/zinc/09/47/84/398094784.db2.gz	LLYOKIDUYCIFMN-ZDUSSCGKSA-N	1	0	294.468	1.698	50	0		CDAARO
Cc1ccc([C@@H](C(=O)NCCCCC[NH3+])N(C)C)cc1	ZINC000091270619	292190172	/nfs/dbraw/zinc/19/01/72/292190172.db2.gz	RDIOWRWGJYQFRB-HNNXBMFYSA-N	1	0	277.412	1.843	50	0		CDAARO
CS(=O)(=O)N1CC[NH+](C2CCCCCC2)CC1	ZINC000000300586	286610776	/nfs/dbraw/zinc/61/07/76/286610776.db2.gz	HGGVPWVXNKXLCS-UHFFFAOYSA-N	1	0	260.403	1.286	50	0		CDAARO
Cc1nc[nH]c1CNC(=O)c1cccc(C[NH+](C)C)c1	ZINC000359515353	158272796	/nfs/dbraw/zinc/27/27/96/158272796.db2.gz	JCNSROIASINPSV-UHFFFAOYSA-N	1	0	272.352	1.710	50	0		CDAARO
COc1cccc(OC)c1OCCCC[NH2+]CCO	ZINC000002931536	169844858	/nfs/dbraw/zinc/84/48/58/169844858.db2.gz	QCGCHLRWZUXBCK-UHFFFAOYSA-N	1	0	269.341	1.445	50	0		CDAARO
Cc1nnc(-c2cnn(C)c2N)n1CC[NH+]1CCCCC1	ZINC000005753235	170137043	/nfs/dbraw/zinc/13/70/43/170137043.db2.gz	YYBBNNUFOJBHDU-UHFFFAOYSA-N	1	0	289.387	1.055	50	0		CDAARO
COC(=O)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1OC(=O)c1ccccc1)[NH2+]2	ZINC000006523804	170209704	/nfs/dbraw/zinc/20/97/04/170209704.db2.gz	AYDBLCSLKNTEJL-RFQIPJPRSA-N	1	0	289.331	1.526	50	0	in-vitro	CDAARO
NC(=O)C1CC[NH+](CCOc2ccccc2F)CC1	ZINC000008317208	170330616	/nfs/dbraw/zinc/33/06/16/170330616.db2.gz	NVTYSROVBIOITC-UHFFFAOYSA-N	1	0	266.316	1.402	50	0		CDAARO
CC(C)c1ccc(N2C(=O)C[C@@H]([NH2+]CCO)C2=O)cc1	ZINC000009225269	170367690	/nfs/dbraw/zinc/36/76/90/170367690.db2.gz	SDZASXWKAGEFCR-CYBMUJFWSA-N	1	0	276.336	1.024	50	0		CDAARO
Cc1ccccc1OCC[NH2+]CCN1CCOCC1	ZINC000020500200	171227059	/nfs/dbraw/zinc/22/70/59/171227059.db2.gz	IKLQGBGBONOUAU-UHFFFAOYSA-N	1	0	264.369	1.296	50	0		CDAARO
Cc1ccc2nc(CN3CCC[N@@H+](C)CC3)cn2c1	ZINC000020865928	171276923	/nfs/dbraw/zinc/27/69/23/171276923.db2.gz	TZPIUEYOXZRTRH-UHFFFAOYSA-N	1	0	258.369	1.780	50	0		CDAARO
NC(=O)c1ccc[n+](Cc2c(F)cccc2Cl)c1	ZINC000021323540	171302474	/nfs/dbraw/zinc/30/24/74/171302474.db2.gz	NXJKGYQZPPSTLW-UHFFFAOYSA-O	1	0	265.695	1.914	50	0		CDAARO
CCCN(C(=O)c1ccccc1OC)[C@H]1CC[NH2+]C1	ZINC000037540150	173262255	/nfs/dbraw/zinc/26/22/55/173262255.db2.gz	ZFDSDOSLQSWXHR-LBPRGKRZSA-N	1	0	262.353	1.909	50	0		CDAARO
COc1ccc([C@H]2C[C@H]2C(=O)N2CC[NH2+]CC2)cc1	ZINC000038478360	174141819	/nfs/dbraw/zinc/14/18/19/174141819.db2.gz	FYOXQDYKWMVTEZ-ZIAGYGMSSA-N	1	0	260.337	1.231	50	0		CDAARO
CC(C)C[NH2+]C[C@@H](O)COCCOc1ccc(F)cc1	ZINC000038642116	174150853	/nfs/dbraw/zinc/15/08/53/174150853.db2.gz	OLKQYJBCTFYMIM-CQSZACIVSA-N	1	0	285.359	1.828	50	0		CDAARO
O=C1c2ccccc2C(=O)N1CCC1CC[NH2+]CC1	ZINC000039200861	174165646	/nfs/dbraw/zinc/16/56/46/174165646.db2.gz	UXIHSXPUZBROTR-UHFFFAOYSA-N	1	0	258.321	1.672	50	0		CDAARO
Cc1cc(-n2cc(C(=O)NCC[NH+](C)C)nn2)ccc1F	ZINC000067262033	175772156	/nfs/dbraw/zinc/77/21/56/175772156.db2.gz	BBOUXGKOORRDFP-UHFFFAOYSA-N	1	0	291.330	1.006	50	0		CDAARO
[NH3+]CCC(=O)N1CCc2onc(-c3ccccc3)c2C1	ZINC000067540770	175777368	/nfs/dbraw/zinc/77/73/68/175777368.db2.gz	WFWARUDMFJVMEY-UHFFFAOYSA-N	1	0	271.320	1.575	50	0		CDAARO
CC(C)Cc1nc(CN(C)[C@@H]2CCC[NH2+]C2)no1	ZINC000067743419	175788822	/nfs/dbraw/zinc/78/88/22/175788822.db2.gz	GYTUIBSKLNOYSV-LLVKDONJSA-N	1	0	252.362	1.452	50	0		CDAARO
Cc1occc1C(=O)N(CC[NH+](C)C)C[C@H]1CCCO1	ZINC000067880881	175799188	/nfs/dbraw/zinc/79/91/88/175799188.db2.gz	NJMYAEUWNSLTGD-CYBMUJFWSA-N	1	0	280.368	1.771	50	0		CDAARO
COc1ccc(OC)c([C@@H]2CCN(C(=O)C3([NH3+])CC3)C2)c1	ZINC000071415532	176160529	/nfs/dbraw/zinc/16/05/29/176160529.db2.gz	RPXSGJFMOHGGGG-LLVKDONJSA-N	1	0	290.363	1.511	50	0		CDAARO
OCC(CO)[N@@H+]1CCC[C@H](CCc2ccc(F)c(F)c2)C1	ZINC000071499079	176192128	/nfs/dbraw/zinc/19/21/28/176192128.db2.gz	FSOVEQOMSDOHHT-CYBMUJFWSA-N	1	0	299.361	1.963	50	0		CDAARO
CN1C(=O)N(Cc2ccccc2)C(=O)C12CC[NH2+]CC2	ZINC000071612829	176233243	/nfs/dbraw/zinc/23/32/43/176233243.db2.gz	VASJLNYSHALIMB-UHFFFAOYSA-N	1	0	273.336	1.203	50	0		CDAARO
Cc1ccc(CC2(NC(=O)[C@H]3C[NH2+]CCO3)CC2)cc1	ZINC000071638873	176238611	/nfs/dbraw/zinc/23/86/11/176238611.db2.gz	DZVKLYXBNSTAHX-CQSZACIVSA-N	1	0	274.364	1.175	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CN1CCN(C(=O)C(C)(C)C)CC1	ZINC000071885838	176289738	/nfs/dbraw/zinc/28/97/38/176289738.db2.gz	WMMZGCWMSWNBDF-AWEZNQCLSA-N	1	0	281.444	1.661	50	0		CDAARO
NC(=[NH2+])[C@@H]1CN(c2ccc(Cl)cc2)C(=O)NC1=O	ZINC000072115189	176318131	/nfs/dbraw/zinc/31/81/31/176318131.db2.gz	RPKUPZRLDUMIPN-QMMMGPOBSA-N	1	0	266.688	1.789	50	0		CDAARO
Cc1nonc1C(=O)N[C@H]1CC[C@H]1[NH2+]C1CCCCCC1	ZINC000072142054	176323733	/nfs/dbraw/zinc/32/37/33/176323733.db2.gz	UGQHFMVAFXHCAF-OLZOCXBDSA-N	1	0	292.383	1.951	50	0		CDAARO
Cc1cncc(C(=O)N2CCC[C@@](O)(C[NH+](C)C)CC2)c1	ZINC000072166784	176331589	/nfs/dbraw/zinc/33/15/89/176331589.db2.gz	ZCASXLGGUQCBKX-INIZCTEOSA-N	1	0	291.395	1.309	50	0		CDAARO
CN1CCN(C(=O)c2ccccc2[C@H]2CC[NH2+]C2)CC1	ZINC000072169875	176332545	/nfs/dbraw/zinc/33/25/45/176332545.db2.gz	WJVLKEXSZCUMEN-ZDUSSCGKSA-N	1	0	273.380	1.151	50	0		CDAARO
CCc1ccc2nc(C)cc(C(=O)N[C@@H]3C[NH2+]C[C@H]3O)c2c1	ZINC000077322114	177252772	/nfs/dbraw/zinc/25/27/72/177252772.db2.gz	MAIPQFXLXDNKOZ-HZPDHXFCSA-N	1	0	299.374	1.168	50	0		CDAARO
O=C(NC[C@H]1CCCO1)c1ccc(-c2c[nH]cn2)cc1	ZINC000521396313	260071803	/nfs/dbraw/zinc/07/18/03/260071803.db2.gz	LDQRNPDOWPTMGO-CYBMUJFWSA-N	1	0	271.320	1.986	50	0		CDAARO
CCCc1noc(CN2CC[C@H]([NH+](CC)CC)C2)n1	ZINC000022926441	265025824	/nfs/dbraw/zinc/02/58/24/265025824.db2.gz	PQMGDFKSPLFMQC-LBPRGKRZSA-N	1	0	266.389	1.938	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2CC[NH2+]C2)C[C@H](c2ccsc2)O1	ZINC000262614933	274329560	/nfs/dbraw/zinc/32/95/60/274329560.db2.gz	CTGMZQJQAYGQDW-NTZNESFSSA-N	1	0	280.393	1.646	50	0		CDAARO
CC1(C)CN(c2ncnc3c(F)cccc32)CC[NH2+]1	ZINC000420286751	275852038	/nfs/dbraw/zinc/85/20/38/275852038.db2.gz	WRRMFBRJHIEUOP-UHFFFAOYSA-N	1	0	260.316	1.957	50	0		CDAARO
CC1=C[C@H](C)[C@H]2C(=O)N(Cc3ccc[n+](C)c3)C(=O)[C@@H]2C1	ZINC000100599095	276186337	/nfs/dbraw/zinc/18/63/37/276186337.db2.gz	PYBDZRRKYOKDCJ-NWANDNLSSA-N	1	0	285.367	1.598	50	0		CDAARO
CC[NH+](CC)CCOC(=O)[C@H]1COc2ccccc2O1	ZINC000001823078	276327458	/nfs/dbraw/zinc/32/74/58/276327458.db2.gz	PJHMVOHUUHWFIW-CQSZACIVSA-N	1	0	279.336	1.711	50	0		CDAARO
CS[C@@H]1CCC[C@@H]1[N@H+](C)CCN1C(=O)CCC1=O	ZINC000110642401	278144258	/nfs/dbraw/zinc/14/42/58/278144258.db2.gz	NVAOHARBGMASTR-WDEREUQCSA-N	1	0	270.398	1.351	50	0		CDAARO
Cc1c(-c2ccc(C[NH+](C)C)cc2)c(=O)n(C)c(=O)n1C	ZINC000426711494	280195259	/nfs/dbraw/zinc/19/52/59/280195259.db2.gz	RTNXPIXOHXUBJV-UHFFFAOYSA-N	1	0	287.363	1.121	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1C[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)[C@H]2C1	ZINC000245305059	280209185	/nfs/dbraw/zinc/20/91/85/280209185.db2.gz	HXMAPJYHAWSQGG-CRWXNKLISA-N	1	0	298.427	1.992	50	0		CDAARO
C[NH+](C)CC1(CNC(=O)Nc2cccnn2)CCCC1	ZINC000097135479	282072398	/nfs/dbraw/zinc/07/23/98/282072398.db2.gz	JAZKWKWSPVQERS-UHFFFAOYSA-N	1	0	277.372	1.720	50	0		CDAARO
C[C@H](C(=O)[O-])[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000299742282	298216222	/nfs/dbraw/zinc/21/62/22/298216222.db2.gz	AYTGETIPXZBJQM-JHJVBQTASA-N	1	0	284.400	1.281	50	0		CDAARO
Cc1cc(C)n(CCCC(=O)NC(C)(C)C[NH+](C)C)n1	ZINC000534590948	328318110	/nfs/dbraw/zinc/31/81/10/328318110.db2.gz	ATXRMXBFZGBJEY-UHFFFAOYSA-N	1	0	280.416	1.737	50	0		CDAARO
CC[C@H](NC(=O)CN(C)CCOC)c1ncccc1C	ZINC000534653323	328338630	/nfs/dbraw/zinc/33/86/30/328338630.db2.gz	CIAGVFKEJZYSDD-ZDUSSCGKSA-N	1	0	279.384	1.536	50	0		CDAARO
C[C@H]([NH2+]CCc1csc(-c2cnccn2)n1)C(C)(C)O	ZINC000534652431	328337968	/nfs/dbraw/zinc/33/79/68/328337968.db2.gz	IHJOTMSUACMKRG-JTQLQIEISA-N	1	0	292.408	1.892	50	0		CDAARO
C[C@H](C(=O)NCCn1ccnn1)[N@H+](C)C1CCCCC1	ZINC000534655986	328339949	/nfs/dbraw/zinc/33/99/49/328339949.db2.gz	VSJNCYGVHGKFHM-GFCCVEGCSA-N	1	0	279.388	1.047	50	0		CDAARO
NC(=O)[C@@H]1CC=CC[C@H]1[NH2+]C1CSCCSC1	ZINC000534658747	328341296	/nfs/dbraw/zinc/34/12/96/328341296.db2.gz	ZPCARIYHQQENMV-GHMZBOCLSA-N	1	0	272.439	1.245	50	0		CDAARO
Cc1nn[nH]c1C(=O)NC[C@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534676064	328356244	/nfs/dbraw/zinc/35/62/44/328356244.db2.gz	VPYJCJCDFKTNMX-LLVKDONJSA-N	1	0	277.372	1.107	50	0		CDAARO
OC[C@@]12C[NH2+]C[C@H]1CN(CCCOc1ccc(F)cc1)C2	ZINC001772710804	1159444922	/nfs/dbraw/zinc/44/49/22/1159444922.db2.gz	WRMMOBREASERSA-BBRMVZONSA-N	1	0	294.370	1.108	50	0		CDAARO
Cc1nc(CN2CCOC[C@@H](C[NH+](C)C)C2)n(C)c1C	ZINC000670441054	482985754	/nfs/dbraw/zinc/98/57/54/482985754.db2.gz	IKSZUGMYKCTNJA-AWEZNQCLSA-N	1	0	280.416	1.047	50	0		CDAARO
CN(C)C(=O)c1cncc(NC[C@@H]2CCCC[N@@H+]2C)n1	ZINC000670445957	482995092	/nfs/dbraw/zinc/99/50/92/482995092.db2.gz	RBHVIKAZKUQLBR-NSHDSACASA-N	1	0	277.372	1.075	50	0		CDAARO
C[N@H+](CC(=O)NC1(C(N)=O)CCCCCC1)C1CCCC1	ZINC000670454834	483030148	/nfs/dbraw/zinc/03/01/48/483030148.db2.gz	QMEOKXGXVMBKMY-UHFFFAOYSA-N	1	0	295.427	1.555	50	0		CDAARO
CC(C)(CCO)C[NH2+][C@H]1CCN(CC(F)(F)F)C1	ZINC000084325910	483272354	/nfs/dbraw/zinc/27/23/54/483272354.db2.gz	YXTSMLQHNUTDOU-JTQLQIEISA-N	1	0	268.323	1.621	50	0		CDAARO
Cc1cc(C)n2ncc(CN3CC[C@H]4C[NH2+]C[C@H]43)c2n1	ZINC000426635561	534130348	/nfs/dbraw/zinc/13/03/48/534130348.db2.gz	UVGWTLMYFUNZEW-GXTWGEPZSA-N	1	0	271.368	1.140	50	0		CDAARO
CC(C)C[C@H]([NH2+]CCS(C)(=O)=O)c1ccccn1	ZINC000096476764	528571091	/nfs/dbraw/zinc/57/10/91/528571091.db2.gz	VCMXOAXUCRFQFA-ZDUSSCGKSA-N	1	0	270.398	1.803	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CCN1CCN(c2cccnn2)CC1	ZINC000268515782	536357337	/nfs/dbraw/zinc/35/73/37/536357337.db2.gz	DNHSGRFKWXJVEX-HNNXBMFYSA-N	1	0	289.427	1.473	50	0		CDAARO
CO[C@H](C[NH3+])CC(=O)N(C)[C@H]1CCc2ccccc2C1	ZINC000262745415	536559716	/nfs/dbraw/zinc/55/97/16/536559716.db2.gz	AFHIAOASWQBIIR-GJZGRUSLSA-N	1	0	276.380	1.366	50	0		CDAARO
[NH3+][C@@H]1CCN(c2cccc(Br)c2)C1=O	ZINC000049648328	538349938	/nfs/dbraw/zinc/34/99/38/538349938.db2.gz	CRPVKUNCTUOQFQ-SECBINFHSA-N	1	0	255.115	1.513	50	0		CDAARO
Cc1cc(C)cc(C(=O)NC[C@@H]2C[N@@H+]3CCC[C@@H]3CO2)c1	ZINC000058345474	538378082	/nfs/dbraw/zinc/37/80/82/538378082.db2.gz	VXTUMJSMPBLLIC-HZPDHXFCSA-N	1	0	288.391	1.896	50	0		CDAARO
COCCOc1ccc(C[NH2+]Cc2c(C)n[nH]c2C)cn1	ZINC000097159422	567905119	/nfs/dbraw/zinc/90/51/19/567905119.db2.gz	IJHYRLVESUITJL-UHFFFAOYSA-N	1	0	290.367	1.737	50	0		CDAARO
CC(=O)c1ccc(NCC[N@@H+]2CCC[C@H](CO)C2)nc1	ZINC000952984432	614253967	/nfs/dbraw/zinc/25/39/67/614253967.db2.gz	VGZYQPIALCMRDS-ZDUSSCGKSA-N	1	0	277.368	1.400	50	0		CDAARO
CCc1nccn1CCNC(=O)[C@H]1CCCCC[N@@H+]1C	ZINC000952977584	615777363	/nfs/dbraw/zinc/77/73/63/615777363.db2.gz	IXGZGNVQJFBHCM-CYBMUJFWSA-N	1	0	278.400	1.436	50	0		CDAARO
Cc1cc(N)nc(N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)[nH+]1	ZINC000871101502	630804829	/nfs/dbraw/zinc/80/48/29/630804829.db2.gz	QMUKOCGIVORDSO-JLLWLGSASA-N	1	0	260.341	1.737	50	0		CDAARO
Cc1c[nH]c([C@H](C)NC(=O)C[N@H+](C)C2CCCC2)n1	ZINC000822182679	1161926980	/nfs/dbraw/zinc/92/69/80/1161926980.db2.gz	FCUJRDFRTKRWIG-NSHDSACASA-N	1	0	264.373	1.770	50	0		CDAARO
Cc1nn(C)cc1-c1ccnc(N2CC[N@H+](C)[C@@H](C)C2)n1	ZINC000105902466	1163697763	/nfs/dbraw/zinc/69/77/63/1163697763.db2.gz	VJOFGMBWCZPBCK-NSHDSACASA-N	1	0	286.383	1.326	50	0		CDAARO
CC(C)OCC[NH+]1CCN(c2cccc([C@H](C)O)n2)CC1	ZINC000863949107	705540368	/nfs/dbraw/zinc/54/03/68/705540368.db2.gz	IHJWNNDJQMQKKY-AWEZNQCLSA-N	1	0	293.411	1.682	50	0		CDAARO
CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1C[C@](O)(C[NH3+])C2	ZINC000238790017	705604772	/nfs/dbraw/zinc/60/47/72/705604772.db2.gz	CYQXYSAXULWVNH-IWIIMEHWSA-N	1	0	256.346	1.238	50	0		CDAARO
C[C@H](C(N)=O)[NH+]1CCC(CNC(=O)C2CCCCC2)CC1	ZINC000952967966	706204964	/nfs/dbraw/zinc/20/49/64/706204964.db2.gz	JBICGWRUZFBDEK-GFCCVEGCSA-N	1	0	295.427	1.269	50	0		CDAARO
CCC[NH2+]C[C@@]1(O)CCCN(Cc2cccc(C)c2)C1=O	ZINC000011953977	710051168	/nfs/dbraw/zinc/05/11/68/710051168.db2.gz	PJPLZUMXNKIDAF-KRWDZBQOSA-N	1	0	290.407	1.848	50	0		CDAARO
Cc1c[nH]c([C@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)n1	ZINC000426698184	710564357	/nfs/dbraw/zinc/56/43/57/710564357.db2.gz	GBEVXRRQOIMOIB-NSHDSACASA-N	1	0	264.373	1.770	50	0		CDAARO
CCNS(=O)(=O)[C@@H]1CC[N@H+](Cc2cccc(C)c2C)C1	ZINC000181558562	710598403	/nfs/dbraw/zinc/59/84/03/710598403.db2.gz	IVBHUTRSSQDJOB-OAHLLOKOSA-N	1	0	296.436	1.817	50	0		CDAARO
Cc1nccn1[C@H](C)C(=O)NCCc1nc(C)cc(C)n1	ZINC000019337867	711744604	/nfs/dbraw/zinc/74/46/04/711744604.db2.gz	QASFSHDNVDGPOM-GFCCVEGCSA-N	1	0	287.367	1.518	50	0		CDAARO
Cc1cc(C)n2ncc(C[NH2+][C@@H]3CC=CC[C@H]3C(N)=O)c2n1	ZINC000952972715	711776057	/nfs/dbraw/zinc/77/60/57/711776057.db2.gz	UPPBLFVCWQBJSN-ZIAGYGMSSA-N	1	0	299.378	1.256	50	0		CDAARO
Cc1nnc([C@@H]2CC[N@@H+](CCCO)CCN2CC(C)C)[nH]1	ZINC000675014192	899868008	/nfs/dbraw/zinc/86/80/08/899868008.db2.gz	TXSIMCQAWQCVNJ-AWEZNQCLSA-N	1	0	295.431	1.200	50	0		CDAARO
Cc1[nH+]cc2ccc(C(=O)N[C@@H](C)Cn3cncn3)cn21	ZINC000952845160	910400498	/nfs/dbraw/zinc/40/04/98/910400498.db2.gz	DEPIHJLXUMXCDF-JTQLQIEISA-N	1	0	284.323	1.053	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CCNS(=O)(=O)CC1CCCC1	ZINC000823778010	925730287	/nfs/dbraw/zinc/73/02/87/925730287.db2.gz	YPQGNSVAYZIYBF-AWEZNQCLSA-N	1	0	288.457	1.970	50	0		CDAARO
Cc1nnc(CNC(=O)CC2CC(C)(C)[NH2+]C(C)(C)C2)o1	ZINC000827801964	925968103	/nfs/dbraw/zinc/96/81/03/925968103.db2.gz	XGPMTZARERGGJG-UHFFFAOYSA-N	1	0	294.399	1.941	50	0		CDAARO
COCCC1([NH+](C)C)CCN(C(=O)c2cccnc2)CC1	ZINC000581804925	927203750	/nfs/dbraw/zinc/20/37/50/927203750.db2.gz	NEQGXIKUHJDTSO-UHFFFAOYSA-N	1	0	291.395	1.655	50	0		CDAARO
CC(=O)NC(C)(C)C[C@H](C)[N@H+](C)Cc1cc[nH]n1	ZINC001506401413	975150474	/nfs/dbraw/zinc/15/04/74/975150474.db2.gz	JEPMJSLGSADKSS-JTQLQIEISA-N	1	0	252.362	1.535	50	0		CDAARO
CCC[N@@H+]1CCCN(CCc2nccn2C)CC1	ZINC001506402529	975150592	/nfs/dbraw/zinc/15/05/92/975150592.db2.gz	OERHREBUPHCTKC-UHFFFAOYSA-N	1	0	250.390	1.380	50	0		CDAARO
CCc1nn(C)c(NC(=O)[C@@H]2CC[N@H+](CCOC)C2)c1C	ZINC001506407971	975153064	/nfs/dbraw/zinc/15/30/64/975153064.db2.gz	LSVHKBQTPTXJGE-GFCCVEGCSA-N	1	0	294.399	1.198	50	0		CDAARO
Cn1ccnc1C(=O)N1CCC2(CC1)CCC[N@H+](C)CC2	ZINC001506427272	975160868	/nfs/dbraw/zinc/16/08/68/975160868.db2.gz	XQYCUHAWSJCALY-UHFFFAOYSA-N	1	0	290.411	1.758	50	0		CDAARO
C[N@@H+]1CCCC2(CCN(c3nccc(N)n3)CC2)CC1	ZINC001506426758	975161043	/nfs/dbraw/zinc/16/10/43/975161043.db2.gz	KGBOXHYOOSRNOT-UHFFFAOYSA-N	1	0	275.400	1.761	50	0		CDAARO
C[C@H](CCNC(=O)N1CCC(CO)CC1)[NH+]1CCCCC1	ZINC000096502601	230385065	/nfs/dbraw/zinc/38/50/65/230385065.db2.gz	BLJZMQLVOVNPCZ-CQSZACIVSA-N	1	0	297.443	1.665	50	0		CDAARO
CC(C)[NH2+]CCN[C@@H](C)c1nnnn1-c1ccccc1	ZINC000193496218	342473403	/nfs/dbraw/zinc/47/34/03/342473403.db2.gz	CRBSRHMUTRFZFE-LBPRGKRZSA-N	1	0	274.372	1.311	50	0		CDAARO
CCC[NH+]1CCC(CC(=O)N[C@H](C)c2ncnn2C)CC1	ZINC000095505022	185000771	/nfs/dbraw/zinc/00/07/71/185000771.db2.gz	HVNLFKZINRQLQF-GFCCVEGCSA-N	1	0	293.415	1.504	50	0		CDAARO
Cc1nn(C)c2nc(NC3CC[NH2+]CC3)sc12	ZINC000095525071	185004186	/nfs/dbraw/zinc/00/41/86/185004186.db2.gz	PYPGPJIKBIABCD-UHFFFAOYSA-N	1	0	251.359	1.502	50	0		CDAARO
CC(C)(C)[C@H](C[NH+]1CCCC1)NC(=O)c1cncnc1	ZINC000584893861	341999268	/nfs/dbraw/zinc/99/92/68/341999268.db2.gz	NOKUIRRVGMYESS-ZDUSSCGKSA-N	1	0	276.384	1.717	50	0		CDAARO
[NH3+][C@@]1(CO)CCc2cc(Br)ccc2C1	ZINC000082496703	178062944	/nfs/dbraw/zinc/06/29/44/178062944.db2.gz	MSTRFUJCHQGTND-NSHDSACASA-N	1	0	256.143	1.628	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1cc(F)cc(F)c1	ZINC000095972666	185049315	/nfs/dbraw/zinc/04/93/15/185049315.db2.gz	PWSAMIMKZOTVOY-SNVBAGLBSA-N	1	0	278.324	1.371	50	0		CDAARO
CC[C@@]([NH2+]CC(=O)Nc1cccc(F)c1)(C(N)=O)C(C)C	ZINC000096006557	185062720	/nfs/dbraw/zinc/06/27/20/185062720.db2.gz	IEOSPBDADOLIOY-HNNXBMFYSA-N	1	0	295.358	1.644	50	0		CDAARO
CNC(=O)CC[N@H+](C)Cc1ccc(OC)c2ncccc12	ZINC000240825112	361751026	/nfs/dbraw/zinc/75/10/26/361751026.db2.gz	QMXIDOGDOJMYMR-UHFFFAOYSA-N	1	0	287.363	1.811	50	0		CDAARO
C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cncn1C	ZINC000241701732	361752583	/nfs/dbraw/zinc/75/25/83/361752583.db2.gz	QKTOZYVMRAOSBX-UKRRQHHQSA-N	1	0	298.390	1.670	50	0		CDAARO
Cn1cncc1CCN1CC[NH+](Cc2ccccc2)CC1	ZINC000242273786	361754584	/nfs/dbraw/zinc/75/45/84/361754584.db2.gz	YFXXCOOWZOMLKB-UHFFFAOYSA-N	1	0	284.407	1.780	50	0		CDAARO
CCC[N@@H+]1CCCN(C(=O)c2oc(C)nc2C)CC1	ZINC000089959061	539087697	/nfs/dbraw/zinc/08/76/97/539087697.db2.gz	WCDJRJJBFWLFJX-UHFFFAOYSA-N	1	0	265.357	1.849	50	0		CDAARO
Nc1nc(NCCNc2cccnc2)cc([C@H]2C[C@H]([NH3+])C2)n1	ZINC000244633152	361855389	/nfs/dbraw/zinc/85/53/89/361855389.db2.gz	FXPGYJBEWJKQOB-XYPYZODXSA-N	1	0	299.382	1.183	50	0		CDAARO
C[C@@H](C(=O)Nc1ccccn1)[N@H+](C)CC1(CO)CCCC1	ZINC000244724541	361860712	/nfs/dbraw/zinc/86/07/12/361860712.db2.gz	MWAYNGZMQJJLSL-ZDUSSCGKSA-N	1	0	291.395	1.893	50	0		CDAARO
Nc1nc(NC[C@@H](O)c2ccccc2)cc([C@H]2C[C@@H]([NH3+])C2)n1	ZINC000244883996	361867415	/nfs/dbraw/zinc/86/74/15/361867415.db2.gz	YDGYCQXKSMCWAA-MBNYWOFBSA-N	1	0	299.378	1.409	50	0		CDAARO
COCCn1cncc1C[N@H+](C)CC1(CO)CCCC1	ZINC000244900216	361869011	/nfs/dbraw/zinc/86/90/11/361869011.db2.gz	ZYDNKOSORIIYAU-UHFFFAOYSA-N	1	0	281.400	1.514	50	0		CDAARO
CCCC[C@H]([NH2+][C@@H]1CCN(C(=O)C(C)C)C[C@H]1C)C(N)=O	ZINC000252673351	361886670	/nfs/dbraw/zinc/88/66/70/361886670.db2.gz	RBMVZQNONVWUDN-MCIONIFRSA-N	1	0	297.443	1.513	50	0		CDAARO
NC(=O)N1CCC[N@H+](C/C=C/c2ccc(F)cc2)CC1	ZINC000092754225	361893132	/nfs/dbraw/zinc/89/31/32/361893132.db2.gz	JELVUSLEXDAQRK-HNQUOIGGSA-N	1	0	277.343	1.925	50	0		CDAARO
CCOC[C@H]1CCCN(C(=O)[C@@H]([NH3+])Cc2ccccc2)C1	ZINC000097019156	185153207	/nfs/dbraw/zinc/15/32/07/185153207.db2.gz	CJPYPVFMEDFVHQ-HOTGVXAUSA-N	1	0	290.407	1.832	50	0		CDAARO
[NH3+][C@H]1COC[C@H]1Oc1cnn(Cc2cc3ccccc3o2)c1	ZINC000685941769	539045950	/nfs/dbraw/zinc/04/59/50/539045950.db2.gz	BGFUZAXWEMUABP-GOEBONIOSA-N	1	0	299.330	1.783	50	0		CDAARO
c1[nH]nc2cc(C[N@@H+]3CC[C@@H](N4CCOCC4)C3)ccc12	ZINC000179844760	539138409	/nfs/dbraw/zinc/13/84/09/539138409.db2.gz	YVHDUKAIKBKXHH-OAHLLOKOSA-N	1	0	286.379	1.469	50	0		CDAARO
COc1ccccc1CNC(=O)N1CC[N@@H+]2CCC[C@@H]2C1	ZINC000171807179	362071371	/nfs/dbraw/zinc/07/13/71/362071371.db2.gz	NFGKUCUXGQOFLT-CQSZACIVSA-N	1	0	289.379	1.685	50	0		CDAARO
C[NH+](C)[C@H]1C[C@@H](NC(=O)CCc2ccncc2)C1(C)C	ZINC000585130211	362063021	/nfs/dbraw/zinc/06/30/21/362063021.db2.gz	KMZVAQPUIPNDNE-KGLIPLIRSA-N	1	0	275.396	1.859	50	0		CDAARO
CC(=O)c1ccc(NC(=O)N2CC([NH+](C)C)C2)cc1	ZINC000095462313	342431601	/nfs/dbraw/zinc/43/16/01/342431601.db2.gz	LEEIFPDAQDNXRI-UHFFFAOYSA-N	1	0	261.325	1.667	50	0		CDAARO
CN1C[C@H]([NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)CCC1=O	ZINC000096493411	529829848	/nfs/dbraw/zinc/82/98/48/529829848.db2.gz	QCSIWJPUYBPFBG-OSRDXIQISA-N	1	0	278.396	1.545	50	0		CDAARO
CCNC(=O)N1CC[C@H]([NH2+][C@@H](C)c2cnn(C(C)C)c2)C1	ZINC000090412323	362331892	/nfs/dbraw/zinc/33/18/92/362331892.db2.gz	WLWKSMUGPVANSM-JSGCOSHPSA-N	1	0	293.415	1.918	50	0		CDAARO
C[C@H]([NH2+]Cc1nncn1-c1ccccc1)[C@@H]1CCCO1	ZINC000273186149	192068356	/nfs/dbraw/zinc/06/83/56/192068356.db2.gz	PCOKWTZMPIWHCM-JSGCOSHPSA-N	1	0	272.352	1.924	50	0		CDAARO
COc1cccc([C@H]2CC[N@@H+]2CCn2cc[nH]c2=O)c1	ZINC000252480645	362385713	/nfs/dbraw/zinc/38/57/13/362385713.db2.gz	CBSREUDANZITJQ-CQSZACIVSA-N	1	0	273.336	1.632	50	0		CDAARO
CN(C[C@H]1CCCO1)C(=O)c1ccc(C[NH+](C)C)cc1	ZINC000083851187	178754258	/nfs/dbraw/zinc/75/42/58/178754258.db2.gz	XEWFZTBKKVRNMX-OAHLLOKOSA-N	1	0	276.380	1.999	50	0		CDAARO
Cc1nccn1C[C@@H]1CCC[N@H+]1CCN1CCO[C@H](C)C1	ZINC000192753357	362698578	/nfs/dbraw/zinc/69/85/78/362698578.db2.gz	DIEPXTVZOYWYCS-ZBFHGGJFSA-N	1	0	292.427	1.377	50	0		CDAARO
CC[N@@H+]1CC[C@@H](CNC(=O)CCCn2ccnc2)C1	ZINC000105320711	346621815	/nfs/dbraw/zinc/62/18/15/346621815.db2.gz	QYWFNFNDUWGLCR-ZDUSSCGKSA-N	1	0	264.373	1.121	50	0		CDAARO
CC(C)[C@H](O)C(=O)N(C)CC[N@H+](C)C1CCCC1	ZINC000584889134	349348004	/nfs/dbraw/zinc/34/80/04/349348004.db2.gz	SRPARWBTVABWST-ZDUSSCGKSA-N	1	0	256.390	1.336	50	0		CDAARO
Nc1nc(C[NH2+][C@H]2CCC(=O)N(CC3CC3)CC2)cs1	ZINC000584892485	349351899	/nfs/dbraw/zinc/35/18/99/349351899.db2.gz	SOMJOWHQYGJKON-NSHDSACASA-N	1	0	294.424	1.436	50	0		CDAARO
COCC1(N(C)C(=O)[C@@H]2CC23CC[NH2+]CC3)CC1	ZINC000584894593	349354143	/nfs/dbraw/zinc/35/41/43/349354143.db2.gz	OPWVBXDZCDOXSG-NSHDSACASA-N	1	0	252.358	1.014	50	0		CDAARO
O=C(NCC1([NH+]2CCCC2)CCCCC1)C1(CO)CC1	ZINC000584900317	349362171	/nfs/dbraw/zinc/36/21/71/349362171.db2.gz	ATGDUOCBXHLZGK-UHFFFAOYSA-N	1	0	280.412	1.674	50	0		CDAARO
Cc1noc(C2CCN(C(=O)[C@H]3CCC[N@@H+](C)C3)CC2)n1	ZINC000090608695	180012348	/nfs/dbraw/zinc/01/23/48/180012348.db2.gz	CXVWWVPKVMNMQR-ZDUSSCGKSA-N	1	0	292.383	1.426	50	0		CDAARO
CNC(=O)c1ccc(C[N@@H+]2C[C@@H](C)[C@](O)(C(C)C)C2)cc1	ZINC000091486342	180167154	/nfs/dbraw/zinc/16/71/54/180167154.db2.gz	RGDQYVJPRMDZLD-CXAGYDPISA-N	1	0	290.407	1.885	50	0		CDAARO
CCCn1cnnc1CNc1nc(N)[nH+]c(CC)c1C	ZINC000091380816	180143743	/nfs/dbraw/zinc/14/37/43/180143743.db2.gz	GYPGSQWWZNRNFF-UHFFFAOYSA-N	1	0	275.360	1.543	50	0		CDAARO
COCCn1cncc1CN1C[C@H]([NH+](C)C)[C@@H](C2CC2)C1	ZINC000091643647	180214001	/nfs/dbraw/zinc/21/40/01/180214001.db2.gz	RPFBGTZFYPRNJA-CVEARBPZSA-N	1	0	292.427	1.302	50	0		CDAARO
CCOc1ccc(C[N@@H+]2CC[C@@]3(C2)CCCNC3=O)cn1	ZINC000091691679	180227585	/nfs/dbraw/zinc/22/75/85/180227585.db2.gz	NTIDJOCOINYFCV-MRXNPFEDSA-N	1	0	289.379	1.582	50	0		CDAARO
CN1CCO[C@H](C[NH2+]Cc2ccc(F)cc2F)C1	ZINC000105472150	186058857	/nfs/dbraw/zinc/05/88/57/186058857.db2.gz	JSUKQWSLGLHRGC-GFCCVEGCSA-N	1	0	256.296	1.385	50	0		CDAARO
CC[C@H]1CN(C(=O)[C@H]([NH3+])Cc2ccccc2)CCO1	ZINC000036770027	362966657	/nfs/dbraw/zinc/96/66/57/362966657.db2.gz	OCPOSFUIUZNKOX-UONOGXRCSA-N	1	0	262.353	1.194	50	0		CDAARO
CCCC[N@@H+]1CCC[C@@H](c2n[nH]cc2NC(=O)COC)C1	ZINC000096000125	351469291	/nfs/dbraw/zinc/46/92/91/351469291.db2.gz	PARCIKZHXUAADL-GFCCVEGCSA-N	1	0	294.399	1.974	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CN(C(=O)c2ccccc2Cl)CCO1	ZINC000122884400	187057929	/nfs/dbraw/zinc/05/79/29/187057929.db2.gz	XUAAUNTWTLFWLS-SKDRFNHKSA-N	1	0	268.744	1.528	50	0		CDAARO
[NH3+]CCN1C(=O)S/C(=C\c2ccccc2F)C1=O	ZINC000003266704	355996909	/nfs/dbraw/zinc/99/69/09/355996909.db2.gz	XCGPTKJEUUNMGG-YFHOEESVSA-N	1	0	266.297	1.821	50	0		CDAARO
C[NH+](C)CC(=O)NC[C@](C)(O)c1ccccc1Cl	ZINC000097379050	356106946	/nfs/dbraw/zinc/10/69/46/356106946.db2.gz	QAUMAQWREVDGSU-ZDUSSCGKSA-N	1	0	270.760	1.225	50	0		CDAARO
CCc1ncc(C(=O)N2CC[C@@H](C[NH2+]C)C2)s1	ZINC000299740002	356285727	/nfs/dbraw/zinc/28/57/27/356285727.db2.gz	UOZJPTXZCWJJQV-VIFPVBQESA-N	1	0	253.371	1.387	50	0		CDAARO
Cc1noc(C)c1CC(=O)NCc1cccnc1N(C)C	ZINC000032688044	356334471	/nfs/dbraw/zinc/33/44/71/356334471.db2.gz	WNCMDBMHXKKCIO-UHFFFAOYSA-N	1	0	288.351	1.611	50	0		CDAARO
CN(C)c1ccc(C(=O)NCC[C@H]2CCCC[N@@H+]2C)cn1	ZINC000015074160	356405498	/nfs/dbraw/zinc/40/54/98/356405498.db2.gz	RIGQQFGZANSPRS-CQSZACIVSA-N	1	0	290.411	1.752	50	0		CDAARO
NNc1[nH+]cnc2c1cnn2-c1ccc(Cl)cc1	ZINC000016776713	356446836	/nfs/dbraw/zinc/44/68/36/356446836.db2.gz	IMYWBYQUIQVNJS-UHFFFAOYSA-N	1	0	260.688	1.755	50	0		CDAARO
COc1ccc(C[NH2+]CCN2CCOCC2)cc1OC	ZINC000019367845	356482931	/nfs/dbraw/zinc/48/29/31/356482931.db2.gz	IIPRZVUZDRUWGY-UHFFFAOYSA-N	1	0	280.368	1.126	50	0		CDAARO
C[C@@H]1CN(C(=O)C[C@H]([NH3+])c2ccccc2)C[C@H](C)O1	ZINC000019426040	356484966	/nfs/dbraw/zinc/48/49/66/356484966.db2.gz	CMVFCAPGNXSBNG-SCRDCRAPSA-N	1	0	262.353	1.712	50	0		CDAARO
CSc1ccc(CN2CC[NH+](CCO)CC2)cc1	ZINC000019606609	356493575	/nfs/dbraw/zinc/49/35/75/356493575.db2.gz	FWSYUYNLKFVYQY-UHFFFAOYSA-N	1	0	266.410	1.518	50	0		CDAARO
CCS(=O)(=O)N1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1	ZINC000019850712	356509557	/nfs/dbraw/zinc/50/95/57/356509557.db2.gz	DSKJNSAMSJTGHR-QWHCGFSZSA-N	1	0	274.430	1.532	50	0		CDAARO
CCCNc1nc(SC)nc2c1cnn2CC[NH3+]	ZINC000026421731	356692561	/nfs/dbraw/zinc/69/25/61/356692561.db2.gz	QTMWPSHKXNBTQL-UHFFFAOYSA-N	1	0	266.374	1.329	50	0		CDAARO
C[NH2+]CC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000000209320	356812528	/nfs/dbraw/zinc/81/25/28/356812528.db2.gz	BCYLMWGLBAKEBZ-SNVBAGLBSA-N	1	0	278.352	1.369	50	0		CDAARO
CN(CC1CCOCC1)C(=O)[C@@H]([NH3+])Cc1ccccc1	ZINC000042783709	357080372	/nfs/dbraw/zinc/08/03/72/357080372.db2.gz	ZNYJZDOGZXANPS-HNNXBMFYSA-N	1	0	276.380	1.441	50	0		CDAARO
COC(=O)c1cc(N)ccc1N1CC[NH2+]C[C@H]1C(C)C	ZINC000052507978	357274457	/nfs/dbraw/zinc/27/44/57/357274457.db2.gz	VTZFLRMASHDESD-AWEZNQCLSA-N	1	0	277.368	1.490	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1cc(F)c(F)cc1F	ZINC000095432153	357516417	/nfs/dbraw/zinc/51/64/17/357516417.db2.gz	KHYWGRNRJXBATI-ZETCQYMHSA-N	1	0	296.314	1.510	50	0		CDAARO
CCN(Cc1nccn1C)C[C@@H]1CC[N@H+](CC)C1	ZINC000065404653	357538276	/nfs/dbraw/zinc/53/82/76/357538276.db2.gz	MSNKTVJDMNCVSZ-CYBMUJFWSA-N	1	0	250.390	1.584	50	0		CDAARO
CCN(Cc1nccn1C)C[C@H]1CC[N@H+](CC)C1	ZINC000065404652	357538297	/nfs/dbraw/zinc/53/82/97/357538297.db2.gz	MSNKTVJDMNCVSZ-ZDUSSCGKSA-N	1	0	250.390	1.584	50	0		CDAARO
CC(C)[N@@H+]1CCN(Cc2ccccc2OCCO)C[C@H]1C	ZINC000065491518	357544638	/nfs/dbraw/zinc/54/46/38/357544638.db2.gz	CQPLKXRYQXGYLM-OAHLLOKOSA-N	1	0	292.423	1.972	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC000065516472	357547221	/nfs/dbraw/zinc/54/72/21/357547221.db2.gz	WRRCTWBSFUZXTC-CQSZACIVSA-N	1	0	264.344	1.921	50	0		CDAARO
Cc1nc([C@@H]([NH3+])Cc2c[nH]cn2)n(-c2ccc(F)cc2)n1	ZINC000067472835	357610890	/nfs/dbraw/zinc/61/08/90/357610890.db2.gz	PKCPGPAXKYRFPD-ZDUSSCGKSA-N	1	0	286.314	1.680	50	0		CDAARO
CCc1[nH]nc(C(=O)NCC[C@H]2CCC[N@H+](C)C2)c1C	ZINC000067821596	357630532	/nfs/dbraw/zinc/63/05/32/357630532.db2.gz	BZYKQMIIMPLXRC-GFCCVEGCSA-N	1	0	278.400	1.742	50	0		CDAARO
COc1ccc(CC(=O)N2CC[NH2+][C@H](C)C2)cc1F	ZINC000188449663	357687171	/nfs/dbraw/zinc/68/71/71/357687171.db2.gz	YUFKVYVSMPBYHZ-SNVBAGLBSA-N	1	0	266.316	1.197	50	0		CDAARO
CCn1c2ccc(NC(=O)[C@H]3CC[C@@H]([NH3+])C3)cc2oc1=O	ZINC000072473753	357838233	/nfs/dbraw/zinc/83/82/33/357838233.db2.gz	RKAYLAMORNZCKA-VHSXEESVSA-N	1	0	289.335	1.680	50	0		CDAARO
CCCCOC[C@H](O)C[NH+]1CCN(c2ccccc2)CC1	ZINC000023118546	358044557	/nfs/dbraw/zinc/04/45/57/358044557.db2.gz	RDSWFKWPVIMBSW-QGZVFWFLSA-N	1	0	292.423	1.986	50	0		CDAARO
CC(=O)N1CCC(C[NH2+][C@@H](C)CCn2cccn2)CC1	ZINC000097234814	358050475	/nfs/dbraw/zinc/05/04/75/358050475.db2.gz	LZBJMIWEPJAEMP-ZDUSSCGKSA-N	1	0	278.400	1.510	50	0		CDAARO
C[NH2+]Cc1cn(-c2cccc(Br)c2)nn1	ZINC000081401675	358123322	/nfs/dbraw/zinc/12/33/22/358123322.db2.gz	YFTYMDVDQBRURR-UHFFFAOYSA-N	1	0	267.130	1.749	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COCc2ccccc2)CC1	ZINC000019790727	358142414	/nfs/dbraw/zinc/14/24/14/358142414.db2.gz	JLCAHOLJNZHZOZ-MRXNPFEDSA-N	1	0	278.396	1.202	50	0		CDAARO
C[C@@H]1CN([C@H]2CCN(CC(F)(F)F)C2=O)CCS1	ZINC000247401167	358193033	/nfs/dbraw/zinc/19/30/33/358193033.db2.gz	BGRXJMQXZJVTPJ-BDAKNGLRSA-N	1	0	282.331	1.587	50	0		CDAARO
CC(C)(F)C(=O)NCc1ccccc1C[N@@H+]1CC[C@@H](O)C1	ZINC000195557801	358564675	/nfs/dbraw/zinc/56/46/75/358564675.db2.gz	PZGLHQWOQDBHFU-CQSZACIVSA-N	1	0	294.370	1.618	50	0		CDAARO
C[C@H](C[C@@H]1CCCO1)NC(=O)N1CC[C@@H](C[NH+](C)C)C1	ZINC000195570396	358566484	/nfs/dbraw/zinc/56/64/84/358566484.db2.gz	MDMCCWVAJOFMJF-RDBSUJKOSA-N	1	0	283.416	1.537	50	0		CDAARO
Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2Cn2ccnc2)n1	ZINC000195573487	358566944	/nfs/dbraw/zinc/56/69/44/358566944.db2.gz	QRZKSAWDQYQKOK-CYBMUJFWSA-N	1	0	272.352	1.957	50	0		CDAARO
C[C@@H](C[N@@H+]1C[C@@H](C)O[C@H](C(N)=O)C1)c1ccc(F)cc1	ZINC000195573078	358567077	/nfs/dbraw/zinc/56/70/77/358567077.db2.gz	ONYSJKIEDCRUAN-WDMOLILDSA-N	1	0	280.343	1.504	50	0		CDAARO
Cc1ccc(C[N@@H+]2C[C@@H](O)C[C@H]2CO)cc1Cl	ZINC000194722203	358533920	/nfs/dbraw/zinc/53/39/20/358533920.db2.gz	VGGNZICVHOREFP-RYUDHWBXSA-N	1	0	255.745	1.576	50	0		CDAARO
Cc1ccc2[nH]c(C[NH2+]C[C@@H]3C[C@H](F)CN3)cc(=O)c2c1	ZINC000095371197	358687568	/nfs/dbraw/zinc/68/75/68/358687568.db2.gz	NCOGKGKIWRWEOL-RYUDHWBXSA-N	1	0	289.354	1.626	50	0		CDAARO
COc1ccc(/C=C/C[N@@H+]2CC[C@](C)(O)[C@@H](O)C2)cc1	ZINC000096151941	358709098	/nfs/dbraw/zinc/70/90/98/358709098.db2.gz	FAPMWBPBXMGVAV-PIGHNIFASA-N	1	0	277.364	1.526	50	0		CDAARO
[NH3+]C[C@@H]1CN(Cc2c(Cl)cncc2Cl)CCO1	ZINC000097594933	358786749	/nfs/dbraw/zinc/78/67/49/358786749.db2.gz	URQLRGXPHIFXMJ-MRVPVSSYSA-N	1	0	276.167	1.548	50	0		CDAARO
Cc1ncc(C[N@H+](C)C[C@@H]2CC(=O)N(C3CCCC3)C2)[nH]1	ZINC000097610066	358787413	/nfs/dbraw/zinc/78/74/13/358787413.db2.gz	IZPFAOLZAXVHMK-ZDUSSCGKSA-N	1	0	290.411	1.941	50	0		CDAARO
O=C(NCCc1c[nH]cn1)C1CC[NH+](C2CCCC2)CC1	ZINC000097696159	358793518	/nfs/dbraw/zinc/79/35/18/358793518.db2.gz	NSTMASJMNSEVGX-UHFFFAOYSA-N	1	0	290.411	1.723	50	0		CDAARO
C[N@H+](CCc1nc2cc(Cl)ccc2[nH]1)C[C@H](O)CO	ZINC000097759448	358797341	/nfs/dbraw/zinc/79/73/41/358797341.db2.gz	KDBAIJZUJHGMOP-JTQLQIEISA-N	1	0	283.759	1.044	50	0		CDAARO
OC[C@]1(O)CCC[N@H+](Cc2cccc3cc[nH]c32)CC1	ZINC000214966193	358866318	/nfs/dbraw/zinc/86/63/18/358866318.db2.gz	NZWCSFZMUGVOND-INIZCTEOSA-N	1	0	274.364	1.877	50	0		CDAARO
CN(Cc1nccs1)C(=O)C[N@H+](C)C1CCCC1	ZINC000219323389	359088325	/nfs/dbraw/zinc/08/83/25/359088325.db2.gz	SNIPWMSCADEWPS-UHFFFAOYSA-N	1	0	267.398	1.976	50	0		CDAARO
CN(Cc1cc2ccccc2n(C)c1=O)[C@@H]1CC[N@H+](C)C1	ZINC000219851634	359133424	/nfs/dbraw/zinc/13/34/24/359133424.db2.gz	NUDHSDPGOYZOIO-OAHLLOKOSA-N	1	0	285.391	1.674	50	0		CDAARO
CN(C)C(=O)[C@@H]1C[N@H+](Cc2cccc(F)c2F)C[C@H]1CO	ZINC000257177760	359134493	/nfs/dbraw/zinc/13/44/93/359134493.db2.gz	BIADKIMGUSDISL-NWDGAFQWSA-N	1	0	298.333	1.093	50	0		CDAARO
CC(C)C[N@H+](C)[C@@H]1CCc2nn(CC3CC3)c(=O)n2CC1	ZINC000257178279	359141017	/nfs/dbraw/zinc/14/10/17/359141017.db2.gz	ZUVXPPPGEUPDBO-CQSZACIVSA-N	1	0	292.427	1.748	50	0		CDAARO
[NH3+]CC(=O)N1CCc2[nH]nc(-c3ccccc3F)c2C1	ZINC000067723835	283419836	/nfs/dbraw/zinc/41/98/36/283419836.db2.gz	GDKKKACUYOTMGJ-UHFFFAOYSA-N	1	0	274.299	1.059	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2ccoc2)CC1	ZINC000089414473	359284001	/nfs/dbraw/zinc/28/40/01/359284001.db2.gz	HGSYBIJDLLTXOR-UHFFFAOYSA-N	1	0	266.341	1.368	50	0		CDAARO
CCCC[C@H]([NH3+])C(=O)NCc1ccccc1-n1cncn1	ZINC000222543362	359353144	/nfs/dbraw/zinc/35/31/44/359353144.db2.gz	MDQZVBZQKDKIQG-ZDUSSCGKSA-N	1	0	287.367	1.401	50	0		CDAARO
Cc1csc(CCNC(=O)CC[N@@H+]2C[C@@H]3CC[C@H]2C3)n1	ZINC000223020445	359393876	/nfs/dbraw/zinc/39/38/76/359393876.db2.gz	SPJLWJHCBISUOK-OLZOCXBDSA-N	1	0	293.436	1.985	50	0		CDAARO
CC[N@H+](C1CN(C(=O)c2ccoc2)C1)C1CCOCC1	ZINC000257183676	359492020	/nfs/dbraw/zinc/49/20/20/359492020.db2.gz	SDBINSBVLPFXPL-UHFFFAOYSA-N	1	0	278.352	1.605	50	0		CDAARO
CCCC[C@H](C)C(=O)N1CC(C[NH+]2CCN(C)CC2)C1	ZINC000408517297	359901565	/nfs/dbraw/zinc/90/15/65/359901565.db2.gz	FZLCOBSZSRBDNE-AWEZNQCLSA-N	1	0	281.444	1.519	50	0		CDAARO
Cc1noc(C)c1[C@H](C)C(=O)N1CC[C@H]([NH3+])C[C@H]1C	ZINC000408519167	359911876	/nfs/dbraw/zinc/91/18/76/359911876.db2.gz	LHKGICDVGRIUMC-PTRXPTGYSA-N	1	0	265.357	1.733	50	0		CDAARO
CC(=O)NCCc1ccc(CC2CC[NH2+]CC2)cc1	ZINC000409419575	360227280	/nfs/dbraw/zinc/22/72/80/360227280.db2.gz	OEWXVHXSLVGWPH-UHFFFAOYSA-N	1	0	260.381	1.907	50	0		CDAARO
[NH3+]C[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2)CCO1	ZINC000011887426	360400615	/nfs/dbraw/zinc/40/06/15/360400615.db2.gz	VLOPLTFWADMLSQ-LLVKDONJSA-N	1	0	288.269	1.505	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1C(=O)N1CCCC[C@H]1Cn1cccn1	ZINC000248165668	360427648	/nfs/dbraw/zinc/42/76/48/360427648.db2.gz	ZOZQWRVBAGWUQO-UONOGXRCSA-N	1	0	276.384	1.358	50	0		CDAARO
Cc1nc([C@@H]2CCOC2)cc(N2CCC(C[NH3+])CC2)n1	ZINC000426492727	360573918	/nfs/dbraw/zinc/57/39/18/360573918.db2.gz	AUBCELDWWRVJHR-CYBMUJFWSA-N	1	0	276.384	1.464	50	0		CDAARO
O=C(Cn1nccc1[C@H]1CCC[NH2+]C1)N1CCCCCC1	ZINC000426396332	360663284	/nfs/dbraw/zinc/66/32/84/360663284.db2.gz	BLRKUAINFIGIIF-AWEZNQCLSA-N	1	0	290.411	1.753	50	0		CDAARO
O=C(NC[C@@H]1C[C@H](F)C[NH2+]1)c1ccc2c(c1)CCCO2	ZINC000426442518	360670510	/nfs/dbraw/zinc/67/05/10/360670510.db2.gz	KAZVOPJMBCPYMM-STQMWFEESA-N	1	0	278.327	1.441	50	0		CDAARO
C[NH2+]Cc1nnc(SC[C@@H](O)c2ccccc2)n1C	ZINC000426711960	360698496	/nfs/dbraw/zinc/69/84/96/360698496.db2.gz	BPNGVNCBADWIGL-LLVKDONJSA-N	1	0	278.381	1.360	50	0		CDAARO
CC(C)COC(=O)N1CCC([NH2+][C@@H]2C=C[C@H](CO)C2)CC1	ZINC000129743073	360877769	/nfs/dbraw/zinc/87/77/69/360877769.db2.gz	CSWNRBWVGKHXFA-DZGCQCFKSA-N	1	0	296.411	1.770	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(NCCc2cnccn2)c1C	ZINC000032516037	360969779	/nfs/dbraw/zinc/96/97/79/360969779.db2.gz	GOTDBNRZKVUROL-UHFFFAOYSA-N	1	0	272.356	1.604	50	0		CDAARO
O[C@@H](C[NH+]1CCCCC1)c1ccc2c(c1)OCCO2	ZINC000001456005	361187136	/nfs/dbraw/zinc/18/71/36/361187136.db2.gz	IBZCOXOCBPZAIR-ZDUSSCGKSA-N	1	0	263.337	1.977	50	0		CDAARO
CC[C@@H]1COCCN1C(=O)C[C@H]([NH3+])c1ccccc1	ZINC000036326647	361653898	/nfs/dbraw/zinc/65/38/98/361653898.db2.gz	JVASEWDVOCOGIL-KGLIPLIRSA-N	1	0	262.353	1.714	50	0		CDAARO
NC(=O)CC[N@@H+]1CCCN(Cc2ccccc2)CC1	ZINC000025304119	364771105	/nfs/dbraw/zinc/77/11/05/364771105.db2.gz	OMVNULHXGDMNHX-UHFFFAOYSA-N	1	0	261.369	1.070	50	0		CDAARO
Cc1c(CNC(=O)[C@H](C)[NH+]2[C@@H](C)CC[C@@H]2C)cnn1C	ZINC000089882976	366951421	/nfs/dbraw/zinc/95/14/21/366951421.db2.gz	IPKCOFQOZAPJSF-GVXVVHGQSA-N	1	0	278.400	1.606	50	0		CDAARO
CC[N@@H+]1CCCN(c2ncccc2-c2nc(C)no2)CC1	ZINC000089977269	366993165	/nfs/dbraw/zinc/99/31/65/366993165.db2.gz	ISICBNJXULRDBR-UHFFFAOYSA-N	1	0	287.367	1.972	50	0		CDAARO
C[N@H+](CCCO)C1CCN(c2ccc(F)cn2)CC1	ZINC000252505993	367652420	/nfs/dbraw/zinc/65/24/20/367652420.db2.gz	VVEWQQVQEQKGNM-UHFFFAOYSA-N	1	0	267.348	1.504	50	0		CDAARO
O=C(N[C@H]1CC[N@H+](Cc2ccccc2)C1)N1CC=CC1	ZINC000630093338	367734161	/nfs/dbraw/zinc/73/41/61/367734161.db2.gz	KBMFOBAEDYKBMH-HNNXBMFYSA-N	1	0	271.364	1.842	50	0		CDAARO
Cc1c[nH+]c(C)n1CCNC(=O)c1nn(C)c2ccccc21	ZINC000575555004	369130863	/nfs/dbraw/zinc/13/08/63/369130863.db2.gz	JGXUJIRIXPJALJ-UHFFFAOYSA-N	1	0	297.362	1.817	50	0		CDAARO
Cn1cncc1C(=O)NC1CC[NH+](C2CCCC2)CC1	ZINC000289608473	369589667	/nfs/dbraw/zinc/58/96/67/369589667.db2.gz	LCSIUBKVUWKBEG-UHFFFAOYSA-N	1	0	276.384	1.557	50	0		CDAARO
CC(C)COC(=O)N1CCC([NH2+][C@H]2CCC[C@H]2CO)CC1	ZINC000089157194	370139879	/nfs/dbraw/zinc/13/98/79/370139879.db2.gz	ZTKUNKSAVDGOEC-ZFWWWQNUSA-N	1	0	298.427	1.994	50	0		CDAARO
CCCOc1cncc(NC(=O)[C@H]([NH3+])C2CCOCC2)c1	ZINC000638583979	371306153	/nfs/dbraw/zinc/30/61/53/371306153.db2.gz	PNXWTGQVFVMAIA-CQSZACIVSA-N	1	0	293.367	1.563	50	0		CDAARO
CS[C@@H]1C[N@H+](CCc2ccncc2C)C[C@@H]1N(C)C	ZINC000573840015	371677969	/nfs/dbraw/zinc/67/79/69/371677969.db2.gz	KKXQVLSEONDSJO-LSDHHAIUSA-N	1	0	279.453	1.910	50	0		CDAARO
Cc1nnc(CN2CCC3(CCC(=O)N(C)C3)CC2)s1	ZINC000299799961	372771046	/nfs/dbraw/zinc/77/10/46/372771046.db2.gz	YALOSDPSNLKDST-UHFFFAOYSA-N	1	0	294.424	1.681	50	0		CDAARO
CC[N@H+](C)C[C@H](C)CNC(=O)CCC(=O)NC1CCCC1	ZINC000055227551	284348868	/nfs/dbraw/zinc/34/88/68/284348868.db2.gz	RSYDKMLLUTZAHP-CYBMUJFWSA-N	1	0	297.443	1.529	50	0		CDAARO
CCc1nnc(CNc2cc([C@H]3C[C@@H]([NH3+])C3)ncn2)s1	ZINC000244899586	189915333	/nfs/dbraw/zinc/91/53/33/189915333.db2.gz	ZMIMIFKHRMRLOC-DTORHVGOSA-N	1	0	290.396	1.707	50	0		CDAARO
Cc1cccc(NC(=O)NCCC[NH+]2CCCC2)n1	ZINC000360890765	374028069	/nfs/dbraw/zinc/02/80/69/374028069.db2.gz	ZYUFWNTUHYZCPI-UHFFFAOYSA-N	1	0	262.357	1.997	50	0		CDAARO
CS[C@@H]1CC[C@@H]([N@H+](C)CCS(C)(=O)=O)C1	ZINC000110641741	374174788	/nfs/dbraw/zinc/17/47/88/374174788.db2.gz	BGHRXVUIZYPYNM-NXEZZACHSA-N	1	0	251.417	1.247	50	0		CDAARO
Cc1nc(SCCNc2nc(N)[nH+]c(C)c2C)n[nH]1	ZINC000095383783	374897163	/nfs/dbraw/zinc/89/71/63/374897163.db2.gz	XYTKGTSLNRAXII-UHFFFAOYSA-N	1	0	279.373	1.306	50	0		CDAARO
C[C@@H]1C[C@H]([NH2+]CCCNC(=O)OC(C)(C)C)CN1C	ZINC000095421832	374923967	/nfs/dbraw/zinc/92/39/67/374923967.db2.gz	XUILBISTRDRGNR-NEPJUHHUSA-N	1	0	271.405	1.583	50	0		CDAARO
COc1cccc(-c2ncnc(N3CC[NH+](C)CC3)c2N)c1	ZINC000096282116	375073815	/nfs/dbraw/zinc/07/38/15/375073815.db2.gz	KCSUYEPEMPUAKH-UHFFFAOYSA-N	1	0	299.378	1.486	50	0		CDAARO
Brc1cnc2[nH]c3c(c2c1)C[NH2+]CC3	ZINC000218068002	375784992	/nfs/dbraw/zinc/78/49/92/375784992.db2.gz	QACOFSNXCIYUCW-UHFFFAOYSA-N	1	0	252.115	1.971	50	0		CDAARO
COc1ccc(C)cc1/C=C\C(=O)N1CCC[C@H]([NH3+])C1	ZINC000606441868	375823291	/nfs/dbraw/zinc/82/32/91/375823291.db2.gz	PQYSSNYESPZRID-QPBFKRLHSA-N	1	0	274.364	1.967	50	0		CDAARO
CCOc1ccccc1/C=C\C(=O)N1CC[C@H](C[NH3+])C1	ZINC000606441563	375823453	/nfs/dbraw/zinc/82/34/53/375823453.db2.gz	OTDOUANNIWPCGD-MEJMFZKBSA-N	1	0	274.364	1.906	50	0		CDAARO
COCC1(CNC(=O)[C@@H](C)C[NH+]2CCOCC2)CCCC1	ZINC000456864090	375829336	/nfs/dbraw/zinc/82/93/36/375829336.db2.gz	ZMWPVWJZWPEEKB-AWEZNQCLSA-N	1	0	298.427	1.278	50	0		CDAARO
CC1(C)NC(=O)N(CC[N@@H+]2CC[C@@H]3CCCC[C@H]3C2)C1=O	ZINC000241795469	376018527	/nfs/dbraw/zinc/01/85/27/376018527.db2.gz	RZLCTGGONMSZQL-STQMWFEESA-N	1	0	293.411	1.829	50	0		CDAARO
COCC[NH2+]CC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000003896865	285075447	/nfs/dbraw/zinc/07/54/47/285075447.db2.gz	PDKPMVYIKZKRQF-UHFFFAOYSA-N	1	0	266.385	1.307	50	0		CDAARO
COc1ccnc(C(=O)N2C[C@H]3CC[C@@H](C2)[C@H]3[NH+](C)C)c1	ZINC000223893031	533041279	/nfs/dbraw/zinc/04/12/79/533041279.db2.gz	SRNNUUWJGSNDJJ-JYAVWHMHSA-N	1	0	289.379	1.502	50	0		CDAARO
COc1ccc(C(=O)N2CC=C(C)CC2)c(OCC[NH3+])c1	ZINC000426535501	256859736	/nfs/dbraw/zinc/85/97/36/256859736.db2.gz	MZEIODVZNKLGMP-UHFFFAOYSA-N	1	0	290.363	1.825	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC000094345304	184785994	/nfs/dbraw/zinc/78/59/94/184785994.db2.gz	LKMPYOYICALTEG-CPCISQLKSA-N	1	0	272.270	1.832	50	0		CDAARO
[NH3+][C@@H]1CCN(c2nccn3nc(-c4ccccc4)cc23)C1	ZINC000070458575	390606692	/nfs/dbraw/zinc/60/66/92/390606692.db2.gz	FNVPVFCDGNSYPZ-CYBMUJFWSA-N	1	0	279.347	1.934	50	0		CDAARO
COc1ccc(C(=O)N2CC[NH+]3CCC2CC3)c(OC)c1	ZINC000019884533	391106685	/nfs/dbraw/zinc/10/66/85/391106685.db2.gz	IJQWTGLXTODXEQ-UHFFFAOYSA-N	1	0	290.363	1.624	50	0		CDAARO
O=S(=O)(Cc1ccccc1Cl)NC[C@@H]1CCC[NH2+]1	ZINC000440358035	391365042	/nfs/dbraw/zinc/36/50/42/391365042.db2.gz	SGZBOBHCUUJEKZ-NSHDSACASA-N	1	0	288.800	1.511	50	0		CDAARO
Cn1cc(C[NH2+]CC(C)(C)NC(=O)OC(C)(C)C)cn1	ZINC000083475173	391482314	/nfs/dbraw/zinc/48/23/14/391482314.db2.gz	AQGAYTPPKLGMJB-UHFFFAOYSA-N	1	0	282.388	1.813	50	0		CDAARO
COCCN(Cc1ccnn1C)Cc1cccnc1	ZINC000191117996	130185553	/nfs/dbraw/zinc/18/55/53/130185553.db2.gz	CCETWRDALJJIGO-UHFFFAOYSA-N	1	0	260.341	1.464	50	0		CDAARO
C[C@H]([NH2+][C@H](CO)[C@H]1CCCOC1)[C@@H]1C[C@H]1C1CC1	ZINC000527722886	391943455	/nfs/dbraw/zinc/94/34/55/391943455.db2.gz	ZHUPBHJAEIEGIH-MFGQWXODSA-N	1	0	253.386	1.798	50	0		CDAARO
Cc1cncc(NC(=O)C2([NH3+])Cc3ccccc3C2)c1	ZINC000649332040	392049382	/nfs/dbraw/zinc/04/93/82/392049382.db2.gz	SNEHQTNZYGMJMX-UHFFFAOYSA-N	1	0	267.332	1.825	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)c2cncn2-c2ccccc2)C1	ZINC000269103626	132112317	/nfs/dbraw/zinc/11/23/17/132112317.db2.gz	AZCKCDUDHZRIFR-LBPRGKRZSA-N	1	0	270.336	1.436	50	0		CDAARO
C[N@@H+](CC(=O)NCCc1ccc(F)cc1)C[C@H]1CCOC1	ZINC000494551439	393025208	/nfs/dbraw/zinc/02/52/08/393025208.db2.gz	ZBOTZNXEXJTCND-CQSZACIVSA-N	1	0	294.370	1.453	50	0		CDAARO
CC(C)[N@H+](C)CCNC(=O)N1C[C@H](C)S[C@@H](C)C1	ZINC000096439885	393186382	/nfs/dbraw/zinc/18/63/82/393186382.db2.gz	OFPZJJYOJOKUEN-RYUDHWBXSA-N	1	0	273.446	1.862	50	0		CDAARO
COc1ccc(F)cc1C(=O)N1CCC(C[NH3+])CC1	ZINC000095971491	147113524	/nfs/dbraw/zinc/11/35/24/147113524.db2.gz	ZPABNACHOMZHKE-UHFFFAOYSA-N	1	0	266.316	1.645	50	0		CDAARO
C[N@@H+]1CCC[C@H]1C(=O)NCCCOC1CCCC1	ZINC000354290523	156369809	/nfs/dbraw/zinc/36/98/09/156369809.db2.gz	AVKUFCBDZMYKLP-ZDUSSCGKSA-N	1	0	254.374	1.546	50	0		CDAARO
C[C@@H]([NH3+])C(=O)N(Cc1cccs1)C[C@H]1CCCO1	ZINC000037801387	286905365	/nfs/dbraw/zinc/90/53/65/286905365.db2.gz	HLFAVMHTEDFRFB-GHMZBOCLSA-N	1	0	268.382	1.603	50	0		CDAARO
C[C@@H](O)C(=O)NC[C@@H](c1ccccc1)[NH+]1CCC(C)CC1	ZINC000095979913	287076316	/nfs/dbraw/zinc/07/63/16/287076316.db2.gz	SPSOQIWAMGXYOV-ZBFHGGJFSA-N	1	0	290.407	1.957	50	0		CDAARO
O=C1C[C@@H]([NH2+]CCc2ccccn2)C(=O)N1c1ccccc1	ZINC000004954084	170045217	/nfs/dbraw/zinc/04/52/17/170045217.db2.gz	MYQZIFFKLZYGNB-OAHLLOKOSA-N	1	0	295.342	1.546	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@H](O)C2)c(OC)c1OC	ZINC000004990288	170050605	/nfs/dbraw/zinc/05/06/05/170050605.db2.gz	JVARUSOZNFPFEX-LBPRGKRZSA-N	1	0	281.352	1.669	50	0		CDAARO
CC(C)(C)[NH2+]C[C@@H](O)Cn1cc(CO)c2ccccc21	ZINC000005521114	170107808	/nfs/dbraw/zinc/10/78/08/170107808.db2.gz	SAELQCWWYUKSFI-CYBMUJFWSA-N	1	0	276.380	1.883	50	0		CDAARO
CCOC(=O)c1[nH]c(C)c(C(=O)NCC[NH+](C)C)c1C	ZINC000006805007	170245403	/nfs/dbraw/zinc/24/54/03/170245403.db2.gz	KUSIFNWESKZQKJ-UHFFFAOYSA-N	1	0	281.356	1.100	50	0		CDAARO
COc1ccc(S(=O)(=O)[C@@H](C[NH3+])c2cccnc2)cc1	ZINC000008031098	170315307	/nfs/dbraw/zinc/31/53/07/170315307.db2.gz	KDESKLSRXACSPO-AWEZNQCLSA-N	1	0	292.360	1.564	50	0		CDAARO
CC[NH+](CC)CC(=O)Nc1ccc(C(=O)N(C)C)cc1	ZINC000009498384	170379324	/nfs/dbraw/zinc/37/93/24/170379324.db2.gz	ZHAAMJUDTNURHI-UHFFFAOYSA-N	1	0	277.368	1.669	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNc1ncnc2c1cnn2C	ZINC000014212172	170625499	/nfs/dbraw/zinc/62/54/99/170625499.db2.gz	BMWFMIQNUOPKJA-SNVBAGLBSA-N	1	0	260.345	1.260	50	0		CDAARO
Brc1cccc(CN2CC[NH2+]CC2)c1	ZINC000019737219	170850299	/nfs/dbraw/zinc/85/02/99/170850299.db2.gz	TUKZQYYLUARXKM-UHFFFAOYSA-N	1	0	255.159	1.854	50	0		CDAARO
CC[NH+]1CCN(CCOCCOc2ccc(F)cc2)CC1	ZINC000020406272	171182570	/nfs/dbraw/zinc/18/25/70/171182570.db2.gz	PWIRTTZKYVVWOA-UHFFFAOYSA-N	1	0	296.386	1.859	50	0		CDAARO
Cc1ccc(OC[C@H](O)C[NH2+][C@@H]2CCO[C@H]2C)c(C)c1	ZINC000032523771	171731800	/nfs/dbraw/zinc/73/18/00/171731800.db2.gz	YEGOIUNTNBMTEZ-RRFJBIMHSA-N	1	0	279.380	1.810	50	0		CDAARO
CCc1ccc(S(=O)(=O)N2CCC[C@@H]([NH3+])C2)cc1	ZINC000036297044	172590156	/nfs/dbraw/zinc/59/01/56/172590156.db2.gz	CFTVTUIHFADRKU-GFCCVEGCSA-N	1	0	268.382	1.361	50	0		CDAARO
O=S(=O)(NC[C@H]1CCCC[NH2+]1)c1cc(F)ccc1F	ZINC000037377307	173166633	/nfs/dbraw/zinc/16/66/33/173166633.db2.gz	JVYSNRMXQBRXTC-SNVBAGLBSA-N	1	0	290.335	1.385	50	0		CDAARO
[NH3+]CCOc1ccc2nnc(-c3ccccc3F)n2n1	ZINC000038478043	174142090	/nfs/dbraw/zinc/14/20/90/174142090.db2.gz	KVMYOMJHQXDIMI-UHFFFAOYSA-N	1	0	273.271	1.268	50	0		CDAARO
[NH3+]CCc1nc(CS(=O)(=O)c2ccccc2)cs1	ZINC000040165571	174197463	/nfs/dbraw/zinc/19/74/63/174197463.db2.gz	LWWBYIIJJRGXLP-UHFFFAOYSA-N	1	0	282.390	1.618	50	0		CDAARO
Cn1nc(COCc2ccccc2F)c2c1CC[NH2+]C2	ZINC000066323486	175756634	/nfs/dbraw/zinc/75/66/34/175756634.db2.gz	ZIBNMOACAXFJIA-UHFFFAOYSA-N	1	0	275.327	1.922	50	0		CDAARO
C[N@@H+]1CCOC[C@H](CNc2cnc3ccccc3n2)C1	ZINC000072137292	176322595	/nfs/dbraw/zinc/32/25/95/176322595.db2.gz	ZNHMHLNVXCCECT-GFCCVEGCSA-N	1	0	272.352	1.620	50	0		CDAARO
COc1cccc(C(=O)N2CCC[C@@H]([NH+](C)C)CC2)c1O	ZINC000072148298	176325784	/nfs/dbraw/zinc/32/57/84/176325784.db2.gz	WCPDENDCKQHZHG-GFCCVEGCSA-N	1	0	292.379	1.957	50	0		CDAARO
CCCc1cc(NC[C@H]2CCC[NH2+]2)n2nccc2n1	ZINC000072412109	176398848	/nfs/dbraw/zinc/39/88/48/176398848.db2.gz	FAPRYUYQZNZYBE-GFCCVEGCSA-N	1	0	259.357	1.846	50	0		CDAARO
O[C@@]1(CNCc2csc3c2CCCC3)C[NH2+]CCOC1	ZINC000077389432	177262156	/nfs/dbraw/zinc/26/21/56/177262156.db2.gz	NSXSEIHMZPFXAH-OAHLLOKOSA-N	1	0	296.436	1.067	50	0		CDAARO
O=S(=O)(NCC[C@@H]1CC[NH2+]C1)c1ccccc1Cl	ZINC000110797200	227224974	/nfs/dbraw/zinc/22/49/74/227224974.db2.gz	SMRZLEQOAUBTCD-JTQLQIEISA-N	1	0	288.800	1.618	50	0		CDAARO
CCOC(=O)C1CC[NH+](C[C@H](O)COC2CCCC2)CC1	ZINC000012419925	424377397	/nfs/dbraw/zinc/37/73/97/424377397.db2.gz	DDDDSBLKSQZIAX-AWEZNQCLSA-N	1	0	299.411	1.582	50	0		CDAARO
CC[N@@H+]1CCC[C@H]([C@H]2NCCc3nc(N)sc32)C1	ZINC000071681690	276179239	/nfs/dbraw/zinc/17/92/39/276179239.db2.gz	UZMGXJDDFLOXRZ-GXSJLCMTSA-N	1	0	266.414	1.644	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+]C[C@H]2CN(C3CC3)CCO2)C1(C)C	ZINC000108490561	276345434	/nfs/dbraw/zinc/34/54/34/276345434.db2.gz	ANBIQRZGIHBNDM-RRFJBIMHSA-N	1	0	282.428	1.643	50	0		CDAARO
CC(C)(C)OC(=O)N1CCOC2(CC[NH2+]CC2)C1	ZINC000036155482	277189372	/nfs/dbraw/zinc/18/93/72/277189372.db2.gz	XLEJZQHSRRYDFL-UHFFFAOYSA-N	1	0	256.346	1.376	50	0		CDAARO
C[N@@H+]1C[C@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1	ZINC000072161303	277205831	/nfs/dbraw/zinc/20/58/31/277205831.db2.gz	UCHZOFZGBCEQMN-KBRIMQKVSA-N	1	0	286.375	1.907	50	0		CDAARO
C[NH2+][C@@H]1c2cc(Br)ccc2OC[C@@H]1CO	ZINC000003912784	277296485	/nfs/dbraw/zinc/29/64/85/277296485.db2.gz	GRTHRMQDCVCQBA-CPCISQLKSA-N	1	0	272.142	1.711	50	0		CDAARO
COc1cccc2c1ncn([C@@H]1CCC[NH2+]C1)c2=O	ZINC000032576732	278043173	/nfs/dbraw/zinc/04/31/73/278043173.db2.gz	WJCJIEGNOXQCLB-SNVBAGLBSA-N	1	0	259.309	1.330	50	0		CDAARO
CC[N@H+](CCNC(=O)Nc1ccc(F)cn1)C1CC1	ZINC000123369673	279202820	/nfs/dbraw/zinc/20/28/20/279202820.db2.gz	FMFHJBWOTXYUIO-UHFFFAOYSA-N	1	0	266.320	1.827	50	0		CDAARO
CC[C@@H]1CN(C(=O)C[NH2+][C@H](C)[C@H](C)n2cccn2)CCO1	ZINC000106909889	280350193	/nfs/dbraw/zinc/35/01/93/280350193.db2.gz	YQGITJFJGZTUBZ-HZSPNIEDSA-N	1	0	294.399	1.060	50	0		CDAARO
Cc1ccc(C)c([C@@H]2CN(C(=O)[C@H](C)[NH3+])[C@@H](C)CO2)c1	ZINC000119065669	280799097	/nfs/dbraw/zinc/79/90/97/280799097.db2.gz	FUKXZIYTYDHLJE-YDHLFZDLSA-N	1	0	276.380	1.939	50	0		CDAARO
COc1cc(/C=C\C(=O)N2CC[C@@H]([NH3+])C2)cc(OC)c1	ZINC000255135533	289358138	/nfs/dbraw/zinc/35/81/38/289358138.db2.gz	ITOXYTFNLNZTQD-VSQXVHSFSA-N	1	0	276.336	1.277	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)/C=C\c2ccccc2OC)C1	ZINC000255174385	289360664	/nfs/dbraw/zinc/36/06/64/289360664.db2.gz	VIBSDUFTVKOOJD-WSROAFLRSA-N	1	0	274.364	1.776	50	0		CDAARO
C[C@H]([NH2+][C@@H]1CCCC1(C)C)C(=O)NC[C@@H]1CCCO1	ZINC000191307202	290003885	/nfs/dbraw/zinc/00/38/85/290003885.db2.gz	XGDGAEZWESZAQU-RWMBFGLXSA-N	1	0	268.401	1.838	50	0		CDAARO
CN(c1nc(C(F)(F)F)nc2nc[nH]c21)C1CC([NH3+])C1	ZINC000568732629	294089870	/nfs/dbraw/zinc/08/98/70/294089870.db2.gz	GQZQMMIAQAPIRO-UHFFFAOYSA-N	1	0	286.261	1.298	50	0		CDAARO
[NH3+]C[C@H]1CCC[C@@H]1NS(=O)(=O)c1cc(F)cc(F)c1	ZINC000089091611	295271235	/nfs/dbraw/zinc/27/12/35/295271235.db2.gz	OSULEEQSACYXDR-PELKAZGASA-N	1	0	290.335	1.371	50	0		CDAARO
O=C([C@@H]1C=CC[NH2+]1)N1CCC(Oc2ccccc2F)CC1	ZINC000534579705	328311244	/nfs/dbraw/zinc/31/12/44/328311244.db2.gz	RCBGKNIMVMTHMD-AWEZNQCLSA-N	1	0	290.338	1.724	50	0		CDAARO
COc1nccnc1NCC1(C[NH+]2CCCC2)CC1	ZINC000534581902	328312235	/nfs/dbraw/zinc/31/22/35/328312235.db2.gz	DPVOTVHEKALQER-UHFFFAOYSA-N	1	0	262.357	1.195	50	0		CDAARO
O=C(N[C@H]1COC[C@@H]1[NH+]1CCCCC1)C1CCCC1	ZINC000534589086	328317227	/nfs/dbraw/zinc/31/72/27/328317227.db2.gz	WAHPNPKRELNDJG-KBPBESRZSA-N	1	0	266.385	1.546	50	0		CDAARO
Cc1cc(C(=O)NCC2(C[NH+]3CCCC3)CC2)nc(C)n1	ZINC000534673013	328348449	/nfs/dbraw/zinc/34/84/49/328348449.db2.gz	OYBRQMNRJPHCMG-UHFFFAOYSA-N	1	0	288.395	1.699	50	0		CDAARO
Cc1nc(N)nc(NCC[C@@H]2CCC[N@@H+](C)C2)c1Cl	ZINC000534662464	328350396	/nfs/dbraw/zinc/35/03/96/328350396.db2.gz	QSTHTJYRDWASPO-JTQLQIEISA-N	1	0	283.807	1.417	50	0		CDAARO
CO[C@H]1CCN(C(=O)Cc2cc(F)ccc2F)[C@H](C[NH3+])C1	ZINC000195557545	323571888	/nfs/dbraw/zinc/57/18/88/323571888.db2.gz	GDFHQBJBSVXZII-STQMWFEESA-N	1	0	298.333	1.472	50	0		CDAARO
CCC[NH+](CCC(=O)OCC)CCC(=O)OCC	ZINC000096517673	333238784	/nfs/dbraw/zinc/23/87/84/333238784.db2.gz	JDRNVMDHXGEKPR-UHFFFAOYSA-N	1	0	259.346	1.605	50	0		CDAARO
Cn1ncc2c1ncnc2N[C@@H]1C[C@H]([NH+](C)C)C1(C)C	ZINC000585092408	482828701	/nfs/dbraw/zinc/82/87/01/482828701.db2.gz	VJRQKINAHPVSQX-MNOVXSKESA-N	1	0	274.372	1.504	50	0		CDAARO
Cc1nn(CCO)c(C)c1C[N@@H+]1CC[C@@H](O)CC(C)(C)C1	ZINC000670441045	482985652	/nfs/dbraw/zinc/98/56/52/482985652.db2.gz	PDFYIXHOFVHSBW-CQSZACIVSA-N	1	0	295.427	1.475	50	0		CDAARO
CC(C)(C)[C@H]([NH3+])C(=O)Nc1cnn(Cc2ccncc2)c1	ZINC000178660914	483021455	/nfs/dbraw/zinc/02/14/55/483021455.db2.gz	VTIJBEMJCQSEOC-CYBMUJFWSA-N	1	0	287.367	1.638	50	0		CDAARO
C[NH+](C)CC1(CO)CCN(C(=O)[C@H]2CC23CCC3)CC1	ZINC000670468333	483059704	/nfs/dbraw/zinc/05/97/04/483059704.db2.gz	SBOSQKQLHXUHKK-CYBMUJFWSA-N	1	0	280.412	1.339	50	0		CDAARO
CC[C@@H](C)[N@H+](C)CC(=O)N(CCC(N)=O)c1ccccc1	ZINC000084721800	483318175	/nfs/dbraw/zinc/31/81/75/483318175.db2.gz	NFZULTCLFCSZJK-CYBMUJFWSA-N	1	0	291.395	1.625	50	0		CDAARO
COc1ccc(C[NH2+]CCN2CCOCC2)c(OC)c1	ZINC000019872166	524070555	/nfs/dbraw/zinc/07/05/55/524070555.db2.gz	SMOKXEPHNFNMGY-UHFFFAOYSA-N	1	0	280.368	1.126	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[NH+](C2CCOCC2)CC1	ZINC000097840706	526408371	/nfs/dbraw/zinc/40/83/71/526408371.db2.gz	DSIMMXOFLAHCGT-UHFFFAOYSA-N	1	0	270.373	1.718	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)/C=C/c2ccc3c(c2)OCCO3)C1	ZINC000178514166	527238552	/nfs/dbraw/zinc/23/85/52/527238552.db2.gz	RLVLLDXNMFQEBC-CXLRFSCWSA-N	1	0	288.347	1.278	50	0		CDAARO
C[C@@H](CNC(=O)c1ccc(NC(=O)C2CC2)s1)[NH+](C)C	ZINC000033093942	570246898	/nfs/dbraw/zinc/24/68/98/570246898.db2.gz	OQKHQXVZYPTTAY-VIFPVBQESA-N	1	0	295.408	1.777	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)NC2(C(N)=O)CCCC2)CC1	ZINC000746264864	576766717	/nfs/dbraw/zinc/76/67/17/576766717.db2.gz	HLJLOQJTNVYCJX-UHFFFAOYSA-N	1	0	281.400	1.021	50	0		CDAARO
C[C@@H]1C[C@H](N)C[NH2+][C@@H]1[C@@H]1CC[C@@H](C(F)(F)F)NC1	ZINC000757213059	577036402	/nfs/dbraw/zinc/03/64/02/577036402.db2.gz	NNGYGHVINMQSEQ-UVOCVTCTSA-N	1	0	265.323	1.242	50	0		CDAARO
C[C@@H]1CC[C@H](c2ccc(NS(C)(=O)=O)cc2)C[NH2+]1	ZINC000757216177	577036415	/nfs/dbraw/zinc/03/64/15/577036415.db2.gz	YFZMMQOOIVEXHT-PWSUYJOCSA-N	1	0	268.382	1.914	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](CNCc2ccc(CO)o2)C1	ZINC000952980187	614112748	/nfs/dbraw/zinc/11/27/48/614112748.db2.gz	WKYXUNCNRAYTNK-CYBMUJFWSA-N	1	0	266.385	1.839	50	0		CDAARO
CCOc1ccc(C[NH2+]CCN2CCCC[C@H]2CO)cn1	ZINC000952972995	615511023	/nfs/dbraw/zinc/51/10/23/615511023.db2.gz	QZRPGKCIGRCCSU-HNNXBMFYSA-N	1	0	293.411	1.417	50	0		CDAARO
CCn1nc(C)c(COC(=O)C[C@@H](C[NH3+])CC(C)C)n1	ZINC000888094388	617753704	/nfs/dbraw/zinc/75/37/04/617753704.db2.gz	SKLQLDQEMPALOV-LBPRGKRZSA-N	1	0	282.388	1.661	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)NC1(c2nc[nH]n2)CCC1	ZINC000888096037	617757679	/nfs/dbraw/zinc/75/76/79/617757679.db2.gz	HRXUCICOESRNDJ-NSHDSACASA-N	1	0	279.388	1.311	50	0		CDAARO
Cn1cc([C@@](C)(O)C[NH2+]Cc2cnc(C3CC3)o2)cn1	ZINC000888100635	617764130	/nfs/dbraw/zinc/76/41/30/617764130.db2.gz	XSTHAEVNMQSXPP-AWEZNQCLSA-N	1	0	276.340	1.283	50	0		CDAARO
CO[C@@H]1CCC[C@@]12CCC[N@H+](CCN1CCOCC1)C2	ZINC001704300529	1177680794	/nfs/dbraw/zinc/68/07/94/1177680794.db2.gz	XCWXILYTHNZEPB-CVEARBPZSA-N	1	0	282.428	1.600	50	0		CDAARO
CCCO[C@@H]1CCC[N@H+](CCn2c(=O)cc(C)[nH]c2=O)C1	ZINC001704356254	1177701036	/nfs/dbraw/zinc/70/10/36/1177701036.db2.gz	FRBRMXDDOPJZBM-CYBMUJFWSA-N	1	0	295.383	1.148	50	0		CDAARO
CCN(CC[NH+](C)C)c1nccc(-c2cnn(C)c2)n1	ZINC000023130150	897149299	/nfs/dbraw/zinc/14/92/99/897149299.db2.gz	AGPULBIYIOWJMX-UHFFFAOYSA-N	1	0	274.372	1.265	50	0		CDAARO
Cc1ccsc1CN(C)C(=O)[C@@H]([NH3+])Cc1cnc[nH]1	ZINC000952975456	910524450	/nfs/dbraw/zinc/52/44/50/910524450.db2.gz	RRWMBVRFXLOEPO-NSHDSACASA-N	1	0	278.381	1.308	50	0		CDAARO
C[C@@H](C(N)=O)[NH+]1CCC(CNC(=O)C2CCCCC2)CC1	ZINC000952967971	910534996	/nfs/dbraw/zinc/53/49/96/910534996.db2.gz	JBICGWRUZFBDEK-LBPRGKRZSA-N	1	0	295.427	1.269	50	0		CDAARO
C[C@@H](Cn1ccnc1)[NH2+]CC1(Cn2ccnc2)CC1	ZINC000821495616	925587864	/nfs/dbraw/zinc/58/78/64/925587864.db2.gz	OFJDXPXPQSLTFQ-ZDUSSCGKSA-N	1	0	259.357	1.538	50	0		CDAARO
CCC[C@@H](CNS(=O)(=O)CC1CCCC1)[NH+](C)C	ZINC000822790893	925649955	/nfs/dbraw/zinc/64/99/55/925649955.db2.gz	CAWYAVPJARSSMU-ZDUSSCGKSA-N	1	0	276.446	1.826	50	0		CDAARO
CN(CC(=O)N1[C@@H]2CC[C@H]1C[C@@H](O)C2)Cc1cccnc1	ZINC000823676252	925718811	/nfs/dbraw/zinc/71/88/11/925718811.db2.gz	LBYJOFQAIOSICU-FICVDOATSA-N	1	0	289.379	1.028	50	0		CDAARO
COc1ncc(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@H]3OC)cn1	ZINC000824500068	925826923	/nfs/dbraw/zinc/82/69/23/925826923.db2.gz	NWLXOAKTHAMPAW-ITGUQSILSA-N	1	0	263.341	1.342	50	0		CDAARO
CN(C)C(=O)[C@H]1CN(CCCc2ccco2)CCO1	ZINC000827790970	925965092	/nfs/dbraw/zinc/96/50/92/925965092.db2.gz	PKRLBCVNZWCWEI-CYBMUJFWSA-N	1	0	266.341	1.001	50	0		CDAARO
O[C@@H]1C[NH2+]CCN(Cc2ccccc2-c2ccco2)C1	ZINC000219615097	930897726	/nfs/dbraw/zinc/89/77/26/930897726.db2.gz	NOXXAYCNEQBRNJ-CQSZACIVSA-N	1	0	272.348	1.713	50	0		CDAARO
Cc1cc(C(=O)N2CCN(C3CC3)C[C@H]2C)ns1	ZINC000585130649	931019443	/nfs/dbraw/zinc/01/94/43/931019443.db2.gz	XNZWBJBHLOBKTG-SECBINFHSA-N	1	0	265.382	1.760	50	0		CDAARO
Cc1nc2ccccc2n1CC[NH2+][C@H](C)c1cnnn1C	ZINC000863982400	934382391	/nfs/dbraw/zinc/38/23/91/934382391.db2.gz	IMVOHQDIKJDSFN-LLVKDONJSA-N	1	0	284.367	1.824	50	0		CDAARO
COc1cccc(F)c1C(=O)N1C[C@H]([NH3+])[C@@H](C(C)C)C1	ZINC000091690071	934873319	/nfs/dbraw/zinc/87/33/19/934873319.db2.gz	ONWUCTZIDAPSRP-PWSUYJOCSA-N	1	0	280.343	1.890	50	0		CDAARO
[NH3+][C@@H](c1ccns1)C1(O)CCC2(CC1)OCCO2	ZINC000958528166	935020128	/nfs/dbraw/zinc/02/01/28/935020128.db2.gz	KLIOAWFYTQOHJM-JTQLQIEISA-N	1	0	270.354	1.191	50	0		CDAARO
CCC[C@]1(CO)C[N@H+](Cc2cccnc2C)CC[C@H]1O	ZINC001529120819	968985074	/nfs/dbraw/zinc/98/50/74/968985074.db2.gz	MGWKGVOIMIJQNP-HZPDHXFCSA-N	1	0	278.396	1.735	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1cc(OC)nc(N)n1	ZINC001529171934	969002944	/nfs/dbraw/zinc/00/29/44/969002944.db2.gz	BAMGUNZWSMUNCA-JTQLQIEISA-N	1	0	265.361	1.354	50	0		CDAARO
Cc1nnc(N2C[C@H](O)[C@@H]([NH+]3CCCC3)C2)c2ccccc12	ZINC001506398160	975147913	/nfs/dbraw/zinc/14/79/13/975147913.db2.gz	LZPKVICCPMPSCZ-HOTGVXAUSA-N	1	0	298.390	1.584	50	0		CDAARO
Cc1cccc(CCN(CC[NH+](C)C)C[C@H]2CCCO2)n1	ZINC001506399490	975149003	/nfs/dbraw/zinc/14/90/03/975149003.db2.gz	GUAZKYJHCAUHIY-QGZVFWFLSA-N	1	0	291.439	1.975	50	0		CDAARO
Cc1cccnc1N1CC[NH+](CCc2nccn2C)CC1	ZINC001506400697	975149043	/nfs/dbraw/zinc/14/90/43/975149043.db2.gz	WJNJZUVVLDYEPE-UHFFFAOYSA-N	1	0	285.395	1.488	50	0		CDAARO
C[NH+](C)Cc1cccc(-c2nc3c([nH]2)C(=O)NCCC3)c1	ZINC000095512481	185002012	/nfs/dbraw/zinc/00/20/12/185002012.db2.gz	JHFLSORVXPNGBC-UHFFFAOYSA-N	1	0	284.363	1.814	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)C[C@@H]1CCCOC1	ZINC000426399072	230417474	/nfs/dbraw/zinc/41/74/74/230417474.db2.gz	RPPCKIGXPUEMLM-ZDUSSCGKSA-N	1	0	277.368	1.157	50	0		CDAARO
COC(=O)CCCC(=O)N1CCC([N@@H+]2CCC[C@@H]2C)CC1	ZINC000095943089	185037569	/nfs/dbraw/zinc/03/75/69/185037569.db2.gz	XGSCEHJLHCOPOT-ZDUSSCGKSA-N	1	0	296.411	1.805	50	0		CDAARO
CCOc1cc(C)ccc1C[NH2+][C@@H](C)CC(N)=O	ZINC000095969294	185047597	/nfs/dbraw/zinc/04/75/97/185047597.db2.gz	WBPDJXGKCBLLBT-NSHDSACASA-N	1	0	250.342	1.747	50	0		CDAARO
CCN(CC)CC[N@@H+]1CCCC[C@H]1[C@@H]1CNC(=O)C1	ZINC000195555796	342626407	/nfs/dbraw/zinc/62/64/07/342626407.db2.gz	QMOSCNVCYPKZRJ-KBPBESRZSA-N	1	0	267.417	1.319	50	0		CDAARO
[NH3+]CCNS(=O)(=O)/C=C/c1ccccc1Cl	ZINC000195544472	342626609	/nfs/dbraw/zinc/62/66/09/342626609.db2.gz	PFBRFDBVQZUJFW-VMPITWQZSA-N	1	0	260.746	1.189	50	0		CDAARO
CC(C)COC[C@H](C)NC(=O)[C@@]1(C)CCCC[NH2+]1	ZINC000195556993	342626684	/nfs/dbraw/zinc/62/66/84/342626684.db2.gz	OHLZHJGMGXSHLZ-GXTWGEPZSA-N	1	0	256.390	1.696	50	0		CDAARO
CCn1cc(C(=O)Nc2cnc3c(c2)C[NH2+]CC3)cn1	ZINC000195549175	342626771	/nfs/dbraw/zinc/62/67/71/342626771.db2.gz	IXJTYLXBRHXBLU-UHFFFAOYSA-N	1	0	271.324	1.196	50	0		CDAARO
CO[C@@H]1CCN(C(=O)COC2CCCCC2)[C@@H](C[NH3+])C1	ZINC000195557585	342626840	/nfs/dbraw/zinc/62/68/40/342626840.db2.gz	PWGRXQNIWJDVPK-TZMCWYRMSA-N	1	0	284.400	1.300	50	0		CDAARO
O=C1C[C@@H]([NH2+]CC2CC2)C(=O)N1c1ccc(F)cc1	ZINC000083251949	178370336	/nfs/dbraw/zinc/37/03/36/178370336.db2.gz	AOAKLZCIAGZKQF-GFCCVEGCSA-N	1	0	262.284	1.457	50	0		CDAARO
C[C@@H]([NH2+]Cc1ccon1)C1(N2CCOCC2)CCCC1	ZINC000195570220	342628764	/nfs/dbraw/zinc/62/87/64/342628764.db2.gz	IAMLTSFRWHFRAR-CYBMUJFWSA-N	1	0	279.384	1.798	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1cnc(-c2ccccn2)s1	ZINC000125412852	187183752	/nfs/dbraw/zinc/18/37/52/187183752.db2.gz	ZRVHQJKMXOQBGR-JTQLQIEISA-N	1	0	288.376	1.639	50	0		CDAARO
CCn1ccc(CN2CC[N@H+](CC3CC3)[C@@H](CCO)C2)n1	ZINC000244633312	361855661	/nfs/dbraw/zinc/85/56/61/361855661.db2.gz	GAUWTTYQFGIKPD-INIZCTEOSA-N	1	0	292.427	1.182	50	0		CDAARO
Cc1cnc(C)c(NC[C@@H](C)N2CCOC[C@H]2C)n1	ZINC000252585190	361856951	/nfs/dbraw/zinc/85/69/51/361856951.db2.gz	GYDXJPMAWSCGMD-VXGBXAGGSA-N	1	0	264.373	1.615	50	0		CDAARO
Cc1cccc(S(=O)(=O)NCC[NH2+]C2CC2)c1Cl	ZINC000097234939	342205595	/nfs/dbraw/zinc/20/55/95/342205595.db2.gz	IWLKTLSTPONZAC-UHFFFAOYSA-N	1	0	288.800	1.679	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+]C[C@](C)(O)c2cnn(C)c2)C12CCC2	ZINC000097034569	185156956	/nfs/dbraw/zinc/15/69/56/185156956.db2.gz	JEGUHUCJEBTTOZ-ZNMIVQPWSA-N	1	0	293.411	1.565	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OC[C@@H]1CCCNC1=O	ZINC000585133974	342215710	/nfs/dbraw/zinc/21/57/10/342215710.db2.gz	PAKIWQGUEXDWRP-RYUDHWBXSA-N	1	0	270.373	1.067	50	0		CDAARO
C[C@H]([NH3+])CONC(=O)/C=C/c1c(F)cccc1F	ZINC000585136821	342215997	/nfs/dbraw/zinc/21/59/97/342215997.db2.gz	UHFYAXUZWYZVNJ-GJIOHYHPSA-N	1	0	256.252	1.373	50	0		CDAARO
C[C@@H]1C[C@H](N2CC[C@H](CNc3ccccn3)C2)C(=O)O1	ZINC000097200651	342217062	/nfs/dbraw/zinc/21/70/62/342217062.db2.gz	QBQYGQJINRHXCR-UPJWGTAASA-N	1	0	275.352	1.519	50	0		CDAARO
CC(C)(C)OC(=O)[C@H]1C[C@@H]([NH3+])[C@@H](n2cc(C3CC3)nn2)C1	ZINC000669371712	539071731	/nfs/dbraw/zinc/07/17/31/539071731.db2.gz	SGNUQEAGCSURPZ-LOWVWBTDSA-N	1	0	292.383	1.776	50	0		CDAARO
O=C(Cc1cccs1)N1CC[NH+]([C@@H]2CCC[C@H]2O)CC1	ZINC000084442208	342262841	/nfs/dbraw/zinc/26/28/41/342262841.db2.gz	QMXDIABSLMXMQG-ZIAGYGMSSA-N	1	0	294.420	1.348	50	0		CDAARO
Cc1nccc(N2CCC[C@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)n1	ZINC000195570830	282185882	/nfs/dbraw/zinc/18/58/82/282185882.db2.gz	ZRASOMLHLUMZES-GUTXKFCHSA-N	1	0	290.411	1.863	50	0		CDAARO
CO[C@H](C[NH2+]CCc1ccncc1C)C1CCOCC1	ZINC000585116602	362044524	/nfs/dbraw/zinc/04/45/24/362044524.db2.gz	CHWQMXIPFQOYDZ-MRXNPFEDSA-N	1	0	278.396	1.964	50	0		CDAARO
Cc1nn(-c2ccccn2)c(N2CCN(C)CC2)c1C=O	ZINC000038352504	343419668	/nfs/dbraw/zinc/41/96/68/343419668.db2.gz	WBECHJJHACZWAK-UHFFFAOYSA-N	1	0	285.351	1.140	50	0		CDAARO
Cc1nn(C)c2nc(N(C)[C@@H]3CC[N@H+](C)C3)sc12	ZINC000095515325	282285267	/nfs/dbraw/zinc/28/52/67/282285267.db2.gz	DMLAJBHVWYYFPS-SECBINFHSA-N	1	0	265.386	1.479	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F)[C@@H]1CC[NH2+]C1	ZINC000179075352	362249175	/nfs/dbraw/zinc/24/91/75/362249175.db2.gz	ZXPWLZIIQYCWHW-OUAUKWLOSA-N	1	0	280.318	1.889	50	0		CDAARO
COCCN(CC[NH+](C)C)C(=O)c1cc(C)ccc1F	ZINC000084131247	362258069	/nfs/dbraw/zinc/25/80/69/362258069.db2.gz	GSSHVZYEPIFCOA-UHFFFAOYSA-N	1	0	282.359	1.784	50	0		CDAARO
CCO[C@H]1C[C@@H]([N@H+](C)CCC(=O)N2CCOCC2)C1(C)C	ZINC000084800724	362275016	/nfs/dbraw/zinc/27/50/16/362275016.db2.gz	SHVFYLOFFRRNDC-KGLIPLIRSA-N	1	0	298.427	1.371	50	0		CDAARO
Cc1cc(Cl)ccc1C[NH2+]CCC(=O)N1CCOCC1	ZINC000129072979	362502969	/nfs/dbraw/zinc/50/29/69/362502969.db2.gz	HSUHVCVQNDJEPG-UHFFFAOYSA-N	1	0	296.798	1.987	50	0		CDAARO
CN(Cc1nc2ccccc2s1)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000534584470	345507069	/nfs/dbraw/zinc/50/70/69/345507069.db2.gz	BYXNIWHWOFAHKB-NSHDSACASA-N	1	0	273.361	1.783	50	0		CDAARO
O=C(N[C@@H]1CC[NH2+]C1)c1cnoc1-c1ccccc1	ZINC000097492607	185616555	/nfs/dbraw/zinc/61/65/55/185616555.db2.gz	PYKREPVDNUKZEF-LLVKDONJSA-N	1	0	257.293	1.433	50	0		CDAARO
COc1nccnc1N1CCC([C@@H](C)[NH+](C)C)CC1	ZINC000096133653	136519214	/nfs/dbraw/zinc/51/92/14/136519214.db2.gz	TWCOYRSOJVOOKT-LLVKDONJSA-N	1	0	264.373	1.652	50	0		CDAARO
CC[N@@H+]1CC[C@H](CNC(=O)CCCn2ccnc2)C1	ZINC000105320708	346621660	/nfs/dbraw/zinc/62/16/60/346621660.db2.gz	QYWFNFNDUWGLCR-CYBMUJFWSA-N	1	0	264.373	1.121	50	0		CDAARO
C[N@@H+]1CC[C@@H](Oc2ncc(Br)cn2)C1	ZINC000306822622	362784583	/nfs/dbraw/zinc/78/45/83/362784583.db2.gz	NNBYFHZJBJTLNA-MRVPVSSYSA-N	1	0	258.119	1.322	50	0		CDAARO
Cc1cc(N(C)C)nc(NCCNC(=O)C(C)C)[nH+]1	ZINC000036708113	362836330	/nfs/dbraw/zinc/83/63/30/362836330.db2.gz	UKMZNCDPZBBQNS-UHFFFAOYSA-N	1	0	265.361	1.035	50	0		CDAARO
COC(=O)c1ccc(C2=NOC3(C2)CC[NH2+]CC3)nc1	ZINC000140770198	348752478	/nfs/dbraw/zinc/75/24/78/348752478.db2.gz	OQNTUTPOPLLSFR-UHFFFAOYSA-N	1	0	275.308	1.115	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CCNC(=O)c1cnc(N)s1	ZINC000584896619	349358099	/nfs/dbraw/zinc/35/80/99/349358099.db2.gz	UFNMQILJUSSAQO-SECBINFHSA-N	1	0	268.386	1.160	50	0		CDAARO
CO[C@H]1C[N@H+](Cc2c(C)cc(C)c(CO)c2C)C[C@@H]1O	ZINC000584889186	349347933	/nfs/dbraw/zinc/34/79/33/349347933.db2.gz	DLTRUIDUMZDCGQ-HOTGVXAUSA-N	1	0	279.380	1.296	50	0		CDAARO
O=C(C[NH+]1CCCCCCC1)NCC1(CO)CCC1	ZINC000584891524	349350604	/nfs/dbraw/zinc/35/06/04/349350604.db2.gz	MOXLNMVCKPALQQ-UHFFFAOYSA-N	1	0	268.401	1.531	50	0		CDAARO
COCCn1cnnc1C[NH2+]C1Cc2ccccc2C1	ZINC000584892644	349351779	/nfs/dbraw/zinc/35/17/79/349351779.db2.gz	SGGWIFIWAKHONF-UHFFFAOYSA-N	1	0	272.352	1.182	50	0		CDAARO
CCOC(=O)N1CC[C@@H]([NH2+]Cc2cncn2C2CC2)C1	ZINC000584894132	349354231	/nfs/dbraw/zinc/35/42/31/349354231.db2.gz	YDWKBLBNBUITBG-LLVKDONJSA-N	1	0	278.356	1.538	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@@H]1NC(=O)c1cccc(F)c1F	ZINC000091496330	180172053	/nfs/dbraw/zinc/17/20/53/180172053.db2.gz	HLXHBEOZAOBXQR-KCJUWKMLSA-N	1	0	254.280	1.835	50	0		CDAARO
[NH3+][C@@H]1CCCN(Cc2cc(=O)c3cccc(F)c3[nH]2)CC1	ZINC000091575086	180197272	/nfs/dbraw/zinc/19/72/72/180197272.db2.gz	HIUAFMDNFMLGEN-LLVKDONJSA-N	1	0	289.354	1.980	50	0		CDAARO
CCN(C)c1cc(N2C[C@H]([NH3+])[C@@H](C(C)C)C2)ncn1	ZINC000091585716	180199598	/nfs/dbraw/zinc/19/95/98/180199598.db2.gz	YXFMHOUDVBOKHW-NEPJUHHUSA-N	1	0	263.389	1.352	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2ccc3cc[nH]c3c2)C[C@@H]1C1CC1	ZINC000091624808	180209398	/nfs/dbraw/zinc/20/93/98/180209398.db2.gz	ZIEBFFWYHUXXNC-KGLIPLIRSA-N	1	0	269.348	1.977	50	0		CDAARO
COc1ccc([C@H]2CN(C(=O)c3ccc[nH]3)C[C@@H]2[NH3+])cc1	ZINC000091964990	180293887	/nfs/dbraw/zinc/29/38/87/180293887.db2.gz	WQSRWQAZEIORQQ-KGLIPLIRSA-N	1	0	285.347	1.590	50	0		CDAARO
COCCN1C[C@H]([NH+](C)C)[C@@H](c2ccc(C)o2)C1	ZINC000091892560	180280730	/nfs/dbraw/zinc/28/07/30/180280730.db2.gz	RZGDGXDTBMZTOE-STQMWFEESA-N	1	0	252.358	1.564	50	0		CDAARO
COc1ccc(-c2cc(C(=O)NCC[NH+](C)C)[nH]n2)cc1	ZINC000091893050	180280916	/nfs/dbraw/zinc/28/09/16/180280916.db2.gz	WPLYBRBSKXDWEF-UHFFFAOYSA-N	1	0	288.351	1.377	50	0		CDAARO
COc1ccc(OC[C@H](O)CN2CCC[N@H+](C)CC2)cc1	ZINC000106713736	186132918	/nfs/dbraw/zinc/13/29/18/186132918.db2.gz	SEFMBSHIRBZFEX-CQSZACIVSA-N	1	0	294.395	1.072	50	0		CDAARO
COc1ccc(F)cc1CN1CC[N@H+](C[C@H](C)O)[C@H](C)C1	ZINC000106840877	186139820	/nfs/dbraw/zinc/13/98/20/186139820.db2.gz	ZLZAZFBPLBOJRB-OLZOCXBDSA-N	1	0	296.386	1.721	50	0		CDAARO
C[NH+](C)[C@H]1CCN([C@@H]2CCCN(CC(C)(C)C)C2=O)C1	ZINC000583650933	366007688	/nfs/dbraw/zinc/00/76/88/366007688.db2.gz	CYZVTJOBSLETAL-UONOGXRCSA-N	1	0	281.444	1.659	50	0		CDAARO
CCNC(=O)[C@@H]1CCC[C@@H](C(=O)NCC)C1[NH+]1CCCC1	ZINC000096026865	351475685	/nfs/dbraw/zinc/47/56/85/351475685.db2.gz	GOOWOXXQXVQZBW-CHWSQXEVSA-N	1	0	295.427	1.139	50	0		CDAARO
Cn1nccc1C[NH2+][C@H]1CCC[C@H]1NC(=O)OC(C)(C)C	ZINC000122895683	187058248	/nfs/dbraw/zinc/05/82/48/187058248.db2.gz	WGQOAFFFPSMXRI-QWHCGFSZSA-N	1	0	294.399	1.956	50	0		CDAARO
C[C@@H]1C[C@@H]1c1ccc(C[NH2+]CC2(CO)COC2)o1	ZINC000123031608	187067035	/nfs/dbraw/zinc/06/70/35/187067035.db2.gz	PEIJVGOYSIYVOW-PWSUYJOCSA-N	1	0	251.326	1.502	50	0		CDAARO
Cn1nn[n+]2c3c(cnc12)CC/C3=C\c1ccccc1	ZINC000084334723	282889582	/nfs/dbraw/zinc/88/95/82/282889582.db2.gz	HQBKUTWLKJYSIA-FMIVXFBMSA-N	1	0	264.312	1.436	50	0		CDAARO
O=C(C1CC[NH2+]CC1)N1CCN(c2ccccc2F)CC1	ZINC000004707002	356040782	/nfs/dbraw/zinc/04/07/82/356040782.db2.gz	ZVVWEAPAFUORTR-UHFFFAOYSA-N	1	0	291.370	1.474	50	0		CDAARO
C[NH2+][C@@H]1c2cc(Br)ccc2OC[C@H]1CO	ZINC000003912786	356012625	/nfs/dbraw/zinc/01/26/25/356012625.db2.gz	GRTHRMQDCVCQBA-HQJQHLMTSA-N	1	0	272.142	1.711	50	0		CDAARO
CC(C)(C[NH2+][C@H]1CCc2ccc(F)cc21)C(N)=O	ZINC000097371018	356089290	/nfs/dbraw/zinc/08/92/90/356089290.db2.gz	HXHSHFHGVSAVGH-LBPRGKRZSA-N	1	0	250.317	1.914	50	0		CDAARO
C[NH+](C)CC[C@@H]1CN(C(=O)c2ccc(F)cc2F)CCO1	ZINC000012093920	356287380	/nfs/dbraw/zinc/28/73/80/356287380.db2.gz	PUWJPPDNRQJJIQ-GFCCVEGCSA-N	1	0	298.333	1.758	50	0		CDAARO
CC(C)C[N@H+](C)C[C@]1(O)CCCN(CC(C)(C)C)C1=O	ZINC000012466925	356301370	/nfs/dbraw/zinc/30/13/70/356301370.db2.gz	RXKFTIUOCAVAGH-MRXNPFEDSA-N	1	0	284.444	1.974	50	0		CDAARO
C[C@@H]([NH2+]C1CCCC1)c1nc(N)nc(N(C)C)n1	ZINC000014184998	356377973	/nfs/dbraw/zinc/37/79/73/356377973.db2.gz	PAPPXJGNNHBQJW-MRVPVSSYSA-N	1	0	250.350	1.113	50	0		CDAARO
Cc1ccc(O[C@H](C)C(=O)NC2CC[NH+](C)CC2)cc1	ZINC000016580040	356442024	/nfs/dbraw/zinc/44/20/24/356442024.db2.gz	JTXCTXMYYBFHQX-CYBMUJFWSA-N	1	0	276.380	1.973	50	0		CDAARO
C[NH+]1CCC(NC(=O)COc2ccc(F)cc2)CC1	ZINC000016604625	356442993	/nfs/dbraw/zinc/44/29/93/356442993.db2.gz	OVYIDVYMGILGFC-UHFFFAOYSA-N	1	0	266.316	1.415	50	0		CDAARO
CC(C)(C)OC(=O)[C@H](C[NH3+])NC(=O)OCc1ccccc1	ZINC000016696906	356445116	/nfs/dbraw/zinc/44/51/16/356445116.db2.gz	GUTOOFAUODQZRP-LBPRGKRZSA-N	1	0	294.351	1.582	50	0		CDAARO
CC(C)=CC[N@@H+]1CCN(Cc2ccncc2)C[C@@H]1CCO	ZINC000019339793	356480892	/nfs/dbraw/zinc/48/08/92/356480892.db2.gz	IEIVYTIMQVWUQC-KRWDZBQOSA-N	1	0	289.423	1.916	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COc2ccc(C)cc2C)CC1	ZINC000019363154	356482971	/nfs/dbraw/zinc/48/29/71/356482971.db2.gz	ZMXRQPYWTHNBTE-INIZCTEOSA-N	1	0	292.423	1.681	50	0		CDAARO
[NH3+]CCS[C@@H]1CC(=O)N(Cc2cccs2)C1=O	ZINC000018271525	356471999	/nfs/dbraw/zinc/47/19/99/356471999.db2.gz	ZFHMDDMFWUYZPV-SECBINFHSA-N	1	0	270.379	1.068	50	0		CDAARO
CCc1ccc(C[NH2+][C@@H]2CCS(=O)(=O)C2)cc1	ZINC000019772552	356500782	/nfs/dbraw/zinc/50/07/82/356500782.db2.gz	YFGRULIWGIAXPJ-CYBMUJFWSA-N	1	0	253.367	1.526	50	0		CDAARO
COc1ccc(-c2n[nH]cc2CN2CC[NH+](C)CC2)cc1	ZINC000019924878	356516582	/nfs/dbraw/zinc/51/65/82/356516582.db2.gz	VKIGEGBBIFEMOM-UHFFFAOYSA-N	1	0	286.379	1.833	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)c1ccc(=O)[nH]n1)c1ccsc1	ZINC000023132870	356629444	/nfs/dbraw/zinc/62/94/44/356629444.db2.gz	KRIWGQUVTDFCEA-LLVKDONJSA-N	1	0	292.364	1.276	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)c1ccc(=O)[nH]c1)c1ccsc1	ZINC000023133118	356629863	/nfs/dbraw/zinc/62/98/63/356629863.db2.gz	LPBVHAMFJLKBCE-LBPRGKRZSA-N	1	0	291.376	1.469	50	0		CDAARO
CCCC[N@H+](C)[C@@H](C(=O)NC(N)=O)c1ccccc1	ZINC000023696691	356648270	/nfs/dbraw/zinc/64/82/70/356648270.db2.gz	VVLUKIWZJWHVJI-GFCCVEGCSA-N	1	0	263.341	1.655	50	0		CDAARO
CSCCC(=O)N[C@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000023338553	356640554	/nfs/dbraw/zinc/64/05/54/356640554.db2.gz	XPXSHTPTLDJHCE-ZDUSSCGKSA-N	1	0	299.484	1.414	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCNc2cc(Cl)nc(N)n2)C[C@H](C)O1	ZINC000024056941	356651822	/nfs/dbraw/zinc/65/18/22/356651822.db2.gz	IIFXDPAFQWUMLV-AOOOYVTPSA-N	1	0	299.806	1.623	50	0		CDAARO
CS(=O)(=O)c1ccc2nc(N3CC[NH2+]CC3)sc2c1	ZINC000026422420	356692545	/nfs/dbraw/zinc/69/25/45/356692545.db2.gz	BZOQFZVYJJDCJF-UHFFFAOYSA-N	1	0	297.405	1.109	50	0		CDAARO
C[C@H]([NH2+]Cc1cncn1C)c1ccc2c(c1)OCO2	ZINC000112340317	356723437	/nfs/dbraw/zinc/72/34/37/356723437.db2.gz	ACOKKEJZFDCLLN-JTQLQIEISA-N	1	0	259.309	2.000	50	0		CDAARO
COc1ccnc(NCC(C)(C)N2C[C@@H](C)O[C@@H](C)C2)n1	ZINC000028936795	356728528	/nfs/dbraw/zinc/72/85/28/356728528.db2.gz	GRIDYUKRRAZUDZ-TXEJJXNPSA-N	1	0	294.399	1.785	50	0		CDAARO
Cc1cc(C)c(C)c(S(=O)(=O)N2CCNCC2)c1C	ZINC000034781225	356820131	/nfs/dbraw/zinc/82/01/31/356820131.db2.gz	JMUKEMDGNYTFDQ-UHFFFAOYSA-N	1	0	282.409	1.514	50	0		CDAARO
[NH3+]C[C@@H](c1ccncc1)N1CCC(O)(C(F)(F)F)CC1	ZINC000035287512	356831556	/nfs/dbraw/zinc/83/15/56/356831556.db2.gz	GQQYAXJIHFVCJV-NSHDSACASA-N	1	0	289.301	1.471	50	0		CDAARO
[NH3+]CCOc1ccc(I)cc1	ZINC000036904118	356889823	/nfs/dbraw/zinc/88/98/23/356889823.db2.gz	CMRQIELSCFJHBQ-UHFFFAOYSA-N	1	0	263.078	1.629	50	0		CDAARO
Cc1cc(C[C@H](C)[NH2+]CCC(=O)Nc2nccs2)[nH]n1	ZINC000065371021	357532434	/nfs/dbraw/zinc/53/24/34/357532434.db2.gz	UVWLEZKATLFCQP-VIFPVBQESA-N	1	0	293.396	1.724	50	0		CDAARO
Cc1cccc(N2NC3(CC[NH+](C)CC3)NC2=S)c1C	ZINC000334160483	357550395	/nfs/dbraw/zinc/55/03/95/357550395.db2.gz	FRMCOFZLHPLMDS-UHFFFAOYSA-N	1	0	290.436	1.924	50	0		CDAARO
COc1ccc(S(=O)(=O)NCC2CC[NH+](C)CC2)cc1	ZINC000022999726	357581816	/nfs/dbraw/zinc/58/18/16/357581816.db2.gz	DTGHELCOGRWHBL-UHFFFAOYSA-N	1	0	298.408	1.315	50	0		CDAARO
COC[C@@H](NC1CC[NH+](CC(C)C)CC1)c1ccnn1C	ZINC000067805048	357629108	/nfs/dbraw/zinc/62/91/08/357629108.db2.gz	ZSVZUUXKBRHDOA-OAHLLOKOSA-N	1	0	294.443	1.818	50	0		CDAARO
COCC(=O)NC[C@@H](c1ccccc1C)[NH+](C)C	ZINC000067934815	357639030	/nfs/dbraw/zinc/63/90/30/357639030.db2.gz	JGDJKOXVVLEVJK-ZDUSSCGKSA-N	1	0	250.342	1.360	50	0		CDAARO
CCCC[NH2+]Cc1cccn1CCN1CCOCC1	ZINC000004681533	357742205	/nfs/dbraw/zinc/74/22/05/357742205.db2.gz	XWOUMYAUPMCTLT-UHFFFAOYSA-N	1	0	265.401	1.710	50	0		CDAARO
OCCn1ncc(-c2ccncc2)c1[C@@H]1CCC[NH2+]1	ZINC000072344083	357829590	/nfs/dbraw/zinc/82/95/90/357829590.db2.gz	AMIRELMVGNSVOG-ZDUSSCGKSA-N	1	0	258.325	1.362	50	0		CDAARO
Nc1nc2c(c(N3C[C@@H]4CC=CC[C@@H]4C3)n1)CC[NH2+]CC2	ZINC000072474793	357837714	/nfs/dbraw/zinc/83/77/14/357837714.db2.gz	YSPJLDCCUGHWCC-TXEJJXNPSA-N	1	0	285.395	1.149	50	0		CDAARO
CSc1cccc(CN(C)C[C@@]2(O)CC[NH2+]C2)c1	ZINC000072468365	357838204	/nfs/dbraw/zinc/83/82/04/357838204.db2.gz	MUHFCTSYFSFNMG-CQSZACIVSA-N	1	0	266.410	1.565	50	0		CDAARO
CCCc1nccn1C[C@H](O)C[NH+]1C[C@@H](C)O[C@H](C)C1	ZINC000095438671	357869614	/nfs/dbraw/zinc/86/96/14/357869614.db2.gz	RTOIJHSTFSBJHW-MGPQQGTHSA-N	1	0	281.400	1.306	50	0		CDAARO
COc1ccc(C(=O)N2CC[N@@H+]3CCC[C@@H]3C2)c(OC)c1	ZINC000027932311	357938224	/nfs/dbraw/zinc/93/82/24/357938224.db2.gz	MPKZPVIHODPMLW-GFCCVEGCSA-N	1	0	290.363	1.624	50	0		CDAARO
C[C@H]([NH2+]CC(=O)NCc1ccccc1F)[C@@H]1CCCO1	ZINC000097111730	357986902	/nfs/dbraw/zinc/98/69/02/357986902.db2.gz	INUITPNANDIHEM-FZMZJTMJSA-N	1	0	280.343	1.599	50	0		CDAARO
C[C@@H](CN1CCOCC1)[NH2+][C@H](CO)c1ccccc1	ZINC000097238529	358051416	/nfs/dbraw/zinc/05/14/16/358051416.db2.gz	AIIHAGBTUAGAFG-DZGCQCFKSA-N	1	0	264.369	1.030	50	0		CDAARO
COc1cc(CN(C)CC[NH+](C)C)cc(OC)c1O	ZINC000019606638	358106947	/nfs/dbraw/zinc/10/69/47/358106947.db2.gz	NBKYFGFZLIYAKT-UHFFFAOYSA-N	1	0	268.357	1.403	50	0		CDAARO
CCn1c(C)cc(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)c1C	ZINC000192466024	358205352	/nfs/dbraw/zinc/20/53/52/358205352.db2.gz	BUBBYELYQWYYNO-OKILXGFUSA-N	1	0	275.396	1.758	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N[C@@H]1CCC[NH2+][C@@H]1C	ZINC000193450989	358295670	/nfs/dbraw/zinc/29/56/70/358295670.db2.gz	AXVRYIMJJRHDGW-DGCLKSJQSA-N	1	0	282.409	1.668	50	0		CDAARO
COC[C@H]1CCC[N@@H+]([C@@H](C(N)=O)c2ccccc2)C1	ZINC000195530220	358559104	/nfs/dbraw/zinc/55/91/04/358559104.db2.gz	DFOPSTJBNIXSRJ-GXTWGEPZSA-N	1	0	262.353	1.571	50	0		CDAARO
CCc1cc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3[NH2+]2)on1	ZINC000195542400	358559863	/nfs/dbraw/zinc/55/98/63/358559863.db2.gz	IKWNUZXGTOKNGZ-BPNCWPANSA-N	1	0	277.368	1.774	50	0		CDAARO
CCn1c2ccccc2cc(CN2CC[NH2+]CC2)c1=O	ZINC000095095765	358678272	/nfs/dbraw/zinc/67/82/72/358678272.db2.gz	AHLXJYQZGZVQCK-UHFFFAOYSA-N	1	0	271.364	1.427	50	0		CDAARO
CCc1cnc(N)nc1NCC[C@@H](C)[N@@H+](C)CC	ZINC000095355664	358683742	/nfs/dbraw/zinc/68/37/42/358683742.db2.gz	JFDWDDSUVPEWMO-SNVBAGLBSA-N	1	0	251.378	1.763	50	0		CDAARO
CC(C)c1cc(N2CC[C@]3(CN(C)C(=O)O3)C2)nc(N)[nH+]1	ZINC000095360442	358684386	/nfs/dbraw/zinc/68/43/86/358684386.db2.gz	UDFAFMOZNJPAMQ-AWEZNQCLSA-N	1	0	291.355	1.213	50	0		CDAARO
COCc1cc(N2CC[C@@H]3CC[C@H](C2)[N@@H+]3C)ncn1	ZINC000095366589	358686645	/nfs/dbraw/zinc/68/66/45/358686645.db2.gz	FJJMEDJCUMEYKL-QWHCGFSZSA-N	1	0	262.357	1.296	50	0		CDAARO
CCc1cnc(N)nc1N1CC[C@H]([NH+]2CCCC2)C1	ZINC000095372350	358688794	/nfs/dbraw/zinc/68/87/94/358688794.db2.gz	KCAGJVJPHMDVLV-LBPRGKRZSA-N	1	0	261.373	1.296	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CCC(=O)NCCSc1c[nH]nn1	ZINC000095379680	358689679	/nfs/dbraw/zinc/68/96/79/358689679.db2.gz	IWTXVSIWIQZOSV-NSHDSACASA-N	1	0	297.428	1.278	50	0		CDAARO
Cc1nn(C)c2nc(NCC3CC[NH2+]CC3)sc12	ZINC000095497650	358695083	/nfs/dbraw/zinc/69/50/83/358695083.db2.gz	SVJBGQDBHPJSHW-UHFFFAOYSA-N	1	0	265.386	1.750	50	0		CDAARO
CC[NH+](CC)[C@@H]1CCN(C(=O)c2ncoc2C)C1	ZINC000097729583	358794789	/nfs/dbraw/zinc/79/47/89/358794789.db2.gz	BDSHMQVRUIZYKI-LLVKDONJSA-N	1	0	251.330	1.539	50	0		CDAARO
Cc1n[nH]c(CCC(=O)NCCCn2ccnc2)c1C	ZINC000097756347	358796323	/nfs/dbraw/zinc/79/63/23/358796323.db2.gz	LCXCZKQIOIBVNT-UHFFFAOYSA-N	1	0	275.356	1.362	50	0		CDAARO
O=C(CCCc1cn[nH]c1)N1CCC[C@H](c2ncc[nH]2)C1	ZINC000097766443	358797248	/nfs/dbraw/zinc/79/72/48/358797248.db2.gz	WNPVTKGGDBFXPO-ZDUSSCGKSA-N	1	0	287.367	1.862	50	0		CDAARO
OC1(C[NH+]2CCCC2)CCN(Cc2cscn2)CC1	ZINC000215386858	358887264	/nfs/dbraw/zinc/88/72/64/358887264.db2.gz	KULXXBOSGWFZAP-UHFFFAOYSA-N	1	0	281.425	1.566	50	0		CDAARO
C[N@@H+]1CCN2CCN(C/C=C/c3ccc(F)cc3)C[C@@H]2C1	ZINC000215680919	358899429	/nfs/dbraw/zinc/89/94/29/358899429.db2.gz	IGKFSSCAKVZJFG-YATRRXNKSA-N	1	0	289.398	1.771	50	0		CDAARO
C[N@H+]1C[C@H]2CN(Cc3ccccc3OCCO)C[C@H]2C1	ZINC000215840615	358905424	/nfs/dbraw/zinc/90/54/24/358905424.db2.gz	AWMARNNKSODODC-GASCZTMLSA-N	1	0	276.380	1.051	50	0		CDAARO
CC[C@H](NC(=O)CCC[NH+]1CCCC1)c1ccnn1C	ZINC000219370574	359091888	/nfs/dbraw/zinc/09/18/88/359091888.db2.gz	CPULGNGIYXAEPB-ZDUSSCGKSA-N	1	0	278.400	1.863	50	0		CDAARO
COc1ccc(CC[C@@H](C)[NH2+]CCN2CCOCC2)cc1	ZINC000022916989	359142842	/nfs/dbraw/zinc/14/28/42/359142842.db2.gz	WNJANOHTAAFPEC-OAHLLOKOSA-N	1	0	292.423	1.938	50	0		CDAARO
C[NH+](C)CCNC(=O)c1noc2c1COc1ccccc1-2	ZINC000033028790	359276058	/nfs/dbraw/zinc/27/60/58/359276058.db2.gz	CVIQLIUZAFNMFD-UHFFFAOYSA-N	1	0	287.319	1.525	50	0		CDAARO
Cc1cc(=O)cc(C(=O)N2CCC([C@H](C)[NH+](C)C)CC2)o1	ZINC000223708662	359448490	/nfs/dbraw/zinc/44/84/90/359448490.db2.gz	CSLIKNHGNCXSAJ-LBPRGKRZSA-N	1	0	292.379	1.751	50	0		CDAARO
CC[N@@H+]1CC[C@H](CNCc2cccc3c2OCCO3)C1	ZINC000037644343	359438442	/nfs/dbraw/zinc/43/84/42/359438442.db2.gz	BMXJMUROMUIYQF-CYBMUJFWSA-N	1	0	276.380	1.889	50	0		CDAARO
O=C(c1ccoc1)N1CCC[C@@H](C[NH+]2CCOCC2)CC1	ZINC000257184106	359501436	/nfs/dbraw/zinc/50/14/36/359501436.db2.gz	TXOQUZWWPGDSOL-CQSZACIVSA-N	1	0	292.379	1.854	50	0		CDAARO
Cc1ccc(C[N@H+]2C[C@@H](c3ccncc3)[C@H](CO)C2)nc1	ZINC000257192425	359592407	/nfs/dbraw/zinc/59/24/07/359592407.db2.gz	QPWOTEIGDAEEEW-RDJZCZTQSA-N	1	0	283.375	1.993	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)COc1cccc(F)c1	ZINC000262027816	359603775	/nfs/dbraw/zinc/60/37/75/359603775.db2.gz	NTWZVJKHOFWBDH-SNVBAGLBSA-N	1	0	252.289	1.025	50	0		CDAARO
CC1(C)c2ccccc2CC[N@H+]1CCN1C(=O)CNC1=O	ZINC000408513786	359894739	/nfs/dbraw/zinc/89/47/39/359894739.db2.gz	HCBMNVHFEFWWBV-UHFFFAOYSA-N	1	0	287.363	1.332	50	0		CDAARO
Cc1ncc2c(c1CNC(=O)[C@]1(C)CCCO1)CC[NH2+]C2	ZINC000072426977	359935998	/nfs/dbraw/zinc/93/59/98/359935998.db2.gz	IXFCDJBURUBPGJ-INIZCTEOSA-N	1	0	289.379	1.221	50	0		CDAARO
C[C@H]1C[C@@H](C(=O)N[C@H]2CCCC[C@@H]2CO)CC[NH2+]1	ZINC000262333625	360057264	/nfs/dbraw/zinc/05/72/64/360057264.db2.gz	FHIPHDWPCNDWSZ-RVMXOQNASA-N	1	0	254.374	1.042	50	0		CDAARO
CCN1C(=O)[C@H]2CC3(CN2C1=O)CC[NH+](C1CCC1)CC3	ZINC000409419986	360228149	/nfs/dbraw/zinc/22/81/49/360228149.db2.gz	PAFUHVHUHFEVDU-CYBMUJFWSA-N	1	0	291.395	1.678	50	0		CDAARO
CC[C@@H]1CN([C@H](C)c2nc(C)no2)CC[N@@H+]1CCOC	ZINC000248018431	360319918	/nfs/dbraw/zinc/31/99/18/360319918.db2.gz	KZKNJMURWDHMCV-DGCLKSJQSA-N	1	0	282.388	1.482	50	0		CDAARO
Cc1ncccc1CSc1nnc(CC[NH3+])n1C	ZINC000426487293	360572864	/nfs/dbraw/zinc/57/28/64/360572864.db2.gz	FHQJXGUDTYZQPX-UHFFFAOYSA-N	1	0	263.370	1.312	50	0		CDAARO
Cc1ccccc1-n1c(C[NH3+])nnc1SCCCO	ZINC000426507876	360677573	/nfs/dbraw/zinc/67/75/73/360677573.db2.gz	MSOKEAQTBURAEZ-UHFFFAOYSA-N	1	0	278.381	1.509	50	0		CDAARO
COc1cccc(-n2c(C[NH3+])nnc2SC[C@@H](C)O)c1	ZINC000426409091	360665694	/nfs/dbraw/zinc/66/56/94/360665694.db2.gz	SDLYGQZPIVYYKE-SECBINFHSA-N	1	0	294.380	1.208	50	0		CDAARO
CC[C@@H](CNC(=O)c1cc(=O)cc(C)[nH]1)[NH+]1CCCCC1	ZINC000426428041	360669324	/nfs/dbraw/zinc/66/93/24/360669324.db2.gz	NKVHQSPEVHMPAH-ZDUSSCGKSA-N	1	0	291.395	1.678	50	0		CDAARO
C[NH2+]Cc1nnc(SCCn2cc(Cl)cn2)n1C	ZINC000426443197	360670823	/nfs/dbraw/zinc/67/08/23/360670823.db2.gz	ITFNEAPPMJRWKS-UHFFFAOYSA-N	1	0	286.792	1.177	50	0		CDAARO
CCc1ccc(C(=O)NCCC[N@@H+]2CCC[C@H](O)C2)[nH]1	ZINC000426552094	361012797	/nfs/dbraw/zinc/01/27/97/361012797.db2.gz	YJOXHRITSKYNQO-ZDUSSCGKSA-N	1	0	279.384	1.154	50	0		CDAARO
C[C@@H]1C[N@@H+](C[C@@H](O)COC2CCCCC2)C[C@H](C)O1	ZINC000012414140	361229434	/nfs/dbraw/zinc/22/94/34/361229434.db2.gz	WRNHQEHAJUBKFK-HZSPNIEDSA-N	1	0	271.401	1.806	50	0		CDAARO
OCC[C@]1([NH2+]Cc2cccc3c2OCCO3)CCOC1	ZINC000278112349	366761616	/nfs/dbraw/zinc/76/16/16/366761616.db2.gz	BLTIEALXKFUTNL-HNNXBMFYSA-N	1	0	279.336	1.089	50	0		CDAARO
O=S(=O)(NC[C@@H]1CCC[NH2+]C1)c1ccccc1F	ZINC000019271219	364072607	/nfs/dbraw/zinc/07/26/07/364072607.db2.gz	QYJOEXAESIUATJ-SNVBAGLBSA-N	1	0	272.345	1.104	50	0		CDAARO
O=C(Cc1ccccc1Cl)N1CCC[NH2+]CC1	ZINC000019388875	364074581	/nfs/dbraw/zinc/07/45/81/364074581.db2.gz	FLDLZSTXMRYBOX-UHFFFAOYSA-N	1	0	252.745	1.704	50	0		CDAARO
O=C(N1CCC[C@H]([C@@H]2CCCC[NH2+]2)C1)C(F)(F)F	ZINC000306254360	364901236	/nfs/dbraw/zinc/90/12/36/364901236.db2.gz	OTDXOACONCIDHG-UWVGGRQHSA-N	1	0	264.291	1.929	50	0		CDAARO
Cc1nc(/C=C\C(=O)N2CC[NH2+]C[C@@H]2C)cs1	ZINC000606441627	366875565	/nfs/dbraw/zinc/87/55/65/366875565.db2.gz	BXLMSQYLSJBVON-TYRPZCRBSA-N	1	0	251.355	1.285	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1ncccc1S(N)(=O)=O	ZINC000089977244	366993866	/nfs/dbraw/zinc/99/38/66/366993866.db2.gz	NMSICFJSWDQFCX-NSHDSACASA-N	1	0	298.412	1.015	50	0		CDAARO
OC[C@H](O)C[NH2+]Cc1ccc(SC(F)(F)F)cc1	ZINC000090282352	367027796	/nfs/dbraw/zinc/02/77/96/367027796.db2.gz	RNUJXDRNNNJSSB-SECBINFHSA-N	1	0	281.299	1.741	50	0		CDAARO
Cc1ccc(C)c(CC(=O)N[C@H]2CC[NH2+]C[C@H]2C)c1	ZINC000094345414	367399381	/nfs/dbraw/zinc/39/93/81/367399381.db2.gz	IOJPQDWJWCMNEZ-HIFRSBDPSA-N	1	0	260.381	1.960	50	0		CDAARO
Cc1ccc(C(=O)N[C@H]2CC[NH2+]C[C@@H]2C)cc1F	ZINC000094345420	367472055	/nfs/dbraw/zinc/47/20/55/367472055.db2.gz	MCUGJJNOCHPIBJ-GWCFXTLKSA-N	1	0	250.317	1.862	50	0		CDAARO
CCOc1cc(CNC(=O)N2CC[C@H]([NH3+])C2)ccc1OC	ZINC000417646239	242572922	/nfs/dbraw/zinc/57/29/22/242572922.db2.gz	IHYIZQAJSCWCDA-LBPRGKRZSA-N	1	0	293.367	1.337	50	0		CDAARO
COC(=O)[C@@H]1[C@@H](O)CCCN1Cc1ccc(F)c(C)c1	ZINC000252549064	368154689	/nfs/dbraw/zinc/15/46/89/368154689.db2.gz	QRESKCTYKULCBG-KBPBESRZSA-N	1	0	281.327	1.632	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]Cc2cc(CC)no2)CC1	ZINC000089156970	370139946	/nfs/dbraw/zinc/13/99/46/370139946.db2.gz	WQACVOHGXZNMQD-UHFFFAOYSA-N	1	0	281.356	1.948	50	0		CDAARO
COCC[NH+]1[C@H](C)CN(Cc2ccnc(N)c2)C[C@H]1C	ZINC000193446406	370494111	/nfs/dbraw/zinc/49/41/11/370494111.db2.gz	ZXCFLQMKDMIRQY-CHWSQXEVSA-N	1	0	278.400	1.205	50	0		CDAARO
O=C(NCC1CC[NH+]([C@@H]2CCOC2)CC1)c1ccco1	ZINC000575608547	370625690	/nfs/dbraw/zinc/62/56/90/370625690.db2.gz	TYUMSQYIYSARIA-CYBMUJFWSA-N	1	0	278.352	1.510	50	0		CDAARO
Cn1nc(CNC(=O)CC[NH+](C)C)c2c1cccc2Cl	ZINC000299757529	372745133	/nfs/dbraw/zinc/74/51/33/372745133.db2.gz	JATLIIYBPVLVHC-UHFFFAOYSA-N	1	0	294.786	1.795	50	0		CDAARO
Cc1cc(C)cc(NC(=O)N[C@@H]2C[NH2+]CC[C@H]2O)c1	ZINC000299790280	372764409	/nfs/dbraw/zinc/76/44/09/372764409.db2.gz	BNYVTNVITHAGHV-CHWSQXEVSA-N	1	0	263.341	1.148	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@H]1NC(=O)Cc1ccc(F)cc1F	ZINC000095066531	373706495	/nfs/dbraw/zinc/70/64/95/373706495.db2.gz	FNGZTJNRLRFTOO-NOZJJQNGSA-N	1	0	268.307	1.764	50	0		CDAARO
Cc1noc([C@@H]2C[N@H+](Cc3cccc(F)c3)C[C@H]2CO)n1	ZINC000253412515	373722005	/nfs/dbraw/zinc/72/20/05/373722005.db2.gz	RFWODKUQXJXQSB-GXTWGEPZSA-N	1	0	291.326	1.725	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(c2cnc3ccccc3n2)C[C@@H]1C	ZINC000106839994	373785598	/nfs/dbraw/zinc/78/55/98/373785598.db2.gz	KJQDZROGKDMIOC-STQMWFEESA-N	1	0	286.379	1.521	50	0		CDAARO
CC(C)CCN1C(=O)C[C@@H]([N@@H+]2CC[C@]3(CCOC3)C2)C1=O	ZINC000102683622	374156266	/nfs/dbraw/zinc/15/62/66/374156266.db2.gz	LWTYVPAICCMJPD-CJNGLKHVSA-N	1	0	294.395	1.272	50	0		CDAARO
C[C@H](C[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)[S@@](C)=O	ZINC000108329941	412824925	/nfs/dbraw/zinc/82/49/25/412824925.db2.gz	WEIYYPXDJDGTLF-DZJNOPEPSA-N	1	0	271.426	1.691	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1ccc(OC)cc1O	ZINC000019840143	374805564	/nfs/dbraw/zinc/80/55/64/374805564.db2.gz	OYAGXVGFHWUOEU-LLVKDONJSA-N	1	0	278.352	1.615	50	0		CDAARO
[NH3+]CCCOC1CCN(C(=O)c2ccc(F)cc2F)CC1	ZINC000094070854	374810894	/nfs/dbraw/zinc/81/08/94/374810894.db2.gz	FLNKDJJKKBKHLA-UHFFFAOYSA-N	1	0	298.333	1.935	50	0		CDAARO
OCC1CCN(CC[NH2+]Cc2cccc3c[nH]nc32)CC1	ZINC000095409417	374911290	/nfs/dbraw/zinc/91/12/90/374911290.db2.gz	DKMQSQYWEKHNJG-UHFFFAOYSA-N	1	0	288.395	1.357	50	0		CDAARO
Fc1ccc(N2CCC(C[NH+]3CCOCC3)CC2)nc1	ZINC000096136124	375059676	/nfs/dbraw/zinc/05/96/76/375059676.db2.gz	MTPDSGRJCNPURN-UHFFFAOYSA-N	1	0	279.359	1.769	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)NC[C@@H](O)c1ccccc1Cl	ZINC000299739397	375199905	/nfs/dbraw/zinc/19/99/05/375199905.db2.gz	NYVBJFREQOCWFU-CQSZACIVSA-N	1	0	296.798	1.879	50	0		CDAARO
C[C@@H]1CCCN(C(=O)C2CCSCC2)[C@H]1C[NH3+]	ZINC000299739874	375200100	/nfs/dbraw/zinc/20/01/00/375200100.db2.gz	SOXPZDJAUARDJX-PWSUYJOCSA-N	1	0	256.415	1.715	50	0		CDAARO
CCc1noc(C[C@H]2CCOC3(CC[NH2+]CC3)C2)n1	ZINC000257181263	190007668	/nfs/dbraw/zinc/00/76/68/190007668.db2.gz	FKAFUFVIKBBJHT-LLVKDONJSA-N	1	0	265.357	1.723	50	0		CDAARO
C[C@H]([NH3+])CONC(=O)/C=C\c1c(F)cccc1F	ZINC000606445133	375826476	/nfs/dbraw/zinc/82/64/76/375826476.db2.gz	UHFYAXUZWYZVNJ-SLGIHZDVSA-N	1	0	256.252	1.373	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)NCC[C@H]1CCC[N@@H+](C)C1	ZINC000067489681	377109214	/nfs/dbraw/zinc/10/92/14/377109214.db2.gz	HGYSWTOLSAPJRV-CYBMUJFWSA-N	1	0	278.400	1.417	50	0		CDAARO
CCS(=O)(=O)NCC[N@@H+]1[C@H](C)C[C@H]2CCCC[C@H]21	ZINC000245339185	378072093	/nfs/dbraw/zinc/07/20/93/378072093.db2.gz	RBZCOTIIGANSMM-JHJVBQTASA-N	1	0	274.430	1.579	50	0		CDAARO
Cn1cncc1C(=O)NC1CC[NH+](Cc2ccncc2)CC1	ZINC000278512065	194021025	/nfs/dbraw/zinc/02/10/25/194021025.db2.gz	ASHJLQXHXVVSQT-UHFFFAOYSA-N	1	0	299.378	1.210	50	0		CDAARO
O=S1(=O)N=C([C@@H]2CCC[NH2+]C2)Nc2ccccc21	ZINC000019375689	285074190	/nfs/dbraw/zinc/07/41/90/285074190.db2.gz	KKMPELAPYDJMTC-SECBINFHSA-N	1	0	265.338	1.199	50	0		CDAARO
COCCC1(C(=O)NC2CC[NH+](C3CC3)CC2)CCC1	ZINC000096471712	533180581	/nfs/dbraw/zinc/18/05/81/533180581.db2.gz	PBIIDLIRMIWURF-UHFFFAOYSA-N	1	0	280.412	1.936	50	0		CDAARO
CCn1ncnc1CN(CC[NH+](C)C)Cc1ccsc1	ZINC000055281467	256877445	/nfs/dbraw/zinc/87/74/45/256877445.db2.gz	NSOWOXNCGNKSTQ-UHFFFAOYSA-N	1	0	293.440	1.923	50	0		CDAARO
CS(=O)(=O)c1cc(F)ccc1N1CCC[NH2+]CC1	ZINC000015443734	390216817	/nfs/dbraw/zinc/21/68/17/390216817.db2.gz	VRIBWPNQUFTKKP-UHFFFAOYSA-N	1	0	272.345	1.029	50	0		CDAARO
COc1ccccc1OCCN1CC[NH2+][C@@H](C)C1	ZINC000033359727	390389564	/nfs/dbraw/zinc/38/95/64/390389564.db2.gz	WKKSBZMLDRMLNH-LBPRGKRZSA-N	1	0	250.342	1.368	50	0		CDAARO
Cc1ccccc1CNC(=O)C[N@@H+](C)C(C)(C)CO	ZINC000096412971	390511232	/nfs/dbraw/zinc/51/12/32/390511232.db2.gz	UIOSUGKDVPZKLT-UHFFFAOYSA-N	1	0	264.369	1.314	50	0		CDAARO
CN(C(=O)COCc1ccccc1Cl)[C@H]1CC[NH2+]C1	ZINC000179049475	390938317	/nfs/dbraw/zinc/93/83/17/390938317.db2.gz	AFSSNJHHEIGADK-LBPRGKRZSA-N	1	0	282.771	1.677	50	0		CDAARO
CS(=O)(=O)CC1(C[NH2+]Cc2ccsc2)CC1	ZINC000096449365	533330454	/nfs/dbraw/zinc/33/04/54/533330454.db2.gz	BEWIVFJHFQNTKO-UHFFFAOYSA-N	1	0	259.396	1.663	50	0		CDAARO
CC1CCC(C[N@@H+]2C[C@H]3OCCN(C)[C@H]3C2)CC1	ZINC000093642451	391716221	/nfs/dbraw/zinc/71/62/21/391716221.db2.gz	JRBOKPHKHFWPRU-PFSRBDOWSA-N	1	0	252.402	1.828	50	0		CDAARO
Fc1ccc(C[N@@H+]2CC[C@@H]3OCc4cnnn4[C@H]3C2)cc1	ZINC000299790277	391721440	/nfs/dbraw/zinc/72/14/40/391721440.db2.gz	BQZWUEXFEZVYGD-GJZGRUSLSA-N	1	0	288.326	1.763	50	0		CDAARO
CC(C)C[N@@H+]1CCCN(C(=O)c2ccnnc2)CC1	ZINC000372284868	391846114	/nfs/dbraw/zinc/84/61/14/391846114.db2.gz	FPKGPAYEAZPVGA-UHFFFAOYSA-N	1	0	262.357	1.281	50	0		CDAARO
C[C@@H]1CCNC(=O)[C@H]1[NH2+]Cc1ccc(Cl)cc1	ZINC000193592617	391901447	/nfs/dbraw/zinc/90/14/47/391901447.db2.gz	BHFNTYUJMQZJJC-SKDRFNHKSA-N	1	0	252.745	1.954	50	0		CDAARO
O=C(C[NH+]1CCCC1)Nc1ccc(N2CCOCC2)cc1	ZINC000007588718	134666218	/nfs/dbraw/zinc/66/62/18/134666218.db2.gz	VSQMMPIDVSACFW-UHFFFAOYSA-N	1	0	289.379	1.558	50	0		CDAARO
[NH3+][C@H]1CC[C@H](C(=O)N2CCN(c3ccc(O)cc3)CC2)C1	ZINC000091546291	135072260	/nfs/dbraw/zinc/07/22/60/135072260.db2.gz	LOVTUSVNAOKKRV-STQMWFEESA-N	1	0	289.379	1.168	50	0		CDAARO
Cc1cc2ncn([C@H]3CC(=O)N(C)C3=O)c2cc1C	ZINC000100268262	398103755	/nfs/dbraw/zinc/10/37/55/398103755.db2.gz	UBWHKBKIXHRVDB-LBPRGKRZSA-N	1	0	257.293	1.583	50	0		CDAARO
O=C(NC1CC[NH+](C2CCCC2)CC1)N[C@H]1CCCOC1	ZINC000095407387	147114425	/nfs/dbraw/zinc/11/44/25/147114425.db2.gz	FTUMDZADHBWRHL-AWEZNQCLSA-N	1	0	295.427	1.872	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNS(=O)(=O)CC1CCCC1	ZINC000178337740	148052312	/nfs/dbraw/zinc/05/23/12/148052312.db2.gz	BHICFHPYEBEYEQ-AWEZNQCLSA-N	1	0	288.457	1.970	50	0		CDAARO
Cc1n[nH]cc1C1CC[NH+]([C@@H]2CCN(C(C)C)C2=O)CC1	ZINC000375337794	160370379	/nfs/dbraw/zinc/37/03/79/160370379.db2.gz	UUFZYJXFSGJNQU-OAHLLOKOSA-N	1	0	290.411	1.907	50	0		CDAARO
CS(=O)(=O)N[C@@H](c1ccccc1)[C@@H]([NH3+])c1ccccc1	ZINC000002511780	286619717	/nfs/dbraw/zinc/61/97/17/286619717.db2.gz	FSRRNSLQEDUDTP-GJZGRUSLSA-N	1	0	290.388	1.977	50	0		CDAARO
COc1csc(C(=O)N2CCC[C@@]3(CC[NH2+]C3)C2)c1	ZINC000367401447	159482589	/nfs/dbraw/zinc/48/25/89/159482589.db2.gz	LEVPDQMMYMGZSD-AWEZNQCLSA-N	1	0	280.393	1.972	50	0		CDAARO
C[C@@H](c1ccccc1)S(=O)(=O)CCSC(N)=[NH2+]	ZINC000004697663	170001140	/nfs/dbraw/zinc/00/11/40/170001140.db2.gz	GFLGZLRLTYTSMA-VIFPVBQESA-N	1	0	272.395	1.789	50	0		CDAARO
C[NH+](C)CCn1cnc2c3ccccc3[nH]c2c1=O	ZINC000004808952	170020295	/nfs/dbraw/zinc/02/02/95/170020295.db2.gz	NMEQPELIIZLQFH-UHFFFAOYSA-N	1	0	256.309	1.439	50	0		CDAARO
COc1ccc(OC)c(C[N@@H+]2CCC[C@@H](CO)C2)c1	ZINC000004948781	170044622	/nfs/dbraw/zinc/04/46/22/170044622.db2.gz	SKJLZHXVXSIVQB-GFCCVEGCSA-N	1	0	265.353	1.908	50	0		CDAARO
OCCNc1nc2ccccc2n1CC[NH+]1CCCCC1	ZINC000005027704	170057520	/nfs/dbraw/zinc/05/75/20/170057520.db2.gz	VDQSCQNVQBJBPB-UHFFFAOYSA-N	1	0	288.395	1.926	50	0		CDAARO
COC[C@H](O)c1ccc(OC[C@@H](O)C[NH2+]C(C)C)cc1	ZINC000005760468	170137728	/nfs/dbraw/zinc/13/77/28/170137728.db2.gz	OFRYBPCSEMMZHR-ZFWWWQNUSA-N	1	0	283.368	1.104	50	0	world	CDAARO
C[NH+](C)CCNS(=O)(=O)c1ccc2c(c1)CCC2	ZINC000007612687	170294116	/nfs/dbraw/zinc/29/41/16/170294116.db2.gz	GIIFIANAHCRQQB-UHFFFAOYSA-N	1	0	268.382	1.015	50	0		CDAARO
O=C(CSC1=[NH+]CCN1)Nc1ccc(Cl)cc1	ZINC000008048420	170316242	/nfs/dbraw/zinc/31/62/42/170316242.db2.gz	GWIWTBCBMURHDT-UHFFFAOYSA-N	1	0	269.757	1.971	50	0		CDAARO
O=C(CC[NH+]1CCCCC1)NC(=O)NCc1ccccc1	ZINC000010050725	170396972	/nfs/dbraw/zinc/39/69/72/170396972.db2.gz	ZTWUWRQYFCTTEN-UHFFFAOYSA-N	1	0	289.379	1.888	50	0		CDAARO
C[NH+](C)CCCNS(=O)(=O)Cc1ccccc1F	ZINC000010111491	170397655	/nfs/dbraw/zinc/39/76/55/170397655.db2.gz	QXRPITNEFSGGEG-UHFFFAOYSA-N	1	0	274.361	1.197	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1cccc(C)c1O	ZINC000019839319	170888199	/nfs/dbraw/zinc/88/81/99/170888199.db2.gz	PFLRYICUOKPIEH-UHFFFAOYSA-N	1	0	250.342	1.772	50	0		CDAARO
C[NH+](C)[C@H]1CCN(Cc2nc(Cc3ccsc3)no2)C1	ZINC000020868061	171276696	/nfs/dbraw/zinc/27/66/96/171276696.db2.gz	HAQKUYRWGWKALR-LBPRGKRZSA-N	1	0	292.408	1.858	50	0		CDAARO
COc1ccc(C[NH2+]CCN2CCOCC2)cc1Cl	ZINC000020967704	171282100	/nfs/dbraw/zinc/28/21/00/171282100.db2.gz	NYILZHGYHZDXGO-UHFFFAOYSA-N	1	0	284.787	1.770	50	0		CDAARO
[NH3+][C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2F)C1	ZINC000036905550	172794298	/nfs/dbraw/zinc/79/42/98/172794298.db2.gz	OSZOOGSQIXVSND-SECBINFHSA-N	1	0	276.308	1.077	50	0		CDAARO
[NH3+]CCOc1ccc2nnc(-c3cccc(F)c3)n2n1	ZINC000038478044	174142063	/nfs/dbraw/zinc/14/20/63/174142063.db2.gz	KYUBDRWITBSVNQ-UHFFFAOYSA-N	1	0	273.271	1.268	50	0		CDAARO
Cc1cccc(-n2cccc2CN2CCO[C@H](C[NH3+])C2)c1	ZINC000071422122	176160885	/nfs/dbraw/zinc/16/08/85/176160885.db2.gz	MXDFLPLIQZCCKQ-QGZVFWFLSA-N	1	0	285.391	1.945	50	0		CDAARO
C[NH2+]CC(=O)N1CCC[C@H]1c1nc(-c2cccnc2)no1	ZINC000071761209	176261293	/nfs/dbraw/zinc/26/12/93/176261293.db2.gz	AGUKOZCFGREYIN-NSHDSACASA-N	1	0	287.323	1.015	50	0		CDAARO
CCCn1ccnc1CN1CCC[C@](O)(C[NH+](C)C)CC1	ZINC000072144887	176325107	/nfs/dbraw/zinc/32/51/07/176325107.db2.gz	XWRIMQIRYIMFAM-MRXNPFEDSA-N	1	0	294.443	1.572	50	0		CDAARO
C[NH+](C)CCNc1cc(-c2ccc[nH]c2=O)c2cc[nH]c2n1	ZINC000072165876	176331279	/nfs/dbraw/zinc/33/12/79/176331279.db2.gz	YUVDOXXCVOEHKU-UHFFFAOYSA-N	1	0	297.362	1.892	50	0		CDAARO
CC[C@H]1COCCN1C(=O)[C@H](Cc1ccccc1)[NH+](C)C	ZINC000077522239	177277678	/nfs/dbraw/zinc/27/76/78/177277678.db2.gz	QZEZUIWLKXWRQR-HOTGVXAUSA-N	1	0	290.407	1.797	50	0		CDAARO
C[NH+]1CCN(c2ncnc(-c3ccccc3)c2N)CC1	ZINC000096282102	273901495	/nfs/dbraw/zinc/90/14/95/273901495.db2.gz	YJDZOMAPICHLOA-UHFFFAOYSA-N	1	0	269.352	1.478	50	0		CDAARO
O=c1c2cccc(C(F)(F)F)c2ncn1[C@H]1CC[NH2+]C1	ZINC000042963324	275043007	/nfs/dbraw/zinc/04/30/07/275043007.db2.gz	FZFPKRLKDHAHPE-QMMMGPOBSA-N	1	0	283.253	1.950	50	0		CDAARO
Brc1nnc(N2CCC[NH2+]CC2)s1	ZINC000072137439	275378792	/nfs/dbraw/zinc/37/87/92/275378792.db2.gz	OIMOFEIMUFTFCL-UHFFFAOYSA-N	1	0	263.164	1.100	50	0		CDAARO
CC(C)c1nn(C)c(Cl)c1C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179104718	276071278	/nfs/dbraw/zinc/07/12/78/276071278.db2.gz	ULMDCYKODSXBOJ-VIFPVBQESA-N	1	0	284.791	1.631	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]([C@H]2NCCc3nc(N)sc32)C1	ZINC000071681692	276168033	/nfs/dbraw/zinc/16/80/33/276168033.db2.gz	UZMGXJDDFLOXRZ-MWLCHTKSSA-N	1	0	266.414	1.644	50	0		CDAARO
CCOC(=O)c1n[nH]cc1CN1CCC[C@]2(CC[NH2+]C2)C1	ZINC000067820047	276303538	/nfs/dbraw/zinc/30/35/38/276303538.db2.gz	HVDHXQDIPJICGM-OAHLLOKOSA-N	1	0	292.383	1.162	50	0		CDAARO
C[NH+]1CCN(c2cncc(Br)c2)CC1	ZINC000071255624	277113873	/nfs/dbraw/zinc/11/38/73/277113873.db2.gz	OJCUHUIYERGNRZ-UHFFFAOYSA-N	1	0	256.147	1.596	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(CC1)C[NH2+]CCO2	ZINC000066054966	277181884	/nfs/dbraw/zinc/18/18/84/277181884.db2.gz	FRROFBJYHIEDPS-UHFFFAOYSA-N	1	0	256.346	1.376	50	0	in-vitro	CDAARO
COc1cccc2c1CC[C@H]2[NH2+][C@H]1CCCNC1=O	ZINC000095421370	278036792	/nfs/dbraw/zinc/03/67/92/278036792.db2.gz	XPUSFAWKQLEPJN-OLZOCXBDSA-N	1	0	260.337	1.551	50	0		CDAARO
COc1cnc(N2CCN(c3cc(C)[nH+]c(C)c3)CC2)nc1	ZINC000077555234	278072163	/nfs/dbraw/zinc/07/21/63/278072163.db2.gz	UKPKGJIQCFOKOM-UHFFFAOYSA-N	1	0	299.378	1.824	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@@H]2Cc3ccccc3C[NH2+]2)C[C@H](C)O1	ZINC000019474677	278673102	/nfs/dbraw/zinc/67/31/02/278673102.db2.gz	OJBMKRPUCMZCIY-ZOWXZIJZSA-N	1	0	274.364	1.337	50	0		CDAARO
[NH3+]C[C@@H]1CN(c2nc3cc(Cl)ccc3o2)CCO1	ZINC000022637899	279644388	/nfs/dbraw/zinc/64/43/88/279644388.db2.gz	XWNXQWYCGICPDT-SECBINFHSA-N	1	0	267.716	1.645	50	0		CDAARO
O=S1(=O)CCN(c2cc[nH+]c3ccccc32)CC1	ZINC000095409594	280347438	/nfs/dbraw/zinc/34/74/38/280347438.db2.gz	LIYGBFXLAKKIAE-UHFFFAOYSA-N	1	0	262.334	1.470	50	0		CDAARO
CCOCC(C)(C)NC(=O)N(C)Cc1nc(C)c[nH]1	ZINC000534590127	328317789	/nfs/dbraw/zinc/31/77/89/328317789.db2.gz	BRSRLIWUNAEOQG-UHFFFAOYSA-N	1	0	268.361	1.675	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)N[C@H](CO)CC1CCCCC1	ZINC000534592634	328318584	/nfs/dbraw/zinc/31/85/84/328318584.db2.gz	NANAMCJDGXZHLY-HNNXBMFYSA-N	1	0	282.428	1.824	50	0		CDAARO
Cc1n[nH]nc1C(=O)N1CCCC2(CC[NH2+]CC2)CC1	ZINC000534644795	328330359	/nfs/dbraw/zinc/33/03/59/328330359.db2.gz	VAQWEQHBLYUDTE-UHFFFAOYSA-N	1	0	277.372	1.109	50	0		CDAARO
Cc1ccc2c(c1)C(=O)N1C[C@H]([NH+](C)C)C[C@H]1C(=O)N2	ZINC000534651173	328337259	/nfs/dbraw/zinc/33/72/59/328337259.db2.gz	GBUIJCLRRRAWTJ-MFKMUULPSA-N	1	0	273.336	1.092	50	0		CDAARO
CCOCC(=O)NC[C@@H]1CC[N@@H+](C2CCCCC2)C1	ZINC000534655005	328338990	/nfs/dbraw/zinc/33/89/90/328338990.db2.gz	XRCZRYVLLVSMIJ-ZDUSSCGKSA-N	1	0	268.401	1.794	50	0		CDAARO
Cc1ncncc1C(=O)NC[C@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534658245	328341284	/nfs/dbraw/zinc/34/12/84/328341284.db2.gz	QEJMMPHMUOKUOW-CYBMUJFWSA-N	1	0	288.395	1.779	50	0		CDAARO
Cn1c(Sc2ncccc2F)nnc1C1CC[NH2+]CC1	ZINC000534674472	328349109	/nfs/dbraw/zinc/34/91/09/328349109.db2.gz	KEMZMGQEUMGUKI-UHFFFAOYSA-N	1	0	293.371	1.967	50	0		CDAARO
CCC(CC)(C[NH3+])NS(=O)(=O)c1ccc(C(C)=O)cc1	ZINC000124070703	323209263	/nfs/dbraw/zinc/20/92/63/323209263.db2.gz	UXHWMRGKYIUFHT-UHFFFAOYSA-N	1	0	298.408	1.685	50	0		CDAARO
C[C@@]1(C(=O)NCC2(CO)CCCC2)CCC[NH2+]C1	ZINC000135096339	328448927	/nfs/dbraw/zinc/44/89/27/328448927.db2.gz	OCEGXQQOFCIEIE-CYBMUJFWSA-N	1	0	254.374	1.045	50	0		CDAARO
Cc1nc(C(=O)N2CCCC[C@H]2[C@@H](C)[NH3+])cs1	ZINC000087428991	330372988	/nfs/dbraw/zinc/37/29/88/330372988.db2.gz	ARQJCOWHKDSIHB-KCJUWKMLSA-N	1	0	253.371	1.793	50	0		CDAARO
Cc1nc(CN(CC[NH+](C)C)C(=O)C[C@@H]2C=CCC2)c[nH]1	ZINC001772702420	1159437652	/nfs/dbraw/zinc/43/76/52/1159437652.db2.gz	RVOKXNPEWGRMBP-CQSZACIVSA-N	1	0	290.411	1.965	50	0		CDAARO
CCC[NH+]1CCC(CCNc2nnc(CNC)o2)CC1	ZINC001772707574	1159442667	/nfs/dbraw/zinc/44/26/67/1159442667.db2.gz	WBLGFRKUXBZQSV-UHFFFAOYSA-N	1	0	281.404	1.713	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CC2(CO)CCC2)n1	ZINC000670456665	483036163	/nfs/dbraw/zinc/03/61/63/483036163.db2.gz	FEHZVUTYOILMNE-LBPRGKRZSA-N	1	0	251.374	1.641	50	0		CDAARO
O[C@H]1CN(CCOCc2ccccc2)C[C@@H]1[NH+]1CCCC1	ZINC000670461356	483044698	/nfs/dbraw/zinc/04/46/98/483044698.db2.gz	VIMDRNNHTJWWCB-IRXDYDNUSA-N	1	0	290.407	1.344	50	0		CDAARO
O=C([C@@H]1CC=CCC1)N1CCC(O)(C[NH+]2CCCC2)CC1	ZINC000670461635	483045117	/nfs/dbraw/zinc/04/51/17/483045117.db2.gz	RGQHAFBEQSLTBX-OAHLLOKOSA-N	1	0	292.423	1.792	50	0		CDAARO
CC1(C)CCC[C@H]([NH2+]CCc2nc(N)cc(=O)[nH]2)C1	ZINC000670463561	483054592	/nfs/dbraw/zinc/05/45/92/483054592.db2.gz	ZYURYBPJGRDMPU-JTQLQIEISA-N	1	0	264.373	1.865	50	0		CDAARO
Cc1ccc(N2CC[N@H+](CCn3cnnc3)[C@@H](C)C2)cc1	ZINC000670472617	483081787	/nfs/dbraw/zinc/08/17/87/483081787.db2.gz	GFRRHYCIZYMDJD-HNNXBMFYSA-N	1	0	285.395	1.797	50	0		CDAARO
COC(=O)[C@H]1C[C@H]2COC[C@@H](C1)[C@H]2[NH2+]Cc1ccccc1	ZINC000665887151	483134569	/nfs/dbraw/zinc/13/45/69/483134569.db2.gz	ASMBGGAZSSWLBF-OTHNOENXSA-N	1	0	289.375	1.990	50	0		CDAARO
c1[nH]nc2c1cccc2C[NH2+]CCc1nncn1C1CC1	ZINC000084044417	483236103	/nfs/dbraw/zinc/23/61/03/483236103.db2.gz	JRJOMCFIMWAMIT-UHFFFAOYSA-N	1	0	282.351	1.822	50	0		CDAARO
Cc1ccc(C[N@@H+]2CCC[C@H](NS(C)(=O)=O)C2)cc1C	ZINC000096489806	533929755	/nfs/dbraw/zinc/92/97/55/533929755.db2.gz	IXMCSLHUZDSYJK-HNNXBMFYSA-N	1	0	296.436	1.817	50	0		CDAARO
[NH3+]CC[C@H]1CN(Cc2cnccc2Cl)CCO1	ZINC000426711313	534654641	/nfs/dbraw/zinc/65/46/41/534654641.db2.gz	LMPBDVDEPLOTCZ-NSHDSACASA-N	1	0	255.749	1.285	50	0		CDAARO
COCc1cc(C[NH2+]C2CSCCSC2)[nH]n1	ZINC000067872324	522924776	/nfs/dbraw/zinc/92/47/76/522924776.db2.gz	RRLRIZQRQCBDSC-UHFFFAOYSA-N	1	0	273.427	1.494	50	0		CDAARO
COc1ccc(NC(=O)NCC[NH+](C)C)c2cccnc12	ZINC000097051781	567903528	/nfs/dbraw/zinc/90/35/28/567903528.db2.gz	PJEYCZQHIPPCAC-UHFFFAOYSA-N	1	0	288.351	1.927	50	0		CDAARO
CCCCc1ncc(C[N@H+](C)[C@H](C)CC(N)=O)[nH]1	ZINC000952990123	614491345	/nfs/dbraw/zinc/49/13/45/614491345.db2.gz	KLOHTGMGIGDDJG-SNVBAGLBSA-N	1	0	252.362	1.448	50	0		CDAARO
CCC(CC)[C@@H]([NH3+])C1(O)CCC2(CC1)OCCO2	ZINC000958528771	614577051	/nfs/dbraw/zinc/57/70/51/614577051.db2.gz	USKOXGZHDSLFJE-GFCCVEGCSA-N	1	0	257.374	1.798	50	0		CDAARO
C[C@@H]1[NH2+]CCN(C(=O)C[C@@H](O)c2ccccc2)[C@H]1C	ZINC000888096876	617760255	/nfs/dbraw/zinc/76/02/55/617760255.db2.gz	UXQMATVNQFZIBY-SGMGOOAPSA-N	1	0	262.353	1.319	50	0		CDAARO
OCC1(CO)[C@@H]2C[N@@H+](CC3CCC(F)(F)CC3)C[C@@H]21	ZINC001772707907	1159442532	/nfs/dbraw/zinc/44/25/32/1159442532.db2.gz	XYHUYORSEGDGNS-TXEJJXNPSA-N	1	0	275.339	1.345	50	0		CDAARO
CC(C)N1C(=O)C2(CCCCC2)[C@@H]1C(=O)NCC[NH+](C)C	ZINC000581821566	1161981982	/nfs/dbraw/zinc/98/19/82/1161981982.db2.gz	GYFMCSVJCYDNJU-ZDUSSCGKSA-N	1	0	295.427	1.234	50	0		CDAARO
Clc1ccc2ncc(N3C[C@@H]4C[C@H]3C[NH2+]4)nc2c1	ZINC000032565326	912885207	/nfs/dbraw/zinc/88/52/07/912885207.db2.gz	FXARYFMNQJFHLX-UWVGGRQHSA-N	1	0	260.728	1.834	50	0		CDAARO
C[C@H](C(=O)N(C)CC[NH+]1CCCCCC1)n1ccnc1	ZINC000426646957	902880025	/nfs/dbraw/zinc/88/00/25/902880025.db2.gz	BYWUNKXEZRWRDL-CQSZACIVSA-N	1	0	278.400	1.779	50	0		CDAARO
CC(C)c1nccn1CCC[NH2+]Cc1cncnc1	ZINC000952870370	910421576	/nfs/dbraw/zinc/42/15/76/910421576.db2.gz	YIWQVPKJDGYBDW-UHFFFAOYSA-N	1	0	259.357	1.976	50	0		CDAARO
[NH3+]C[C@@H]1Cc2cccc(-c3n[nH]c(=O)c4ccccc43)c2O1	ZINC000067542293	936618984	/nfs/dbraw/zinc/61/89/84/936618984.db2.gz	JQHFYEDOIHQOCF-NSHDSACASA-N	1	0	293.326	1.852	50	0		CDAARO
CC[C@]1(O)CCC[N@H+](Cc2cnc(OC)nc2)C1	ZINC000822691562	925645792	/nfs/dbraw/zinc/64/57/92/925645792.db2.gz	VDHGFZAUKAOYLJ-ZDUSSCGKSA-N	1	0	251.330	1.222	50	0		CDAARO
CCn1nc(-c2ccco2)nc1C[C@H](C)N1CCOCC1	ZINC000823600814	925708808	/nfs/dbraw/zinc/70/88/08/925708808.db2.gz	XQYAMMBVTPBBOY-LBPRGKRZSA-N	1	0	290.367	1.821	50	0		CDAARO
Cc1nonc1CN(C)C[C@@H]1CC[N@H+](C)C1(C)C	ZINC000823719847	925722233	/nfs/dbraw/zinc/72/22/33/925722233.db2.gz	PPURGDJODSLFBK-NSHDSACASA-N	1	0	252.362	1.540	50	0		CDAARO
C[NH2+]Cc1nc(-c2ccccc2)nn1CC(C)(C)O	ZINC000824050892	925797270	/nfs/dbraw/zinc/79/72/70/925797270.db2.gz	PWRIONFMIDXBSE-UHFFFAOYSA-N	1	0	260.341	1.435	50	0		CDAARO
C[C@@H](NC(=O)N1CC[C@H]([NH3+])C1)c1ccc(F)cc1	ZINC000827541531	925943379	/nfs/dbraw/zinc/94/33/79/925943379.db2.gz	HIVZQNXFPQTFSM-SKDRFNHKSA-N	1	0	251.305	1.629	50	0		CDAARO
OC[C@H]1CCCCN1CC[NH2+]C1Cc2ccccc2C1	ZINC000828710915	926168431	/nfs/dbraw/zinc/16/84/31/926168431.db2.gz	PSFPTIATHGUZCR-QGZVFWFLSA-N	1	0	274.408	1.590	50	0		CDAARO
O=C(N[C@@H]1C[N@H+](C2CCCCC2)CC[C@@H]1CO)C1CC1	ZINC000581799001	927201265	/nfs/dbraw/zinc/20/12/65/927201265.db2.gz	GUZNEDNEQPXUEH-UKRRQHHQSA-N	1	0	280.412	1.528	50	0		CDAARO
CC(C)S(=O)(=O)N1CCC(CC2CC2)([NH+](C)C)CC1	ZINC000581810818	927205257	/nfs/dbraw/zinc/20/52/57/927205257.db2.gz	AWTZCZGRHFCBES-UHFFFAOYSA-N	1	0	288.457	1.921	50	0		CDAARO
COC(=O)/C=C/c1ccc(OCC[N@H+](C)CCCO)cc1	ZINC000585079845	930851806	/nfs/dbraw/zinc/85/18/06/930851806.db2.gz	PKZWRYFYEVVRQF-RMKNXTFCSA-N	1	0	293.363	1.566	50	0		CDAARO
CSC[C@H](C)C(=O)N[C@H]1C[C@H]([NH+](C)C)C12CCC2	ZINC000585130858	931022100	/nfs/dbraw/zinc/02/21/00/931022100.db2.gz	DPPKEWIMOJCZRC-SRVKXCTJSA-N	1	0	270.442	1.975	50	0		CDAARO
O=C(C[C@H](O)c1cccc(F)c1)NC[C@@H]1CCC[NH2+]1	ZINC000864092210	934606020	/nfs/dbraw/zinc/60/60/20/934606020.db2.gz	NFDSXKWCNRHJLN-STQMWFEESA-N	1	0	266.316	1.117	50	0		CDAARO
CCCN1C[C@H]([NH2+]Cc2ccc(CC)cn2)CC1=O	ZINC001529161507	968999530	/nfs/dbraw/zinc/99/95/30/968999530.db2.gz	KZMZAAUMYJWCPJ-CQSZACIVSA-N	1	0	261.369	1.745	50	0		CDAARO
COc1cc(OC)nc(NC[C@H]2CCC[N@@H+]2C(C)C)n1	ZINC001506396452	975147847	/nfs/dbraw/zinc/14/78/47/975147847.db2.gz	GUIPDGUJYRJOSJ-LLVKDONJSA-N	1	0	280.372	1.779	50	0		CDAARO
CC(=O)NC(C)(C)C[C@@H](C)[NH2+]CCc1ncc[nH]1	ZINC001506400966	975149995	/nfs/dbraw/zinc/14/99/95/975149995.db2.gz	AZQGSFUNUFFBQJ-SNVBAGLBSA-N	1	0	252.362	1.235	50	0		CDAARO
Cn1ccnc1CC[NH+]1CCC(Oc2cccnc2)CC1	ZINC001506407708	975152930	/nfs/dbraw/zinc/15/29/30/975152930.db2.gz	ROOBFFOIYLKCDG-UHFFFAOYSA-N	1	0	286.379	1.901	50	0		CDAARO
CCNC(=O)c1ccc(NC(=O)[C@@H](C)[NH3+])cc1Cl	ZINC001506415162	975155443	/nfs/dbraw/zinc/15/54/43/975155443.db2.gz	WLEYQEXPIHQBCU-SSDOTTSWSA-N	1	0	269.732	1.375	50	0		CDAARO
CCc1nccn1[C@H]1CCCN(C(=O)C[NH2+]C2CC2)C1	ZINC000178925553	342450447	/nfs/dbraw/zinc/45/04/47/342450447.db2.gz	FPXOMUOSUWRZSU-ZDUSSCGKSA-N	1	0	276.384	1.361	50	0		CDAARO
Cc1cc([C@H](C)[NH2+]CCCNS(C)(=O)=O)c(C)s1	ZINC000096476472	230379767	/nfs/dbraw/zinc/37/97/67/230379767.db2.gz	IYOXIIIWHIMYGK-JTQLQIEISA-N	1	0	290.454	1.955	50	0		CDAARO
C[N@H+](Cc1nc(-c2cccnn2)no1)C1CCCC1	ZINC000095516436	185001211	/nfs/dbraw/zinc/00/12/11/185001211.db2.gz	NFNPPWSCRAXCIG-UHFFFAOYSA-N	1	0	259.313	1.901	50	0		CDAARO
O=C(Cn1ccc([C@H]2CCC[NH2+]C2)n1)NCc1ccccn1	ZINC000426379705	230416262	/nfs/dbraw/zinc/41/62/62/230416262.db2.gz	KNNOWCCMWCRDGL-ZDUSSCGKSA-N	1	0	299.378	1.062	50	0		CDAARO
C[C@@H]1C[C@@H]([NH3+])CCN1C(=O)Cc1cccc(F)c1	ZINC000124794776	230394562	/nfs/dbraw/zinc/39/45/62/230394562.db2.gz	KUPIMUMTGLKBIB-MFKMUULPSA-N	1	0	250.317	1.706	50	0		CDAARO
OCCN1CC[NH+](C[C@H]2CCOc3ccccc3C2)CC1	ZINC000095529735	185005407	/nfs/dbraw/zinc/00/54/07/185005407.db2.gz	SUHHDRQTPXLAGF-HNNXBMFYSA-N	1	0	290.407	1.238	50	0		CDAARO
Cc1c[nH]c(CNC(=O)CC[C@@H](C)[NH+]2CCCC2)n1	ZINC000426489391	230419894	/nfs/dbraw/zinc/41/98/94/230419894.db2.gz	RDGMNXXEQUEALB-GFCCVEGCSA-N	1	0	264.373	1.599	50	0		CDAARO
Cn1c(Sc2ccncc2F)nnc1C1CC[NH2+]CC1	ZINC000426635197	230425190	/nfs/dbraw/zinc/42/51/90/230425190.db2.gz	AQMDBCYVIXVKFT-UHFFFAOYSA-N	1	0	293.371	1.967	50	0		CDAARO
[NH3+]CCOc1ccc(Cl)cc1C(=O)N1CCC[C@H]1CO	ZINC000426707239	230426930	/nfs/dbraw/zinc/42/69/30/230426930.db2.gz	PYXRHUOUERDMBU-NSHDSACASA-N	1	0	298.770	1.274	50	0		CDAARO
CS(=O)(=O)N[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CCCSC1	ZINC000097371011	342002249	/nfs/dbraw/zinc/00/22/49/342002249.db2.gz	XZJVYNWJQAHZSH-IJLUTSLNSA-N	1	0	292.470	1.190	50	0		CDAARO
COc1ccc([C@H](C)[NH2+]CCN2C(=O)CNC2=O)cc1C	ZINC000095940756	185035631	/nfs/dbraw/zinc/03/56/31/185035631.db2.gz	NXOUQHCPEOJFBD-NSHDSACASA-N	1	0	291.351	1.206	50	0		CDAARO
Cc1cc(N)n(-c2cc(SCC[NH+](C)C)ncn2)n1	ZINC000095966062	185045284	/nfs/dbraw/zinc/04/52/84/185045284.db2.gz	NIQQETQNZYTVEH-UHFFFAOYSA-N	1	0	278.385	1.207	50	0		CDAARO
COC[C@H](Cc1ccccc1)[NH2+][C@H](C)CN1CCOCC1	ZINC000095967311	185047202	/nfs/dbraw/zinc/04/72/02/185047202.db2.gz	QCZNLCHEZHZMMF-WBVHZDCISA-N	1	0	292.423	1.554	50	0		CDAARO
CC(C)(C[NH3+])NS(=O)(=O)c1cccc2ccccc21	ZINC000095972608	185049458	/nfs/dbraw/zinc/04/94/58/185049458.db2.gz	WBAAITGVTPOQSU-UHFFFAOYSA-N	1	0	278.377	1.855	50	0		CDAARO
Cn1cc(C(=O)C[C@@H]2CCC[N@@H+]2C[C@@H]2CCOC2)cn1	ZINC000095977654	185051792	/nfs/dbraw/zinc/05/17/92/185051792.db2.gz	ZMTYBABQLQKULY-JSGCOSHPSA-N	1	0	277.368	1.494	50	0		CDAARO
COc1ccc(C[N@@H+]2C[C@H](C(N)=O)CC[C@@H]2C)c(OC)c1	ZINC000095982667	185053990	/nfs/dbraw/zinc/05/39/90/185053990.db2.gz	DBPIUQSOSNEJGU-WCQYABFASA-N	1	0	292.379	1.790	50	0		CDAARO
CN(Cc1ncnn1C)[C@H]1CC[N@H+](CCc2ccccc2)C1	ZINC000095995529	185060669	/nfs/dbraw/zinc/06/06/69/185060669.db2.gz	KOEDYGWHCBLNDS-INIZCTEOSA-N	1	0	299.422	1.564	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+]C1CCN(C(=O)C(C)(C)C)CC1	ZINC000096008888	185064005	/nfs/dbraw/zinc/06/40/05/185064005.db2.gz	MQICPEXOWCKBML-UHFFFAOYSA-N	1	0	298.427	1.812	50	0		CDAARO
CCOc1oc(C(=O)NCC[N@H+](CC)C2CC2)nc1C	ZINC000096012697	185065801	/nfs/dbraw/zinc/06/58/01/185065801.db2.gz	SYLQATOWCNUZPL-UHFFFAOYSA-N	1	0	281.356	1.596	50	0		CDAARO
CO[C@@H](C(=O)N1CC[C@@H](C[NH+]2CCCCC2)C1)C1CC1	ZINC000241644486	361753142	/nfs/dbraw/zinc/75/31/42/361753142.db2.gz	PRDTZXWALOFUGJ-DZGCQCFKSA-N	1	0	280.412	1.746	50	0		CDAARO
COCc1noc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2CO)n1	ZINC000124989958	187164753	/nfs/dbraw/zinc/16/47/53/187164753.db2.gz	RGSSMHKFNNLJBB-HBNTYKKESA-N	1	0	269.345	1.418	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN1C(=O)C1CCCCC1	ZINC000085469753	282128810	/nfs/dbraw/zinc/12/88/10/282128810.db2.gz	ZTNICKVCRDNOTF-CYBMUJFWSA-N	1	0	254.374	1.356	50	0		CDAARO
CC[NH+]1CCC(c2nc([C@H]3CCOC3)no2)CC1	ZINC000096133585	185104448	/nfs/dbraw/zinc/10/44/48/185104448.db2.gz	FRMDVGZHLDUPKI-NSHDSACASA-N	1	0	251.330	1.773	50	0		CDAARO
COc1nccnc1N1CCCN(c2cc[nH+]c(C)c2)CC1	ZINC000096132459	185104606	/nfs/dbraw/zinc/10/46/06/185104606.db2.gz	AIPAOIIIDNEJOU-UHFFFAOYSA-N	1	0	299.378	1.905	50	0		CDAARO
CCc1ncc(CN(C)C(=O)[C@@H]([NH3+])C(C)C)s1	ZINC000195543825	342626677	/nfs/dbraw/zinc/62/66/77/342626677.db2.gz	SAINKUYUWBUVMM-NSHDSACASA-N	1	0	255.387	1.647	50	0		CDAARO
CCCn1ncnc1[C@H](C)NC(=O)C[N@H+](C)C1CCCC1	ZINC000244594106	361853133	/nfs/dbraw/zinc/85/31/33/361853133.db2.gz	DGLBRKZNLGWROE-LBPRGKRZSA-N	1	0	293.415	1.740	50	0		CDAARO
CCc1nccn1CC[N@@H+]1CCCC[C@H]1CCO	ZINC000244605547	361853980	/nfs/dbraw/zinc/85/39/80/361853980.db2.gz	FAQLDSOAXIYNHY-ZDUSSCGKSA-N	1	0	251.374	1.682	50	0		CDAARO
CC(C)C(=O)N1CC[C@](O)(c2ccccc2)[C@H]([NH+](C)C)C1	ZINC000097942695	342160259	/nfs/dbraw/zinc/16/02/59/342160259.db2.gz	FDBHUTVHSCAKMR-WBVHZDCISA-N	1	0	290.407	1.693	50	0		CDAARO
COC[C@@H]1CC[N@H+](CCCOc2ccc(C(N)=O)cc2)C1	ZINC000244734971	361859639	/nfs/dbraw/zinc/85/96/39/361859639.db2.gz	NQSFIGZCLJUQSU-CYBMUJFWSA-N	1	0	292.379	1.523	50	0		CDAARO
CC(C)[N@@H+]1CC[C@@H](CN(C)C(=O)CCc2cn[nH]c2)C1	ZINC000244773794	361861576	/nfs/dbraw/zinc/86/15/76/361861576.db2.gz	PGRJLZDDKCRLNV-AWEZNQCLSA-N	1	0	278.400	1.531	50	0		CDAARO
Cc1cccc(CCNc2cc([C@H]3C[C@@H]([NH3+])C3)nc(N)n2)n1	ZINC000244778759	361862876	/nfs/dbraw/zinc/86/28/76/361862876.db2.gz	PVYPCUXLQHVLOA-TXEJJXNPSA-N	1	0	298.394	1.622	50	0		CDAARO
CCC1=NO[C@@H](C[N@@H+]2CCCN(c3ncccn3)CC2)C1	ZINC000244858579	361866782	/nfs/dbraw/zinc/86/67/82/361866782.db2.gz	VNRSIQASXIYODQ-CQSZACIVSA-N	1	0	289.383	1.544	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](O)[C@@H]([NH+]2CCc3ccccc3CC2)C1	ZINC000227340929	539088286	/nfs/dbraw/zinc/08/82/86/539088286.db2.gz	ALBKJDCBTBGXHD-JYJNAYRXSA-N	1	0	289.375	1.400	50	0		CDAARO
COC1CCN(CC[NH2+][C@H](C)c2cccnc2)CC1	ZINC000092766917	361927155	/nfs/dbraw/zinc/92/71/55/361927155.db2.gz	ZKXBRLUBNVCCCE-CYBMUJFWSA-N	1	0	263.385	1.843	50	0		CDAARO
c1cn([C@H]2CCC[N@@H+](CCO[C@H]3CCCCO3)CC2)nn1	ZINC000585116339	362043648	/nfs/dbraw/zinc/04/36/48/362043648.db2.gz	RBLIVZWAXAORLQ-GJZGRUSLSA-N	1	0	294.399	1.848	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCN(c2cc(F)ccc2F)CC1	ZINC000095971704	342431849	/nfs/dbraw/zinc/43/18/49/342431849.db2.gz	KTWOJMZJQDCICE-LBPRGKRZSA-N	1	0	283.322	1.351	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)c1cnccc1N	ZINC000128118588	187353346	/nfs/dbraw/zinc/35/33/46/187353346.db2.gz	REFZYKRGGMUCCK-LLVKDONJSA-N	1	0	262.357	1.220	50	0		CDAARO
CN(Cc1ncc[nH]1)c1cc(C2CC([NH3+])C2)ncn1	ZINC000219850614	530026058	/nfs/dbraw/zinc/02/60/58/530026058.db2.gz	WZCJMNAEJNJEGN-UHFFFAOYSA-N	1	0	258.329	1.041	50	0		CDAARO
CC(C)[C@H](C[NH2+][C@H]1CCOC1)ONC(=O)OC(C)(C)C	ZINC000398827651	345586712	/nfs/dbraw/zinc/58/67/12/345586712.db2.gz	CNJHTUQJDFQOBX-RYUDHWBXSA-N	1	0	288.388	1.846	50	0		CDAARO
O=C1N(Cc2ccccc2)CCN1[C@@H]1CCC[NH2+]C1	ZINC000085347907	179029099	/nfs/dbraw/zinc/02/90/99/179029099.db2.gz	RWFMRUWZLKGIRS-CQSZACIVSA-N	1	0	259.353	1.676	50	0		CDAARO
Cc1cc(N2CCC[C@@H](CS(C)(=O)=O)C2)cc[nH+]1	ZINC000292627098	136677978	/nfs/dbraw/zinc/67/79/78/136677978.db2.gz	DVCQGWIZIDCIQV-GFCCVEGCSA-N	1	0	268.382	1.651	50	0		CDAARO
C[C@@H](CC(=O)N(C)Cc1cccc(O)c1)[NH+](C)C	ZINC000584889844	349348667	/nfs/dbraw/zinc/34/86/67/349348667.db2.gz	QQNPSULBRUGLGE-NSHDSACASA-N	1	0	250.342	1.691	50	0		CDAARO
CN(C)C(=O)CC[C@H]1CCC[N@@H+](C2CCOCC2)C1	ZINC000584892784	349352628	/nfs/dbraw/zinc/35/26/28/349352628.db2.gz	GGEXRNQKZJQIHJ-CYBMUJFWSA-N	1	0	268.401	1.746	50	0		CDAARO
CC[NH+](CC)CCCn1cnc2cccnc2c1=O	ZINC000584897334	349359351	/nfs/dbraw/zinc/35/93/51/349359351.db2.gz	QQIDESXVAULXJA-UHFFFAOYSA-N	1	0	260.341	1.523	50	0		CDAARO
OC[C@H]1CN(Cc2cccnc2)C[C@H]1C[NH+]1CCCCC1	ZINC000091416653	180149746	/nfs/dbraw/zinc/14/97/46/180149746.db2.gz	ZIAXIOFKQBQMLF-IAGOWNOFSA-N	1	0	289.423	1.608	50	0		CDAARO
COCC[N@H+](C)C[C@@H]1CN(c2cccc(C)n2)C[C@@H]1CO	ZINC000091644937	180214767	/nfs/dbraw/zinc/21/47/67/180214767.db2.gz	KFVTZOPTTIYJJU-HUUCEWRRSA-N	1	0	293.411	1.013	50	0		CDAARO
CO[C@H]1CC[N@H+](Cc2cc(=O)c3cc(F)ccc3[nH]2)C1	ZINC000091820312	180264049	/nfs/dbraw/zinc/26/40/49/180264049.db2.gz	FOBNWYVEYJPPNM-LBPRGKRZSA-N	1	0	276.311	1.888	50	0		CDAARO
CC[C@H]1CN(Cc2cnc(C)cn2)CC[N@@H+]1C[C@H](C)O	ZINC000106906946	186150006	/nfs/dbraw/zinc/15/00/06/186150006.db2.gz	RBSVBWYRPGFAMU-ZFWWWQNUSA-N	1	0	278.400	1.062	50	0		CDAARO
Cc1ccc(C[C@@H](C[NH3+])CO)cc1Br	ZINC000107496822	186176819	/nfs/dbraw/zinc/17/68/19/186176819.db2.gz	FYWBDJKLELUPOO-JTQLQIEISA-N	1	0	258.159	1.867	50	0		CDAARO
C[NH+](C)CCCS(=O)(=O)N[C@H]1CCCc2ccccc21	ZINC000583651408	366009562	/nfs/dbraw/zinc/00/95/62/366009562.db2.gz	KZPQCGVPMHFRIU-HNNXBMFYSA-N	1	0	296.436	1.935	50	0		CDAARO
[NH3+]C[C@H]1CCCN1C(=O)Cc1cccc(Br)c1	ZINC000122319651	187026411	/nfs/dbraw/zinc/02/64/11/187026411.db2.gz	JTNZLDIMEZWCGT-GFCCVEGCSA-N	1	0	297.196	1.941	50	0		CDAARO
C[C@@H]([NH3+])CCNS(=O)(=O)c1cccc2ccccc21	ZINC000123899628	187113937	/nfs/dbraw/zinc/11/39/37/187113937.db2.gz	MIASWSQLPOORFV-LLVKDONJSA-N	1	0	278.377	1.855	50	0		CDAARO
c1ccc(C[N@@H+]2CC[C@H](Nc3ccc4nnnn4n3)C2)cc1	ZINC000012944106	366094926	/nfs/dbraw/zinc/09/49/26/366094926.db2.gz	PISYHFSXZTZLHW-ZDUSSCGKSA-N	1	0	295.350	1.206	50	0		CDAARO
COc1ccc2c3c1O[C@H]1C[C@@H](O)C=C[C@@]31CC[N@@H+](C)C2	ZINC000000491073	355914424	/nfs/dbraw/zinc/91/44/24/355914424.db2.gz	ASUTZQLVASHGKV-JDFRZJQESA-N	1	0	287.359	1.850	50	0	biogenic,fda	CDAARO
C[C@@H](C[NH+](C)C)OC(=O)c1ccc2c(c1)OCO2	ZINC000000206169	355896558	/nfs/dbraw/zinc/89/65/58/355896558.db2.gz	NPAGVLZASGSDFL-VIFPVBQESA-N	1	0	251.282	1.522	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)C(=O)Nc1ccc(F)cc1	ZINC000002854921	355984697	/nfs/dbraw/zinc/98/46/97/355984697.db2.gz	NTYBNCQWAGMSGA-CYBMUJFWSA-N	1	0	293.342	1.365	50	0		CDAARO
COc1ccc(OCC(=O)OCCC[NH+](C)C)cc1	ZINC000001856449	355953350	/nfs/dbraw/zinc/95/33/50/355953350.db2.gz	NBAPSBYXHUDEOL-UHFFFAOYSA-N	1	0	267.325	1.569	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](CN(C)C(=O)CSC)C1	ZINC000584901737	355956531	/nfs/dbraw/zinc/95/65/31/355956531.db2.gz	KJSUJYKCCRMSOB-LBPRGKRZSA-N	1	0	274.430	1.166	50	0		CDAARO
COc1ccccc1/C(C)=C\C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000255212697	356020204	/nfs/dbraw/zinc/02/02/04/356020204.db2.gz	PNFYAMCHDYOILI-SUIFULHWSA-N	1	0	274.364	1.906	50	0		CDAARO
Nc1ccc(N2CCN(c3ccccc3)CC2)nc1	ZINC000008031022	356113384	/nfs/dbraw/zinc/11/33/84/356113384.db2.gz	WNYRUKPZNBDMMK-UHFFFAOYSA-N	1	0	254.337	1.990	50	0		CDAARO
COc1ccccc1C/C(C)=C\C(=O)N1CC[C@H](C[NH3+])C1	ZINC000255387388	356075698	/nfs/dbraw/zinc/07/56/98/356075698.db2.gz	BRVIVNNVNXMSHI-QLKUMGTLSA-N	1	0	288.391	1.991	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@H](C[NH2+][C@H]2CCOC2)C1	ZINC000097372196	356091694	/nfs/dbraw/zinc/09/16/94/356091694.db2.gz	XAUVDQSSGQNPCX-RYUDHWBXSA-N	1	0	270.373	1.622	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cn1)[C@@H]1CCCO1	ZINC000097374147	356094604	/nfs/dbraw/zinc/09/46/04/356094604.db2.gz	UCKIOGAVCQKVRI-KOLCDFICSA-N	1	0	283.759	1.831	50	0		CDAARO
CC(=O)c1ccc(NCC(C)(C)N2CCOCC2)nc1	ZINC000032547786	356228957	/nfs/dbraw/zinc/22/89/57/356228957.db2.gz	MAAXAWHNFUDMLL-UHFFFAOYSA-N	1	0	277.368	1.807	50	0		CDAARO
COc1cc(OC)cc([C@H]2[NH2+]CCc3nc[nH]c32)c1	ZINC000012243711	356291829	/nfs/dbraw/zinc/29/18/29/356291829.db2.gz	GKPQGYHEHZJQHQ-CYBMUJFWSA-N	1	0	259.309	1.662	50	0	biogenic	CDAARO
C[NH+](C)CCNS(=O)(=O)Cc1cccc(Cl)c1	ZINC000013631900	356350874	/nfs/dbraw/zinc/35/08/74/356350874.db2.gz	ILPHHMSJSOJFQU-UHFFFAOYSA-N	1	0	276.789	1.321	50	0		CDAARO
C[C@@H](C(=O)Nc1ccc(Cl)cn1)N1CCC(O)CC1	ZINC000032759371	356360705	/nfs/dbraw/zinc/36/07/05/356360705.db2.gz	JMUHGWVLXQOZFL-VIFPVBQESA-N	1	0	283.759	1.519	50	0		CDAARO
CNC(=O)NC(=O)[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1C	ZINC000014190359	356379479	/nfs/dbraw/zinc/37/94/79/356379479.db2.gz	DKLBPLAMIHXGIV-NWDGAFQWSA-N	1	0	277.368	1.798	50	0		CDAARO
COc1ccc(NC(=O)c2ccc(NN)[nH+]c2)cc1	ZINC000015829692	356425548	/nfs/dbraw/zinc/42/55/48/356425548.db2.gz	GTYCKEWMQBFGNA-UHFFFAOYSA-N	1	0	258.281	1.628	50	0		CDAARO
Cc1ccc(NC(=O)C(=O)NCCC[NH+](C)C)c(C)c1	ZINC000004583792	356433082	/nfs/dbraw/zinc/43/30/82/356433082.db2.gz	IHEZXNWALJFBMY-UHFFFAOYSA-N	1	0	277.368	1.310	50	0		CDAARO
C[C@H](CN1CC[NH+](C)CC1)OC(=O)c1ccccc1	ZINC000019456177	356485439	/nfs/dbraw/zinc/48/54/39/356485439.db2.gz	RDIGRIHLBCLZPD-CYBMUJFWSA-N	1	0	262.353	1.479	50	0		CDAARO
NC(=[NH2+])c1ccc(N2CCN(c3ccccc3)CC2)nc1	ZINC000019507343	356488545	/nfs/dbraw/zinc/48/85/45/356488545.db2.gz	UKIJUFIFFKYHSH-UHFFFAOYSA-N	1	0	281.363	1.692	50	0		CDAARO
Cc1ccc(NC(=O)CC[NH+]2CCN(C)CC2)cc1C	ZINC000019214057	356477251	/nfs/dbraw/zinc/47/72/51/356477251.db2.gz	XHJPSILVYWQALM-UHFFFAOYSA-N	1	0	275.396	1.879	50	0		CDAARO
Clc1ccccc1C[NH2+]CCN1CCOCC1	ZINC000019871927	356511989	/nfs/dbraw/zinc/51/19/89/356511989.db2.gz	KFPXXAQGXWOOFL-UHFFFAOYSA-N	1	0	254.761	1.762	50	0		CDAARO
CC(C)=CC[N@@H+]1CCN(Cc2cc(C)n[nH]2)C[C@@H]1CCO	ZINC000019761169	356501312	/nfs/dbraw/zinc/50/13/12/356501312.db2.gz	YFHIGPYGFPHRQM-INIZCTEOSA-N	1	0	292.427	1.553	50	0		CDAARO
C[NH+]1CCN(CCCNC(=O)c2ccc(Cl)cc2)CC1	ZINC000022935085	356625460	/nfs/dbraw/zinc/62/54/60/356625460.db2.gz	DOSAESGGECWNRM-UHFFFAOYSA-N	1	0	295.814	1.707	50	0		CDAARO
C[NH+](C)Cc1ccc(NC(=O)c2ccc[nH]c2=O)cc1	ZINC000023899623	356650131	/nfs/dbraw/zinc/65/01/31/356650131.db2.gz	AOUWNLIVWVBTGI-UHFFFAOYSA-N	1	0	271.320	1.689	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H](O)[C@@H]2[C@]2(CCCCC2=O)C1	ZINC000012416722	283206365	/nfs/dbraw/zinc/20/63/65/283206365.db2.gz	FYBWQOYLTXRONY-DDHJSBNISA-N	1	0	251.370	1.839	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H]2CCC[N@@H+]2[C@@]12c1ccccc1NC2=O	ZINC000034099991	356810018	/nfs/dbraw/zinc/81/00/18/356810018.db2.gz	GWGXYUQKCIFYGS-PKWAYOAASA-N	1	0	286.331	1.491	50	0		CDAARO
C[NH+](C)[C@H]1CC=CC(=O)N(Cc2ccccc2)C1=O	ZINC000045069501	363572099	/nfs/dbraw/zinc/57/20/99/363572099.db2.gz	GOGKOMXYTKJKTQ-ZDUSSCGKSA-N	1	0	258.321	1.432	50	0		CDAARO
COC(=O)c1ccc(COCC2CC[NH2+]CC2)cc1	ZINC000042782955	357080305	/nfs/dbraw/zinc/08/03/05/357080305.db2.gz	DZWHVFFPIRACAJ-UHFFFAOYSA-N	1	0	263.337	1.989	50	0		CDAARO
CCn1cnnc1CCNC(=O)[C@@H](C)[NH+]1CCCCCC1	ZINC000096436402	357472462	/nfs/dbraw/zinc/47/24/62/357472462.db2.gz	HBXARWUFXNVPPF-CYBMUJFWSA-N	1	0	293.415	1.221	50	0		CDAARO
CCC[NH+]1CCC(CC(=O)NCc2cnc(C)cn2)CC1	ZINC000065404089	357538085	/nfs/dbraw/zinc/53/80/85/357538085.db2.gz	ZLQILFRIKVJTHH-UHFFFAOYSA-N	1	0	290.411	1.913	50	0		CDAARO
Cc1nccn1C[C@@H](C)[NH2+]CC1(CO)CCCC1	ZINC000067756194	357624601	/nfs/dbraw/zinc/62/46/01/357624601.db2.gz	XQVAEHPIHBUKGM-GFCCVEGCSA-N	1	0	251.374	1.722	50	0		CDAARO
CN(CCC(F)(F)F)C[C@H]1CCC[N@H+](CCO)C1	ZINC000067804125	357629136	/nfs/dbraw/zinc/62/91/36/357629136.db2.gz	YTERNYBKHGNKLP-LLVKDONJSA-N	1	0	268.323	1.575	50	0		CDAARO
CC/C=C\CCCN1C[C@H]([NH3+])C[C@H]1C(=O)NC(C)C	ZINC000067676242	357618219	/nfs/dbraw/zinc/61/82/19/357618219.db2.gz	HUYITDYXVGLURW-QJTIAFMVSA-N	1	0	267.417	1.659	50	0		CDAARO
C[C@H](Cn1cncn1)[NH2+]Cc1[nH]nc2c1CCCCC2	ZINC000067878580	357634985	/nfs/dbraw/zinc/63/49/85/357634985.db2.gz	ONTQMMPMPKGDGX-LLVKDONJSA-N	1	0	274.372	1.448	50	0		CDAARO
COC(=O)c1ccccc1OCCN1CC[NH+](C)CC1	ZINC000097082774	357945570	/nfs/dbraw/zinc/94/55/70/357945570.db2.gz	TYADWQYJZCFCKW-UHFFFAOYSA-N	1	0	278.352	1.099	50	0		CDAARO
C[C@H]([NH2+]CC(=O)NCc1cccs1)[C@@H]1CCCO1	ZINC000097111718	357987098	/nfs/dbraw/zinc/98/70/98/357987098.db2.gz	JQKZQHSNNKZJIV-JQWIXIFHSA-N	1	0	268.382	1.521	50	0		CDAARO
C[C@H]([NH2+]CC(=O)N1CCC(C)CC1)c1cnn(C)c1	ZINC000097112181	357987165	/nfs/dbraw/zinc/98/71/65/357987165.db2.gz	DLGZAUVGEFTLPI-LBPRGKRZSA-N	1	0	264.373	1.329	50	0		CDAARO
C[C@@H]1C[N@@H+](C[C@@H](O)COCc2ccccc2)C[C@H](C)O1	ZINC000019594717	358107282	/nfs/dbraw/zinc/10/72/82/358107282.db2.gz	YTWHNHAFBLEEKO-IJEWVQPXSA-N	1	0	279.380	1.673	50	0		CDAARO
O=C(NCCN1CC[NH2+]CC1)Nc1ccc(Cl)cc1	ZINC000019798636	358143264	/nfs/dbraw/zinc/14/32/64/358143264.db2.gz	XWEVSELENOOAOY-UHFFFAOYSA-N	1	0	282.775	1.367	50	0		CDAARO
CCOC(=O)C1(NC(=O)OC(C)(C)C)CC[NH2+]CC1	ZINC000082046698	358145154	/nfs/dbraw/zinc/14/51/54/358145154.db2.gz	BKQVCPZQSRJEJC-UHFFFAOYSA-N	1	0	272.345	1.196	50	0		CDAARO
Cc1cc(C)n2nc(C(=O)N3CCCC[C@H]([NH3+])C3)cc2n1	ZINC000082114528	358148007	/nfs/dbraw/zinc/14/80/07/358148007.db2.gz	WSFIUNXAIYBFJV-LBPRGKRZSA-N	1	0	287.367	1.300	50	0		CDAARO
C[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)[C@@H](N)c1ccccc1	ZINC000129455095	358284094	/nfs/dbraw/zinc/28/40/94/358284094.db2.gz	POSFYXUKUUMCSE-YUELXQCFSA-N	1	0	273.380	1.382	50	0		CDAARO
CC(C)C(=O)NC[C@@H](c1ccc2c(c1)OCO2)[NH+](C)C	ZINC000012196010	358552517	/nfs/dbraw/zinc/55/25/17/358552517.db2.gz	XZCDMHLZXOXNSN-LBPRGKRZSA-N	1	0	278.352	1.790	50	0	biogenic	CDAARO
NC(=O)NC(=O)CC[N@@H+]1CCC[C@@H]1/C=C\c1ccccc1	ZINC000543731728	358557643	/nfs/dbraw/zinc/55/76/43/358557643.db2.gz	ULNHNVOVNWBCEQ-QIAWRQBBSA-N	1	0	287.363	1.749	50	0		CDAARO
CCc1cc(NC[C@@H](O)C[NH+]2CCCCC2)ncn1	ZINC000095360082	358684899	/nfs/dbraw/zinc/68/48/99/358684899.db2.gz	GJSABSWTHBFVFP-CYBMUJFWSA-N	1	0	264.373	1.298	50	0		CDAARO
CCc1cnc(N(C)CCCC[NH+]2CCOCC2)nc1	ZINC000095372695	358688640	/nfs/dbraw/zinc/68/86/40/358688640.db2.gz	CEYHPGRDCXOFBM-UHFFFAOYSA-N	1	0	278.400	1.588	50	0		CDAARO
CCc1[nH+]c(N)nc(NCCCn2cc(C)cn2)c1C	ZINC000095384238	358690647	/nfs/dbraw/zinc/69/06/47/358690647.db2.gz	HABPNZRALDFERY-UHFFFAOYSA-N	1	0	274.372	1.937	50	0		CDAARO
Cc1cccc(=O)n1CCC(=O)NCC(C)(C)C[NH+](C)C	ZINC000097307718	358766760	/nfs/dbraw/zinc/76/67/60/358766760.db2.gz	BACCQMORKQXSRU-UHFFFAOYSA-N	1	0	293.411	1.251	50	0		CDAARO
CCN(CC[NH+](C)C)C(=O)c1cnc(C2CC2)nc1	ZINC000097681961	358792947	/nfs/dbraw/zinc/79/29/47/358792947.db2.gz	PHMQLUPFTDAUHQ-UHFFFAOYSA-N	1	0	262.357	1.378	50	0		CDAARO
Cc1occc1C(=O)N1CC[N@@H+](C2CCCC2)C[C@@H](O)C1	ZINC000097698633	358793891	/nfs/dbraw/zinc/79/38/91/358793891.db2.gz	UIVMCSNRVYYKPK-CQSZACIVSA-N	1	0	292.379	1.649	50	0		CDAARO
O=C(NCCc1c[nH]cn1)[C@H]1CCc2ccccc21	ZINC000215966169	358913072	/nfs/dbraw/zinc/91/30/72/358913072.db2.gz	FJQCSZOUINBKQE-AWEZNQCLSA-N	1	0	255.321	1.798	50	0		CDAARO
[NH3+]C1CC(c2cc(N3CCC(F)(F)CC3)ncn2)C1	ZINC000222846547	359377742	/nfs/dbraw/zinc/37/77/42/359377742.db2.gz	DOGMHWRKIKOJFF-UHFFFAOYSA-N	1	0	268.311	1.917	50	0		CDAARO
Cc1ccnc(CNc2cc(C3CC([NH3+])C3)nc(N)n2)c1	ZINC000223254775	359411378	/nfs/dbraw/zinc/41/13/78/359411378.db2.gz	FBRUJQRKHFRHHS-UHFFFAOYSA-N	1	0	284.367	1.579	50	0		CDAARO
CN1C(=O)[C@H]2C[N@H+](Cc3ccc(F)cc3F)C[C@H]2C1=O	ZINC000257185246	359511173	/nfs/dbraw/zinc/51/11/73/359511173.db2.gz	WHPCEHUEPRVDAT-PHIMTYICSA-N	1	0	280.274	1.011	50	0		CDAARO
CC(=O)N[C@@H]1C[N@H+](Cc2cc(C)ccc2C)C[C@H]1CO	ZINC000257191868	359589802	/nfs/dbraw/zinc/58/98/02/359589802.db2.gz	ROVGDUGLCALBEC-JKSUJKDBSA-N	1	0	276.380	1.232	50	0		CDAARO
COc1ccc(F)cc1C(=O)N1CCC[C@H]([NH3+])C1	ZINC000084589939	360104666	/nfs/dbraw/zinc/10/46/66/360104666.db2.gz	OCLHUPSATRGDAD-JTQLQIEISA-N	1	0	252.289	1.398	50	0		CDAARO
COc1cc(CN2CCC([NH3+])CC2)cc(OC)c1	ZINC000011729474	360254623	/nfs/dbraw/zinc/25/46/23/360254623.db2.gz	WTBBUZDGTUDIJS-UHFFFAOYSA-N	1	0	250.342	1.627	50	0		CDAARO
CCS(=O)(=O)N1CCC(Cn2c(C)c[nH+]c2C)CC1	ZINC000409420069	360229350	/nfs/dbraw/zinc/22/93/50/360229350.db2.gz	MMOULIXWABZEBI-UHFFFAOYSA-N	1	0	285.413	1.562	50	0		CDAARO
CCOc1cc(N2C[C@@H]3CCC[N@@H+]3C[C@@H]2C)ncn1	ZINC000124649696	360386147	/nfs/dbraw/zinc/38/61/47/360386147.db2.gz	MJZDZZNIWDKGKD-RYUDHWBXSA-N	1	0	262.357	1.548	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CCCC[C@H]2[NH3+])c(F)c1	ZINC000123275619	360355294	/nfs/dbraw/zinc/35/52/94/360355294.db2.gz	WTCQBFMZUVUDTN-VXGBXAGGSA-N	1	0	286.372	1.682	50	0		CDAARO
[NH3+][C@@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	ZINC000061627438	283552009	/nfs/dbraw/zinc/55/20/09/283552009.db2.gz	XZJLAMVKYUITNU-SECBINFHSA-N	1	0	258.243	1.765	50	0		CDAARO
Cc1nc(C(F)(F)F)ncc1CN1CC[NH2+][C@@H](C)C1	ZINC000426388095	360662172	/nfs/dbraw/zinc/66/21/72/360662172.db2.gz	ZWSZKPHCJROLDS-QMMMGPOBSA-N	1	0	274.290	1.598	50	0		CDAARO
COCC1(NC(=O)c2cccc(OCC[NH3+])c2)CCCC1	ZINC000426414855	360667224	/nfs/dbraw/zinc/66/72/24/360667224.db2.gz	VQBLWBZDMVYYNN-UHFFFAOYSA-N	1	0	292.379	1.713	50	0		CDAARO
COc1cc2c(cc1CN1C[C@@H]3CC[NH2+][C@@H]3C1)OCO2	ZINC000426415696	360667437	/nfs/dbraw/zinc/66/74/37/360667437.db2.gz	XJSSIIHMQQRQOR-CMPLNLGQSA-N	1	0	276.336	1.218	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)CCCOc2ccccc2F)C1	ZINC000178570515	189127580	/nfs/dbraw/zinc/12/75/80/189127580.db2.gz	OHROSPFFAAPVMH-LBPRGKRZSA-N	1	0	280.343	1.792	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)/C=C/c2ccccc2OC)C1	ZINC000178986343	189159574	/nfs/dbraw/zinc/15/95/74/189159574.db2.gz	VIBSDUFTVKOOJD-GWJCSSMESA-N	1	0	274.364	1.776	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cnn(C(C)(C)C)c2)C1	ZINC000178965352	189158008	/nfs/dbraw/zinc/15/80/08/189158008.db2.gz	MTMZERCHVKLJLK-LLVKDONJSA-N	1	0	264.373	1.320	50	0		CDAARO
[NH3+][C@@H]1CC[C@H]2CN(C(=O)c3cc(Cl)ccn3)C[C@H]12	ZINC000242302076	283599508	/nfs/dbraw/zinc/59/95/08/283599508.db2.gz	YPIHEGPZCTYZTH-INTQDDNPSA-N	1	0	265.744	1.544	50	0		CDAARO
C[NH+]1CCC(O)(CCn2cnc3sccc3c2=O)CC1	ZINC000032533023	360996241	/nfs/dbraw/zinc/99/62/41/360996241.db2.gz	BBWVJSPUHCMPOA-UHFFFAOYSA-N	1	0	293.392	1.305	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@H]([NH3+])CN1Cc1cccc(Cl)c1	ZINC000299793035	200876033	/nfs/dbraw/zinc/87/60/33/200876033.db2.gz	IAEVJDOQYKVKQU-STQMWFEESA-N	1	0	281.787	1.378	50	0		CDAARO
CCC[NH+]1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000001460661	361202440	/nfs/dbraw/zinc/20/24/40/361202440.db2.gz	UMBJEXKGNSLKFC-UHFFFAOYSA-N	1	0	282.409	1.839	50	0		CDAARO
Cc1ccc(CN2CC[C@@H]([NH2+]Cc3ccnn3C)C2=O)cc1	ZINC000191797233	361322978	/nfs/dbraw/zinc/32/29/78/361322978.db2.gz	BBOJGZQHZDHXKV-MRXNPFEDSA-N	1	0	298.390	1.619	50	0		CDAARO
C[NH+](C)CCCNC(=O)N(CCO)Cc1ccccc1F	ZINC000426641395	361330682	/nfs/dbraw/zinc/33/06/82/361330682.db2.gz	QWGIPWIJHVROOZ-UHFFFAOYSA-N	1	0	297.374	1.281	50	0		CDAARO
COc1ccc2c(c1)C[C@@H](N1CCC[NH2+]CC1)CC2	ZINC000133311587	361596601	/nfs/dbraw/zinc/59/66/01/361596601.db2.gz	KFHDHLJUFSVFRZ-HNNXBMFYSA-N	1	0	260.381	1.848	50	0		CDAARO
Cc1ccc2[nH]c(CNC(=O)N3CC[C@@H](C[NH3+])C3)nc2c1	ZINC000426727051	361721320	/nfs/dbraw/zinc/72/13/20/361721320.db2.gz	ZABNMEUSWPOMRL-NSHDSACASA-N	1	0	287.367	1.362	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)c1ccc(OC)cc1	ZINC000130052803	370738148	/nfs/dbraw/zinc/73/81/48/370738148.db2.gz	SYQZXRGFKFNBDE-UHFFFAOYSA-N	1	0	286.397	1.491	50	0		CDAARO
CCO[C@H]1C[C@](CO)([NH2+]Cc2cncnc2)C1(C)C	ZINC000186578939	364611605	/nfs/dbraw/zinc/61/16/05/364611605.db2.gz	WZYBCZLURGCBQJ-GXTWGEPZSA-N	1	0	265.357	1.132	50	0		CDAARO
C[C@H](O)[C@H]1CCC[N@H+](C[C@H](O)c2ccc(F)cc2)C1	ZINC000089933493	366971096	/nfs/dbraw/zinc/97/10/96/366971096.db2.gz	XSSUNARJBJSOIC-WHOFXGATSA-N	1	0	267.344	1.952	50	0		CDAARO
CNC(=O)c1cccc(C[N@H+](C)[C@@H]2CCSC2)c1	ZINC000089935566	366971235	/nfs/dbraw/zinc/97/12/35/366971235.db2.gz	MMBWMAWFTPKFGE-CYBMUJFWSA-N	1	0	264.394	1.984	50	0		CDAARO
C[C@@H](Nc1ncnc2nc(N)ccc21)C(C)(C)C[NH+](C)C	ZINC000090095181	367014025	/nfs/dbraw/zinc/01/40/25/367014025.db2.gz	WIHIRZIFUCZNGX-SNVBAGLBSA-N	1	0	288.399	1.995	50	0		CDAARO
CC(C)(C)n1cc(C[N@@H+]2CC[C@@]3(CNC(=O)C3)C2)cn1	ZINC000279492846	367014902	/nfs/dbraw/zinc/01/49/02/367014902.db2.gz	UZPMJWUSMOVRGV-OAHLLOKOSA-N	1	0	276.384	1.350	50	0		CDAARO
COC(=O)c1ccc([C@H](C)[N@@H+]2CC[C@@H](C)[C@H](O)C2)o1	ZINC000252485815	367572608	/nfs/dbraw/zinc/57/26/08/367572608.db2.gz	AMLHDQJIXRPLBT-OUAUKWLOSA-N	1	0	267.325	1.830	50	0		CDAARO
COc1ccccc1S(=O)(=O)N[C@@H]1CCC[C@@H]1C[NH3+]	ZINC000089091799	368832659	/nfs/dbraw/zinc/83/26/59/368832659.db2.gz	LGWWXCIFHKYCNG-GHMZBOCLSA-N	1	0	284.381	1.101	50	0		CDAARO
CO[C@@H]1CC[N@H+](CC(=O)NCCc2ccc(Cl)cc2)C1	ZINC000361372484	368783247	/nfs/dbraw/zinc/78/32/47/368783247.db2.gz	ODPOCBNBKFRGJR-CQSZACIVSA-N	1	0	296.798	1.719	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F)[C@@H]1CC[NH2+]C1	ZINC000252656866	370984473	/nfs/dbraw/zinc/98/44/73/370984473.db2.gz	WHYYFXQITIXYID-KGYLQXTDSA-N	1	0	280.318	1.889	50	0		CDAARO
COc1ccc(CNC(=O)[C@@H]2CCC[NH2+][C@H]2C)cc1OC	ZINC000094647261	139695951	/nfs/dbraw/zinc/69/59/51/139695951.db2.gz	SYRJYKFHUWOFCK-WCQYABFASA-N	1	0	292.379	1.708	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@H](CNCc2cocn2)C1	ZINC000192280863	371837520	/nfs/dbraw/zinc/83/75/20/371837520.db2.gz	JJSIJXKSZCHBIP-CYBMUJFWSA-N	1	0	253.346	1.121	50	0		CDAARO
Cc1cnc(C(=O)NCc2c(C)ncc3c2CC[NH2+]C3)cn1	ZINC000299759474	372746799	/nfs/dbraw/zinc/74/67/99/372746799.db2.gz	SEHJQCRBWMVNRX-UHFFFAOYSA-N	1	0	297.362	1.064	50	0		CDAARO
COc1cccc(C(=O)N(C)C)c1OCCC[NH3+]	ZINC000299800333	372771529	/nfs/dbraw/zinc/77/15/29/372771529.db2.gz	VRIMLDNXPULTQH-UHFFFAOYSA-N	1	0	252.314	1.125	50	0		CDAARO
CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@H+](Cc2cncn2C)C1	ZINC000177271071	372839634	/nfs/dbraw/zinc/83/96/34/372839634.db2.gz	WSPGUDKBQVTECW-ZIAGYGMSSA-N	1	0	292.427	1.937	50	0		CDAARO
C[C@H](C[NH2+][C@@H]1[C@@H]2CCCO[C@H]2C1(C)C)N1CCOC[C@H]1C	ZINC000253370236	373680199	/nfs/dbraw/zinc/68/01/99/373680199.db2.gz	OCUWOJHJGIJUTM-IBEHDNSVSA-N	1	0	296.455	1.889	50	0		CDAARO
CCOc1ccc(C[NH2+]CC2(O)CCOCC2)cc1OC	ZINC000112717041	374227121	/nfs/dbraw/zinc/22/71/21/374227121.db2.gz	DWQPINGMFBLHOY-UHFFFAOYSA-N	1	0	295.379	1.725	50	0		CDAARO
C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccnn1C	ZINC000248949550	374278217	/nfs/dbraw/zinc/27/82/17/374278217.db2.gz	ZRCQNMKPCRFHNE-UKRRQHHQSA-N	1	0	298.390	1.670	50	0		CDAARO
c1cnc(N2CC[NH+](C[C@@H]3Cc4ccccc4O3)CC2)nc1	ZINC000020820539	374383420	/nfs/dbraw/zinc/38/34/20/374383420.db2.gz	HQJREUFNVUDTJD-HNNXBMFYSA-N	1	0	296.374	1.602	50	0		CDAARO
C[C@@H]1C[C@H](Nc2ccnn2C[C@H]2CCOC2)C[N@@H+]1C1CC1	ZINC000108462744	412829128	/nfs/dbraw/zinc/82/91/28/412829128.db2.gz	FPLPJJACKCPSGZ-MCIONIFRSA-N	1	0	290.411	1.957	50	0		CDAARO
CCn1cc(C(=O)N2CC[NH+](C3CCCCC3)CC2)cn1	ZINC000019952557	374830765	/nfs/dbraw/zinc/83/07/65/374830765.db2.gz	FFGPSXWQNCYHEC-UHFFFAOYSA-N	1	0	290.411	1.994	50	0		CDAARO
C[NH+](C)C1CN(C(=O)Nc2cccnc2N2CCCC2)C1	ZINC000095462312	374960144	/nfs/dbraw/zinc/96/01/44/374960144.db2.gz	YRSNTFSABOZKCS-UHFFFAOYSA-N	1	0	289.383	1.460	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)Cc1ccc2c(c1)OCC2	ZINC000095474649	374967239	/nfs/dbraw/zinc/96/72/39/374967239.db2.gz	YTGHUZBFDPRUJC-HNNXBMFYSA-N	1	0	288.391	1.765	50	0		CDAARO
C[C@H](C[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)[S@](C)=O	ZINC000095988141	375048255	/nfs/dbraw/zinc/04/82/55/375048255.db2.gz	WEIYYPXDJDGTLF-YVHNNKAESA-N	1	0	271.426	1.691	50	0		CDAARO
COC(=O)c1cc(CN2CC[N@H+](C)C[C@@H]2C(C)C)c[nH]1	ZINC000097058996	375142764	/nfs/dbraw/zinc/14/27/64/375142764.db2.gz	OFASQFOAYAGNDD-CQSZACIVSA-N	1	0	279.384	1.573	50	0		CDAARO
C[C@H](Cn1cc(Cl)cn1)C(=O)NC1CC[NH+](C)CC1	ZINC000002804425	375335060	/nfs/dbraw/zinc/33/50/60/375335060.db2.gz	SUHNGFMIKFWNRV-SNVBAGLBSA-N	1	0	284.791	1.383	50	0		CDAARO
C[C@@H](Cn1cc(Cl)cn1)C(=O)NC1CC[NH+](C)CC1	ZINC000002804424	375335081	/nfs/dbraw/zinc/33/50/81/375335081.db2.gz	SUHNGFMIKFWNRV-JTQLQIEISA-N	1	0	284.791	1.383	50	0		CDAARO
Cn1c(CCC[NH2+][C@@H]2CCOC2)nc2ccccc21	ZINC000176498949	375825281	/nfs/dbraw/zinc/82/52/81/375825281.db2.gz	RHXWEBRTDHXSOO-GFCCVEGCSA-N	1	0	259.353	1.884	50	0		CDAARO
O=C(NC[C@]1(O)CCC[NH2+]CC1)OCc1ccccc1	ZINC000261508723	190040142	/nfs/dbraw/zinc/04/01/42/190040142.db2.gz	WFNSIJPBNMYFGZ-HNNXBMFYSA-N	1	0	278.352	1.417	50	0		CDAARO
CNC(=O)c1ccc(-c2cccc3c2O[C@@H](C[NH3+])C3)o1	ZINC000067855021	377266871	/nfs/dbraw/zinc/26/68/71/377266871.db2.gz	PAPSGVYHPBKFEX-SNVBAGLBSA-N	1	0	272.304	1.568	50	0		CDAARO
C=Cn1cc(C(=O)NCC[C@@H]2C[N@H+](C(C)C)CCO2)cn1	ZINC000067855381	377266268	/nfs/dbraw/zinc/26/62/68/377266268.db2.gz	YOTRIFNEQKVDAQ-CQSZACIVSA-N	1	0	292.383	1.213	50	0		CDAARO
CC[C@H](C)C[C@H](C)NC(=O)NC[C@H]1C[N@H+](C)CCN1C	ZINC000245289778	378046891	/nfs/dbraw/zinc/04/68/91/378046891.db2.gz	FBABSUKKOSXUSX-IHRRRGAJSA-N	1	0	284.448	1.356	50	0		CDAARO
CO[C@H]1CN(c2noc(-c3ccccc3)n2)CC[C@H]1[NH3+]	ZINC000071761536	379631520	/nfs/dbraw/zinc/63/15/20/379631520.db2.gz	MRMVXEOFFHHGHI-NEPJUHHUSA-N	1	0	274.324	1.289	50	0		CDAARO
CCc1noc(CN(C)C(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3[NH2+]2)n1	ZINC000095426493	184979332	/nfs/dbraw/zinc/97/93/32/184979332.db2.gz	OCVGDLWYOLZNKY-SRVKXCTJSA-N	1	0	292.383	1.511	50	0		CDAARO
Cn1ccnc1C[NH2+][C@@](C)(CO)C1CCCCC1	ZINC000096417588	390512097	/nfs/dbraw/zinc/51/20/97/390512097.db2.gz	WTNTXMXOQRBKSW-AWEZNQCLSA-N	1	0	251.374	1.841	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2CCC[NH2+]C2)c2ccc(F)cc2O1	ZINC000118962128	390449229	/nfs/dbraw/zinc/44/92/29/390449229.db2.gz	SSFMDHJDQXQEFO-MNOVXSKESA-N	1	0	278.327	1.939	50	0		CDAARO
COc1ccc2[nH]c3c(ncnc3N3CC[NH+](C)CC3)c2c1	ZINC000004834654	390582395	/nfs/dbraw/zinc/58/23/95/390582395.db2.gz	KJZUKKVPIULYDH-UHFFFAOYSA-N	1	0	297.362	1.872	50	0		CDAARO
O=C(NCc1noc(Cc2cccs2)n1)[C@H]1CCC[NH2+]1	ZINC000215573031	390995528	/nfs/dbraw/zinc/99/55/28/390995528.db2.gz	WQJLFLVRLZGPGG-SNVBAGLBSA-N	1	0	292.364	1.090	50	0		CDAARO
CN(C(=O)c1cnc2c(c1)CCCC2)[C@H]1CC[N@H+](C)C1	ZINC000215552614	390995684	/nfs/dbraw/zinc/99/56/84/390995684.db2.gz	DQYKRWGHOZSKMS-AWEZNQCLSA-N	1	0	273.380	1.737	50	0		CDAARO
CC[C@H](CO)[NH2+]C[C@H](O)COc1cc(C)ccc1C	ZINC000026781355	391218312	/nfs/dbraw/zinc/21/83/12/391218312.db2.gz	HYEIYIKEUWTZCS-KGLIPLIRSA-N	1	0	267.369	1.404	50	0		CDAARO
OCC[NH2+]C[C@H](O)c1ccc(Br)cc1	ZINC000071689861	391889332	/nfs/dbraw/zinc/88/93/32/391889332.db2.gz	BYMWMDIOMQFUPJ-JTQLQIEISA-N	1	0	260.131	1.064	50	0		CDAARO
O=C(C1CC1)N1CCC[N@H+](CC[C@H]2CCOC2)CC1	ZINC000438294663	391906093	/nfs/dbraw/zinc/90/60/93/391906093.db2.gz	SDGQRGOWUSIWFT-ZDUSSCGKSA-N	1	0	266.385	1.357	50	0		CDAARO
CC[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2)C[C@H]1O	ZINC000252512146	131135634	/nfs/dbraw/zinc/13/56/34/131135634.db2.gz	NFQZBSHZLRFEQB-VNHYZAJKSA-N	1	0	265.353	1.129	50	0		CDAARO
O=C(CSc1ccncc1)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000261978861	131180959	/nfs/dbraw/zinc/18/09/59/131180959.db2.gz	OIOCVQWTARYPTF-NEPJUHHUSA-N	1	0	277.393	1.527	50	0		CDAARO
Cc1cc(N2CCN(c3cc(C(N)=O)ccn3)CC2)cc[nH+]1	ZINC000032537448	134766124	/nfs/dbraw/zinc/76/61/24/134766124.db2.gz	YAORKAOESVEIQV-UHFFFAOYSA-N	1	0	297.362	1.211	50	0		CDAARO
[NH3+][C@@H]1CCN(c2ncc(Cl)cc2Cl)C[C@H]1O	ZINC000082099774	135004818	/nfs/dbraw/zinc/00/48/18/135004818.db2.gz	IMFOPRLBJNPYOO-RKDXNWHRSA-N	1	0	262.140	1.287	50	0		CDAARO
CNC(=O)[C@@H]1CCCC[C@H]1[NH2+]CCCCCOC	ZINC000097165604	397981992	/nfs/dbraw/zinc/98/19/92/397981992.db2.gz	MXPQGYVWEFYRFN-CHWSQXEVSA-N	1	0	256.390	1.698	50	0		CDAARO
COC[C@H]([NH3+])C(=O)N[C@H](C)[C@H]1Oc2ccccc2[C@H]1C	ZINC000262241323	149037991	/nfs/dbraw/zinc/03/79/91/149037991.db2.gz	HTDWWWVNLRPXHL-KLTVKPSUSA-N	1	0	278.352	1.030	50	0		CDAARO
O=C([C@@H]1CCOC1)N1CCC[C@@H]1C[NH+]1CCCC1	ZINC000066943828	304353763	/nfs/dbraw/zinc/35/37/63/304353763.db2.gz	GARQBOVUXTXDBF-CHWSQXEVSA-N	1	0	252.358	1.110	50	0		CDAARO
Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)N2CCNC2=O)cc1	ZINC000006995915	170261019	/nfs/dbraw/zinc/26/10/19/170261019.db2.gz	VUYOTEKAIFNYCD-LBPRGKRZSA-N	1	0	275.352	1.367	50	0		CDAARO
Cc1cc(=O)n2nc(C[NH+]3C[C@@H](C)C[C@H](C)C3)sc2n1	ZINC000008307371	170329823	/nfs/dbraw/zinc/32/98/23/170329823.db2.gz	WYKAKGWKDYWRJP-UWVGGRQHSA-N	1	0	292.408	1.937	50	0		CDAARO
Brc1ccccc1CN1CC[NH2+]CC1	ZINC000019349187	170775993	/nfs/dbraw/zinc/77/59/93/170775993.db2.gz	XVHSZKUVDNZYDF-UHFFFAOYSA-N	1	0	255.159	1.854	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)Nc2ccc(OC)cc2)CC1	ZINC000020595156	171263895	/nfs/dbraw/zinc/26/38/95/171263895.db2.gz	DYTLGUVPQVQPBM-UHFFFAOYSA-N	1	0	291.395	1.661	50	0		CDAARO
C[NH+](C)CCNC(=O)c1ccc2c(c1)nc1n2CCCC1	ZINC000021942978	171337896	/nfs/dbraw/zinc/33/78/96/171337896.db2.gz	VQOIYUPPKQVRLP-UHFFFAOYSA-N	1	0	286.379	1.664	50	0		CDAARO
C[C@H](Cc1ccccc1F)[NH2+]CCN1CCOCC1	ZINC000022455368	171388116	/nfs/dbraw/zinc/38/81/16/171388116.db2.gz	QXIIGXDXESRKKG-CYBMUJFWSA-N	1	0	266.360	1.679	50	0		CDAARO
CO[C@]1(C)C[C@H](NC(=O)C2([NH+](C)C)CCC2)C1(C)C	ZINC000119492129	412106130	/nfs/dbraw/zinc/10/61/30/412106130.db2.gz	SNOAXNGKAPAXDL-SMDDNHRTSA-N	1	0	268.401	1.791	50	0		CDAARO
CN(C1CC[NH2+]CC1)S(=O)(=O)c1cc(F)ccc1F	ZINC000036299953	172592830	/nfs/dbraw/zinc/59/28/30/172592830.db2.gz	NWEKKOMKDHZKPN-UHFFFAOYSA-N	1	0	290.335	1.337	50	0		CDAARO
COc1ccc([C@@H]2C[C@@H]2C(=O)N2CC[NH2+]CC2)cc1	ZINC000038478357	174142156	/nfs/dbraw/zinc/14/21/56/174142156.db2.gz	FYOXQDYKWMVTEZ-KBPBESRZSA-N	1	0	260.337	1.231	50	0		CDAARO
OCC[C@H]1C[NH2+]CCN1Cc1ccccc1Cl	ZINC000038534547	174144732	/nfs/dbraw/zinc/14/47/32/174144732.db2.gz	UZJGQUXFKRPWNO-LBPRGKRZSA-N	1	0	254.761	1.496	50	0		CDAARO
O=C([C@H]1C[NH2+]CCO1)N(Cc1ccsc1)C1CC1	ZINC000043800426	175106220	/nfs/dbraw/zinc/10/62/20/175106220.db2.gz	CCGXBDRGIPQFGR-GFCCVEGCSA-N	1	0	266.366	1.228	50	0		CDAARO
Cc1nsc(NC(=O)N2CCC(C[NH3+])CC2)n1	ZINC000055089054	175569098	/nfs/dbraw/zinc/56/90/98/175569098.db2.gz	PNZCDRPBTHLDCS-UHFFFAOYSA-N	1	0	255.347	1.049	50	0		CDAARO
Cc1nc[nH]c1C(=O)N1CC([N@H+]2CCCC[C@H]2C)C1	ZINC000071748260	176258942	/nfs/dbraw/zinc/25/89/42/176258942.db2.gz	TUWULIGTICUAJD-SNVBAGLBSA-N	1	0	262.357	1.417	50	0		CDAARO
CCc1ncc(C(=O)N2CCC[C@H]([NH+](C)C)CC2)cn1	ZINC000072153595	176327921	/nfs/dbraw/zinc/32/79/21/176327921.db2.gz	IOFRIBYHHIVQKC-ZDUSSCGKSA-N	1	0	276.384	1.595	50	0		CDAARO
c1cnc(Nc2cccc([C@H]3C[NH2+]CCO3)n2)nc1	ZINC000072343439	176372112	/nfs/dbraw/zinc/37/21/12/176372112.db2.gz	DLFOWMWXXLOEBT-LLVKDONJSA-N	1	0	257.297	1.276	50	0		CDAARO
CCCc1cc(N2CCC[N@H+](C)CC2)n2nccc2n1	ZINC000072407762	176397793	/nfs/dbraw/zinc/39/77/93/176397793.db2.gz	NWHGVRRHRFIDDD-UHFFFAOYSA-N	1	0	273.384	1.824	50	0		CDAARO
CC(C)(O)CCc1ccc(C[N@@H+]2CCC[C@H]2C(N)=O)cc1	ZINC000072429273	176402298	/nfs/dbraw/zinc/40/22/98/176402298.db2.gz	WWKBZXDULJIFQI-HNNXBMFYSA-N	1	0	290.407	1.840	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)CCCc1ccc(Cl)cc1	ZINC000077301056	177250899	/nfs/dbraw/zinc/25/08/99/177250899.db2.gz	GEWNOLZGGAOSRY-KBPBESRZSA-N	1	0	296.798	1.766	50	0		CDAARO
O=C(CN1CC[NH2+]CC1)Nc1ccccc1C(F)(F)F	ZINC000019976779	260115135	/nfs/dbraw/zinc/11/51/35/260115135.db2.gz	LAPHONMHLQUVPN-UHFFFAOYSA-N	1	0	287.285	1.549	50	0		CDAARO
CC1(C)[C@H]([NH2+]Cc2nnc3n2CCCC3)[C@@H]2CCCO[C@H]21	ZINC000248872448	275890368	/nfs/dbraw/zinc/89/03/68/275890368.db2.gz	KTESGAHJDCXLOJ-NILFDRSVSA-N	1	0	290.411	1.908	50	0		CDAARO
CC(C)c1nn(C)c(Cl)c1C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178573080	276071461	/nfs/dbraw/zinc/07/14/61/276071461.db2.gz	IEQFQLDVHALIPQ-VIFPVBQESA-N	1	0	284.791	1.618	50	0		CDAARO
COc1ccnc(N2CC[NH+]([C@@H]3CCSC3)CC2)n1	ZINC000366030917	278066101	/nfs/dbraw/zinc/06/61/01/278066101.db2.gz	DHTZQVNPMAVHQI-LLVKDONJSA-N	1	0	280.397	1.113	50	0		CDAARO
CS[C@@H]1CN(c2nc(C)cc(C)n2)C[C@H]1[NH+](C)C	ZINC000271098651	278157598	/nfs/dbraw/zinc/15/75/98/278157598.db2.gz	MJAXLAINCZCQHO-VXGBXAGGSA-N	1	0	266.414	1.575	50	0		CDAARO
CC1(C)C[C@@H]([NH2+]C2CCC(CS(C)(=O)=O)CC2)CO1	ZINC000572379694	294613308	/nfs/dbraw/zinc/61/33/08/294613308.db2.gz	NSJUHJJHGCBRPN-WXRRBKDZSA-N	1	0	289.441	1.747	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)NC23CC4CC(CC(C4)C2)C3)C1	ZINC000050228889	303488012	/nfs/dbraw/zinc/48/80/12/303488012.db2.gz	KYPZCIXZKZJKHN-MFORYBBRSA-N	1	0	263.385	1.698	50	0		CDAARO
COc1cc(C)ccc1OCCN1C[C@@H]2CC[NH2+][C@@H]2C1	ZINC000534584115	328310591	/nfs/dbraw/zinc/31/05/91/328310591.db2.gz	LALVEZIBXYHZDA-UONOGXRCSA-N	1	0	276.380	1.676	50	0		CDAARO
CC(C)[C@H](CNC(=O)[C@H]1CC[C@@H](O)CC1)[NH+](C)C	ZINC000534646049	328332871	/nfs/dbraw/zinc/33/28/71/328332871.db2.gz	KCEOUEMSAAXUOD-XQQFMLRXSA-N	1	0	256.390	1.240	50	0		CDAARO
O=C(NCCc1cccc(C(F)(F)F)c1)[C@H]1C=CC[NH2+]1	ZINC000534639999	328335466	/nfs/dbraw/zinc/33/54/66/328335466.db2.gz	FAFMOHRLNSXRPK-GFCCVEGCSA-N	1	0	284.281	1.892	50	0		CDAARO
CCn1ncc(CNC(=O)N2CC[C@@H]([NH+](C)C)C2)c1C	ZINC000534658888	328341712	/nfs/dbraw/zinc/34/17/12/328341712.db2.gz	JHYBRVUGRWOGLP-CYBMUJFWSA-N	1	0	279.388	1.057	50	0		CDAARO
CN(Cc1cc(-c2ccccc2)no1)C(=O)[C@H]1C=CC[NH2+]1	ZINC000534655257	328339682	/nfs/dbraw/zinc/33/96/82/328339682.db2.gz	JIMKMAKFFUITGH-CQSZACIVSA-N	1	0	283.331	1.828	50	0		CDAARO
CCOCCC(=O)NC1(C[NH+]2CCCCC2)CC1	ZINC000534657516	328341102	/nfs/dbraw/zinc/34/11/02/328341102.db2.gz	NLCJHBXCDJEBHK-UHFFFAOYSA-N	1	0	254.374	1.548	50	0		CDAARO
COCCN(Cc1ccsc1)C(=O)[C@H]1C=CC[NH2+]1	ZINC000534663995	328351514	/nfs/dbraw/zinc/35/15/14/328351514.db2.gz	ROSSQBPWQBFYIA-GFCCVEGCSA-N	1	0	266.366	1.251	50	0		CDAARO
CN(CCC[C@@H]1CCCO1)C(=O)CN(C)C1CC[NH2+]CC1	ZINC000534675297	328355969	/nfs/dbraw/zinc/35/59/69/328355969.db2.gz	JVMGJPPIOSLDFD-OAHLLOKOSA-N	1	0	297.443	1.088	50	0		CDAARO
[NH3+][C@H](C(=O)N1CCC[C@@H](Cn2ccnn2)C1)c1ccccc1	ZINC000182696371	323296419	/nfs/dbraw/zinc/29/64/19/323296419.db2.gz	KDGHQCXWMSIECM-HIFRSBDPSA-N	1	0	299.378	1.217	50	0		CDAARO
COc1c(C)cnc(C[NH+]2CCC([C@H](O)CO)CC2)c1C	ZINC001772711462	1159445771	/nfs/dbraw/zinc/44/57/71/1159445771.db2.gz	YJIBFUWXPHDWRB-OAHLLOKOSA-N	1	0	294.395	1.272	50	0		CDAARO
O=C(NCc1nc2cc(Cl)ccc2[nH]1)[C@H]1CCC[NH2+]1	ZINC000670433939	482967300	/nfs/dbraw/zinc/96/73/00/482967300.db2.gz	WVLKPOTZBAEBAO-SNVBAGLBSA-N	1	0	278.743	1.585	50	0		CDAARO
Cc1cc(C)nc(NCC[N@@H+]2CCC[C@@H](CO)C2)n1	ZINC000670435530	482971942	/nfs/dbraw/zinc/97/19/42/482971942.db2.gz	YXHYHXHHOGYUKM-CYBMUJFWSA-N	1	0	264.373	1.210	50	0		CDAARO
O=C1Nc2ccccc2C12CC[NH+](CCn1cnnc1)CC2	ZINC000670441784	482986845	/nfs/dbraw/zinc/98/68/45/482986845.db2.gz	SZAGSBXRYGLCEP-UHFFFAOYSA-N	1	0	297.362	1.264	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)NCCCn1ccccc1=O	ZINC000670451140	483011985	/nfs/dbraw/zinc/01/19/85/483011985.db2.gz	FSCHQBQNQBQOIU-UHFFFAOYSA-N	1	0	291.395	1.231	50	0		CDAARO
CCn1cc([C@H]2OCC[C@@H]2C[NH2+]Cc2cnn(C)c2)cn1	ZINC000083843562	483204389	/nfs/dbraw/zinc/20/43/89/483204389.db2.gz	RHVHFZGIUTZSEO-HIFRSBDPSA-N	1	0	289.383	1.504	50	0		CDAARO
Clc1cnn(CC[N@@H+]2CCC[C@@H](c3nnc[nH]3)C2)c1	ZINC000459394363	483248297	/nfs/dbraw/zinc/24/82/97/483248297.db2.gz	SVFYHWGDCKYPOU-SNVBAGLBSA-N	1	0	280.763	1.534	50	0		CDAARO
Cc1ncc(C[N@@H+]2CCC[C@H](CN3CCOCC3)C2)n1C	ZINC000668110186	483566328	/nfs/dbraw/zinc/56/63/28/483566328.db2.gz	ZEUNJKFPCGRZGG-OAHLLOKOSA-N	1	0	292.427	1.273	50	0		CDAARO
CC[C@H](C(=O)NCc1ccc(O)cc1)[N@H+](C)CC	ZINC000822555770	1161928622	/nfs/dbraw/zinc/92/86/22/1161928622.db2.gz	KACKJRWZKRWFDU-CYBMUJFWSA-N	1	0	250.342	1.739	50	0		CDAARO
CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(CC(C)(C)[NH3+])C1	ZINC000261745931	534676157	/nfs/dbraw/zinc/67/61/57/534676157.db2.gz	BWJSHFZPKPNDAR-LLVKDONJSA-N	1	0	279.388	1.285	50	0		CDAARO
CC(=O)N1CCc2cc(-c3nc(C4([NH3+])CCC4)no3)ccc21	ZINC000261804232	534820070	/nfs/dbraw/zinc/82/00/70/534820070.db2.gz	PJQBXAIGOHAVDQ-UHFFFAOYSA-N	1	0	298.346	1.984	50	0		CDAARO
Cc1c2ccccc2oc1[C@H](C)NC(=O)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000299741680	525989825	/nfs/dbraw/zinc/98/98/25/525989825.db2.gz	ADFQOFHVPPJFCW-DMDPSCGWSA-N	1	0	288.347	1.641	50	0		CDAARO
Cc1nnc(SCC[NH2+]C[C@@H]2CCOC2)s1	ZINC000053622897	526383468	/nfs/dbraw/zinc/38/34/68/526383468.db2.gz	VCPUYNGPLPZIPV-VIFPVBQESA-N	1	0	259.400	1.565	50	0		CDAARO
[NH3+][C@@H]1CCN(c2ccc(Br)cc2)C1=O	ZINC000049648557	527364032	/nfs/dbraw/zinc/36/40/32/527364032.db2.gz	VYBOJUGFCIEGAW-SECBINFHSA-N	1	0	255.115	1.513	50	0		CDAARO
CC1CC[NH+](C[C@@H](O)CNC(=O)OC(C)(C)C)CC1	ZINC000096483494	528249055	/nfs/dbraw/zinc/24/90/55/528249055.db2.gz	JNDRGQDLZDTDQZ-LBPRGKRZSA-N	1	0	272.389	1.604	50	0		CDAARO
CC(C)c1ncncc1C(=O)N1CCC[C@@H]([C@@H](C)[NH3+])C1	ZINC000269297201	534922332	/nfs/dbraw/zinc/92/23/32/534922332.db2.gz	WHURRLBBLNNPOI-VXGBXAGGSA-N	1	0	276.384	1.799	50	0		CDAARO
CCCN(C(=O)C1CC[NH+](C(C)C)CC1)[C@H](C)CO	ZINC000952977931	614498883	/nfs/dbraw/zinc/49/88/83/614498883.db2.gz	RNFPQBGRUUFBQE-CYBMUJFWSA-N	1	0	270.417	1.726	50	0		CDAARO
CC[C@H](C(=O)N(C)Cc1cc(C)on1)[N@H+](C)CC	ZINC000952979244	615600135	/nfs/dbraw/zinc/60/01/35/615600135.db2.gz	ZPOUSNGFBUOMAX-GFCCVEGCSA-N	1	0	253.346	1.672	50	0		CDAARO
CC[C@H]([NH3+])[C@]1(O)CCCN(C(=O)OC(C)(C)C)C1	ZINC000958528699	615792130	/nfs/dbraw/zinc/79/21/30/615792130.db2.gz	ZNUGSAZMWZVNIU-GWCFXTLKSA-N	1	0	258.362	1.486	50	0		CDAARO
Cn1cncc1/C=C/C(=O)NCc1ccc2c(c1)C[NH2+]C2	ZINC000888096422	617758533	/nfs/dbraw/zinc/75/85/33/617758533.db2.gz	FYYIGYINJOFYKR-SNAWJCMRSA-N	1	0	282.347	1.353	50	0		CDAARO
CCc1cnc(N)nc1NC[C@@H]1CC2(CO1)CC[NH2+]CC2	ZINC001772705611	1159440739	/nfs/dbraw/zinc/44/07/39/1159440739.db2.gz	YWVPNKPXSZJBGY-LBPRGKRZSA-N	1	0	291.399	1.192	50	0		CDAARO
O=C(c1cccs1)[C@@H]1CCC[N@H+](CCn2cncn2)C1	ZINC001704349298	1177696749	/nfs/dbraw/zinc/69/67/49/1177696749.db2.gz	FEQUYFOKMRIJDY-GFCCVEGCSA-N	1	0	290.392	1.935	50	0		CDAARO
CN(C)C(=O)c1ccc(N2CCC[C@H]([NH+](C)C)C2)nc1	ZINC000264898358	721889811	/nfs/dbraw/zinc/88/98/11/721889811.db2.gz	VOCJVHGRAUKEMT-ZDUSSCGKSA-N	1	0	276.384	1.314	50	0		CDAARO
Cn1c(=O)c2ccccc2nc1OC[C@H]1CCC[N@@H+]1C	ZINC000585654290	897703039	/nfs/dbraw/zinc/70/30/39/897703039.db2.gz	GSNCNNCCTFGGQU-LLVKDONJSA-N	1	0	273.336	1.407	50	0		CDAARO
O=C(N[C@@H]1C[N@H+](C2CCCC2)CC[C@@H]1CO)C1CC1	ZINC000581799228	898355814	/nfs/dbraw/zinc/35/58/14/898355814.db2.gz	MKVZTCONRRCKKC-TZMCWYRMSA-N	1	0	266.385	1.138	50	0		CDAARO
O=C(Nc1ccc(Oc2nn[nH]n2)cc1)[C@H]1CCCC[NH2+]1	ZINC000952869460	910421156	/nfs/dbraw/zinc/42/11/56/910421156.db2.gz	KSXCWMMFLVTGKC-LLVKDONJSA-N	1	0	288.311	1.073	50	0		CDAARO
C[C@H](CNS(=O)(=O)C1CC1)[NH2+]C1(C2CCCC2)CC1	ZINC000821826839	925598877	/nfs/dbraw/zinc/59/88/77/925598877.db2.gz	RMYCJILKUBLAFS-LLVKDONJSA-N	1	0	286.441	1.769	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)Cn2ccnc2C)CC1	ZINC000823076035	925667689	/nfs/dbraw/zinc/66/76/89/925667689.db2.gz	NETZXNCHZIWVSQ-UHFFFAOYSA-N	1	0	264.373	1.182	50	0		CDAARO
C[NH+](C)CC1(O)CCN(Cc2ccc(Cl)o2)CC1	ZINC000823684413	925720934	/nfs/dbraw/zinc/72/09/34/925720934.db2.gz	SUGUMKLJGRXRQD-UHFFFAOYSA-N	1	0	272.776	1.822	50	0		CDAARO
CNC(=O)C[C@H]1CC[N@H+](Cc2ccc(Cl)o2)C1	ZINC000823820868	925731977	/nfs/dbraw/zinc/73/19/77/925731977.db2.gz	CBADEUFNYOHQAS-SECBINFHSA-N	1	0	256.733	1.891	50	0		CDAARO
COc1ccc2c(c1)CC[C@H]([N@@H+]1CCCNC(=O)C1)C2	ZINC000824751216	925834819	/nfs/dbraw/zinc/83/48/19/925834819.db2.gz	UFAVSRDIUOEFTE-AWEZNQCLSA-N	1	0	274.364	1.374	50	0		CDAARO
Cc1ccc(C(=O)NCCNc2cc[nH+]cc2C)c(=O)[nH]1	ZINC000825166293	925855477	/nfs/dbraw/zinc/85/54/77/925855477.db2.gz	SIPOPQRMUBCBIG-UHFFFAOYSA-N	1	0	286.335	1.063	50	0		CDAARO
COCCC1([NH+](C)C)CCN(C(=O)c2ccco2)CC1	ZINC000581805036	927202167	/nfs/dbraw/zinc/20/21/67/927202167.db2.gz	QQJMXTWUNCGGBH-UHFFFAOYSA-N	1	0	280.368	1.853	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](CCCn3cccn3)C[C@@H]2O)on1	ZINC001529100707	968980555	/nfs/dbraw/zinc/98/05/55/968980555.db2.gz	XATHTVZAYIFLOU-HIFRSBDPSA-N	1	0	290.367	1.105	50	0		CDAARO
Cc1ccccc1[C@@]1(O)CC[N@H+](CCn2ccnc2)C1	ZINC001506402823	975150538	/nfs/dbraw/zinc/15/05/38/975150538.db2.gz	PVBVCKLFTFSJNT-MRXNPFEDSA-N	1	0	271.364	1.785	50	0		CDAARO
CCc1nc(N2CC[N@H+](C(C)C)[C@@H](CC)C2)no1	ZINC001506416462	975155230	/nfs/dbraw/zinc/15/52/30/975155230.db2.gz	BOFRHUONMWYMCA-NSHDSACASA-N	1	0	252.362	1.941	50	0		CDAARO
CC[N@H+](CCN1CCCC1=O)CC1CCOCC1	ZINC001506415507	975155884	/nfs/dbraw/zinc/15/58/84/975155884.db2.gz	YCWQEKBLNXMVQS-UHFFFAOYSA-N	1	0	254.374	1.357	50	0		CDAARO
c1cn(CCC[NH2+]C2CSCCSC2)nn1	ZINC001506417949	975157235	/nfs/dbraw/zinc/15/72/35/975157235.db2.gz	MNUJGXXTUFOWDH-UHFFFAOYSA-N	1	0	258.416	1.106	50	0		CDAARO
Cc1n[nH]cc1C[NH2+][C@H]1CCc2nnc(C(C)C)n2C1	ZINC000095958125	342468089	/nfs/dbraw/zinc/46/80/89/342468089.db2.gz	VTIZMDCTWAQGGZ-LBPRGKRZSA-N	1	0	274.372	1.538	50	0		CDAARO
CC[C@H](N[C@H]1CC[N@H+](CC2CCCC2)C1)C(=O)OC	ZINC000192853969	342468969	/nfs/dbraw/zinc/46/89/69/342468969.db2.gz	DNEFRJRNOPOUAD-KBPBESRZSA-N	1	0	268.401	1.792	50	0		CDAARO
C[NH+](C)CCCOC1CCN(C(=O)[C@@H](O)C2CCC2)CC1	ZINC000408519581	230404256	/nfs/dbraw/zinc/40/42/56/230404256.db2.gz	VQGMABAACXJQJR-HNNXBMFYSA-N	1	0	298.427	1.107	50	0		CDAARO
CC1=NO[C@@](C)(C(=O)NCc2cccc(C[NH+](C)C)c2)C1	ZINC000584902777	341987039	/nfs/dbraw/zinc/98/70/39/341987039.db2.gz	NKYWBSFRTJUPFA-MRXNPFEDSA-N	1	0	289.379	1.919	50	0		CDAARO
CNC(=O)CC[N@H+](C)C[C@H]1CCOc2ccccc2C1	ZINC000095509774	185001829	/nfs/dbraw/zinc/00/18/29/185001829.db2.gz	UYKXAXYCDQEFRT-ZDUSSCGKSA-N	1	0	276.380	1.696	50	0		CDAARO
O=S(=O)(c1ccccc1)C1C[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000095629235	185016963	/nfs/dbraw/zinc/01/69/63/185016963.db2.gz	BWIPHMSLSMTDDI-QYJAPNMZSA-N	1	0	251.351	1.743	50	0		CDAARO
O=C(OCc1ccccc1)N1CCOC2(CC[NH2+]CC2)C1	ZINC000095642878	185017200	/nfs/dbraw/zinc/01/72/00/185017200.db2.gz	LHLLVARGJVCPIV-UHFFFAOYSA-N	1	0	290.363	1.778	50	0		CDAARO
C[C@@H](C(=O)N1C[C@@H](C)O[C@@H](C)C1)N(C)CC[NH+]1CCCC1	ZINC000107541748	398151848	/nfs/dbraw/zinc/15/18/48/398151848.db2.gz	OPDMIPYESAZPME-ZNMIVQPWSA-N	1	0	297.443	1.038	50	0		CDAARO
Cc1csc(C[NH2+][C@@H]2CCCCC[C@@H]2C(N)=O)n1	ZINC000097375075	342002851	/nfs/dbraw/zinc/00/28/51/342002851.db2.gz	WJNJEGXBLSJXOI-WDEREUQCSA-N	1	0	267.398	1.975	50	0		CDAARO
CCCN1C(=O)N=NC1SCC[C@H]1CCC[N@@H+]1C	ZINC000095975907	185051281	/nfs/dbraw/zinc/05/12/81/185051281.db2.gz	GVSCPRNHZBEISV-SNVBAGLBSA-N	1	0	270.402	1.970	50	0		CDAARO
CC[N@H+](CC(=O)Nc1cc(C(F)(F)F)n[nH]1)C1CC1	ZINC000095979112	185053152	/nfs/dbraw/zinc/05/31/52/185053152.db2.gz	GPWDYYYVAUYXKL-UHFFFAOYSA-N	1	0	276.262	1.851	50	0		CDAARO
CNC(=O)c1cccc(CC[NH2+][C@H]2CCO[C@H](C)C2)c1	ZINC000095983907	185054925	/nfs/dbraw/zinc/05/49/25/185054925.db2.gz	JAMKRJZZBLBZTF-DOMZBBRYSA-N	1	0	276.380	1.746	50	0		CDAARO
O=C(NCc1ccccc1C[N@H+]1CC[C@H](O)C1)C1CC1	ZINC000096006292	185062933	/nfs/dbraw/zinc/06/29/33/185062933.db2.gz	AEBVRWGZTNZVJD-HNNXBMFYSA-N	1	0	274.364	1.279	50	0		CDAARO
CCO[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CC[NH2+]C2)C1(C)C	ZINC000262636967	361743430	/nfs/dbraw/zinc/74/34/30/361743430.db2.gz	XKZFGBJIOBZSNT-QJPTWQEYSA-N	1	0	254.374	1.258	50	0		CDAARO
C[N@@H+]1CC[C@@H]2CCN(C(=O)c3cc(C4CC4)on3)[C@H]2C1	ZINC000240333283	361746418	/nfs/dbraw/zinc/74/64/18/361746418.db2.gz	FCSOOITZNUIIQC-MFKMUULPSA-N	1	0	275.352	1.718	50	0		CDAARO
C[C@@H]1[C@H](Cc2ccccc2)CC[N@@H+]1CCC(=O)NC(N)=O	ZINC000242288035	361755556	/nfs/dbraw/zinc/75/55/56/361755556.db2.gz	YKNNNHLOOXBZQG-OCCSQVGLSA-N	1	0	289.379	1.525	50	0		CDAARO
CCn1cc(CN2CC[N@H+](CC(C)(C)O)[C@@H](C)C2)cn1	ZINC000249898209	365652266	/nfs/dbraw/zinc/65/22/66/365652266.db2.gz	RRZYBIZYBDPBRD-ZDUSSCGKSA-N	1	0	280.416	1.180	50	0		CDAARO
CN1C(=O)N[C@](C)([C@H]2CCC[N@H+](CC3CCC3)C2)C1=O	ZINC000089914241	539087676	/nfs/dbraw/zinc/08/76/76/539087676.db2.gz	HBFDGHIIUWZJHV-SWLSCSKDSA-N	1	0	279.384	1.439	50	0		CDAARO
O=C(NCC[NH2+]C1CC1)c1c(F)c(F)cc(F)c1F	ZINC000195542875	342626598	/nfs/dbraw/zinc/62/65/98/342626598.db2.gz	PNNFGBMVQXOVRA-UHFFFAOYSA-N	1	0	276.233	1.725	50	0		CDAARO
C[C@@]1(O)CC[N@H+](CCCCOc2ccccc2)C[C@@H]1O	ZINC000096148227	185106859	/nfs/dbraw/zinc/10/68/59/185106859.db2.gz	AGBUSNAYHSSIKD-JKSUJKDBSA-N	1	0	279.380	1.663	50	0		CDAARO
CCc1nn(C)cc1C[NH2+][C@@H]1CCCC[C@H]1C(N)=O	ZINC000195562089	342628587	/nfs/dbraw/zinc/62/85/87/342628587.db2.gz	AOCJHKJULSZKFI-DGCLKSJQSA-N	1	0	264.373	1.116	50	0		CDAARO
OCCN(CC[N@@H+]1C[C@H]2CC[C@@H]1C2)Cc1ccccc1	ZINC000243892370	361829277	/nfs/dbraw/zinc/82/92/77/361829277.db2.gz	AGZQMQQGBUUBHA-DLBZAZTESA-N	1	0	274.408	1.965	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)c2ccn3ccnc3c2)CC1	ZINC000095430998	539088091	/nfs/dbraw/zinc/08/80/91/539088091.db2.gz	FHSFSQAUKUHATO-UHFFFAOYSA-N	1	0	258.325	1.112	50	0		CDAARO
Cc1ncc(C(=O)N2CC([N@H+]3CCCC[C@H]3C)C2)c(C)n1	ZINC000097522299	282142111	/nfs/dbraw/zinc/14/21/11/282142111.db2.gz	LGCBIBIEXXNXRR-LLVKDONJSA-N	1	0	288.395	1.792	50	0		CDAARO
Cc1noc(-c2ccccc2C(=O)N[C@@H]2CC[NH2+]C2)n1	ZINC000127156012	342168021	/nfs/dbraw/zinc/16/80/21/342168021.db2.gz	SEUGRGZZAKJRFZ-SNVBAGLBSA-N	1	0	272.308	1.137	50	0		CDAARO
O=C(c1ccco1)N1CCC[N@H+](C[C@H]2CCOC2)CC1	ZINC000244882708	361867967	/nfs/dbraw/zinc/86/79/67/361867967.db2.gz	XWYWBTXYWVLJQE-CYBMUJFWSA-N	1	0	278.352	1.464	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)c2ccc(-c3nc(C4CC4)no3)cc2)C1	ZINC000097020006	185152734	/nfs/dbraw/zinc/15/27/34/185152734.db2.gz	BZJYJDPRQZFGNK-ZDUSSCGKSA-N	1	0	298.346	1.787	50	0		CDAARO
COc1cc(C[NH+](C)C)ccc1NC(=O)[C@H]1CCCO1	ZINC000585139247	342216648	/nfs/dbraw/zinc/21/66/48/342216648.db2.gz	ZIUGUNQUPRXIQW-CYBMUJFWSA-N	1	0	278.352	1.874	50	0		CDAARO
CCOc1ccccc1CCC(=O)N1CC[NH2+]C[C@@H]1C	ZINC000126063514	187214048	/nfs/dbraw/zinc/21/40/48/187214048.db2.gz	ATTCKOZQHBUHQE-ZDUSSCGKSA-N	1	0	276.380	1.838	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)OCc2ccccc2)C[C@@H]1F	ZINC000139842403	362034026	/nfs/dbraw/zinc/03/40/26/362034026.db2.gz	IOUYHTQXIPFYKF-STQMWFEESA-N	1	0	266.316	1.942	50	0		CDAARO
Cc1nn(C)c2nc(N3CC[NH2+][C@H](C)C3)sc12	ZINC000096133514	282285198	/nfs/dbraw/zinc/28/51/98/282285198.db2.gz	ORWBHEPIKSOABU-SSDOTTSWSA-N	1	0	251.359	1.136	50	0		CDAARO
C[N@H+](C1CCCC1)C(C)(C)C(=O)NC[C@H]1CCC[C@@H]1O	ZINC000096488967	529821646	/nfs/dbraw/zinc/82/16/46/529821646.db2.gz	YBZLJOQCGSUENH-OCCSQVGLSA-N	1	0	282.428	1.917	50	0		CDAARO
CO[C@H](C)c1nc(C)c(C(=O)N(C)[C@H]2CC[NH2+]C2)s1	ZINC000179095193	362253597	/nfs/dbraw/zinc/25/35/97/362253597.db2.gz	DEXPCHCGWXVCFY-ZJUUUORDSA-N	1	0	283.397	1.593	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)CCCOc2ccc(F)cc2)C1	ZINC000191370462	362424264	/nfs/dbraw/zinc/42/42/64/362424264.db2.gz	RFPAZQGLQJRQPZ-CYBMUJFWSA-N	1	0	280.343	1.934	50	0		CDAARO
CCC[C@@H](C)[N@@H+]1CCN(CCC(=O)OC)C[C@H]1C	ZINC000249214858	362475689	/nfs/dbraw/zinc/47/56/89/362475689.db2.gz	DPBHWENEIQLIHP-CHWSQXEVSA-N	1	0	256.390	1.744	50	0		CDAARO
CN(C)CC(=O)Nc1ccccc1NC1CC[NH+](C)CC1	ZINC000097101918	185532239	/nfs/dbraw/zinc/53/22/39/185532239.db2.gz	RMEOWABYYXDRCH-UHFFFAOYSA-N	1	0	290.411	1.693	50	0		CDAARO
C[NH+](C)C1CN(C(=O)Nc2cccc(OCCF)c2)C1	ZINC000097113388	185538120	/nfs/dbraw/zinc/53/81/20/185538120.db2.gz	OFRPPUYBELZZSB-UHFFFAOYSA-N	1	0	281.331	1.813	50	0		CDAARO
C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)N(C)CCO	ZINC000097143545	185547943	/nfs/dbraw/zinc/54/79/43/185547943.db2.gz	INYQCPPIBGEEFN-ZFWWWQNUSA-N	1	0	291.395	1.141	50	0		CDAARO
Cn1cc(CC[NH2+]Cc2cn(C)nc2-c2cccnc2)cn1	ZINC000097159831	185551681	/nfs/dbraw/zinc/55/16/81/185551681.db2.gz	XNMZPTNFXMBFHI-UHFFFAOYSA-N	1	0	296.378	1.548	50	0		CDAARO
C[NH2+][C@H]1CCN(Cc2cnn(-c3cc(C)cc(C)c3)n2)C1	ZINC000097162618	185553140	/nfs/dbraw/zinc/55/31/40/185553140.db2.gz	GSRISENVLGBWKW-AWEZNQCLSA-N	1	0	285.395	1.678	50	0		CDAARO
CC1(C)CN(c2cc(C3CC([NH3+])C3)ncn2)CCO1	ZINC000219259630	136583273	/nfs/dbraw/zinc/58/32/73/136583273.db2.gz	XFSKRVGTRQOOQJ-UHFFFAOYSA-N	1	0	262.357	1.297	50	0		CDAARO
Cn1c(-c2ccc(Cl)cc2)nnc1N1CC[NH2+]CC1	ZINC000020270709	282551944	/nfs/dbraw/zinc/55/19/44/282551944.db2.gz	GNOSXWWDVROCSL-UHFFFAOYSA-N	1	0	277.759	1.545	50	0		CDAARO
Cc1c(C(=O)NCCC[N@@H+]2CCCC[C@@H]2CO)ccn1C	ZINC000584896404	349357469	/nfs/dbraw/zinc/35/74/69/349357469.db2.gz	YESBDGAYDUTXEE-CQSZACIVSA-N	1	0	293.411	1.300	50	0		CDAARO
Cc1cc(=O)[nH]c(CC[NH2+][C@@H]2CCCSC2)n1	ZINC000584891592	349350276	/nfs/dbraw/zinc/35/02/76/349350276.db2.gz	QTQRVKKFZNGARX-SNVBAGLBSA-N	1	0	253.371	1.518	50	0		CDAARO
CCSC[C@H](C)[NH2+]CCc1nc(N)cc(=O)[nH]1	ZINC000584891599	349350555	/nfs/dbraw/zinc/35/05/55/349350555.db2.gz	ZUSUJHRTYDKVEF-QMMMGPOBSA-N	1	0	256.375	1.038	50	0		CDAARO
CN(CC[NH+]1CCCC1)C(=O)COC[C@@H]1CCCCO1	ZINC000584893112	349352542	/nfs/dbraw/zinc/35/25/42/349352542.db2.gz	WUCOBWOZHQKJSD-AWEZNQCLSA-N	1	0	284.400	1.126	50	0		CDAARO
CC(C)OCC(=O)N(C)CC[N@H+](C)C1CCCC1	ZINC000584893443	349353692	/nfs/dbraw/zinc/35/36/92/349353692.db2.gz	WTQVRFVJXMWIHP-UHFFFAOYSA-N	1	0	256.390	1.744	50	0		CDAARO
O=C(c1cc[nH]c1)N1C[C@H](CO)[C@H](C[NH+]2CCCCC2)C1	ZINC000091441191	180156605	/nfs/dbraw/zinc/15/66/05/180156605.db2.gz	ASZNIWIWEZAMKF-HUUCEWRRSA-N	1	0	291.395	1.181	50	0		CDAARO
CCOc1ccccc1C(=O)N[C@@H]1CCC[NH2+][C@@H]1C	ZINC000091496536	180171915	/nfs/dbraw/zinc/17/19/15/180171915.db2.gz	BTLWXOCQCOWUON-DGCLKSJQSA-N	1	0	262.353	1.956	50	0		CDAARO
CC(C)c1ncc(CN2CC[C@@]3(O)CC[NH2+]C[C@H]3C2)cn1	ZINC000091548042	180187649	/nfs/dbraw/zinc/18/76/49/180187649.db2.gz	NBJVQOXHEITGRQ-HOCLYGCPSA-N	1	0	290.411	1.146	50	0		CDAARO
COCC[N@@H+]1C[C@H](NC(=O)CCSC)[C@@H](C2CC2)C1	ZINC000091651187	180217227	/nfs/dbraw/zinc/21/72/27/180217227.db2.gz	HOTVZXCACKCIDN-OLZOCXBDSA-N	1	0	286.441	1.213	50	0		CDAARO
COc1ccccc1C[NH2+]C[C@H]1CN(C)CCO1	ZINC000105472239	186059317	/nfs/dbraw/zinc/05/93/17/186059317.db2.gz	IJVGNPHYJQRQHZ-ZDUSSCGKSA-N	1	0	250.342	1.115	50	0		CDAARO
O=C(CCC1CCCCC1)N1CC[C@@]2(O)CC[NH2+]C[C@H]2C1	ZINC000091877053	180278559	/nfs/dbraw/zinc/27/85/59/180278559.db2.gz	PNVNBEPBSZHVHB-RDJZCZTQSA-N	1	0	294.439	1.920	50	0		CDAARO
O=C1CCCN1CC[N@H+]1CCC[C@](CO)(CC2CC2)C1	ZINC000092002156	180304832	/nfs/dbraw/zinc/30/48/32/180304832.db2.gz	LNFODXMPNPZJEG-INIZCTEOSA-N	1	0	280.412	1.483	50	0		CDAARO
Cc1cnn([C@H](C)[C@@H](C)[NH2+][C@H](C)C(=O)N2CCCC2)c1	ZINC000106669191	186131121	/nfs/dbraw/zinc/13/11/21/186131121.db2.gz	BBBVQDNRUWSLAN-MGPQQGTHSA-N	1	0	278.400	1.742	50	0		CDAARO
COCCNC(=S)NC[C@@H](C)[N@@H+]1CCCC[C@@H]1C	ZINC000109030895	186241110	/nfs/dbraw/zinc/24/11/10/186241110.db2.gz	FOGGBQFYTSWHRG-NWDGAFQWSA-N	1	0	273.446	1.360	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1cccc(OC)c1OC	ZINC000013820636	366010674	/nfs/dbraw/zinc/01/06/74/366010674.db2.gz	RCZDXFJAMRSBKF-LBPRGKRZSA-N	1	0	292.379	1.918	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)c1cnccn1	ZINC000257365752	350963219	/nfs/dbraw/zinc/96/32/19/350963219.db2.gz	KJJVADXBLICJNG-CHWSQXEVSA-N	1	0	260.341	1.175	50	0		CDAARO
C[C@H](Cn1cnc2c(cnn2C)c1=O)[NH2+]Cc1ccccc1	ZINC000583652278	366019410	/nfs/dbraw/zinc/01/94/10/366019410.db2.gz	LAZYHORRHVWRIB-GFCCVEGCSA-N	1	0	297.362	1.308	50	0		CDAARO
CCc1nc(C)c(C(=O)N[C@H]2C[NH+]3CCC2CC3)o1	ZINC000065395010	363035366	/nfs/dbraw/zinc/03/53/66/363035366.db2.gz	IJPXASXUYYRBKI-NSHDSACASA-N	1	0	263.341	1.369	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2CCC[NH2+]C2)c(F)cc1F	ZINC000124128695	187123155	/nfs/dbraw/zinc/12/31/55/187123155.db2.gz	JNYAMJAMJQFMGM-VIFPVBQESA-N	1	0	254.280	1.755	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CC[C@@H]([NH3+])C2)c2cccnc12	ZINC000123596666	187099642	/nfs/dbraw/zinc/09/96/42/187099642.db2.gz	ZLORKWULCKEAHU-LLVKDONJSA-N	1	0	291.376	1.265	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=S)Nc1cccnc1	ZINC000037074078	363350082	/nfs/dbraw/zinc/35/00/82/363350082.db2.gz	LVKSWYDNCMJINN-LBPRGKRZSA-N	1	0	264.398	1.852	50	0		CDAARO
COc1cccc(C(=O)OC2CC[NH+](C)CC2)c1OC	ZINC000000362696	355906371	/nfs/dbraw/zinc/90/63/71/355906371.db2.gz	MYDWTPNQWWSLPO-UHFFFAOYSA-N	1	0	279.336	1.955	50	0		CDAARO
CC(=O)Oc1ccc(C(=O)NCCC[NH+](C)C)cc1	ZINC000002745527	355981487	/nfs/dbraw/zinc/98/14/87/355981487.db2.gz	DGMVCINVHLZGSV-UHFFFAOYSA-N	1	0	264.325	1.293	50	0		CDAARO
CC[C@H](C)[NH2+]C[C@@H](O)COc1cccc(OC)c1	ZINC000002451795	355970188	/nfs/dbraw/zinc/97/01/88/355970188.db2.gz	DKKSGKTWOPLXOM-NWDGAFQWSA-N	1	0	253.342	1.823	50	0		CDAARO
CC[NH+](CC)CCOC(=O)c1ccc2c(c1)OCCO2	ZINC000004104421	356018800	/nfs/dbraw/zinc/01/88/00/356018800.db2.gz	ROMJBMNWJJIGNY-UHFFFAOYSA-N	1	0	279.336	1.956	50	0		CDAARO
CC[C@@H](CNC(=O)c1cnc(C)cn1)[NH+]1CCCC1	ZINC000032653739	356330604	/nfs/dbraw/zinc/33/06/04/356330604.db2.gz	XBHSDXHPQVVNPA-LBPRGKRZSA-N	1	0	262.357	1.389	50	0		CDAARO
CC[NH+](CC)CC(=O)NC(=O)NCCc1cccs1	ZINC000016354215	356438239	/nfs/dbraw/zinc/43/82/39/356438239.db2.gz	LIPSYGPYEJPECA-UHFFFAOYSA-N	1	0	283.397	1.458	50	0		CDAARO
CCCc1ccc(OC[C@@H](O)CN2CC[NH+](C)CC2)cc1	ZINC000019338639	356480787	/nfs/dbraw/zinc/48/07/87/356480787.db2.gz	FCQAVEZABJZXRE-INIZCTEOSA-N	1	0	292.423	1.626	50	0		CDAARO
COc1ccc(CN2CCC[N@H+](C)CC2)c(OC)c1OC	ZINC000019536599	356491194	/nfs/dbraw/zinc/49/11/94/356491194.db2.gz	LAIPESIKUCEWKH-UHFFFAOYSA-N	1	0	294.395	1.850	50	0		CDAARO
Cc1cccc(C)c1OCCOCCN1CC[NH+](C)CC1	ZINC000019792398	356503719	/nfs/dbraw/zinc/50/37/19/356503719.db2.gz	QYAUCRUEQHQVCX-UHFFFAOYSA-N	1	0	292.423	1.946	50	0		CDAARO
O=C(CN1CC[NH2+]CC1)Nc1ccc(Cl)cc1Cl	ZINC000019797591	356504778	/nfs/dbraw/zinc/50/47/78/356504778.db2.gz	POWVSJWSARLGMN-UHFFFAOYSA-N	1	0	288.178	1.837	50	0		CDAARO
c1coc(CCC[NH+]2CCN(c3ncccn3)CC2)c1	ZINC000020599799	356549049	/nfs/dbraw/zinc/54/90/49/356549049.db2.gz	YXPOPOGNZARSFQ-UHFFFAOYSA-N	1	0	272.352	1.824	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)c2cc(OC)cs2)C1	ZINC000128860690	538442627	/nfs/dbraw/zinc/44/26/27/538442627.db2.gz	CMRFRTIXFNFPQN-SECBINFHSA-N	1	0	254.355	1.581	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000023095796	356627694	/nfs/dbraw/zinc/62/76/94/356627694.db2.gz	QQQGFRZKGCDDJU-UHFFFAOYSA-N	1	0	267.417	1.463	50	0		CDAARO
CNC(=O)[C@H]1Cc2ccccc2CN1Cc1c(C)noc1C	ZINC000026916360	356701386	/nfs/dbraw/zinc/70/13/86/356701386.db2.gz	DZZMFXHWTVURHU-MRXNPFEDSA-N	1	0	299.374	1.964	50	0		CDAARO
Cc1cc(NC(=O)C[NH+]2C[C@H](C)C[C@@H](C)C2)n(C)n1	ZINC000029597022	356739848	/nfs/dbraw/zinc/73/98/48/356739848.db2.gz	LZBXWGCXYPADTN-GHMZBOCLSA-N	1	0	264.373	1.645	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[N@H+](C)CCCOc1ccccc1	ZINC000029852601	356743777	/nfs/dbraw/zinc/74/37/77/356743777.db2.gz	XSWABDJEIFZWLQ-LBPRGKRZSA-N	1	0	293.367	1.231	50	0		CDAARO
COc1ccc(CNC(=O)C2(C)CC[NH2+]CC2)cc1	ZINC000032919276	356790130	/nfs/dbraw/zinc/79/01/30/356790130.db2.gz	IQZJHUXXZOYRGW-UHFFFAOYSA-N	1	0	262.353	1.701	50	0		CDAARO
CC(C)C[NH2+]Cc1nc(-c2cccc(C(N)=O)c2)no1	ZINC000034924911	356823704	/nfs/dbraw/zinc/82/37/04/356823704.db2.gz	BEGGUENPBBWWAK-UHFFFAOYSA-N	1	0	274.324	1.581	50	0		CDAARO
[NH3+]CCC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000034928777	356824738	/nfs/dbraw/zinc/82/47/38/356824738.db2.gz	QUVAYZPNAPGERR-UHFFFAOYSA-N	1	0	268.382	1.436	50	0		CDAARO
CCN1CCN(S(=O)(=O)c2ccc(OC)c(C)c2)CC1	ZINC000036289223	356869530	/nfs/dbraw/zinc/86/95/30/356869530.db2.gz	WNSZIPYAVBFSOF-UHFFFAOYSA-N	1	0	298.408	1.330	50	0		CDAARO
CCOC(=O)c1ccc(NCCC[NH+](C)C)c(N)c1	ZINC000041081981	357021651	/nfs/dbraw/zinc/02/16/51/357021651.db2.gz	QBAFFXQSHOTYOK-UHFFFAOYSA-N	1	0	265.357	1.809	50	0		CDAARO
[NH3+][C@H]1CCCN(Cc2nc(-c3cccs3)no2)C1	ZINC000041029394	357018886	/nfs/dbraw/zinc/01/88/86/357018886.db2.gz	CCDLBNOEVGGRND-VIFPVBQESA-N	1	0	264.354	1.721	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1CCNC(=O)CCC(=O)NC1CCCC1	ZINC000055383791	357332570	/nfs/dbraw/zinc/33/25/70/357332570.db2.gz	PJPWPHFKYBOTNJ-CQSZACIVSA-N	1	0	295.427	1.426	50	0		CDAARO
CCOC(=O)C(C(=O)OCC)=C(/C=C/[NH+](C)C)N(C)C	ZINC000055494933	357334223	/nfs/dbraw/zinc/33/42/23/357334223.db2.gz	XKBJKPYTBOPDTQ-MDZDMXLPSA-N	1	0	284.356	1.004	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)COc1cccc(C)c1	ZINC000057159638	357352218	/nfs/dbraw/zinc/35/22/18/357352218.db2.gz	ZVCSOCKHAJGREX-AWEZNQCLSA-N	1	0	276.380	1.974	50	0		CDAARO
CCCC[C@@H](C[NH3+])NS(=O)(=O)c1sc(C)nc1C	ZINC000095432157	357516421	/nfs/dbraw/zinc/51/64/21/357516421.db2.gz	DUPBJWIFYZCUNO-JTQLQIEISA-N	1	0	291.442	1.556	50	0		CDAARO
Cc1nnc([C@H](C)NC(=O)CC[NH+]2CCCCCCC2)[nH]1	ZINC000063872504	357519346	/nfs/dbraw/zinc/51/93/46/357519346.db2.gz	DORBKKFWLDCEHP-LBPRGKRZSA-N	1	0	293.415	1.947	50	0		CDAARO
O=c1[nH]c(CC[NH2+][C@H]2CCSC2)nc2ccccc21	ZINC000065371445	357532079	/nfs/dbraw/zinc/53/20/79/357532079.db2.gz	ZKKUWLNLEWZHPN-JTQLQIEISA-N	1	0	275.377	1.561	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CCC(=O)N1CC(n2cccn2)C1	ZINC000065399230	357538217	/nfs/dbraw/zinc/53/82/17/357538217.db2.gz	DGHADBNZFZZICO-CYBMUJFWSA-N	1	0	276.384	1.531	50	0		CDAARO
CCNc1ccnc(N2CC[C@H]([NH+](CC)CC)C2)n1	ZINC000065403501	357538264	/nfs/dbraw/zinc/53/82/64/357538264.db2.gz	KDCRVEPTIIOOGZ-LBPRGKRZSA-N	1	0	263.389	1.829	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(NCCc2c[nH]cn2)c1C	ZINC000065433010	357541590	/nfs/dbraw/zinc/54/15/90/357541590.db2.gz	KADUELUWHSGDNL-UHFFFAOYSA-N	1	0	260.345	1.537	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1cnc2ccnn2c1C	ZINC000065462179	357543173	/nfs/dbraw/zinc/54/31/73/357543173.db2.gz	MJAVOZDNDNHPFK-LBPRGKRZSA-N	1	0	287.367	1.252	50	0		CDAARO
CC(=O)NCCC1=CCC[N@H+](Cc2c(C)noc2C)C1	ZINC000065464923	357543465	/nfs/dbraw/zinc/54/34/65/357543465.db2.gz	JKALBWGRXYKWFS-UHFFFAOYSA-N	1	0	277.368	1.950	50	0		CDAARO
CC(C)Oc1ccc([C@H]2[NH2+]CCc3nc[nH]c32)cc1CO	ZINC000065525810	357546506	/nfs/dbraw/zinc/54/65/06/357546506.db2.gz	ZFWFVDVNGGMPRW-OAHLLOKOSA-N	1	0	287.363	1.924	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC([NH2+]C2COC2)CC1	ZINC000067802910	357629206	/nfs/dbraw/zinc/62/92/06/357629206.db2.gz	SRLOABIBNBVMQB-UHFFFAOYSA-N	1	0	256.346	1.374	50	0		CDAARO
c1cc(CN2CC[NH+]([C@H]3CCSC3)CC2)no1	ZINC000098019316	538879962	/nfs/dbraw/zinc/87/99/62/538879962.db2.gz	CEZPGQOQQOKBFH-LBPRGKRZSA-N	1	0	253.371	1.298	50	0		CDAARO
COc1cc(CNc2cc(CC[NH3+])nc(C)n2)ccc1O	ZINC000067886083	357635259	/nfs/dbraw/zinc/63/52/59/357635259.db2.gz	YTBMWGYAJKPQFL-UHFFFAOYSA-N	1	0	288.351	1.613	50	0		CDAARO
Cc1cc(F)cc(CN2CC[C@@]([NH3+])(C(=O)[O-])C2)c1	ZINC000067947666	357638976	/nfs/dbraw/zinc/63/89/76/357638976.db2.gz	ZSWZXIUEJDERGD-ZDUSSCGKSA-N	1	0	252.289	1.122	50	0		CDAARO
COc1c(F)cc(CNC[C@]2(O)CCC[NH2+]C2)cc1F	ZINC000072432951	357834712	/nfs/dbraw/zinc/83/47/12/357834712.db2.gz	KFRUWTJHOUQHMQ-AWEZNQCLSA-N	1	0	286.322	1.178	50	0		CDAARO
CC(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](CO)C2)cc1	ZINC000023114710	358037771	/nfs/dbraw/zinc/03/77/71/358037771.db2.gz	WISZMOROTTWOPT-CQSZACIVSA-N	1	0	262.353	1.849	50	0		CDAARO
Cc1cc(F)c(S(=O)(=O)N[C@@H](C[NH3+])C2CC2)cc1F	ZINC000097229398	358043590	/nfs/dbraw/zinc/04/35/90/358043590.db2.gz	PPIOIFNNOQVVFK-NSHDSACASA-N	1	0	290.335	1.289	50	0		CDAARO
F[C@@H]1C[NH2+][C@H](CNc2ncnc3ccsc32)C1	ZINC000082106890	358147218	/nfs/dbraw/zinc/14/72/18/358147218.db2.gz	DIJIYLYPFYDSSG-YUMQZZPRSA-N	1	0	252.318	1.803	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000008266657	283363207	/nfs/dbraw/zinc/36/32/07/283363207.db2.gz	YOVRCEQNLOHWNK-SDDRHHMPSA-N	1	0	267.373	1.343	50	0		CDAARO
C[C@H](Cc1ccccc1)C[N@@H+]1CCO[C@@H](C(N)=O)C1	ZINC000195569288	358566697	/nfs/dbraw/zinc/56/66/97/358566697.db2.gz	AWVJPKFHLGAVTO-TZMCWYRMSA-N	1	0	262.353	1.051	50	0		CDAARO
Cc1cc(CNC(=O)C2CC[NH+](C(C)C)CC2)n(C)n1	ZINC000095359135	358684194	/nfs/dbraw/zinc/68/41/94/358684194.db2.gz	MCURBFFPWPQKIX-UHFFFAOYSA-N	1	0	278.400	1.465	50	0		CDAARO
C[N@@H+]1CCC[C@@H](Cn2ncc3ccccc3c2=O)C1	ZINC000095371442	358687662	/nfs/dbraw/zinc/68/76/62/358687662.db2.gz	GFELSUAJINSLMT-GFCCVEGCSA-N	1	0	257.337	1.738	50	0		CDAARO
CSc1ccccc1CN1CCN([C@H]2CC[NH2+]C2)CC1	ZINC000097499509	358780652	/nfs/dbraw/zinc/78/06/52/358780652.db2.gz	KRTLIGSTNGNTBP-HNNXBMFYSA-N	1	0	291.464	1.888	50	0		CDAARO
O=C([C@H]1C[C@@H](O)C[NH2+]1)N1CC=C(c2ccc(F)cc2)CC1	ZINC000097642356	358789305	/nfs/dbraw/zinc/78/93/05/358789305.db2.gz	KXKVYAVZTBLLML-HUUCEWRRSA-N	1	0	290.338	1.164	50	0		CDAARO
O=C1OCC2(CC[NH+](Cc3cccc4nonc43)CC2)O1	ZINC000097660400	358791639	/nfs/dbraw/zinc/79/16/39/358791639.db2.gz	QMCBPVLEHDCDRH-UHFFFAOYSA-N	1	0	289.291	1.724	50	0		CDAARO
CC[N@@H+](Cc1cn(C)nc1C)C[C@@H](O)c1cccc(O)c1	ZINC000215231384	358879428	/nfs/dbraw/zinc/87/94/28/358879428.db2.gz	HOANCXVLIZMWNQ-MRXNPFEDSA-N	1	0	289.379	1.990	50	0		CDAARO
O=S(=O)(N[C@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccccc1	ZINC000216281692	358935329	/nfs/dbraw/zinc/93/53/29/358935329.db2.gz	CCJULNHRHTZKFT-KBPBESRZSA-N	1	0	280.393	1.592	50	0		CDAARO
Cc1cccnc1CNc1cc(C2CC([NH3+])C2)nc(N)n1	ZINC000219056871	359077207	/nfs/dbraw/zinc/07/72/07/359077207.db2.gz	QMZOUWQOOGISAU-UHFFFAOYSA-N	1	0	284.367	1.579	50	0		CDAARO
O=C(c1ccc(F)c(O)c1)N1CC([NH+]2CCCCC2)C1	ZINC000220669113	359189698	/nfs/dbraw/zinc/18/96/98/359189698.db2.gz	KWOCQHFCVOWCJR-UHFFFAOYSA-N	1	0	278.327	1.842	50	0		CDAARO
Cc1cnc(CNc2cc(C3CC(O)C3)[nH+]c(N)n2)cn1	ZINC000223594060	359437378	/nfs/dbraw/zinc/43/73/78/359437378.db2.gz	TYURKBGIHDQRNQ-UHFFFAOYSA-N	1	0	286.339	1.008	50	0		CDAARO
O=c1oc2ccccc2n1CC[NH+]1CCC(O)CC1	ZINC000026903108	359461591	/nfs/dbraw/zinc/46/15/91/359461591.db2.gz	OGDDIWVYWCTPIO-UHFFFAOYSA-N	1	0	262.309	1.051	50	0		CDAARO
CCC[C@@H](C)C[NH+]1CCC(n2cc(CO)nn2)CC1	ZINC000063847041	359645665	/nfs/dbraw/zinc/64/56/65/359645665.db2.gz	MRCFVJLCYATGAM-GFCCVEGCSA-N	1	0	266.389	1.844	50	0		CDAARO
O=C1NC2(CC[NH2+]CC2)C(=O)N1Cc1ccc(Cl)s1	ZINC000061409426	359845782	/nfs/dbraw/zinc/84/57/82/359845782.db2.gz	DTGBMHCGEXREBG-UHFFFAOYSA-N	1	0	299.783	1.576	50	0		CDAARO
CN(CC[N@H+](C)C1CC1)C(=O)COc1ccc(CO)cc1	ZINC000408518194	359903588	/nfs/dbraw/zinc/90/35/88/359903588.db2.gz	WOLZFCWXSVPLPF-UHFFFAOYSA-N	1	0	292.379	1.110	50	0		CDAARO
CCCCOC[C@@H](O)C[NH+]1CCN(c2ccccn2)CC1	ZINC000033603406	359971917	/nfs/dbraw/zinc/97/19/17/359971917.db2.gz	DAKZIHQIWZQYPD-HNNXBMFYSA-N	1	0	293.411	1.381	50	0		CDAARO
O=C(c1cc2ccccc2oc1=O)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000065394604	360094134	/nfs/dbraw/zinc/09/41/34/360094134.db2.gz	YWKFVKSPJLZQIY-OLZOCXBDSA-N	1	0	298.342	1.760	50	0		CDAARO
CS[C@H](C)C(=O)N1CCC[C@H]1[C@H]1CCC[N@@H+]1C	ZINC000248107152	360363181	/nfs/dbraw/zinc/36/31/81/360363181.db2.gz	GAYVOXCCMSEGAX-UTUOFQBUSA-N	1	0	256.415	1.823	50	0		CDAARO
Cc1[nH]nc2ncc(C[NH2+][C@H]3CCCCNC3=O)cc12	ZINC000089568204	360462274	/nfs/dbraw/zinc/46/22/74/360462274.db2.gz	OUHWCOCJQRNNIL-LBPRGKRZSA-N	1	0	273.340	1.025	50	0		CDAARO
CN(CC[C@H](O)c1ccccc1)C(=O)NCCC[NH+](C)C	ZINC000426529305	360681390	/nfs/dbraw/zinc/68/13/90/360681390.db2.gz	MUEYCKXZVKQLGU-HNNXBMFYSA-N	1	0	293.411	1.703	50	0		CDAARO
Cn1c(Sc2cnccn2)nnc1[C@H]1CCC[NH2+]C1	ZINC000426409240	360665999	/nfs/dbraw/zinc/66/59/99/360665999.db2.gz	FZKDPYIGSPITGP-VIFPVBQESA-N	1	0	276.369	1.223	50	0		CDAARO
CC[C@H](CNC(=O)c1cc(=O)cc(C)[nH]1)[NH+]1CCCCC1	ZINC000426428031	360668922	/nfs/dbraw/zinc/66/89/22/360668922.db2.gz	NKVHQSPEVHMPAH-CYBMUJFWSA-N	1	0	291.395	1.678	50	0		CDAARO
CCC[N@@H+]1CC[C@@H](NC(=O)Cc2nc3ccccc3[nH]2)C1	ZINC000426707293	360698063	/nfs/dbraw/zinc/69/80/63/360698063.db2.gz	XSGYYJAUOUIHKO-GFCCVEGCSA-N	1	0	286.379	1.706	50	0		CDAARO
[NH3+]CCOc1ccc(CC(=O)NC[C@H]2CCCOC2)cc1	ZINC000426739871	360701127	/nfs/dbraw/zinc/70/11/27/360701127.db2.gz	TYWAQFPQCCXCJI-CQSZACIVSA-N	1	0	292.379	1.109	50	0		CDAARO
CCCc1c(C)nc(N2CC[NH+](CC)CC2)[nH]c1=O	ZINC000006665428	360776445	/nfs/dbraw/zinc/77/64/45/360776445.db2.gz	TVHOYXVJEKLNEM-UHFFFAOYSA-N	1	0	264.373	1.173	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2ccc(N3CCCC3)nc2)C1	ZINC000178974472	189159028	/nfs/dbraw/zinc/15/90/28/189159028.db2.gz	LSJYCMGRKRHQAI-CYBMUJFWSA-N	1	0	288.395	1.363	50	0		CDAARO
CC(C)(C)C[NH+]1CCN(C(=O)[C@@H]2CCCO2)CC1	ZINC000036125458	361005539	/nfs/dbraw/zinc/00/55/39/361005539.db2.gz	UOCRWWAEAMBEON-LBPRGKRZSA-N	1	0	254.374	1.356	50	0		CDAARO
CC(C)(C)[C@H]([NH3+])C(=O)NCCn1cc(Cl)cn1	ZINC000299759705	361602732	/nfs/dbraw/zinc/60/27/32/361602732.db2.gz	QSMFCUPHVQNNJN-SECBINFHSA-N	1	0	258.753	1.026	50	0		CDAARO
COC(=O)[C@H](N[C@@H]1CCc2ccccc2C1)[C@@H](C)O	ZINC000191962517	361589649	/nfs/dbraw/zinc/58/96/49/361589649.db2.gz	ZIPAEWXPHPZZNY-LERXQTSPSA-N	1	0	263.337	1.056	50	0		CDAARO
C[C@@H](Cn1cccn1)[NH2+]Cc1cccc2c1OCO2	ZINC000036325293	361654153	/nfs/dbraw/zinc/65/41/53/361654153.db2.gz	OBIKEKFCDFSTSQ-NSHDSACASA-N	1	0	259.309	1.790	50	0		CDAARO
CC(C)(CO)CCCNC(=O)N1CC[C@H]([NH+]2CC=CC2)C1	ZINC000101559233	363934744	/nfs/dbraw/zinc/93/47/44/363934744.db2.gz	QKXVKYXVUVICGB-AWEZNQCLSA-N	1	0	295.427	1.441	50	0		CDAARO
C[C@@H]1CN(C(=O)CCCOc2ccc(F)cc2F)CC[NH2+]1	ZINC000188400664	189501149	/nfs/dbraw/zinc/50/11/49/189501149.db2.gz	XLLFBPNWAPVHKK-LLVKDONJSA-N	1	0	298.333	1.944	50	0		CDAARO
C[C@H]1CCCN(C(=O)COCc2ccccc2)[C@H]1C[NH3+]	ZINC000179224018	364988665	/nfs/dbraw/zinc/98/86/65/364988665.db2.gz	UHCUIRKGARCZSB-ZFWWWQNUSA-N	1	0	276.380	1.789	50	0		CDAARO
COC(=O)CC1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1	ZINC000089886836	366952465	/nfs/dbraw/zinc/95/24/65/366952465.db2.gz	MHOKJCRWCGYSAY-CHWSQXEVSA-N	1	0	255.358	1.565	50	0		CDAARO
C[NH+]1CCC(OC(=O)N2CC[C@@H](OCC3CC3)C2)CC1	ZINC000575617457	371771340	/nfs/dbraw/zinc/77/13/40/371771340.db2.gz	BOFVLRDMVFVCAZ-CQSZACIVSA-N	1	0	282.384	1.718	50	0		CDAARO
CC[N@H+](C)C(C)(C)CNC(=O)[C@@H](C)n1cc(Cl)cn1	ZINC000299767644	372750543	/nfs/dbraw/zinc/75/05/43/372750543.db2.gz	IOPVHBPVEDEBME-SNVBAGLBSA-N	1	0	286.807	1.944	50	0		CDAARO
O=C(N[C@@H]1CCC[N@@H+](C2CCCC2)C1)c1cnc[nH]1	ZINC000299774520	372752563	/nfs/dbraw/zinc/75/25/63/372752563.db2.gz	DPPKNMFXJNMLOF-LLVKDONJSA-N	1	0	262.357	1.547	50	0		CDAARO
Cc1ccc2[nH]c(C[N@@H+]3CC[C@H](O)C3)cc(=O)c2c1	ZINC000299796188	372770073	/nfs/dbraw/zinc/77/00/73/372770073.db2.gz	NHLPCCCQSFNVQF-LBPRGKRZSA-N	1	0	258.321	1.815	50	0		CDAARO
CN(C)c1cccc(NC(=O)N2CC[C@@H]([NH+](C)C)C2)c1	ZINC000299803121	372773418	/nfs/dbraw/zinc/77/34/18/372773418.db2.gz	XKPRVNGHSHOIRH-CQSZACIVSA-N	1	0	276.384	1.920	50	0		CDAARO
Cc1ccccc1C[N@@H+]1CC[C@@H]2CN(S(C)(=O)=O)[C@@H]2C1	ZINC000253413941	373723791	/nfs/dbraw/zinc/72/37/91/373723791.db2.gz	WAPYXOWCNGEJNR-HUUCEWRRSA-N	1	0	294.420	1.461	50	0		CDAARO
CS[C@@H]1CC[C@H]([N@H+](C)CCS(C)(=O)=O)C1	ZINC000110641737	374174847	/nfs/dbraw/zinc/17/48/47/374174847.db2.gz	BGHRXVUIZYPYNM-VHSXEESVSA-N	1	0	251.417	1.247	50	0		CDAARO
Cc1c(F)cccc1-c1ccc(C[N@H+]2C[C@@H](O)[C@@H](O)C2)o1	ZINC000093483549	374758985	/nfs/dbraw/zinc/75/89/85/374758985.db2.gz	HPXJSYVPQDJFRD-GASCZTMLSA-N	1	0	291.322	1.932	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(c2ncnc(N)c2Cl)CC1	ZINC000277751946	374809885	/nfs/dbraw/zinc/80/98/85/374809885.db2.gz	JXEQVHOQMIRRSI-SECBINFHSA-N	1	0	269.780	1.633	50	0		CDAARO
Cc1ccc(CC[C@@H](C)[NH2+]CCS(C)(=O)=O)cc1	ZINC000095421215	374923391	/nfs/dbraw/zinc/92/33/91/374923391.db2.gz	LKKHWSNFNQRQPL-CYBMUJFWSA-N	1	0	269.410	1.950	50	0		CDAARO
CC[C@@H](NC(=O)NC1CC[NH+](CC)CC1)[C@@H]1CCCO1	ZINC000095440301	374943318	/nfs/dbraw/zinc/94/33/18/374943318.db2.gz	WXKPYXGLTFHHGC-KGLIPLIRSA-N	1	0	283.416	1.728	50	0		CDAARO
CCC(=O)Nc1cccc(NC(=O)NCC[NH+](C)C)c1	ZINC000097050917	375140558	/nfs/dbraw/zinc/14/05/58/375140558.db2.gz	VOSGRYXZUXQDOV-UHFFFAOYSA-N	1	0	278.356	1.718	50	0		CDAARO
O=CN1CCC(OC(=O)c2ccn3c[nH+]cc3c2)CC1	ZINC000097049124	375141508	/nfs/dbraw/zinc/14/15/08/375141508.db2.gz	AUGIYSQZNLCZEF-UHFFFAOYSA-N	1	0	273.292	1.112	50	0		CDAARO
C[C@H](CCc1cccc(F)c1)[N@@H+]1CCO[C@H](C(N)=O)C1	ZINC000097084348	375144022	/nfs/dbraw/zinc/14/40/22/375144022.db2.gz	OXSADRJXEUTUSC-RISCZKNCSA-N	1	0	280.343	1.333	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@@H]2CSc3ccccc3O2)C1	ZINC000299739034	375200107	/nfs/dbraw/zinc/20/01/07/375200107.db2.gz	JRVGTEPZXFIWPB-JQWIXIFHSA-N	1	0	278.377	1.347	50	0		CDAARO
O=C(NCCc1csc2ccccc12)[C@@H]1C[C@@H](O)C[NH2+]1	ZINC000299750218	375206706	/nfs/dbraw/zinc/20/67/06/375206706.db2.gz	MXBMYVXKGHDIIU-YPMHNXCESA-N	1	0	290.388	1.283	50	0		CDAARO
CC(=O)Nc1ccc(SCC[NH2+]CCO)cc1	ZINC000002638974	375281752	/nfs/dbraw/zinc/28/17/52/375281752.db2.gz	LBBJKTMDJSCSJD-UHFFFAOYSA-N	1	0	254.355	1.319	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)/C=C\c2ccc3c(c2)OCCO3)C1	ZINC000493316867	375442239	/nfs/dbraw/zinc/44/22/39/375442239.db2.gz	HHUPUFMDLAAMSR-DTRQGZQOSA-N	1	0	274.320	1.031	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)/C=C\c2cncc(F)c2)C1	ZINC000493349950	375445210	/nfs/dbraw/zinc/44/52/10/375445210.db2.gz	INFWCISPKLFKMX-DSYXLKISSA-N	1	0	277.343	1.692	50	0		CDAARO
O=C(NC[C@H]1CC[N@@H+](C2CC2)C1)NC1CCCC1	ZINC000031084018	375737253	/nfs/dbraw/zinc/73/72/53/375737253.db2.gz	XUUDBMOHMAROFC-LLVKDONJSA-N	1	0	251.374	1.713	50	0		CDAARO
C[C@H](CNC(=O)N[C@@H]1[C@H]2CCO[C@H]2C1(C)C)[N@H+](C)C1CC1	ZINC000240333655	376017077	/nfs/dbraw/zinc/01/70/77/376017077.db2.gz	FEQSNETXIMENLX-FMKGYKFTSA-N	1	0	295.427	1.582	50	0		CDAARO
C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CCN1C(=O)NC(C)(C)C1=O	ZINC000240668510	376017228	/nfs/dbraw/zinc/01/72/28/376017228.db2.gz	HNDQKGZCBDRNMJ-GDNZZTSVSA-N	1	0	281.400	1.731	50	0		CDAARO
C[C@@H]1C[C@@H](O)C[C@H](C)[N@H+]1CC(=O)N1CCc2ccccc21	ZINC000241383320	376019531	/nfs/dbraw/zinc/01/95/31/376019531.db2.gz	MUGBIEALRHYHGA-AGGWBTHJSA-N	1	0	288.391	1.809	50	0		CDAARO
COC(=O)CCC[N@@H+]1C[C@@H](O)C[C@H]1C1CCCCC1	ZINC000241277608	376019713	/nfs/dbraw/zinc/01/97/13/376019713.db2.gz	LHOMIELMWPRDIO-KBPBESRZSA-N	1	0	269.385	1.955	50	0		CDAARO
O=C(Cn1cccn1)Nc1ccc2c(c1)C[NH2+]CCO2	ZINC000261836860	190045317	/nfs/dbraw/zinc/04/53/17/190045317.db2.gz	VGPQLOIWPDGYRJ-UHFFFAOYSA-N	1	0	272.308	1.004	50	0		CDAARO
Cc1cnc(C)c(N2CCOC3(CC[NH+](C)CC3)C2)n1	ZINC000645387933	377287604	/nfs/dbraw/zinc/28/76/04/377287604.db2.gz	SVUPWGRLTAFLDZ-UHFFFAOYSA-N	1	0	276.384	1.394	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)Nc1cccnn1)c1cccs1	ZINC000089313841	377824173	/nfs/dbraw/zinc/82/41/73/377824173.db2.gz	DTEIBJMUXIKSFU-JTQLQIEISA-N	1	0	291.380	1.963	50	0		CDAARO
COCCC[NH2+]C[C@H](O)COc1cccc2[nH]c(C)cc21	ZINC000004084740	184530866	/nfs/dbraw/zinc/53/08/66/184530866.db2.gz	NALDNEWIXOEXNR-ZDUSSCGKSA-N	1	0	292.379	1.842	50	0		CDAARO
Cc1cnc(C(=O)NC[C@H](c2ccccc2)[NH+](C)C)cn1	ZINC000023198420	390241937	/nfs/dbraw/zinc/24/19/37/390241937.db2.gz	BNFAYNGDQLCKPZ-OAHLLOKOSA-N	1	0	284.363	1.818	50	0		CDAARO
C[NH2+]Cc1nc2ccc(Br)cc2c(=O)[nH]1	ZINC000031811685	390329049	/nfs/dbraw/zinc/32/90/49/390329049.db2.gz	LMTBXMTVMLPWDN-UHFFFAOYSA-N	1	0	268.114	1.405	50	0		CDAARO
c1ccc(C[N@H+]2CCCC[C@H]2CN2CCOCC2)nc1	ZINC000096424219	390516137	/nfs/dbraw/zinc/51/61/37/390516137.db2.gz	HZOXVRPWDPJBGA-INIZCTEOSA-N	1	0	275.396	1.768	50	0		CDAARO
CC[NH2+]CCN1CCN(c2cccc(OC)c2)CC1	ZINC000048784557	390674506	/nfs/dbraw/zinc/67/45/06/390674506.db2.gz	OEIYYSRPTQRIKW-UHFFFAOYSA-N	1	0	263.385	1.427	50	0		CDAARO
C[C@]1(O)N(C2CC2)C(=O)OC12CC(C)(C)[NH2+]C(C)(C)C2	ZINC000000036889	390801992	/nfs/dbraw/zinc/80/19/92/390801992.db2.gz	XZUBYKNEMFCNPL-CQSZACIVSA-N	1	0	282.384	1.989	50	0		CDAARO
CC(C)c1cc(C(=O)N2CC[N@@H+]3CCC[C@@H]3C2)nc(N)n1	ZINC000216947880	391016551	/nfs/dbraw/zinc/01/65/51/391016551.db2.gz	IUQZNGHXYLZFEG-LLVKDONJSA-N	1	0	289.383	1.102	50	0		CDAARO
Fc1ccc(N2CC[C@@H](N3CCC[NH2+]CC3)C2)cc1	ZINC000259453277	391043933	/nfs/dbraw/zinc/04/39/33/391043933.db2.gz	WIRDEYVOVZBSMA-OAHLLOKOSA-N	1	0	263.360	1.700	50	0		CDAARO
C[N@@H+]1CCN(c2ccc3nnnn3n2)[C@@H](c2ccccc2)C1	ZINC000014135839	391174025	/nfs/dbraw/zinc/17/40/25/391174025.db2.gz	FZZRPSSTHFOIPP-CYBMUJFWSA-N	1	0	295.350	1.012	50	0		CDAARO
CCCN1C[C@@H](C[NH2+][C@H]2CCCSC2)CC1=O	ZINC000421356226	391849635	/nfs/dbraw/zinc/84/96/35/391849635.db2.gz	WQZCLGSWYHXIIP-NEPJUHHUSA-N	1	0	256.415	1.730	50	0		CDAARO
CC(C)[N@H+](C)CC(=O)NC[C@@]1(C)CCCC[C@H]1O	ZINC000245316878	391979467	/nfs/dbraw/zinc/97/94/67/391979467.db2.gz	LAHTXJTZEGNJJI-TZMCWYRMSA-N	1	0	256.390	1.384	50	0		CDAARO
COCC[N@@H+]1CCC[C@H]1CNC(=O)N[C@H]1C=CCCC1	ZINC000089414565	392086545	/nfs/dbraw/zinc/08/65/45/392086545.db2.gz	LSIAGTWCTPRYGD-KBPBESRZSA-N	1	0	281.400	1.505	50	0		CDAARO
C[C@H]1CSCCN1CC(O)C[N@@H+]1CCSC[C@@H]1C	ZINC000194540587	392786925	/nfs/dbraw/zinc/78/69/25/392786925.db2.gz	PQVQJNQBUUIYON-RYUDHWBXSA-N	1	0	290.498	1.222	50	0		CDAARO
Cc1ccc(O)c(C[NH2+]CC(C)(C)N2CCOCC2)n1	ZINC000103340835	397898335	/nfs/dbraw/zinc/89/83/35/397898335.db2.gz	KHTTYIITQIPDRO-UHFFFAOYSA-N	1	0	279.384	1.296	50	0		CDAARO
CC(C)Cn1cc(CN2CCCC[C@@H]2C[NH3+])cn1	ZINC000097162632	397981426	/nfs/dbraw/zinc/98/14/26/397981426.db2.gz	VBIICHHCRQXVKY-CQSZACIVSA-N	1	0	250.390	1.852	50	0		CDAARO
CO[C@H]1C[C@@H](C[NH+]2CCCC2)N(C(=O)[C@H]2CCCOC2)C1	ZINC000408516389	286093802	/nfs/dbraw/zinc/09/38/02/286093802.db2.gz	VEAXDBATVHSXFS-KKUMJFAQSA-N	1	0	296.411	1.125	50	0		CDAARO
CCS[C@H]1CCCC[C@@H]1[NH2+]CCN1C(=O)CCC1=O	ZINC000190021977	286719551	/nfs/dbraw/zinc/71/95/51/286719551.db2.gz	QJOHJAORROEHAC-RYUDHWBXSA-N	1	0	284.425	1.789	50	0		CDAARO
Fc1ccc(OCCOCC[NH2+]C[C@H]2CCCO2)cc1	ZINC000002270006	169783468	/nfs/dbraw/zinc/78/34/68/169783468.db2.gz	RHCPJGMOPIMKFS-OAHLLOKOSA-N	1	0	283.343	1.990	50	0		CDAARO
CCC[C@]1(C(=O)OCC)C[C@H](CSC(N)=[NH2+])OC1=O	ZINC000004112206	169933915	/nfs/dbraw/zinc/93/39/15/169933915.db2.gz	FVMXZJUGGLQTQM-PRHODGIISA-N	1	0	288.369	1.278	50	0		CDAARO
C[NH+](C)CCNC(=O)c1ccccc1Br	ZINC000005248068	170078772	/nfs/dbraw/zinc/07/87/72/170078772.db2.gz	NRMPWVVPSKNDNL-UHFFFAOYSA-N	1	0	271.158	1.741	50	0		CDAARO
COc1cccc(NC(=S)NCCC[NH+](C)C)c1	ZINC000005549516	170112051	/nfs/dbraw/zinc/11/20/51/170112051.db2.gz	MWCMOAXYNKSUMM-UHFFFAOYSA-N	1	0	267.398	1.933	50	0		CDAARO
Cc1c(C)n(CCC[NH+](C)C)c2ncn3ncnc3c12	ZINC000006760121	170241746	/nfs/dbraw/zinc/24/17/46/170241746.db2.gz	BGJAIFNCXHWEOU-UHFFFAOYSA-N	1	0	272.356	1.648	50	0		CDAARO
C[C@@H]1CCC[N@H+](CC(=O)NC(=O)NCC(F)(F)F)C1	ZINC000007340738	170278020	/nfs/dbraw/zinc/27/80/20/170278020.db2.gz	FBNQJOPFSLTQAR-MRVPVSSYSA-N	1	0	281.278	1.106	50	0		CDAARO
C[C@@H](C(=O)Nc1ccc(C(N)=O)cc1)[N@@H+]1CCC[C@H](C)C1	ZINC000007384234	170282033	/nfs/dbraw/zinc/28/20/33/170282033.db2.gz	VFWKLJMZWUBNTP-RYUDHWBXSA-N	1	0	289.379	1.844	50	0		CDAARO
Cn1nnnc1SCCC[NH2+]Cc1ccccc1	ZINC000007540460	170290371	/nfs/dbraw/zinc/29/03/71/170290371.db2.gz	RRYRZZFSRVXERH-UHFFFAOYSA-N	1	0	263.370	1.482	50	0		CDAARO
C[NH+](C)CCNS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000007612664	170294166	/nfs/dbraw/zinc/29/41/66/170294166.db2.gz	GHCHVEQFUGCMOT-UHFFFAOYSA-N	1	0	284.425	1.824	50	0		CDAARO
COc1ccccc1C[C@@H](C)[NH2+][C@@H]1CCCCNC1=O	ZINC000008556440	170340193	/nfs/dbraw/zinc/34/01/93/170340193.db2.gz	PRMOMIGBCGVQBO-TZMCWYRMSA-N	1	0	276.380	1.885	50	0		CDAARO
Cc1csc2nc(CSC(N)=[NH2+])cc(=O)n12	ZINC000009596107	170382140	/nfs/dbraw/zinc/38/21/40/170382140.db2.gz	NYHVLZKXWOSHPL-UHFFFAOYSA-N	1	0	254.340	1.191	50	0		CDAARO
Cc1ccc2c(cc(C(=O)NCC[NH+](C)C)n2C)c1	ZINC000009614553	170383031	/nfs/dbraw/zinc/38/30/31/170383031.db2.gz	MJVLYRVQBKVSSF-UHFFFAOYSA-N	1	0	259.353	1.778	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1Nc1cc(C)nc(-c2cccnc2)n1	ZINC000534661276	411828613	/nfs/dbraw/zinc/82/86/13/411828613.db2.gz	GOITXORNENPBJR-STQMWFEESA-N	1	0	285.351	1.246	50	0		CDAARO
C[C@H](CN1CC[NH+](C)CC1)OC(=O)c1ccccc1F	ZINC000020292748	171134252	/nfs/dbraw/zinc/13/42/52/171134252.db2.gz	DNVMQTVCORLUES-GFCCVEGCSA-N	1	0	280.343	1.618	50	0		CDAARO
CC[NH+]1CCN(CC(=O)NCc2ccc(Cl)cc2)CC1	ZINC000020608803	171267329	/nfs/dbraw/zinc/26/73/29/171267329.db2.gz	KJADSUDWGZFBEZ-UHFFFAOYSA-N	1	0	295.814	1.594	50	0		CDAARO
Cc1cccc(C(=O)NCCCN2CC[NH+](C)CC2)c1	ZINC000020818776	171273115	/nfs/dbraw/zinc/27/31/15/171273115.db2.gz	PEEBFSDNSZSZFU-UHFFFAOYSA-N	1	0	275.396	1.362	50	0		CDAARO
Cc1ccc(CNC(=O)C2CC[NH2+]CC2)cc1F	ZINC000021953160	171340762	/nfs/dbraw/zinc/34/07/62/171340762.db2.gz	QACGDJLKCJEEEO-UHFFFAOYSA-N	1	0	250.317	1.750	50	0		CDAARO
NC(=O)c1ccc(-c2ccc(CN3CC[NH2+]CC3)cc2)cc1	ZINC000032520398	171731790	/nfs/dbraw/zinc/73/17/90/171731790.db2.gz	AEKCDCHDYNSDOB-UHFFFAOYSA-N	1	0	295.386	1.858	50	0		CDAARO
Cc1cccc(N2C[C@H](C(=O)NCC[NH+](C)C)CC2=O)c1	ZINC000034916254	171893470	/nfs/dbraw/zinc/89/34/70/171893470.db2.gz	FCMZQSWIEFKIKR-CYBMUJFWSA-N	1	0	289.379	1.026	50	0		CDAARO
CN1CCc2onc(-c3cccc(C[NH3+])c3)c2C1=O	ZINC000035605815	172292612	/nfs/dbraw/zinc/29/26/12/172292612.db2.gz	WDRFAAPRKVMACK-UHFFFAOYSA-N	1	0	257.293	1.428	50	0		CDAARO
CCNc1ncc(C(=O)N[C@@H]2CCC[N@H+](CC)C2)s1	ZINC000127222686	413912303	/nfs/dbraw/zinc/91/23/03/413912303.db2.gz	SVNLKUCUKYAFNV-SNVBAGLBSA-N	1	0	282.413	1.789	50	0		CDAARO
CC(C)(C)OC(=O)NCC1CN([C@@H]2CCC[NH2+]C2)C1	ZINC000039952021	174177214	/nfs/dbraw/zinc/17/72/14/174177214.db2.gz	INADAXASGPTAFL-GFCCVEGCSA-N	1	0	269.389	1.195	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1cc(=O)[nH]c2ccccc21	ZINC000039975618	174180418	/nfs/dbraw/zinc/18/04/18/174180418.db2.gz	LMNSBMUUWLZQPY-GFCCVEGCSA-N	1	0	299.374	1.742	50	0		CDAARO
Cc1cc(NC(=O)C[NH+]2CCCCCC2)n(C)n1	ZINC000040477511	174282623	/nfs/dbraw/zinc/28/26/23/174282623.db2.gz	OGWJGVNIQLIGCF-UHFFFAOYSA-N	1	0	250.346	1.543	50	0		CDAARO
C[C@@H](Cn1cccn1)[NH2+]CCC(=O)N1CCC(C)CC1	ZINC000067604955	175779397	/nfs/dbraw/zinc/77/93/97/175779397.db2.gz	CCMSCFJYNOGTGK-AWEZNQCLSA-N	1	0	278.400	1.510	50	0		CDAARO
Cc1ccc2c(c1)oc(C(=O)N[C@@H]1CC[C@@H]([NH3+])C1)cc2=O	ZINC000067803737	175793867	/nfs/dbraw/zinc/79/38/67/175793867.db2.gz	QCVUMEYALLIFKS-GHMZBOCLSA-N	1	0	286.331	1.711	50	0		CDAARO
Cc1nnsc1C(=O)N1CCC[C@@H]([NH+](C)C)CC1	ZINC000072133600	176321969	/nfs/dbraw/zinc/32/19/69/176321969.db2.gz	REQMZBZRAHZJOP-SNVBAGLBSA-N	1	0	268.386	1.403	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(C(=O)CCc2csc(N)n2)CC1	ZINC000072152746	176327400	/nfs/dbraw/zinc/32/74/00/176327400.db2.gz	GPUSZHZJKNKFFG-GFCCVEGCSA-N	1	0	296.440	1.601	50	0		CDAARO
C[C@@H]1C[N@@H+](C[C@@H](O)COC2CCCC2)C[C@H](C)O1	ZINC000012419913	424377213	/nfs/dbraw/zinc/37/72/13/424377213.db2.gz	VKESFLWTZYJZIP-FRRDWIJNSA-N	1	0	257.374	1.416	50	0		CDAARO
COc1ccc(-c2cc(C)cc3c2O[C@H](C[NH3+])C3)nn1	ZINC000299790937	274103516	/nfs/dbraw/zinc/10/35/16/274103516.db2.gz	CAIKCALSCCBGSZ-NSHDSACASA-N	1	0	271.320	1.723	50	0		CDAARO
Cc1ccc2[nH]c3c(ncnc3N3CC[NH2+]CC3)c2c1	ZINC000009546885	274768327	/nfs/dbraw/zinc/76/83/27/274768327.db2.gz	YFKUJPYSFSCBLZ-UHFFFAOYSA-N	1	0	267.336	1.829	50	0		CDAARO
O[C@@H](C[NH+]1CCC2(CC1)OCCO2)c1ccc(F)cc1	ZINC000026936782	275050905	/nfs/dbraw/zinc/05/09/05/275050905.db2.gz	IOMVXYCMCCYMHH-AWEZNQCLSA-N	1	0	281.327	1.698	50	0		CDAARO
CN1CCN(C(=O)c2coc3ccccc23)[C@@H](C[NH3+])C1	ZINC000097227701	277100215	/nfs/dbraw/zinc/10/02/15/277100215.db2.gz	GVZQQXPVRFDBCN-NSHDSACASA-N	1	0	273.336	1.148	50	0		CDAARO
CNc1cc(C)[nH+]c(N2CCO[C@H](C(F)(F)F)C2)n1	ZINC000071715063	277302035	/nfs/dbraw/zinc/30/20/35/277302035.db2.gz	QIJKHFDJCZPYOQ-QMMMGPOBSA-N	1	0	276.262	1.594	50	0		CDAARO
CC(C)(C)OC(=O)N1CC2(C1)C[C@H](CC[NH3+])CO2	ZINC000306145413	278380431	/nfs/dbraw/zinc/38/04/31/278380431.db2.gz	DVYBWRVXYPMBFP-JTQLQIEISA-N	1	0	256.346	1.361	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(CC[NH2+]CC2)[C@@H](CO)C1	ZINC000216643696	278384169	/nfs/dbraw/zinc/38/41/69/278384169.db2.gz	TVWJNPSVCJUULZ-GFCCVEGCSA-N	1	0	284.400	1.606	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@]2(C[C@@H](C[NH3+])CO2)C1	ZINC000091303592	278397414	/nfs/dbraw/zinc/39/74/14/278397414.db2.gz	CYIJGWKOFZHWLD-FZMZJTMJSA-N	1	0	270.373	1.751	50	0		CDAARO
O=C(N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)[C@H]1CCC[NH2+]1	ZINC000252507948	279939868	/nfs/dbraw/zinc/93/98/68/279939868.db2.gz	WXXNAGDTTILZDA-APIJFGDWSA-N	1	0	256.349	1.583	50	0		CDAARO
Cc1c(Cl)cccc1OCC(=O)N1CCC[C@H]1C[NH3+]	ZINC000262605075	280233399	/nfs/dbraw/zinc/23/33/99/280233399.db2.gz	BHNXFGMAXGBRHT-NSHDSACASA-N	1	0	282.771	1.977	50	0		CDAARO
Cc1cccc(N2C(=O)C[C@@H]([NH+]3CCCC3)C2=O)c1	ZINC000022016024	281223422	/nfs/dbraw/zinc/22/34/22/281223422.db2.gz	WJRLKLPCDNJTMY-CYBMUJFWSA-N	1	0	258.321	1.723	50	0		CDAARO
CC1(C)C[C@H]([NH2+][C@H]2CC(=O)N(C3CC3)C2)C(C)(C)O1	ZINC000090181387	281359806	/nfs/dbraw/zinc/35/98/06/281359806.db2.gz	KASGNWRGEGBPHC-JQWIXIFHSA-N	1	0	266.385	1.685	50	0		CDAARO
Cc1cccn2c(C[N@@H+]3CCC[C@H](CC(N)=O)C3)cnc12	ZINC000093808969	289059483	/nfs/dbraw/zinc/05/94/83/289059483.db2.gz	OKZAJINDNJYSER-CYBMUJFWSA-N	1	0	286.379	1.730	50	0		CDAARO
Cc1nc2cc(C(=O)N(C)C)ccc2n1C1CC[NH2+]CC1	ZINC000021155669	293441464	/nfs/dbraw/zinc/44/14/64/293441464.db2.gz	XGTTUNKDTUBMHQ-UHFFFAOYSA-N	1	0	286.379	1.971	50	0		CDAARO
CCC[C@@H](CNC(=O)N1CC(c2ccncc2)C1)[NH+](C)C	ZINC000534587882	328316314	/nfs/dbraw/zinc/31/63/14/328316314.db2.gz	CUGOVPAANNZRNZ-HNNXBMFYSA-N	1	0	290.411	1.921	50	0		CDAARO
Cc1cccc([C@@H](CNC(=O)c2cc(N)n[nH]2)[NH+](C)C)c1	ZINC000534646029	328332507	/nfs/dbraw/zinc/33/25/07/328332507.db2.gz	YXQRIVABEKMPPI-CYBMUJFWSA-N	1	0	287.367	1.163	50	0		CDAARO
O=C(NCCc1cccc(C(F)(F)F)c1)[C@@H]1C=CC[NH2+]1	ZINC000534640000	328335404	/nfs/dbraw/zinc/33/54/04/328335404.db2.gz	FAFMOHRLNSXRPK-LBPRGKRZSA-N	1	0	284.281	1.892	50	0		CDAARO
COCC1(C(=O)N[C@H]2COC[C@@H]2[NH+]2CCCCC2)CCC1	ZINC000534640157	328335643	/nfs/dbraw/zinc/33/56/43/328335643.db2.gz	YYKHBWJZVRNBPC-KBPBESRZSA-N	1	0	296.411	1.173	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCNc2cccc(C(N)=O)n2)C1	ZINC000534654381	328338874	/nfs/dbraw/zinc/33/88/74/328338874.db2.gz	CANGQWYTZXWAFW-LLVKDONJSA-N	1	0	262.357	1.324	50	0		CDAARO
Cc1cc(C(=O)NC[C@H]2CC[N@@H+](C3CCCC3)C2)nn1C	ZINC000534658075	328341167	/nfs/dbraw/zinc/34/11/67/328341167.db2.gz	MUMQCUFFCGWTNZ-CYBMUJFWSA-N	1	0	290.411	1.723	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)[C@@]2(C)CCCCO2)CC1	ZINC000534658193	328341237	/nfs/dbraw/zinc/34/12/37/328341237.db2.gz	JYERCOUJRQPYES-CQSZACIVSA-N	1	0	268.401	1.936	50	0		CDAARO
O=C([C@H]1C=CC[NH2+]1)N1CCC(OCc2ccccn2)CC1	ZINC000534663299	328350799	/nfs/dbraw/zinc/35/07/99/328350799.db2.gz	APDIHBRMAMTXAU-OAHLLOKOSA-N	1	0	287.363	1.117	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@]2(C)CC[NH2+]C2)C[C@H](c2ccccc2)O1	ZINC000269249820	330068151	/nfs/dbraw/zinc/06/81/51/330068151.db2.gz	LYLCUMRMYSECSF-FRFSOERESA-N	1	0	288.391	1.975	50	0		CDAARO
COc1ccc(CN(C)C(=O)[C@@H]2CC[C@H]([NH3+])C2)cc1F	ZINC000091540224	482569868	/nfs/dbraw/zinc/56/98/68/482569868.db2.gz	TUTUUSPWKFPXDU-NEPJUHHUSA-N	1	0	280.343	1.920	50	0		CDAARO
[NH3+][C@@H]1CCC[C@@H]1C(=O)N1CCC[C@H](C(F)(F)F)C1	ZINC000085365349	482577530	/nfs/dbraw/zinc/57/75/30/482577530.db2.gz	DJIBCPSWSLSRFY-LPEHRKFASA-N	1	0	264.291	1.915	50	0		CDAARO
CC(C)[C@H]1CN(C(=O)c2cnc(C3CC3)nc2)C[C@@H]1[NH3+]	ZINC000092078980	482599061	/nfs/dbraw/zinc/59/90/61/482599061.db2.gz	KZUZKIIRQUYNIZ-OLZOCXBDSA-N	1	0	274.368	1.409	50	0		CDAARO
O=C1CC[C@@H]([N@@H+]2CCOc3ccccc3C2)CCN1	ZINC000670444371	482991829	/nfs/dbraw/zinc/99/18/29/482991829.db2.gz	CIVQMMLKMNSZEA-CYBMUJFWSA-N	1	0	260.337	1.550	50	0		CDAARO
Cc1ncn(C)c1C(=O)N1CCC2(CC[N@H+](C)C2)CC1	ZINC000670469807	483066625	/nfs/dbraw/zinc/06/66/25/483066625.db2.gz	HGIAQCGLMCNVFG-UHFFFAOYSA-N	1	0	276.384	1.286	50	0		CDAARO
CO[C@H](C)CC(=O)NC[C@H]1CCC[N@@H+](C(C)C)C1	ZINC000084597484	483296697	/nfs/dbraw/zinc/29/66/97/483296697.db2.gz	QBYSCYXNMFQLFV-CHWSQXEVSA-N	1	0	256.390	1.648	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNC(=O)NC[C@H]1CCCO1	ZINC000239760998	521592838	/nfs/dbraw/zinc/59/28/38/521592838.db2.gz	CJDVBKBIKBYHGV-CHWSQXEVSA-N	1	0	269.389	1.339	50	0		CDAARO
Cc1cc(C(=O)NC[C@H]2CCC[NH2+]C2)ccc1F	ZINC000063056107	524099397	/nfs/dbraw/zinc/09/93/97/524099397.db2.gz	MCTWVUAWDBDBJU-NSHDSACASA-N	1	0	250.317	1.864	50	0		CDAARO
COc1cccc(SCC(=O)N2CCC[N@H+](C)CC2)c1	ZINC000365062855	526244068	/nfs/dbraw/zinc/24/40/68/526244068.db2.gz	OCOSDAUPMKJMKQ-UHFFFAOYSA-N	1	0	294.420	1.951	50	0		CDAARO
CCNC(=O)NC(=O)C[NH2+][C@H](C)C(C)(C)c1ccccc1	ZINC000096491402	528162856	/nfs/dbraw/zinc/16/28/56/528162856.db2.gz	QQXNGCQJMYKMEW-GFCCVEGCSA-N	1	0	291.395	1.788	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N1CCC[C@H]1C[NH2+]C	ZINC000193300354	679641444	/nfs/dbraw/zinc/64/14/44/679641444.db2.gz	CNKLJTMDHWAYSX-ZDUSSCGKSA-N	1	0	282.409	1.622	50	0		CDAARO
c1ccc(C[C@H]2CN(c3cnccn3)CC[NH2+]2)cc1	ZINC000952993666	678088683	/nfs/dbraw/zinc/08/86/83/678088683.db2.gz	JYXCOZCFRNUPHL-AWEZNQCLSA-N	1	0	254.337	1.498	50	0		CDAARO
C[NH+]1CCN(CCNC(=O)c2cc3c(s2)CCC3)CC1	ZINC000193905422	678115549	/nfs/dbraw/zinc/11/55/49/678115549.db2.gz	RJJHGZMINYWEFD-UHFFFAOYSA-N	1	0	293.436	1.214	50	0		CDAARO
Cc1nc(CNCCC[N@@H+]2CCC[C@H](CO)C2)n(C)c1C	ZINC000952986806	678739136	/nfs/dbraw/zinc/73/91/36/678739136.db2.gz	BEDZKOFGEKGPRX-HNNXBMFYSA-N	1	0	294.443	1.221	50	0		CDAARO
Cn1ccnc1C[NH2+][C@@H](Cn1ccnc1)C(C)(C)C	ZINC000051923387	678832696	/nfs/dbraw/zinc/83/26/96/678832696.db2.gz	ZRNYGKGQMUASFR-LBPRGKRZSA-N	1	0	261.373	1.821	50	0		CDAARO
CCCc1nc(C)cc(N2CCOC[C@H](C[NH+](C)C)C2)n1	ZINC000072140045	679038959	/nfs/dbraw/zinc/03/89/59/679038959.db2.gz	CMYRELXECXRAIA-CQSZACIVSA-N	1	0	292.427	1.752	50	0		CDAARO
C[C@@]1(CNC(=O)c2cn[nH]n2)CCC[N@@H+]1Cc1ccccc1	ZINC000188257086	679053548	/nfs/dbraw/zinc/05/35/48/679053548.db2.gz	OXZGTTGRDOCUCC-INIZCTEOSA-N	1	0	299.378	1.589	50	0		CDAARO
CC[C@H]1CN(c2ccc(C(C)=O)cn2)CC[N@@H+]1C[C@H](C)O	ZINC000248122608	679413823	/nfs/dbraw/zinc/41/38/23/679413823.db2.gz	UPYWRZSLARMSRE-WFASDCNBSA-N	1	0	291.395	1.566	50	0		CDAARO
Cc1nc(Cl)cc(N2CCC(O)(C[NH+](C)C)CC2)n1	ZINC000710630380	679491486	/nfs/dbraw/zinc/49/14/86/679491486.db2.gz	FKLFCDMNIKFTOQ-UHFFFAOYSA-N	1	0	284.791	1.331	50	0		CDAARO
Cc1nc(CN(CC[NH+](C)C)Cc2nccs2)c[nH]1	ZINC001772706479	1159441153	/nfs/dbraw/zinc/44/11/53/1159441153.db2.gz	ZROJSIVVHWPZHT-UHFFFAOYSA-N	1	0	279.413	1.738	50	0		CDAARO
CCOc1ccc(C[NH+]2CCC([C@@H](O)CO)CC2)cn1	ZINC001772712448	1159446814	/nfs/dbraw/zinc/44/68/14/1159446814.db2.gz	MPAYAFQZBLSFST-AWEZNQCLSA-N	1	0	280.368	1.046	50	0		CDAARO
CN(C)c1nc(NCC[C@@H]2CCC[N@@H+]2C)ncc1F	ZINC001704313011	1177684304	/nfs/dbraw/zinc/68/43/04/1177684304.db2.gz	DUYYIYRARFFNSP-JTQLQIEISA-N	1	0	267.352	1.578	50	0		CDAARO
C[NH+](C)CCN(Cc1c[nH]cn1)C(=O)CC1CCCC1	ZINC001704315858	1177685399	/nfs/dbraw/zinc/68/53/99/1177685399.db2.gz	POZDRRMJQLZRSZ-UHFFFAOYSA-N	1	0	278.400	1.880	50	0		CDAARO
CCc1cc(C[N@H+]2C[C@@H](Cc3cnccn3)[C@H](O)C2)on1	ZINC001704338799	1177695135	/nfs/dbraw/zinc/69/51/35/1177695135.db2.gz	GLOIFYRQIHOPCW-IAQYHMDHSA-N	1	0	288.351	1.062	50	0		CDAARO
c1ncn(CC[N@@H+]2CCC[C@H](OCc3ccccn3)C2)n1	ZINC001704355534	1177699517	/nfs/dbraw/zinc/69/95/17/1177699517.db2.gz	PZCXSVRGLMPMIR-HNNXBMFYSA-N	1	0	287.367	1.354	50	0		CDAARO
C[C@H]([NH2+]Cc1ccsc1S(N)(=O)=O)C1CC1	ZINC000952883706	910454284	/nfs/dbraw/zinc/45/42/84/910454284.db2.gz	OTZVTJMAZCPZQL-ZETCQYMHSA-N	1	0	260.384	1.284	50	0		CDAARO
CCCOc1cccc(NC(=O)[C@]2([NH3+])CC[C@@H](O)C2)c1	ZINC000952884248	910458258	/nfs/dbraw/zinc/45/82/58/910458258.db2.gz	RPOJIQADDSFYRL-DOMZBBRYSA-N	1	0	278.352	1.656	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]C1CCS(=O)(=O)CC1	ZINC000823557287	925709613	/nfs/dbraw/zinc/70/96/13/925709613.db2.gz	JHHDZEMZJPMDFE-LLVKDONJSA-N	1	0	285.413	1.001	50	0		CDAARO
COc1nc(NC(C)(C)CN2CC[NH+](C)CC2)ncc1F	ZINC000824845396	925839847	/nfs/dbraw/zinc/83/98/47/925839847.db2.gz	BZIGXBVUXVABII-UHFFFAOYSA-N	1	0	297.378	1.062	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CCNc1cc(NCCO)ncn1	ZINC000828767795	926180234	/nfs/dbraw/zinc/18/02/34/926180234.db2.gz	QRNCIFMRGRYCGT-GFCCVEGCSA-N	1	0	279.388	1.167	50	0		CDAARO
C[NH+](C)[C@H]1CC[C@@H](NC(=O)OC2CCOCC2)C1	ZINC000585084892	930884189	/nfs/dbraw/zinc/88/41/89/930884189.db2.gz	YQXGGLWSHBAAQD-MNOVXSKESA-N	1	0	256.346	1.374	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+](CC2COCOC2)C1	ZINC000585116867	930969463	/nfs/dbraw/zinc/96/94/63/930969463.db2.gz	KWXCZIXDOYALKN-DZGCQCFKSA-N	1	0	298.427	1.624	50	0		CDAARO
Cc1noc([C@@H]2C[N@@H+](C[C@@H]3CCCOCC3)CCN2C)n1	ZINC000585117578	930985672	/nfs/dbraw/zinc/98/56/72/930985672.db2.gz	MADCIYZAVFVIPT-KGLIPLIRSA-N	1	0	294.399	1.483	50	0		CDAARO
O=C(NCc1nccs1)[C@@H]1CCC[C@@H]2CCC[N@@H+]21	ZINC000585121982	930988147	/nfs/dbraw/zinc/98/81/47/930988147.db2.gz	ITLGEJIXZWZLIZ-MNOVXSKESA-N	1	0	265.382	1.776	50	0		CDAARO
C[C@H](C[NH+](C)C)[C@H]1CCCCN1C(=O)c1ccn(C)n1	ZINC000585128031	931012004	/nfs/dbraw/zinc/01/20/04/931012004.db2.gz	PZQKUTBBNDUKPR-TZMCWYRMSA-N	1	0	278.400	1.613	50	0		CDAARO
C=CC(=O)N1CCO[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]21	ZINC000404184072	940956843	/nfs/dbraw/zinc/95/68/43/940956843.db2.gz	ACFWICWWQPPDNO-HOTGVXAUSA-N	1	0	286.375	1.674	50	0		CDAARO
CCc1nn(C)c(NC(=O)[C@@H]2CCCC[NH2+]2)c1C	ZINC001529179756	969004093	/nfs/dbraw/zinc/00/40/93/969004093.db2.gz	DLNAITFHLYQOIW-NSHDSACASA-N	1	0	250.346	1.372	50	0		CDAARO
Cc1c[nH+]ccc1N1CCC[N@H+](CCCC(=O)[O-])CC1	ZINC001529189290	969009062	/nfs/dbraw/zinc/00/90/62/969009062.db2.gz	KIGFCSDQWPGCKV-UHFFFAOYSA-N	1	0	277.368	1.767	50	0		CDAARO
CN1CCC([NH2+][C@@H]2COC[C@H]2Cc2ccncc2)CC1	ZINC001529191238	969009803	/nfs/dbraw/zinc/00/98/03/969009803.db2.gz	VKJNEVFTAILCOD-GDBMZVCRSA-N	1	0	275.396	1.323	50	0		CDAARO
C[C@@H](CCN(C)C(=O)c1cc(O)ccc1N)[NH+]1CCCC1	ZINC001506400804	975149142	/nfs/dbraw/zinc/14/91/42/975149142.db2.gz	XFEBIQICTIMTNR-LBPRGKRZSA-N	1	0	291.395	1.921	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CCCn2cccn2)n1	ZINC001506400674	975149486	/nfs/dbraw/zinc/14/94/86/975149486.db2.gz	OJODGMQZFDYOBQ-ZDUSSCGKSA-N	1	0	261.373	1.765	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]Cc1cnc(C)cn1	ZINC001506405478	975152081	/nfs/dbraw/zinc/15/20/81/975152081.db2.gz	DUXDXPTYQLDSPT-GFCCVEGCSA-N	1	0	259.357	1.722	50	0		CDAARO
C[C@@H](C[N@H+](C)CCO)NC1(c2cc(F)ccc2F)CC1	ZINC001506407906	975153390	/nfs/dbraw/zinc/15/33/90/975153390.db2.gz	KUXQCNDBPZSJKL-NSHDSACASA-N	1	0	284.350	1.856	50	0		CDAARO
COCc1cc(C[NH2+][C@H](C)Cn2nc(C)cc2C)[nH]n1	ZINC001506411227	975154146	/nfs/dbraw/zinc/15/41/46/975154146.db2.gz	XMKSYCPFPKASAV-LLVKDONJSA-N	1	0	277.372	1.548	50	0		CDAARO
Cc1nnc(N2CC[N@@H+](C)[C@@H](CCO)C2)c2ccccc12	ZINC001506415598	975155463	/nfs/dbraw/zinc/15/54/63/975155463.db2.gz	ZBVMWMUQJYRKQY-ZDUSSCGKSA-N	1	0	286.379	1.441	50	0		CDAARO
CCS(=O)(=O)NCC1CC[NH+](CCC(C)C)CC1	ZINC000096456763	230377668	/nfs/dbraw/zinc/37/76/68/230377668.db2.gz	QPZIXMLPLGPZJY-UHFFFAOYSA-N	1	0	276.446	1.684	50	0		CDAARO
CCCS(=O)(=O)NC[C@H](C)[NH2+]Cc1cnc(C)c(C)c1	ZINC000584903967	341994178	/nfs/dbraw/zinc/99/41/78/341994178.db2.gz	WZIYRIAQQAUESA-LBPRGKRZSA-N	1	0	299.440	1.506	50	0		CDAARO
COC(=O)[C@@H](C)C[C@H](C)[NH2+]Cc1ccnc(OC)c1	ZINC000095940675	185035611	/nfs/dbraw/zinc/03/56/11/185035611.db2.gz	WPIOERJJJLZOLQ-QWRGUYRKSA-N	1	0	266.341	1.768	50	0		CDAARO
C[C@@H](C1CC1)N(C(=O)C[NH2+][C@@H](CO)C1CC1)C1CC1	ZINC000095941347	185036642	/nfs/dbraw/zinc/03/66/42/185036642.db2.gz	AAOWXUJORDKYJQ-HZMBPMFUSA-N	1	0	266.385	1.136	50	0		CDAARO
C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]C[C@H](O)CO)C1	ZINC000238857288	361740970	/nfs/dbraw/zinc/74/09/70/361740970.db2.gz	YPSZPHVKLRDAEC-UKMLZYKCSA-N	1	0	263.381	1.902	50	0		CDAARO
C[C@@](O)(C[N@@H+]1CCC[C@H](Cn2ccnn2)C1)C(F)(F)F	ZINC000241587908	361753485	/nfs/dbraw/zinc/75/34/85/361753485.db2.gz	OYBLWSZGJUEHQP-WDEREUQCSA-N	1	0	292.305	1.303	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@H]2CO)c(OC)c1C	ZINC000006667498	342089139	/nfs/dbraw/zinc/08/91/39/342089139.db2.gz	JBDQEEDZWGBFQW-ZDUSSCGKSA-N	1	0	265.353	1.969	50	0		CDAARO
Cc1nn(C)c2nc(NC[C@H](O)C[NH+]3CCCC3)sc12	ZINC000096130676	185103691	/nfs/dbraw/zinc/10/36/91/185103691.db2.gz	BILKRSRYWIMZHI-JTQLQIEISA-N	1	0	295.412	1.207	50	0		CDAARO
Cc1ccnc(N2CCC[C@@H]2C(=O)N2CCOCC2)c1	ZINC000195539157	342626475	/nfs/dbraw/zinc/62/64/75/342626475.db2.gz	JLQSNYJLHKDDEW-CYBMUJFWSA-N	1	0	275.352	1.218	50	0		CDAARO
CCC(=O)N[C@H]1CCC[N@H+](Cc2ccc(O)cc2)C1	ZINC000195575810	342628791	/nfs/dbraw/zinc/62/87/91/342628791.db2.gz	DXAVHNNXQXGZEH-ZDUSSCGKSA-N	1	0	262.353	1.883	50	0		CDAARO
COC(CN1CCC[C@H]([NH+]2CCCCC2)C1)OC	ZINC000195572055	342628836	/nfs/dbraw/zinc/62/88/36/342628836.db2.gz	FIPOFJGTKZRYAT-ZDUSSCGKSA-N	1	0	256.390	1.556	50	0		CDAARO
COc1cccc([C@H](C)[NH2+][C@H](C)C(=O)N[C@@H]2CCOC2)c1	ZINC000195577529	342628908	/nfs/dbraw/zinc/62/89/08/342628908.db2.gz	JUKDHODNBFBQFD-OUCADQQQSA-N	1	0	292.379	1.639	50	0		CDAARO
Cc1cnccc1CN(C)c1cc([C@H]2C[C@@H]([NH3+])C2)nc(N)n1	ZINC000243892368	361828704	/nfs/dbraw/zinc/82/87/04/361828704.db2.gz	AGYSUQTYRRBCHG-BETUJISGSA-N	1	0	298.394	1.603	50	0		CDAARO
CC[C@H](C(=O)NCc1ccc(C(=O)NC)o1)[NH+]1CCCC1	ZINC000244594259	361853347	/nfs/dbraw/zinc/85/33/47/361853347.db2.gz	DJKQRXQQKUABHX-GFCCVEGCSA-N	1	0	293.367	1.130	50	0		CDAARO
CC(C)C(=O)N1CC[C@@](O)(c2ccccc2)[C@H]([NH+](C)C)C1	ZINC000097942696	342160188	/nfs/dbraw/zinc/16/01/88/342160188.db2.gz	FDBHUTVHSCAKMR-NVXWUHKLSA-N	1	0	290.407	1.693	50	0		CDAARO
CC[N@@H+]1C[C@H](NC(=O)c2cccn2C(C)C)[C@@H](OC)C1	ZINC000244773842	361862141	/nfs/dbraw/zinc/86/21/41/361862141.db2.gz	PHQCCULPVMMGDI-JSGCOSHPSA-N	1	0	279.384	1.518	50	0		CDAARO
CC[N@@H+]1CCCN(c2cc([C@H]3C[C@@H](O)C3)ncn2)CC1	ZINC000244787688	361863804	/nfs/dbraw/zinc/86/38/04/361863804.db2.gz	QBSQDCHQTPBFBA-BETUJISGSA-N	1	0	276.384	1.247	50	0		CDAARO
c1cnn(CC[C@H]2CCCC[N@@H+]2CCn2cncn2)c1	ZINC000244872856	361866326	/nfs/dbraw/zinc/86/63/26/361866326.db2.gz	WFOGDCRZPWKILQ-CQSZACIVSA-N	1	0	274.372	1.419	50	0		CDAARO
CCO[C@@H]1C[C@@](O)(C[NH2+]Cc2c(C)nn(C)c2C)C1(C)C	ZINC000188903410	342204052	/nfs/dbraw/zinc/20/40/52/342204052.db2.gz	CCIFIINIYUFDEQ-GDBMZVCRSA-N	1	0	295.427	1.693	50	0		CDAARO
C[C@](CO)([NH2+]CCO)c1cccc(C(F)(F)F)c1	ZINC000097011829	185151772	/nfs/dbraw/zinc/15/17/72/185151772.db2.gz	ABFXWCDHAQRPSH-LLVKDONJSA-N	1	0	263.259	1.495	50	0		CDAARO
COCC[N@H+](C)CCNC(=O)N1CCC[C@@H](C)[C@H]1C	ZINC000097010467	185152015	/nfs/dbraw/zinc/15/20/15/185152015.db2.gz	FZZCPJYZNVCULW-CHWSQXEVSA-N	1	0	271.405	1.395	50	0		CDAARO
Cc1cccc(CCNC(=O)N2CC[C@@H]([NH+](C)C)C2)n1	ZINC000350624286	539092526	/nfs/dbraw/zinc/09/25/26/539092526.db2.gz	BBFWQFRJCYFHOM-CQSZACIVSA-N	1	0	276.384	1.278	50	0		CDAARO
COc1cccc(C[NH2+][C@@H](C)Cn2cncn2)c1F	ZINC000585079874	539103117	/nfs/dbraw/zinc/10/31/17/539103117.db2.gz	SGLYNQLOJUHTLQ-JTQLQIEISA-N	1	0	264.304	1.604	50	0		CDAARO
c1[nH]nc2cc(C[N@@H+]3CC[C@H](N4CCOCC4)C3)ccc12	ZINC000179844746	539138512	/nfs/dbraw/zinc/13/85/12/539138512.db2.gz	YVHDUKAIKBKXHH-HNNXBMFYSA-N	1	0	286.379	1.469	50	0		CDAARO
C[C@H](Oc1ccccc1Cl)C(=O)N1CC[NH2+]C[C@@H]1C	ZINC000125786491	187200050	/nfs/dbraw/zinc/20/00/50/187200050.db2.gz	YMKZAHPEWDCTOY-QWRGUYRKSA-N	1	0	282.771	1.928	50	0		CDAARO
c1[nH]nc2c1C[N@H+](CCc1ccc3c(c1)CCO3)CC2	ZINC000091078472	342399795	/nfs/dbraw/zinc/39/97/95/342399795.db2.gz	CFXJAACMXSZQTD-UHFFFAOYSA-N	1	0	269.348	1.945	50	0		CDAARO
CS(=O)(=O)N[C@@H]1CCC[C@H]1C[NH2+][C@H]1CCCSC1	ZINC000253370916	342416404	/nfs/dbraw/zinc/41/64/04/342416404.db2.gz	XZJVYNWJQAHZSH-SDDRHHMPSA-N	1	0	292.470	1.190	50	0		CDAARO
CCc1nc2c(s1)[C@H]([NH2+][C@H]1CCCNC1=O)CCC2	ZINC000095967544	342431876	/nfs/dbraw/zinc/43/18/76/342431876.db2.gz	QSNUHXOQZRKHBP-KOLCDFICSA-N	1	0	279.409	1.951	50	0		CDAARO
CCOCC[N@@H+]1CCNC(=O)C[C@H]1c1ccccc1	ZINC000084801349	362275154	/nfs/dbraw/zinc/27/51/54/362275154.db2.gz	HQFIPUVSICFVMJ-AWEZNQCLSA-N	1	0	262.353	1.586	50	0		CDAARO
O[C@H]1C[C@@H]([C@H]([NH2+]C2CCOCC2)c2ccccn2)C1	ZINC000252551375	362393941	/nfs/dbraw/zinc/39/39/41/362393941.db2.gz	UDHISPRTNDGLCP-LNSITVRQSA-N	1	0	262.353	1.662	50	0		CDAARO
Cc1nccn1CC(=O)N[C@H]1CC[N@@H+](C(C)(C)C)C1	ZINC000617340205	345170610	/nfs/dbraw/zinc/17/06/10/345170610.db2.gz	VXORDJDKQJWKTQ-LBPRGKRZSA-N	1	0	264.373	1.181	50	0		CDAARO
C[C@@H](NC(=O)N1CCC(CO)CC1)C(C)(C)C[NH+](C)C	ZINC000085424500	179059796	/nfs/dbraw/zinc/05/97/96/179059796.db2.gz	WFFGXFONBURGEX-GFCCVEGCSA-N	1	0	285.432	1.377	50	0		CDAARO
Cc1nc(C)c(C(=O)NCC[NH+]2CCCCC2)o1	ZINC000174641428	365929420	/nfs/dbraw/zinc/92/94/20/365929420.db2.gz	QBGHPEIHOGEMQX-UHFFFAOYSA-N	1	0	251.330	1.507	50	0		CDAARO
Cc1ccccc1N1CCC([NH2+][C@@H]2CCCNC2=O)CC1	ZINC000584896276	349357619	/nfs/dbraw/zinc/35/76/19/349357619.db2.gz	GZTGZLRHGHOTJV-OAHLLOKOSA-N	1	0	287.407	1.832	50	0		CDAARO
O=C(NC[C@@H]1CCOC1)C1([NH+]2CCCC2)CCCCC1	ZINC000584886758	349345126	/nfs/dbraw/zinc/34/51/26/349345126.db2.gz	ACPFIUGLHFDPJY-AWEZNQCLSA-N	1	0	280.412	1.938	50	0		CDAARO
COCCCC1CCN(C(=O)C[N@@H+]2CCC[C@@H](O)C2)CC1	ZINC000584890491	349349593	/nfs/dbraw/zinc/34/95/93/349349593.db2.gz	JHRYKDWCFFKRHB-OAHLLOKOSA-N	1	0	298.427	1.108	50	0		CDAARO
[NH3+]C1CCN(S(=O)(=O)c2ccc(Cl)cc2F)CC1	ZINC000036753786	362945854	/nfs/dbraw/zinc/94/58/54/362945854.db2.gz	OIIACZIRRIXEBP-UHFFFAOYSA-N	1	0	292.763	1.591	50	0		CDAARO
CN(CCC1(O)CCCC1)C(=O)[C@@H]1CC[N@H+](C)C1	ZINC000584899684	349361670	/nfs/dbraw/zinc/36/16/70/349361670.db2.gz	JHPKHAPMWXQRDA-GFCCVEGCSA-N	1	0	254.374	1.092	50	0		CDAARO
Cc1cc(N[C@H](C)c2nc(-c3ccncc3)no2)nc(N)[nH+]1	ZINC000091364922	180142153	/nfs/dbraw/zinc/14/21/53/180142153.db2.gz	ZWDPQTKPTXLJKA-SECBINFHSA-N	1	0	297.322	1.985	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@@H]1NS(=O)(=O)c1ccc(F)c(F)c1	ZINC000091496880	180172594	/nfs/dbraw/zinc/17/25/94/180172594.db2.gz	XNKUWXHTCCQXHL-PELKAZGASA-N	1	0	290.335	1.384	50	0		CDAARO
[NH3+][C@H]1CN(CC(=O)NC2CCCCCC2)C[C@@H]1C1CC1	ZINC000091636908	180211572	/nfs/dbraw/zinc/21/15/72/180211572.db2.gz	XCWXJLWFWJCUDW-CABCVRRESA-N	1	0	279.428	1.495	50	0		CDAARO
CCCCc1c(C)[nH+]c(N)nc1NCC(=O)N1CCCC1	ZINC000091931029	180288465	/nfs/dbraw/zinc/28/84/65/180288465.db2.gz	ITHGVDPFOYEOTE-UHFFFAOYSA-N	1	0	291.399	1.744	50	0		CDAARO
CNc1nc(N2C[C@H]([NH+](C)C)[C@@H](C3CC3)C2)ncc1F	ZINC000092062234	180315588	/nfs/dbraw/zinc/31/55/88/180315588.db2.gz	ZUVFIPLIYDUNLH-PWSUYJOCSA-N	1	0	279.363	1.434	50	0		CDAARO
Cc1c(Br)cccc1C[C@@H](C[NH3+])CO	ZINC000107510811	186176784	/nfs/dbraw/zinc/17/67/84/186176784.db2.gz	ASGSFMPFGJRNGS-VIFPVBQESA-N	1	0	258.159	1.867	50	0		CDAARO
C[C@@H](NC(=O)c1ccc2nccn2c1)[C@@H]1CCCC[NH2+]1	ZINC000583652123	366019566	/nfs/dbraw/zinc/01/95/66/366019566.db2.gz	YXWSPNOUHGWRTJ-YPMHNXCESA-N	1	0	272.352	1.595	50	0		CDAARO
CCc1nnc(CN2CC[C@@H]([NH+](CC)CC)C2)[nH]1	ZINC000158749263	188392222	/nfs/dbraw/zinc/39/22/22/188392222.db2.gz	AVZMRBKNMLTPSO-LLVKDONJSA-N	1	0	251.378	1.283	50	0		CDAARO
C[C@H]1CCC[N@H+](C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000002692798	355978973	/nfs/dbraw/zinc/97/89/73/355978973.db2.gz	HCCKNZYVNMCZOW-STQMWFEESA-N	1	0	293.363	1.887	50	0		CDAARO
C[C@@H]1CCCN(C(=O)/C=C\c2ccnn2C)[C@@H]1C[NH3+]	ZINC000255064944	355982361	/nfs/dbraw/zinc/98/23/61/355982361.db2.gz	GDVOBBWQOYIQSU-SVJDAXRGSA-N	1	0	262.357	1.019	50	0		CDAARO
C[NH+](C)CCNS(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000002850394	355984857	/nfs/dbraw/zinc/98/48/57/355984857.db2.gz	SWTCJHFPWQHHNL-UHFFFAOYSA-N	1	0	297.207	1.833	50	0		CDAARO
Cc1ccc(C[NH2+]CCSc2nnnn2C)cc1	ZINC000002181797	355963181	/nfs/dbraw/zinc/96/31/81/355963181.db2.gz	OUANNIFAYASYMS-UHFFFAOYSA-N	1	0	263.370	1.400	50	0		CDAARO
Cc1cccc(NC(=O)C(=O)NC[C@@H](C)C[NH+](C)C)c1	ZINC000002252453	355965457	/nfs/dbraw/zinc/96/54/57/355965457.db2.gz	WCRAYGZWBUYZLW-GFCCVEGCSA-N	1	0	277.368	1.247	50	0		CDAARO
CC[NH2+][C@H](C)c1nc2ccccc2c(=O)n1CCOC	ZINC000005091542	356049536	/nfs/dbraw/zinc/04/95/36/356049536.db2.gz	VKHOEPKMLBSPHI-LLVKDONJSA-N	1	0	275.352	1.713	50	0		CDAARO
C[C@@H]1[C@H](c2ccccc2)[N@H+](C)CC[C@]12NC(=O)NC2=O	ZINC000004011776	356014725	/nfs/dbraw/zinc/01/47/25/356014725.db2.gz	FQTIIVLASVNVSP-HCKVZZMMSA-N	1	0	273.336	1.278	50	0		CDAARO
C[C@H]([NH2+]CC(=O)NCc1ccc(F)cc1)[C@H]1CCCO1	ZINC000097374123	356094685	/nfs/dbraw/zinc/09/46/85/356094685.db2.gz	NNPSNGLPANITQW-SMDDNHRTSA-N	1	0	280.343	1.599	50	0		CDAARO
CCC[NH+]1CCN(C(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000013326153	356344467	/nfs/dbraw/zinc/34/44/67/356344467.db2.gz	YDYDQYQJRWQKNB-UHFFFAOYSA-N	1	0	290.363	1.626	50	0		CDAARO
OCCCCC[NH2+]Cc1ccc2c(c1)OCCO2	ZINC000013718356	356354746	/nfs/dbraw/zinc/35/47/46/356354746.db2.gz	GZABGFKWWWXTCB-UHFFFAOYSA-N	1	0	251.326	1.710	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2cncnc2)CCCCCC1	ZINC000273602471	192225756	/nfs/dbraw/zinc/22/57/56/192225756.db2.gz	GGKHYEXWMQFCBG-UHFFFAOYSA-N	1	0	276.384	1.861	50	0		CDAARO
C[C@H](CNC(=O)[C@]1(C)CC1(Cl)Cl)N1CCOCC1	ZINC000032817372	356379993	/nfs/dbraw/zinc/37/99/93/356379993.db2.gz	ROXJJFQFSOFHPH-KOLCDFICSA-N	1	0	295.210	1.407	50	0		CDAARO
CC[NH+](CC)CCNC(=O)C(=O)Nc1ccccc1Cl	ZINC000004583770	356433173	/nfs/dbraw/zinc/43/31/73/356433173.db2.gz	HOJDDHYSOASRPK-UHFFFAOYSA-N	1	0	297.786	1.737	50	0		CDAARO
[NH3+]Cc1ccnc(OCc2ccc3c(c2)OCO3)c1	ZINC000019405519	356484090	/nfs/dbraw/zinc/48/40/90/356484090.db2.gz	OWLXWVCYOVOZES-UHFFFAOYSA-N	1	0	258.277	1.848	50	0		CDAARO
CCOc1ccc(N2C(=O)C[C@@H](SCC[NH3+])C2=O)cc1	ZINC000018142158	356468642	/nfs/dbraw/zinc/46/86/42/356468642.db2.gz	JYVSRDOMPMYDMZ-GFCCVEGCSA-N	1	0	294.376	1.409	50	0		CDAARO
CN1CCC([N@@H+]2CCC[C@@H](C(=O)NC(C)(C)C)C2)CC1	ZINC000020542327	356546955	/nfs/dbraw/zinc/54/69/55/356546955.db2.gz	XETHINUHJAPLBL-CYBMUJFWSA-N	1	0	281.444	1.707	50	0		CDAARO
CC1(C(=O)N2CCC(C[NH3+])(C(F)(F)F)CC2)CC1	ZINC000725264737	538455709	/nfs/dbraw/zinc/45/57/09/538455709.db2.gz	QREWFFOVEABWER-UHFFFAOYSA-N	1	0	264.291	1.916	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H](O)[C@H]2[C@]2(CCCCC2=O)C1	ZINC000245255180	283206096	/nfs/dbraw/zinc/20/60/96/283206096.db2.gz	FYBWQOYLTXRONY-NZBPQXDJSA-N	1	0	251.370	1.839	50	0		CDAARO
CC1CC[NH+](CCCN[C@@H](C(N)=O)c2ccccc2)CC1	ZINC000026226190	356689251	/nfs/dbraw/zinc/68/92/51/356689251.db2.gz	MAWJUTSZKDCCCO-MRXNPFEDSA-N	1	0	289.423	1.925	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H]2CCC[N@@H+]2[C@]12c1ccccc1NC2=O	ZINC000012505485	356699965	/nfs/dbraw/zinc/69/99/65/356699965.db2.gz	GWGXYUQKCIFYGS-KNHMANMVSA-N	1	0	286.331	1.491	50	0		CDAARO
CSC[C@H](C)C(=O)N(C)[C@@H]1CC[N@H+](C)C[C@H]1C	ZINC000247171539	356708072	/nfs/dbraw/zinc/70/80/72/356708072.db2.gz	AUAUCHWGPDGIHO-GRYCIOLGSA-N	1	0	258.431	1.784	50	0		CDAARO
c1cnc(N2CCC[C@H]([NH2+]C3CCOCC3)C2)nc1	ZINC000037090065	356739805	/nfs/dbraw/zinc/73/98/05/356739805.db2.gz	FZUNIRZLYKCDNO-ZDUSSCGKSA-N	1	0	262.357	1.214	50	0		CDAARO
C[C@@H]1CN(C(=O)C[C@@H]2OCCc3ccccc32)CC[NH2+]1	ZINC000188430666	356748466	/nfs/dbraw/zinc/74/84/66/356748466.db2.gz	HTGWTNZWVXZGMW-DOMZBBRYSA-N	1	0	274.364	1.511	50	0		CDAARO
Cc1nccn1-c1ccccc1CNS(C)(=O)=O	ZINC000032497826	356780368	/nfs/dbraw/zinc/78/03/68/356780368.db2.gz	XQXLREHVVUZCBX-UHFFFAOYSA-N	1	0	265.338	1.230	50	0		CDAARO
COc1cccc([C@H](O)C[NH2+]Cc2cccnc2)c1	ZINC000032110630	356775179	/nfs/dbraw/zinc/77/51/79/356775179.db2.gz	ZBONKMQPIAVUFD-OAHLLOKOSA-N	1	0	258.321	1.913	50	0		CDAARO
c1cn(CCC[NH2+]Cc2ccc3c(c2)OCO3)cn1	ZINC000034778554	356820260	/nfs/dbraw/zinc/82/02/60/356820260.db2.gz	JCZLMHJTOFIGFJ-UHFFFAOYSA-N	1	0	259.309	1.792	50	0		CDAARO
CN(CC1CC[NH+](C)CC1)C(=O)C[C@@H]1CCOC1	ZINC000352082778	356825006	/nfs/dbraw/zinc/82/50/06/356825006.db2.gz	KBHDNAJWDCOUAA-ZDUSSCGKSA-N	1	0	254.374	1.213	50	0		CDAARO
COC(=O)c1c(C(F)(F)F)ccnc1N1CC[NH2+]CC1	ZINC000043827511	357098673	/nfs/dbraw/zinc/09/86/73/357098673.db2.gz	OKNPNANNUFNWMX-UHFFFAOYSA-N	1	0	289.257	1.297	50	0		CDAARO
Cc1nc(C)n(C[C@@H]2CCC[N@@H+](Cc3cnn(C)c3)C2)n1	ZINC000084280394	357122043	/nfs/dbraw/zinc/12/20/43/357122043.db2.gz	IVFBKVKXJDLPSZ-CQSZACIVSA-N	1	0	288.399	1.541	50	0		CDAARO
Cc1cc(C(=O)NC[C@@H]2CCC[NH2+]C2)ccc1F	ZINC000063056106	357501858	/nfs/dbraw/zinc/50/18/58/357501858.db2.gz	MCTWVUAWDBDBJU-LLVKDONJSA-N	1	0	250.317	1.864	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)c1ccc2c(c1)CCO2	ZINC000095431208	357449581	/nfs/dbraw/zinc/44/95/81/357449581.db2.gz	AVXJMPNOQWPBDW-UHFFFAOYSA-N	1	0	298.408	1.417	50	0		CDAARO
Cc1noc(-c2cccnc2N2CC[NH+](CC3CC3)CC2)n1	ZINC000096427330	357471224	/nfs/dbraw/zinc/47/12/24/357471224.db2.gz	DJSSXJMBNVRCFF-UHFFFAOYSA-N	1	0	299.378	1.972	50	0		CDAARO
Cc1nnc(SCCCNC(=O)[C@@H]2CC[NH2+]C2)s1	ZINC000065417866	357540457	/nfs/dbraw/zinc/54/04/57/357540457.db2.gz	SMHYDEWXVBWOPO-SECBINFHSA-N	1	0	286.426	1.054	50	0		CDAARO
CC(C)[N@@H+](Cc1ccc(CO)o1)C[C@H]1CCC(=O)N1	ZINC000065506432	357545531	/nfs/dbraw/zinc/54/55/31/357545531.db2.gz	BCXLPXLNZQMQQA-LLVKDONJSA-N	1	0	266.341	1.261	50	0		CDAARO
COCCc1ccccc1OC[C@H](O)C[NH2+]C(C)C	ZINC000065747781	357550451	/nfs/dbraw/zinc/55/04/51/357550451.db2.gz	RQZBCLSVVDPFIC-CQSZACIVSA-N	1	0	267.369	1.613	50	0	in-vitro	CDAARO
Cc1c[nH+]ccc1-n1nc(C2CC2)nc1-c1nc[nH]n1	ZINC000067677032	357617787	/nfs/dbraw/zinc/61/77/87/357617787.db2.gz	JNNVBHFYITVRPR-UHFFFAOYSA-N	1	0	267.296	1.633	50	0		CDAARO
COCC(=O)NC[C@@H]1CC[N@H+](Cc2cc(C)ccc2C)C1	ZINC000067697435	357619085	/nfs/dbraw/zinc/61/90/85/357619085.db2.gz	JJEXBNTYDUPUMD-HNNXBMFYSA-N	1	0	290.407	1.888	50	0		CDAARO
COc1ncnc(N)c1C[NH2+]C[C@@H](C)c1c(C)noc1C	ZINC000095434252	357655146	/nfs/dbraw/zinc/65/51/46/357655146.db2.gz	SZAOFEYZYRYGPW-MRVPVSSYSA-N	1	0	291.355	1.566	50	0		CDAARO
C[C@H](Oc1ccccc1Cl)C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188448130	357686697	/nfs/dbraw/zinc/68/66/97/357686697.db2.gz	XIEFHKLFFULDAW-MNOVXSKESA-N	1	0	282.771	1.928	50	0		CDAARO
Nc1nc2c(s1)[C@@H](c1ccc3nsnc3c1)[NH2+]CC2	ZINC000071753673	357777894	/nfs/dbraw/zinc/77/78/94/357777894.db2.gz	OUELQUDZHKFICP-SNVBAGLBSA-N	1	0	289.389	1.965	50	0		CDAARO
Cc1nc(CNc2nc(N)nc3c2CC[NH2+]CC3)cs1	ZINC000072454754	357836800	/nfs/dbraw/zinc/83/68/00/357836800.db2.gz	ZJGGJJGLMOZGQS-UHFFFAOYSA-N	1	0	290.396	1.124	50	0		CDAARO
C[C@H](CCn1cccn1)[NH+]1CCC2(CN(C)C(=O)O2)CC1	ZINC000072477244	357837586	/nfs/dbraw/zinc/83/75/86/357837586.db2.gz	IFLHBQYUOGELKS-CYBMUJFWSA-N	1	0	292.383	1.578	50	0		CDAARO
COC(=O)C1(C[NH2+]Cc2ccccn2)CCOCC1	ZINC000097108638	357983621	/nfs/dbraw/zinc/98/36/21/357983621.db2.gz	KTMSDJBCOYEYFM-UHFFFAOYSA-N	1	0	264.325	1.141	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)NC(=O)NC1CC1)[C@H](C)c1ccccc1	ZINC000097110015	357986054	/nfs/dbraw/zinc/98/60/54/357986054.db2.gz	WGLKOWYAGKHJRB-NWDGAFQWSA-N	1	0	289.379	1.756	50	0		CDAARO
Cc1cccc(CNC(=O)C[NH2+][C@H](C)[C@H]2CCCO2)c1	ZINC000097111612	357986860	/nfs/dbraw/zinc/98/68/60/357986860.db2.gz	KNJMKIZRXGPGRE-UKRRQHHQSA-N	1	0	276.380	1.768	50	0		CDAARO
CSc1cncc(NC[C@H](O)C[NH+]2CCCCC2)n1	ZINC000097162929	358004438	/nfs/dbraw/zinc/00/44/38/358004438.db2.gz	VHEBTUYSTOBJKB-NSHDSACASA-N	1	0	282.413	1.457	50	0		CDAARO
Cc1cc(C)n2nc(C(=O)N3CCCC[C@@H]([NH3+])C3)cc2n1	ZINC000082114529	358148073	/nfs/dbraw/zinc/14/80/73/358148073.db2.gz	WSFIUNXAIYBFJV-GFCCVEGCSA-N	1	0	287.367	1.300	50	0		CDAARO
CSCC[C@@H]([NH3+])C(=O)N(C)CCOc1ccc(C)cc1	ZINC000130992330	358322141	/nfs/dbraw/zinc/32/21/41/358322141.db2.gz	DLZZMDFYTBSBQE-CQSZACIVSA-N	1	0	296.436	1.913	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(Cc2cscn2)C[C@H]1C	ZINC000247011228	358382433	/nfs/dbraw/zinc/38/24/33/358382433.db2.gz	CEYKKMCUQIFMFJ-MNOVXSKESA-N	1	0	255.387	1.030	50	0		CDAARO
CC(C)(C)OC(=O)N1C[C@@H](C[NH3+])CC(F)(F)C1	ZINC000091692689	358522054	/nfs/dbraw/zinc/52/20/54/358522054.db2.gz	PZRLKSYZJHAEEK-MRVPVSSYSA-N	1	0	250.289	1.837	50	0		CDAARO
CN(C(=O)[C@@H]([NH3+])Cc1ccccc1)[C@@H]1CCSC1	ZINC000037175088	363614118	/nfs/dbraw/zinc/61/41/18/363614118.db2.gz	BNICCPVXWWLLNN-OLZOCXBDSA-N	1	0	264.394	1.520	50	0		CDAARO
CC[NH+]1CCC(CC(=O)NCCn2cccc2)CC1	ZINC000095367834	358686249	/nfs/dbraw/zinc/68/62/49/358686249.db2.gz	YYERUKASPWHDOD-UHFFFAOYSA-N	1	0	263.385	1.726	50	0		CDAARO
Cc1ccc2c(c1)C[C@@H](C(=O)N1CCc3[nH]cnc3C1)N2	ZINC000096163788	358712274	/nfs/dbraw/zinc/71/22/74/358712274.db2.gz	SGORDSSXYCQYOQ-AWEZNQCLSA-N	1	0	282.347	1.640	50	0		CDAARO
NC(=O)CC[N@@H+]1CCc2nc(-c3cccc(F)c3)[nH]c2C1	ZINC000097642011	358789367	/nfs/dbraw/zinc/78/93/67/358789367.db2.gz	MRDURWFPGJDSTR-UHFFFAOYSA-N	1	0	288.326	1.449	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](c2nnc(C3CCOCC3)[nH]2)C1	ZINC000097694609	358793740	/nfs/dbraw/zinc/79/37/40/358793740.db2.gz	FJKZAPYBQSTJGE-ZDUSSCGKSA-N	1	0	294.399	1.525	50	0		CDAARO
C[N@H+](CCc1nc2cc(Cl)ccc2[nH]1)C[C@@H](O)CO	ZINC000097759449	358797468	/nfs/dbraw/zinc/79/74/68/358797468.db2.gz	KDBAIJZUJHGMOP-SNVBAGLBSA-N	1	0	283.759	1.044	50	0		CDAARO
CSc1ccccc1CN1CCOC[C@@H]1CO	ZINC000215090926	358874536	/nfs/dbraw/zinc/87/45/36/358874536.db2.gz	UEIHYLXTIBJOOD-LBPRGKRZSA-N	1	0	253.367	1.602	50	0		CDAARO
CC[C@@H]1CN(Cc2ccccc2OCCO)CCO1	ZINC000216366970	358941338	/nfs/dbraw/zinc/94/13/38/358941338.db2.gz	YUVJLAFLGXAQFY-CQSZACIVSA-N	1	0	265.353	1.669	50	0		CDAARO
[NH3+]C1CC(c2cc(NCC3(CO)CCC3)ncn2)C1	ZINC000219311620	359087221	/nfs/dbraw/zinc/08/72/21/359087221.db2.gz	PWEYUAGPTGMBLV-UHFFFAOYSA-N	1	0	262.357	1.256	50	0		CDAARO
O=C(c1c[nH]cn1)N1CCCC[C@@H]1C[NH+]1CCCC1	ZINC000219636112	359109559	/nfs/dbraw/zinc/10/95/59/359109559.db2.gz	AOBWYLAZWVXBBF-GFCCVEGCSA-N	1	0	262.357	1.500	50	0		CDAARO
CCOc1ccc(OCc2nc(C[NH3+])cc(=O)[nH]2)cc1	ZINC000023380307	359114814	/nfs/dbraw/zinc/11/48/14/359114814.db2.gz	LFBGSWGLGVZFEF-UHFFFAOYSA-N	1	0	275.308	1.206	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCc2nnc(-c3cnccn3)o2)C1	ZINC000257175225	359053804	/nfs/dbraw/zinc/05/38/04/359053804.db2.gz	NYDRMGAGDJEORR-LLVKDONJSA-N	1	0	273.340	1.801	50	0		CDAARO
COC(=O)CC1([NH2+]CCn2cncn2)CCCCC1	ZINC000089400629	359127585	/nfs/dbraw/zinc/12/75/85/359127585.db2.gz	IBHGOFWXWRQAET-UHFFFAOYSA-N	1	0	266.345	1.134	50	0		CDAARO
CN(Cc1ccon1)c1cc(C2CC([NH3+])C2)ncn1	ZINC000222646619	359362698	/nfs/dbraw/zinc/36/26/98/359362698.db2.gz	SVAUVQUATAHGCA-UHFFFAOYSA-N	1	0	259.313	1.306	50	0		CDAARO
C[C@@H](C[NH+]1CCOCC1)C(=O)NCCCc1ccncc1	ZINC000223374355	359420385	/nfs/dbraw/zinc/42/03/85/359420385.db2.gz	SABYYYGDEIFCEV-AWEZNQCLSA-N	1	0	291.395	1.099	50	0		CDAARO
O=C1CC[N@@H+](Cc2ccncc2)CCC[C@@H](CO)CCN1	ZINC000257186053	359519068	/nfs/dbraw/zinc/51/90/68/359519068.db2.gz	YGJGUXBLCXZBPW-OAHLLOKOSA-N	1	0	291.395	1.182	50	0		CDAARO
CN1C(=O)N(C)[C@]2(CC[N@H+](CCc3ccccc3)C2)C1=O	ZINC000257197408	359630137	/nfs/dbraw/zinc/63/01/37/359630137.db2.gz	AFWLRBQIBOFPNF-INIZCTEOSA-N	1	0	287.363	1.197	50	0		CDAARO
CC(C)CCO[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2[NH3+])C1	ZINC000408519284	359911919	/nfs/dbraw/zinc/91/19/19/359911919.db2.gz	KOYCFHLOCZCNMO-MGPQQGTHSA-N	1	0	268.401	1.777	50	0		CDAARO
COC(=O)[C@H]1CN(CCc2ccccc2)C[C@@H](C)O1	ZINC000089496908	359941645	/nfs/dbraw/zinc/94/16/45/359941645.db2.gz	UBZPCEORFNIRHJ-TZMCWYRMSA-N	1	0	263.337	1.491	50	0		CDAARO
CCc1cnc(CN(C)[C@H]2CCN([C@H]3CCOC3=O)C2)o1	ZINC000257366202	359947610	/nfs/dbraw/zinc/94/76/10/359947610.db2.gz	NBDBMOMEIWUZSF-AAEUAGOBSA-N	1	0	293.367	1.059	50	0		CDAARO
Cc1c[nH+]c(C)n1C[C@H]1CCN(S(=O)(=O)C(C)C)C1	ZINC000409420918	360224438	/nfs/dbraw/zinc/22/44/38/360224438.db2.gz	DFVUBZIOOAYPQB-ZDUSSCGKSA-N	1	0	285.413	1.560	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@H]1CCN(C(=O)c2cccn2C)C1	ZINC000409421098	360230428	/nfs/dbraw/zinc/23/04/28/360230428.db2.gz	HNVABLRPGPYGHN-ZDUSSCGKSA-N	1	0	272.352	1.926	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1C[C@H](OC(=O)[C@@H](CO)c1ccccc1)C2	ZINC000100271918	360320045	/nfs/dbraw/zinc/32/00/45/360320045.db2.gz	RKUNBYITZUJHSG-FZKCQIBNSA-N	1	0	289.375	1.931	50	0	investigational	CDAARO
CC(C)(C)c1ccc(C(=O)N2CCO[C@H](C[NH3+])C2)cc1	ZINC000011887262	360400624	/nfs/dbraw/zinc/40/06/24/360400624.db2.gz	PGSCWYDDORSOEK-CQSZACIVSA-N	1	0	276.380	1.784	50	0		CDAARO
C[N@@H+](Cc1nc(-c2cccnc2)no1)C[C@@H]1CCOC1	ZINC000178345448	189109619	/nfs/dbraw/zinc/10/96/19/189109619.db2.gz	GQXOGMWYVXLSBW-NSHDSACASA-N	1	0	274.324	1.600	50	0		CDAARO
COc1cccc(-n2c(C[NH3+])nnc2SC[C@H](C)O)c1	ZINC000426409099	360666379	/nfs/dbraw/zinc/66/63/79/360666379.db2.gz	SDLYGQZPIVYYKE-VIFPVBQESA-N	1	0	294.380	1.208	50	0		CDAARO
Cc1ccc(C)c(OCC(=O)N2CC[C@H](C[NH3+])C2)c1	ZINC000178565721	189127859	/nfs/dbraw/zinc/12/78/59/189127859.db2.gz	CVWAQRLRGJPJND-CYBMUJFWSA-N	1	0	262.353	1.489	50	0		CDAARO
O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)[C@@H]1CCCO1	ZINC000036090447	360895682	/nfs/dbraw/zinc/89/56/82/360895682.db2.gz	QAERRSINMWMGRW-JSGCOSHPSA-N	1	0	278.352	1.712	50	0		CDAARO
CC(C)n1ccc(C(=O)N(C)CCCc2nccn2C)n1	ZINC000426526337	360983642	/nfs/dbraw/zinc/98/36/42/360983642.db2.gz	ZMGRJQBCXJWVDQ-UHFFFAOYSA-N	1	0	289.383	1.902	50	0		CDAARO
CC[NH2+]Cc1cccc(NC(=O)CN2CCCC2=O)c1	ZINC000036281061	361424794	/nfs/dbraw/zinc/42/47/94/361424794.db2.gz	GPLZHXKSNCWLRH-UHFFFAOYSA-N	1	0	275.352	1.357	50	0		CDAARO
COc1ccc2c(c1)C[C@H](N1CCC[NH2+]CC1)CC2	ZINC000133311360	361596128	/nfs/dbraw/zinc/59/61/28/361596128.db2.gz	KFHDHLJUFSVFRZ-OAHLLOKOSA-N	1	0	260.381	1.848	50	0		CDAARO
CCC(=O)N1CCC([NH+]2CCC(OC)CC2)CC1	ZINC000197924511	364542721	/nfs/dbraw/zinc/54/27/21/364542721.db2.gz	KYNKMRKXBLSOEA-UHFFFAOYSA-N	1	0	254.374	1.498	50	0		CDAARO
CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1CCCN1CCOCC1	ZINC000175037642	364618725	/nfs/dbraw/zinc/61/87/25/364618725.db2.gz	WGQBRMVSMXMOIC-JKSUJKDBSA-N	1	0	281.444	1.267	50	0		CDAARO
O=C(C[NH+]1CCCC1)N1CCC(c2ccncc2)CC1	ZINC000221390485	283813641	/nfs/dbraw/zinc/81/36/41/283813641.db2.gz	BWTGMLJKPZZSKX-UHFFFAOYSA-N	1	0	273.380	1.883	50	0		CDAARO
[NH3+][C@@H]1CCCN(c2nc(C(F)(F)F)nc3nc[nH]c32)C1	ZINC000642986915	365303584	/nfs/dbraw/zinc/30/35/84/365303584.db2.gz	OKNBOKCSNMCMKG-ZCFIWIBFSA-N	1	0	286.261	1.299	50	0		CDAARO
CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1[NH2+]Cc1c[nH]nc1C	ZINC000089948808	366977970	/nfs/dbraw/zinc/97/79/70/366977970.db2.gz	MTGFFYDXOHGZJP-SWLSCSKDSA-N	1	0	290.411	1.845	50	0		CDAARO
O=C(NCCN1CCO[C@H](c2ccccc2)C1)C1CC1	ZINC000017178660	367033902	/nfs/dbraw/zinc/03/39/02/367033902.db2.gz	FIUDFTDHOPNMCZ-HNNXBMFYSA-N	1	0	274.364	1.586	50	0		CDAARO
OC[C@@H]1C[C@@H](O)C[N@@H+]1CCSC1CCCCC1	ZINC000252488460	367577671	/nfs/dbraw/zinc/57/76/71/367577671.db2.gz	ISHPOYHPSRVTLM-NWDGAFQWSA-N	1	0	259.415	1.480	50	0		CDAARO
CCNC(=O)C(C)(C)C[NH2+][C@@H]1C[C@H]2OCCC[C@@H]12	ZINC000252523242	367784317	/nfs/dbraw/zinc/78/43/17/367784317.db2.gz	CEHUHTHQWKXSPY-QJPTWQEYSA-N	1	0	254.374	1.306	50	0		CDAARO
O=C1CC[C@H]([NH2+]Cc2ccc3c[nH]nc3c2)C2(CCC2)N1	ZINC000282970285	368127401	/nfs/dbraw/zinc/12/74/01/368127401.db2.gz	YZSMEJRZVGIEQT-AWEZNQCLSA-N	1	0	284.363	1.854	50	0		CDAARO
C[C@@H]([NH2+]C[C@H]1COC2(CCOCC2)O1)C(C)(C)C	ZINC000095991796	296133674	/nfs/dbraw/zinc/13/36/74/296133674.db2.gz	CVKNKIWCGDMUNL-NEPJUHHUSA-N	1	0	257.374	1.933	50	0		CDAARO
C[NH+]1C[C@H]2CN(c3cc(C4CCC4)ncn3)C[C@@H]2C1	ZINC000575606478	370616387	/nfs/dbraw/zinc/61/63/87/370616387.db2.gz	HOBUYXUTUBPHDQ-STQMWFEESA-N	1	0	258.369	1.742	50	0		CDAARO
CCCC[C@H]([NH2+][C@H]1CCN(C(=O)C(C)C)C[C@H]1C)C(N)=O	ZINC000252673352	371684394	/nfs/dbraw/zinc/68/43/94/371684394.db2.gz	RBMVZQNONVWUDN-RDBSUJKOSA-N	1	0	297.443	1.513	50	0		CDAARO
O=C(CCn1cnc2ccccc21)NC[C@@H]1CCC[NH2+]1	ZINC000178735459	372205606	/nfs/dbraw/zinc/20/56/06/372205606.db2.gz	BMZGPMPYOJJVAJ-LBPRGKRZSA-N	1	0	272.352	1.295	50	0		CDAARO
CC(C)[NH+]1CCC(CNC(=O)c2csnc2N)CC1	ZINC000299778146	372754811	/nfs/dbraw/zinc/75/48/11/372754811.db2.gz	MFAPTGKLPKGVSN-UHFFFAOYSA-N	1	0	282.413	1.576	50	0		CDAARO
CCCn1cnnc1CN(C)C[C@@H](C)[NH+]1CCCC1	ZINC000244652046	189907920	/nfs/dbraw/zinc/90/79/20/189907920.db2.gz	GYTLCWCAPWPURW-CYBMUJFWSA-N	1	0	265.405	1.604	50	0		CDAARO
O=C([C@@H]1C[C@@H](O)C[NH2+]1)N1CCC(c2ccccc2)CC1	ZINC000037804558	373354088	/nfs/dbraw/zinc/35/40/88/373354088.db2.gz	QYCAPEGBMQZOHB-CABCVRRESA-N	1	0	274.364	1.115	50	0		CDAARO
CCC[NH2+][C@@H]1CC(=O)N(c2ccc(OC)cc2)C1=O	ZINC000002329321	373761350	/nfs/dbraw/zinc/76/13/50/373761350.db2.gz	HSWKDRBRRNLLBM-GFCCVEGCSA-N	1	0	262.309	1.327	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CCNC(=O)N[C@H](CCO)C1CC1	ZINC000106916189	373789467	/nfs/dbraw/zinc/78/94/67/373789467.db2.gz	YQWYKBRBUCCBAU-GXTWGEPZSA-N	1	0	283.416	1.321	50	0		CDAARO
[NH3+]C[C@H](NS(=O)(=O)c1cccc2ccccc21)C1CC1	ZINC000123941930	374706214	/nfs/dbraw/zinc/70/62/14/374706214.db2.gz	QAZAULDHMSFMRN-AWEZNQCLSA-N	1	0	290.388	1.855	50	0		CDAARO
Cc1ccccc1CC(=O)N1CCC(OCCC[NH3+])CC1	ZINC000094071003	374812709	/nfs/dbraw/zinc/81/27/09/374812709.db2.gz	RKPMKKKPLNGVEH-UHFFFAOYSA-N	1	0	290.407	1.894	50	0		CDAARO
CCCc1nnc(N2CCC3(C2)CC[NH+](C)CC3)o1	ZINC000095383308	374897236	/nfs/dbraw/zinc/89/72/36/374897236.db2.gz	YDFWKDWRPWNGLI-UHFFFAOYSA-N	1	0	264.373	1.944	50	0		CDAARO
CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@H](O)Cc1ccccc1	ZINC000095417040	374918599	/nfs/dbraw/zinc/91/85/99/374918599.db2.gz	ULUWZSFNSSRVJB-CVEARBPZSA-N	1	0	290.407	1.581	50	0		CDAARO
CCn1cc(C[N@@H+]2C[C@@H]3CCC[C@@]3(C(=O)OC)C2)cn1	ZINC000108496696	412831133	/nfs/dbraw/zinc/83/11/33/412831133.db2.gz	LTJKLFIWQCAKNF-DZGCQCFKSA-N	1	0	277.368	1.678	50	0		CDAARO
O=C(CNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[NH2+]1)N1CCCCC1	ZINC000095956840	375040517	/nfs/dbraw/zinc/04/05/17/375040517.db2.gz	WLNFUCYBFSGRBD-IHRRRGAJSA-N	1	0	293.411	1.036	50	0		CDAARO
CCCC[C@H](C(N)=O)[N@@H+]1CCC[C@H]1[C@@H]1CCCN1C(C)=O	ZINC000299754279	375210561	/nfs/dbraw/zinc/21/05/61/375210561.db2.gz	DZJJBYHRPXAQOC-SOUVJXGZSA-N	1	0	295.427	1.506	50	0		CDAARO
COC(=O)/C=C\c1ccc(OCC[N@H+](C)CCCO)cc1	ZINC000606443576	375824337	/nfs/dbraw/zinc/82/43/37/375824337.db2.gz	PKZWRYFYEVVRQF-TWGQIWQCSA-N	1	0	293.363	1.566	50	0		CDAARO
C[C@H](CNC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C)[N@H+](C)C1CC1	ZINC000240333659	376017271	/nfs/dbraw/zinc/01/72/71/376017271.db2.gz	FEQSNETXIMENLX-ZRJCITRHSA-N	1	0	295.427	1.582	50	0		CDAARO
CCn1c2ccccc2c(=O)n(CC[NH+](CC)CC)c1=O	ZINC000140154695	376506545	/nfs/dbraw/zinc/50/65/45/376506545.db2.gz	FLDFDBYMTYWTTJ-UHFFFAOYSA-N	1	0	289.379	1.525	50	0		CDAARO
CCc1ccccc1C[NH+]1CCC([C@@H](O)C(=O)OC)CC1	ZINC000189257497	377233623	/nfs/dbraw/zinc/23/36/23/377233623.db2.gz	ADQRYZWNEGKRLD-MRXNPFEDSA-N	1	0	291.391	1.995	50	0		CDAARO
CCn1cncc1C[NH+]1CCC(c2cc(=O)[nH]cn2)CC1	ZINC000067743263	377234635	/nfs/dbraw/zinc/23/46/35/377234635.db2.gz	BEZGHMGPCABMEL-UHFFFAOYSA-N	1	0	287.367	1.366	50	0		CDAARO
COc1cccc(C(=O)N2CCC[C@@]3(CC[NH2+]C3)C2)c1O	ZINC000067851419	377260512	/nfs/dbraw/zinc/26/05/12/377260512.db2.gz	YOINWFPTSNWJQS-INIZCTEOSA-N	1	0	290.363	1.617	50	0		CDAARO
Cc1ccccc1N1C(=N)S[C@@H]2CS(=O)(=O)C[C@H]21	ZINC000009009262	377798140	/nfs/dbraw/zinc/79/81/40/377798140.db2.gz	NGMIMFWOBUOOMP-GHMZBOCLSA-N	1	0	282.390	1.649	50	0		CDAARO
CNC(=O)CC1CC[NH+](CC[C@@H]2CCOC2)CC1	ZINC000438125641	249573467	/nfs/dbraw/zinc/57/34/67/249573467.db2.gz	ITMPNHTYMZZOSM-CYBMUJFWSA-N	1	0	254.374	1.261	50	0		CDAARO
Cc1ccc(-n2cc(C(=O)N3CCC([NH3+])CC3)nn2)cc1C	ZINC000071768198	184575421	/nfs/dbraw/zinc/57/54/21/184575421.db2.gz	BIANGFPFJAYVDL-UHFFFAOYSA-N	1	0	299.378	1.447	50	0		CDAARO
COC[C@@H](C)NC(=O)C[N@H+](C)C1CCC(C)CC1	ZINC000032751519	285206377	/nfs/dbraw/zinc/20/63/77/285206377.db2.gz	UHDXTCZTISJBRT-OTTFEQOBSA-N	1	0	256.390	1.648	50	0		CDAARO
C[C@@H]1CC[NH2+]C[C@H]1NC(=O)c1ccc(F)c(F)c1F	ZINC000094184052	184760075	/nfs/dbraw/zinc/76/00/75/184760075.db2.gz	XSDVHYUVXJZHAT-GMSGAONNSA-N	1	0	272.270	1.832	50	0		CDAARO
O=C(NCC[NH2+]C1CC1)c1ccc(F)c(F)c1F	ZINC000094185025	184760460	/nfs/dbraw/zinc/76/04/60/184760460.db2.gz	JWKIJECVBGSHJU-UHFFFAOYSA-N	1	0	258.243	1.586	50	0		CDAARO
CC(C)C(=O)N1CC[C@@H]([NH2+]C2CCSCC2)C1	ZINC000095415605	184974010	/nfs/dbraw/zinc/97/40/10/184974010.db2.gz	RYLNZXBZMHWUQF-GFCCVEGCSA-N	1	0	256.415	1.729	50	0		CDAARO
CCc1ccc(OC[C@H](O)CN2CC[NH+](CC)CC2)cc1	ZINC000019790343	390229013	/nfs/dbraw/zinc/22/90/13/390229013.db2.gz	SSGZTFFYHNEZRO-MRXNPFEDSA-N	1	0	292.423	1.626	50	0		CDAARO
Cc1cc(S(=O)(=O)N[C@@H]2CC[NH2+]C2)sc1C	ZINC000095467160	184995376	/nfs/dbraw/zinc/99/53/76/184995376.db2.gz	MBRADMDSTGOXPP-SECBINFHSA-N	1	0	260.384	1.005	50	0		CDAARO
COCCCNC(=O)[C@H](C)N1CCC[C@H]([NH+]2CCCC2)C1	ZINC000096419580	390513198	/nfs/dbraw/zinc/51/31/98/390513198.db2.gz	IKSFADJZHWLGNH-GJZGRUSLSA-N	1	0	297.443	1.088	50	0		CDAARO
CC(C)C(=O)N[C@@H]1CCC[N@H+](CCOC[C@@H]2CCCO2)C1	ZINC000096421098	390514254	/nfs/dbraw/zinc/51/42/54/390514254.db2.gz	DSVMEOMJTYDWEQ-CABCVRRESA-N	1	0	298.427	1.419	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@@H]2CCC[NH2+]C2)c2ccc(F)cc2O1	ZINC000118961949	390449292	/nfs/dbraw/zinc/44/92/92/390449292.db2.gz	SSFMDHJDQXQEFO-GHMZBOCLSA-N	1	0	278.327	1.939	50	0		CDAARO
CC1=C[C@H](N2C(=O)NC3(CC[NH2+]CC3)C2=O)CC(C)(C)C1	ZINC000077564524	390811133	/nfs/dbraw/zinc/81/11/33/390811133.db2.gz	VAYFLSXOWXFMSQ-LBPRGKRZSA-N	1	0	291.395	1.795	50	0		CDAARO
Cc1[nH]nc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)c1Cl	ZINC000091997696	390892521	/nfs/dbraw/zinc/89/25/21/390892521.db2.gz	KQMQWZBAKGFDBU-BDAKNGLRSA-N	1	0	268.748	1.181	50	0		CDAARO
CCOC(=O)N1CC[C@](C)([NH+]2CCC(O)CC2)C1	ZINC000095081536	390910426	/nfs/dbraw/zinc/91/04/26/390910426.db2.gz	KAORKQKJTABAMV-ZDUSSCGKSA-N	1	0	256.346	1.064	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@H]1C(=O)NCCc1cnn(C)c1	ZINC000096421669	393185538	/nfs/dbraw/zinc/18/55/38/393185538.db2.gz	QAHDQDNCKFEFCG-AWEZNQCLSA-N	1	0	278.400	1.342	50	0		CDAARO
CCOCCCCNC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@@H]21	ZINC000097049216	393192973	/nfs/dbraw/zinc/19/29/73/393192973.db2.gz	YCRALOCODWRVFF-CABCVRRESA-N	1	0	297.443	1.929	50	0		CDAARO
CNc1cc(C)[nH+]c(N2CC[C@](C)(O)[C@H](C)C2)n1	ZINC000091518623	135071016	/nfs/dbraw/zinc/07/10/16/135071016.db2.gz	GHLZHZCVBREPQZ-RNCFNFMXSA-N	1	0	250.346	1.424	50	0		CDAARO
O=C(NCC(F)(F)C(F)F)[C@@H]1C[C@H]2CCCC[C@H]2[NH2+]1	ZINC000261568279	140350227	/nfs/dbraw/zinc/35/02/27/140350227.db2.gz	JSPHZCDMEXFAMT-HLTSFMKQSA-N	1	0	282.281	1.924	50	0		CDAARO
C[C@H]([NH2+]C[C@@H]1CC[C@H](C(=O)N(C)C)O1)C(C)(C)C(F)F	ZINC000657939242	413098749	/nfs/dbraw/zinc/09/87/49/413098749.db2.gz	WGPMUWNCNGBYGI-GARJFASQSA-N	1	0	292.370	1.892	50	0		CDAARO
CC(=O)CN1CCc2c3ccccc3oc(=O)c2C1	ZINC000039405483	397831155	/nfs/dbraw/zinc/83/11/55/397831155.db2.gz	HVEJYMJDUIALFU-UHFFFAOYSA-N	1	0	257.289	1.740	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCC[C@@H](c2nncn2C(C)C)C1	ZINC000299749341	397995002	/nfs/dbraw/zinc/99/50/02/397995002.db2.gz	JZWBTGQDTPJYFP-NEPJUHHUSA-N	1	0	279.388	1.302	50	0		CDAARO
COCC1(C[NH2+][C@H](C)CN2CCOCC2)CCC1	ZINC000385677487	398117181	/nfs/dbraw/zinc/11/71/81/398117181.db2.gz	FTWBGCCEQUJYRY-CYBMUJFWSA-N	1	0	256.390	1.113	50	0		CDAARO
CCc1cccc(NC(=O)CN2CC[C@@H](n3cncn3)C2)c1	ZINC000375319695	160367286	/nfs/dbraw/zinc/36/72/86/160367286.db2.gz	OWYRIPAKSZCTOJ-OAHLLOKOSA-N	1	0	299.378	1.726	50	0		CDAARO
C[NH+](C)CCNS(=O)(=O)c1ccc2ccccc2c1	ZINC000004784967	170017027	/nfs/dbraw/zinc/01/70/27/170017027.db2.gz	XOVJYRRGJQVYPZ-UHFFFAOYSA-N	1	0	278.377	1.680	50	0		CDAARO
Cn1nnnc1SCC[NH2+]Cc1ccc(F)cc1	ZINC000004998020	170052283	/nfs/dbraw/zinc/05/22/83/170052283.db2.gz	ZZCIUIBIJYJXAH-UHFFFAOYSA-N	1	0	267.333	1.231	50	0		CDAARO
COc1ccc(CNC(=O)[C@@H]2CCC[N@@H+]2C)cc1OC	ZINC000005171218	170073324	/nfs/dbraw/zinc/07/33/24/170073324.db2.gz	XDICPEWCQDSCJS-LBPRGKRZSA-N	1	0	278.352	1.414	50	0		CDAARO
CC[C@@H](Oc1ccccc1)C(=O)NCCC[NH+](C)C	ZINC000006119779	170177573	/nfs/dbraw/zinc/17/75/73/170177573.db2.gz	XAESZPQJQCCZQH-CQSZACIVSA-N	1	0	264.369	1.912	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCCC[NH+](C)C)c(C)c1	ZINC000007374544	170279710	/nfs/dbraw/zinc/27/97/10/170279710.db2.gz	JSBUTKMBWQNTRL-UHFFFAOYSA-N	1	0	270.398	1.533	50	0		CDAARO
Cc1c(O)ccc2c(C[NH+]3CCC(O)CC3)cc(=O)oc12	ZINC000008204340	170324384	/nfs/dbraw/zinc/32/43/84/170324384.db2.gz	VDXDOOPTVPIYFP-UHFFFAOYSA-N	1	0	289.331	1.764	50	0		CDAARO
CC(C)(C)[NH2+]CC(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000009113148	170363953	/nfs/dbraw/zinc/36/39/53/170363953.db2.gz	GRGCYKHHGKCMHF-UHFFFAOYSA-N	1	0	289.379	1.905	50	0		CDAARO
CC[C@H](C)[NH+]1CCC2(CC1)C(=O)N(C)C(=O)N2CCOC	ZINC000014740827	170644026	/nfs/dbraw/zinc/64/40/26/170644026.db2.gz	KXMJHDDDTGHTTO-LBPRGKRZSA-N	1	0	297.399	1.160	50	0		CDAARO
Cc1ccc(OC[C@@H](O)C[NH2+][C@@H](C)CCO)c(C)c1	ZINC000019146173	170753518	/nfs/dbraw/zinc/75/35/18/170753518.db2.gz	DEOOYKKCFLVNMU-KBPBESRZSA-N	1	0	267.369	1.404	50	0		CDAARO
c1cnn(CC2CC[NH+](CCCn3cncn3)CC2)c1	ZINC000020905628	171278906	/nfs/dbraw/zinc/27/89/06/171278906.db2.gz	DALSZUWIUPLSNI-UHFFFAOYSA-N	1	0	274.372	1.277	50	0		CDAARO
CC(C)[NH+]1CCC(N(C)c2ncnc3c2cnn3C)CC1	ZINC000024208542	171432896	/nfs/dbraw/zinc/43/28/96/171432896.db2.gz	GTBKCXVASGKJCI-UHFFFAOYSA-N	1	0	288.399	1.672	50	0		CDAARO
CCC[NH2+]Cc1nc(-c2cccc(C(N)=O)c2)no1	ZINC000034925180	171894289	/nfs/dbraw/zinc/89/42/89/171894289.db2.gz	SSRBVENDMFAUHG-UHFFFAOYSA-N	1	0	260.297	1.335	50	0		CDAARO
Cn1c2ccc(C[NH2+]CCCn3ccnc3)cc2n(C)c1=O	ZINC000035268952	172092034	/nfs/dbraw/zinc/09/20/34/172092034.db2.gz	ZPVWOPKAISOMAK-UHFFFAOYSA-N	1	0	299.378	1.253	50	0		CDAARO
C[C@H](c1cccnc1)[NH+]1CCC(CNS(C)(=O)=O)CC1	ZINC000285418938	196279017	/nfs/dbraw/zinc/27/90/17/196279017.db2.gz	JNKVEXSPRGCZJV-GFCCVEGCSA-N	1	0	297.424	1.404	50	0		CDAARO
CCc1ccc(S(=O)(=O)N2CCC[C@H]([NH3+])C2)cc1	ZINC000036297042	172590094	/nfs/dbraw/zinc/59/00/94/172590094.db2.gz	CFTVTUIHFADRKU-LBPRGKRZSA-N	1	0	268.382	1.361	50	0		CDAARO
CCSCCn1nc(CC2CC[NH2+]CC2)n(CC)c1=O	ZINC000065507721	175745547	/nfs/dbraw/zinc/74/55/47/175745547.db2.gz	IECLOCFWQNMIDW-UHFFFAOYSA-N	1	0	298.456	1.360	50	0		CDAARO
COc1cccc(CSc2nnc(C[NH3+])n2C)c1	ZINC000071373653	176138944	/nfs/dbraw/zinc/13/89/44/176138944.db2.gz	AGMVCHXDOALBFM-UHFFFAOYSA-N	1	0	264.354	1.575	50	0		CDAARO
O=C(CO)N1C[C@H](c2ccccc2)[C@@H]2[C@H]1C1CC[NH+]2CC1	ZINC000071764620	176261988	/nfs/dbraw/zinc/26/19/88/176261988.db2.gz	UFGSEVABLQPKLN-DJIMGWMZSA-N	1	0	286.375	1.068	50	0		CDAARO
O=C(c1cc[nH]c1)N1CCC([N@@H+]2CCC[C@@H](O)C2)CC1	ZINC000072137031	176322454	/nfs/dbraw/zinc/32/24/54/176322454.db2.gz	MQNKDQHPTNQJJT-CQSZACIVSA-N	1	0	277.368	1.076	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)c2ccc(Cn3ccnc3)o2)CC1	ZINC000072146669	176324804	/nfs/dbraw/zinc/32/48/04/176324804.db2.gz	BRGSNGNGCDVSEO-GFCCVEGCSA-N	1	0	288.351	1.478	50	0		CDAARO
O=C(NC1CC1)[C@@H]1CN(Cc2cc3ccccc3[nH]2)CC[NH2+]1	ZINC000072145698	176325128	/nfs/dbraw/zinc/32/51/28/176325128.db2.gz	ZYAWAMVCRRMESL-INIZCTEOSA-N	1	0	298.390	1.220	50	0		CDAARO
O=C(CCC[N@H+]1CCOC[C@@H](CO)C1)c1ccc(F)cc1	ZINC000077343327	177254602	/nfs/dbraw/zinc/25/46/02/177254602.db2.gz	JICZSNJEOBJDJL-CYBMUJFWSA-N	1	0	295.354	1.729	50	0		CDAARO
C[C@H](Cc1ccccc1)N1C(=O)NC2(CC[NH2+]CC2)C1=O	ZINC000077516558	177277012	/nfs/dbraw/zinc/27/70/12/177277012.db2.gz	RATVVACKQCOBPZ-GFCCVEGCSA-N	1	0	287.363	1.292	50	0		CDAARO
COc1ccc(CNC(=O)[C@H]2CCCC[N@@H+]2C)cc1F	ZINC000078646001	177365654	/nfs/dbraw/zinc/36/56/54/177365654.db2.gz	SHTACHLHHQUWFS-CYBMUJFWSA-N	1	0	280.343	1.935	50	0		CDAARO
CCc1ccc(NC(=O)C[NH2+]CCN2CCOCC2)cc1	ZINC000022030196	262344003	/nfs/dbraw/zinc/34/40/03/262344003.db2.gz	GNIZTKFMMWLZHZ-UHFFFAOYSA-N	1	0	291.395	1.109	50	0		CDAARO
NNc1[nH+]cnc2c1cnn2Cc1ccc(Cl)cc1	ZINC000000521148	274954085	/nfs/dbraw/zinc/95/40/85/274954085.db2.gz	QMXNRAPPJBFRHT-UHFFFAOYSA-N	1	0	274.715	1.814	50	0		CDAARO
CC(C)(C)OC(=O)N1C[C@@H]([NH2+]Cc2ccccc2)[C@@H](O)C1	ZINC000042689325	275521413	/nfs/dbraw/zinc/52/14/13/275521413.db2.gz	GVYATPKTSSTHKN-KGLIPLIRSA-N	1	0	292.379	1.756	50	0		CDAARO
CC1(C)CCC[C@@H](C[NH2+]CCNS(C)(=O)=O)C1	ZINC000096483693	276107535	/nfs/dbraw/zinc/10/75/35/276107535.db2.gz	CEBSEMBPUSKQQZ-LLVKDONJSA-N	1	0	262.419	1.342	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)c1cccc(C)c1F	ZINC000122649333	277032955	/nfs/dbraw/zinc/03/29/55/277032955.db2.gz	UVOQNJPLRAKOQJ-LLVKDONJSA-N	1	0	250.317	1.958	50	0		CDAARO
CN1c2ccccc2[C@]2(CCC[N@H+](CCCO)C2)C1=O	ZINC000072154949	277219152	/nfs/dbraw/zinc/21/91/52/277219152.db2.gz	NXCRLJYQZFPWDS-MRXNPFEDSA-N	1	0	274.364	1.379	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)c2cncnc2C(C)C)C1	ZINC000269100406	277275330	/nfs/dbraw/zinc/27/53/30/277275330.db2.gz	BJTOOCSOMKNRPL-LBPRGKRZSA-N	1	0	276.384	1.672	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@@H]1NC(=O)c1cccc(F)c1F	ZINC000094345235	277934124	/nfs/dbraw/zinc/93/41/24/277934124.db2.gz	RVIOFXNDFATHHU-KCJUWKMLSA-N	1	0	254.280	1.693	50	0		CDAARO
CC(C)c1ccc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)c(=O)[nH]1	ZINC000091435206	278029673	/nfs/dbraw/zinc/02/96/73/278029673.db2.gz	JSUSFNBWKDYPDK-OLZOCXBDSA-N	1	0	289.379	1.308	50	0		CDAARO
C[C@@H]1[NH2+]CCN(Cc2ccc3c(c2)OCCO3)[C@H]1C	ZINC000097095774	279038104	/nfs/dbraw/zinc/03/81/04/279038104.db2.gz	XTMSOZFCPMPGTE-RYUDHWBXSA-N	1	0	262.353	1.640	50	0		CDAARO
CC[C@H](OC)C(=O)N1CC[C@@H]([NH+]2CCCC2)[C@@H]1C	ZINC000253419894	288128041	/nfs/dbraw/zinc/12/80/41/288128041.db2.gz	DLHPMUBYESNPAV-XQQFMLRXSA-N	1	0	254.374	1.497	50	0		CDAARO
Cn1cnnc1C1CC[NH+](C[C@@H]2CCOC2)CC1	ZINC000097515015	279392985	/nfs/dbraw/zinc/39/29/85/279392985.db2.gz	ZACORYPHHCQSOZ-NSHDSACASA-N	1	0	250.346	1.031	50	0		CDAARO
CC(C)N1CCCC[C@H]1C[NH2+][C@@H](C)CS(C)(=O)=O	ZINC000096491733	279493012	/nfs/dbraw/zinc/49/30/12/279493012.db2.gz	DBEFSNPSGLKEPA-STQMWFEESA-N	1	0	276.446	1.272	50	0		CDAARO
O=C(c1c(F)cc(F)cc1F)N1CCC[NH2+]CC1	ZINC000086995683	280156851	/nfs/dbraw/zinc/15/68/51/280156851.db2.gz	HFASKTXCQKORSS-UHFFFAOYSA-N	1	0	258.243	1.539	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1N1CCC[C@@H](COC)C1	ZINC000091461896	281368494	/nfs/dbraw/zinc/36/84/94/281368494.db2.gz	FERBOFAWMNMPMT-LLVKDONJSA-N	1	0	264.373	1.792	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)/C=C\c2ccccc2OC)C1	ZINC000255225022	289361902	/nfs/dbraw/zinc/36/19/02/289361902.db2.gz	RPJFUCIPGLHLHT-CFYYFVFUSA-N	1	0	274.364	1.919	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)/C=C\c2ccc(-n3ccnc3)cc2)C1	ZINC000255382823	289369423	/nfs/dbraw/zinc/36/94/23/289369423.db2.gz	LCQXXILFYKGCEZ-GTBONMDNSA-N	1	0	296.374	1.835	50	0		CDAARO
C[C@@H]1CN(C(=O)/C=C\c2ccc(C(N)=O)cc2)C[C@H](C)[NH2+]1	ZINC000255392151	289370020	/nfs/dbraw/zinc/37/00/20/289370020.db2.gz	GSPWYVLLIBZYJE-CAGCLMLXSA-N	1	0	287.363	1.008	50	0		CDAARO
COC[C@H]1CCCC[N@H+](CCN2CCO[C@@H](C)C2)C1	ZINC000253397235	293195550	/nfs/dbraw/zinc/19/55/50/293195550.db2.gz	LRMVODRVXHRKCK-GJZGRUSLSA-N	1	0	270.417	1.456	50	0		CDAARO
COc1ccc([C@H]([NH2+]C2CCOCC2)[C@H]2C[C@@H](O)C2)cn1	ZINC000244718830	295244357	/nfs/dbraw/zinc/24/43/57/295244357.db2.gz	LRPHSNSGOSGIRH-BJJXKVORSA-N	1	0	292.379	1.671	50	0		CDAARO
O=C1CC[C@H]([NH2+]CCc2ncc[nH]2)CCN1CC1CC1	ZINC000534581868	328312135	/nfs/dbraw/zinc/31/21/35/328312135.db2.gz	ZCXMNLFPFNATLG-ZDUSSCGKSA-N	1	0	276.384	1.333	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)c2ccc(CO)cc2)CC1	ZINC000534634133	328333007	/nfs/dbraw/zinc/33/30/07/328333007.db2.gz	MWPLMEBGESADQI-UHFFFAOYSA-N	1	0	276.380	1.783	50	0		CDAARO
COc1ccc(CNC(=O)[C@H]2CCC[NH2+]CC2)cc1OC	ZINC000534637064	328334219	/nfs/dbraw/zinc/33/42/19/328334219.db2.gz	JWSXKSPLZXRIQX-ZDUSSCGKSA-N	1	0	292.379	1.710	50	0		CDAARO
CCCc1nc(C[NH2+][C@H]2CCNC(=O)CC2)cs1	ZINC000534640838	328336039	/nfs/dbraw/zinc/33/60/39/328336039.db2.gz	OILHCIWKSVLWOJ-SNVBAGLBSA-N	1	0	267.398	1.854	50	0		CDAARO
Cc1ccnc(CC(=O)NC[C@H](C(C)C)[NH+](C)C)c1	ZINC000534660347	328342555	/nfs/dbraw/zinc/34/25/55/328342555.db2.gz	BDVWYFXVTNEXDW-CQSZACIVSA-N	1	0	263.385	1.635	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2cncc(=O)[nH]2)CCCCCC1	ZINC000534647884	328342969	/nfs/dbraw/zinc/34/29/69/328342969.db2.gz	VVWGYFMYPINXTL-UHFFFAOYSA-N	1	0	292.383	1.154	50	0		CDAARO
COc1nccnc1NC[C@@H](c1cccc(C)c1)[NH+](C)C	ZINC000534666896	328345621	/nfs/dbraw/zinc/34/56/21/328345621.db2.gz	OBHCMCKOPYRIEQ-AWEZNQCLSA-N	1	0	286.379	1.930	50	0		CDAARO
Cn1nc(-c2nc(-c3ccccc3)no2)c2c1CC[NH2+]C2	ZINC000066323505	482442775	/nfs/dbraw/zinc/44/27/75/482442775.db2.gz	JSFPYLFUXQZLMM-UHFFFAOYSA-N	1	0	281.319	1.783	50	0		CDAARO
COC(=O)N1CC[C@H]([NH2+]Cc2ccc([S@@](C)=O)cc2)C1	ZINC000085329588	482575912	/nfs/dbraw/zinc/57/59/12/482575912.db2.gz	PWXZVSREIKPBLO-YUNKPMOVSA-N	1	0	296.392	1.354	50	0		CDAARO
O=C(CCC(F)(F)F)NCC[N@H+]1CCCC[C@H]1CO	ZINC000670448714	483003286	/nfs/dbraw/zinc/00/32/86/483003286.db2.gz	MMAPWEWBRVOSPD-JTQLQIEISA-N	1	0	282.306	1.292	50	0		CDAARO
O=C(CCC(F)(F)F)NCC[N@H+]1CCC[C@H](CO)C1	ZINC000670455430	483028094	/nfs/dbraw/zinc/02/80/94/483028094.db2.gz	WTIPOEXXQXDSLA-JTQLQIEISA-N	1	0	282.306	1.149	50	0		CDAARO
CC(C)[N@@H+]1CCO[C@H](CC(=O)NCCc2nccs2)C1	ZINC000670456067	483032074	/nfs/dbraw/zinc/03/20/74/483032074.db2.gz	NYKJQMAXCXSIIA-GFCCVEGCSA-N	1	0	297.424	1.301	50	0		CDAARO
Cc1cc(C)n(CC[N@H+](C)CCn2cnnc2C)n1	ZINC000670455801	483033648	/nfs/dbraw/zinc/03/36/48/483033648.db2.gz	SAQWGKJNRKAONK-UHFFFAOYSA-N	1	0	262.361	1.032	50	0		CDAARO
CC/C=C\CCC[N@@H+]1C[C@H](O)[C@@H](N2CCOCC2)C1	ZINC000822293525	1161928051	/nfs/dbraw/zinc/92/80/51/1161928051.db2.gz	NUNGAJSPYHDLGO-CGXNLCPXSA-N	1	0	268.401	1.110	50	0		CDAARO
C[NH+](C)CCN1C[C@@H](C(=O)NCC2=CCCCC2)CC1=O	ZINC000095367380	521772683	/nfs/dbraw/zinc/77/26/83/521772683.db2.gz	DGMWDTUFIGLETB-AWEZNQCLSA-N	1	0	293.411	1.013	50	0		CDAARO
C[NH+](C)CCN1C[C@H](C(=O)NCC2=CCCCC2)CC1=O	ZINC000095367379	521773829	/nfs/dbraw/zinc/77/38/29/521773829.db2.gz	DGMWDTUFIGLETB-CQSZACIVSA-N	1	0	293.411	1.013	50	0		CDAARO
Cc1nn(CC(C)C)c(C)c1CC(=O)N1CC[C@H](C[NH3+])C1	ZINC000178559761	526269577	/nfs/dbraw/zinc/26/95/77/526269577.db2.gz	ZRDYPROLBUODCQ-CQSZACIVSA-N	1	0	292.427	1.506	50	0		CDAARO
CCS[C@H]1CC[C@@H]([N@H+](C)CCN2C(=O)CCC2=O)C1	ZINC000096441697	529232981	/nfs/dbraw/zinc/23/29/81/529232981.db2.gz	RMRVKXYHKGDTLJ-NEPJUHHUSA-N	1	0	284.425	1.741	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@](O)([C@@H]([NH3+])c2ccns2)C1	ZINC000958528249	613978949	/nfs/dbraw/zinc/97/89/49/613978949.db2.gz	LLILTSKFDXHRON-GWCFXTLKSA-N	1	0	299.396	1.515	50	0		CDAARO
CCCN(CCC[NH+]1CCC(F)(F)CC1)CC(=O)NC	ZINC000952993102	614578343	/nfs/dbraw/zinc/57/83/43/614578343.db2.gz	WHNWOEKNZYIHBN-UHFFFAOYSA-N	1	0	291.386	1.566	50	0		CDAARO
CCc1ccc(C[NH2+]CCN2CCCC[C@@H]2CO)nc1	ZINC000952965411	615674041	/nfs/dbraw/zinc/67/40/41/615674041.db2.gz	DFMUBEUVBVKQCA-MRXNPFEDSA-N	1	0	277.412	1.580	50	0		CDAARO
CC[NH+](CC)[C@@H]1CCN(CCn2nccc2C)C1	ZINC000244882547	679736224	/nfs/dbraw/zinc/73/62/24/679736224.db2.gz	XTWISRVKOZLYRU-CQSZACIVSA-N	1	0	250.390	1.608	50	0		CDAARO
Cc1noc(-c2ccccc2C(=O)NC[C@@H]2CCC[NH2+]2)n1	ZINC000178761048	679743440	/nfs/dbraw/zinc/74/34/40/679743440.db2.gz	JQWDSLHIDMHHAJ-NSHDSACASA-N	1	0	286.335	1.527	50	0		CDAARO
Cc1nc(NC(=O)c2ccc([C@H]3CCC[NH2+]3)s2)n(C)n1	ZINC000023192370	682421192	/nfs/dbraw/zinc/42/11/92/682421192.db2.gz	DEAIUBVVWKYMAW-SECBINFHSA-N	1	0	291.380	1.862	50	0		CDAARO
C[C@@H]1C[N@H+]([C@H]2CCC(=O)N(CC3CC3)CC2)C[C@H](C)O1	ZINC000952987704	682449404	/nfs/dbraw/zinc/44/94/04/682449404.db2.gz	MQRXXCYVJOZVJF-GUTXKFCHSA-N	1	0	280.412	1.887	50	0		CDAARO
Cn1cc(C[NH2+][C@H]2CCCN(Cc3ccccn3)C2)cn1	ZINC000023374413	682791687	/nfs/dbraw/zinc/79/16/87/682791687.db2.gz	SPPZNSYHPGCXON-INIZCTEOSA-N	1	0	285.395	1.569	50	0		CDAARO
C[N@@H+]1CCC[C@@H](c2cc(=O)[nH]c(-c3ccccn3)n2)C1	ZINC000023213950	683087915	/nfs/dbraw/zinc/08/79/15/683087915.db2.gz	RPZCSHUQQYBUDC-LLVKDONJSA-N	1	0	270.336	1.641	50	0		CDAARO
CCN1CCC[C@@H]([N@@H+]2CCC[C@@H](CN3CCCC3=O)C2)C1	ZINC000032541247	683330733	/nfs/dbraw/zinc/33/07/33/683330733.db2.gz	MSEIUFLSRDEAKW-HZPDHXFCSA-N	1	0	293.455	1.805	50	0		CDAARO
F[C@@H]1CN[C@H](C[NH2+]C2CCN(Cc3ccccn3)CC2)C1	ZINC000082137697	683420863	/nfs/dbraw/zinc/42/08/63/683420863.db2.gz	XXOBMDFZWVNUFW-BBRMVZONSA-N	1	0	292.402	1.336	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1CCNc1cnc2ccccc2n1	ZINC000952978575	684111501	/nfs/dbraw/zinc/11/15/01/684111501.db2.gz	AUHNLXVDVRTCPY-CYBMUJFWSA-N	1	0	286.379	1.889	50	0		CDAARO
C[NH+](C)CCN(Cc1c[nH]cn1)C(=O)c1ccc(Cl)o1	ZINC001704310750	1177683453	/nfs/dbraw/zinc/68/34/53/1177683453.db2.gz	SAPZDULUYXZKQH-UHFFFAOYSA-N	1	0	296.758	1.860	50	0		CDAARO
CCn1ccnc1CN(C)CC[C@H]1CCC[N@@H+]1C	ZINC001704357656	1177701463	/nfs/dbraw/zinc/70/14/63/1177701463.db2.gz	VHPSGBDAYLMEEX-CYBMUJFWSA-N	1	0	250.390	1.819	50	0		CDAARO
CCc1cc(N[C@H]2CCOC2)nc(N2CCCC2)[nH+]1	ZINC001529174461	921113892	/nfs/dbraw/zinc/11/38/92/921113892.db2.gz	UNDKJQQQTCKETR-LBPRGKRZSA-N	1	0	262.357	1.840	50	0		CDAARO
Cc1nc(N2CC[N@@H+](C)[C@H](CCO)C2)ccc1Cl	ZINC001506414089	909051054	/nfs/dbraw/zinc/05/10/54/909051054.db2.gz	NRFQQCUCEGJKMC-LLVKDONJSA-N	1	0	269.776	1.546	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)NCc1ccc2c(c1)OCO2	ZINC000823778668	925729093	/nfs/dbraw/zinc/72/90/93/925729093.db2.gz	UIYZGWQGKPQMEG-CYBMUJFWSA-N	1	0	290.363	1.906	50	0		CDAARO
COc1nccnc1NC[C@@H]1Cc2ccccc2C[N@@H+]1C	ZINC000824853279	925840104	/nfs/dbraw/zinc/84/01/04/925840104.db2.gz	PFDMXNVNIZWLRJ-AWEZNQCLSA-N	1	0	284.363	1.954	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1Cc1nc(CC(N)=O)nn1C(C)(C)C	ZINC000826842490	925919552	/nfs/dbraw/zinc/91/95/52/925919552.db2.gz	WVXWLBFACPJUBZ-LLVKDONJSA-N	1	0	293.415	1.088	50	0		CDAARO
C[NH+](C)[C@@H]1CCN(C(=O)Cc2ccccc2)C[C@@H]1CO	ZINC000581782298	927197012	/nfs/dbraw/zinc/19/70/12/927197012.db2.gz	MQTGGMHVLVNYFX-HUUCEWRRSA-N	1	0	276.380	1.000	50	0		CDAARO
CC[NH+](CC)[C@@H]1CCOC2(CCN(C(=O)COC)CC2)C1	ZINC000581784442	927197656	/nfs/dbraw/zinc/19/76/56/927197656.db2.gz	ZJLVSQOUWWHGTC-CQSZACIVSA-N	1	0	298.427	1.515	50	0		CDAARO
Cc1nc([C@@H](C)OC(=O)C[C@@H](C[NH3+])CC(C)C)no1	ZINC000585138377	931032086	/nfs/dbraw/zinc/03/20/86/931032086.db2.gz	LQLTUYXRGOFKSS-KOLCDFICSA-N	1	0	269.345	1.993	50	0		CDAARO
O=C(NC1CC1)[C@H]1CCC[N@H+]1CCOc1ccc(F)cc1	ZINC000097258895	935061800	/nfs/dbraw/zinc/06/18/00/935061800.db2.gz	FVNAWJDHEUWRQD-OAHLLOKOSA-N	1	0	292.354	1.948	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3ccc(C)o3)C[C@H]2O)[nH]n1	ZINC001529166947	969000524	/nfs/dbraw/zinc/00/05/24/969000524.db2.gz	BFSNSQCRBOFZKR-IUODEOHRSA-N	1	0	275.352	1.655	50	0		CDAARO
C[C@@H](Cn1cncn1)[NH2+]C1CCN(Cc2ccco2)CC1	ZINC001506401676	975150429	/nfs/dbraw/zinc/15/04/29/975150429.db2.gz	NMWMEUNOJLHSLJ-ZDUSSCGKSA-N	1	0	289.383	1.514	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C(=O)c1cc(O)ccc1N	ZINC001506402768	975150697	/nfs/dbraw/zinc/15/06/97/975150697.db2.gz	PBCQZNROAUEMGZ-UHFFFAOYSA-N	1	0	291.395	1.921	50	0		CDAARO
Cc1ccc2ncccc2c1C[NH2+][C@@H](C)CN(C)CCO	ZINC001506417041	975155330	/nfs/dbraw/zinc/15/53/30/975155330.db2.gz	KGCQPYYZVAGJST-AWEZNQCLSA-N	1	0	287.407	1.945	50	0		CDAARO
C[C@H](C[N@H+](C)CCO)NCc1noc(C2CCCC2)n1	ZINC001506419637	975156804	/nfs/dbraw/zinc/15/68/04/975156804.db2.gz	UHPXTTWZEFTDPH-LLVKDONJSA-N	1	0	282.388	1.129	50	0		CDAARO
COCCCC[NH+]1CCN(c2nccnc2N(C)C)CC1	ZINC001506419682	975156844	/nfs/dbraw/zinc/15/68/44/975156844.db2.gz	IOGWSYTYMQBWBL-UHFFFAOYSA-N	1	0	293.415	1.091	50	0		CDAARO
OCC1(O)CC[NH+](C[C@@H]2CCOc3ccccc3C2)CC1	ZINC000095515140	185002017	/nfs/dbraw/zinc/00/20/17/185002017.db2.gz	JDRGLDALXPJYRG-CQSZACIVSA-N	1	0	291.391	1.447	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)CCOC	ZINC000106779577	349484411	/nfs/dbraw/zinc/48/44/11/349484411.db2.gz	MQVQLNCWJKRTFQ-QWHCGFSZSA-N	1	0	254.374	1.498	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(C(=O)Cc2[nH]nc3ccccc32)C1	ZINC000095959735	185043798	/nfs/dbraw/zinc/04/37/98/185043798.db2.gz	XWJWVILKOKDBPU-LBPRGKRZSA-N	1	0	286.379	1.516	50	0		CDAARO
c1ncn(Cc2ccc(C[NH2+]C[C@@H]3CCOC3)cc2)n1	ZINC000095966289	185045666	/nfs/dbraw/zinc/04/56/66/185045666.db2.gz	AIABOKBTYRHIBA-HNNXBMFYSA-N	1	0	272.352	1.453	50	0		CDAARO
COCCN1CCC[C@H]1C[NH2+][C@@H](C)c1cncc(F)c1	ZINC000095967644	185046958	/nfs/dbraw/zinc/04/69/58/185046958.db2.gz	UREMEBPFEBQKGD-WFASDCNBSA-N	1	0	281.375	1.982	50	0		CDAARO
COc1ccccc1[C@@H]1CCN(C(=O)CCC[NH3+])C1	ZINC000095971143	185048789	/nfs/dbraw/zinc/04/87/89/185048789.db2.gz	XRDSOGAHHAXBNS-GFCCVEGCSA-N	1	0	262.353	1.750	50	0		CDAARO
CCC(=O)NCc1ccccc1C[N@@H+]1CC[C@H](O)C1	ZINC000096006290	185062772	/nfs/dbraw/zinc/06/27/72/185062772.db2.gz	FSQLZTSDSXOSRE-AWEZNQCLSA-N	1	0	262.353	1.279	50	0		CDAARO
COC(=O)C1CCN(C(=O)C[C@@H](C)[NH2+]C2CCCC2)CC1	ZINC000096008823	185063511	/nfs/dbraw/zinc/06/35/11/185063511.db2.gz	OQORAZCHLMESKJ-GFCCVEGCSA-N	1	0	296.411	1.709	50	0		CDAARO
CC(C)c1cc(C(=O)N2CC[C@H]3CC[N@H+](C)C[C@H]32)no1	ZINC000241897149	361754840	/nfs/dbraw/zinc/75/48/40/361754840.db2.gz	TVZQTXMPFFFWRZ-DGCLKSJQSA-N	1	0	277.368	1.964	50	0		CDAARO
CSC[C@H]1CCCN(C(=O)CC2CC[NH2+]CC2)C1	ZINC000394073973	342089975	/nfs/dbraw/zinc/08/99/75/342089975.db2.gz	WXAWGQPVZMTAPA-ZDUSSCGKSA-N	1	0	270.442	1.978	50	0		CDAARO
C[C@@]1(C(=O)N(CCO)CCc2ccccc2)CCC[NH2+]C1	ZINC000195554231	342625909	/nfs/dbraw/zinc/62/59/09/342625909.db2.gz	MDRQARLBVCKWAV-QGZVFWFLSA-N	1	0	290.407	1.440	50	0		CDAARO
O=C1C[C@@H]([NH2+]CC2CC2)C(=O)N1c1ccc(Cl)cc1	ZINC000083251947	178370408	/nfs/dbraw/zinc/37/04/08/178370408.db2.gz	TVPYRVWWNFLNIB-GFCCVEGCSA-N	1	0	278.739	1.972	50	0		CDAARO
CCc1ccccc1OCC[N@@H+]1CC[C@](C)(O)[C@@H](O)C1	ZINC000096149661	185107313	/nfs/dbraw/zinc/10/73/13/185107313.db2.gz	DASJDINGTMIEDL-HOTGVXAUSA-N	1	0	279.380	1.445	50	0		CDAARO
C[N@H+](CCC(=O)NCc1cccs1)CC1(C)COC1	ZINC000243932266	361830957	/nfs/dbraw/zinc/83/09/57/361830957.db2.gz	BTXPMRWAXMYHGV-UHFFFAOYSA-N	1	0	282.409	1.723	50	0		CDAARO
CC(C)(C)C(=O)N1CCC[N@H+](CC2CCOCC2)CC1	ZINC000095958899	539088122	/nfs/dbraw/zinc/08/81/22/539088122.db2.gz	AISLMQBKWPEKGS-UHFFFAOYSA-N	1	0	282.428	1.993	50	0		CDAARO
OC1(c2ccccc2)CC[NH+](CCn2cncn2)CC1	ZINC000244719251	361858171	/nfs/dbraw/zinc/85/81/71/361858171.db2.gz	LZSHIFRMYVBJMV-UHFFFAOYSA-N	1	0	272.352	1.262	50	0		CDAARO
C[C@@H](C(=O)NCc1ccccc1)[N@H+](C)CC1(C)COC1	ZINC000244874179	361867800	/nfs/dbraw/zinc/86/78/00/361867800.db2.gz	WWBYEKGXONMYTN-ZDUSSCGKSA-N	1	0	276.380	1.660	50	0		CDAARO
CNC(=O)CC[N@H+](C)Cc1ccc2nsnc2c1	ZINC000244874794	361867896	/nfs/dbraw/zinc/86/78/96/361867896.db2.gz	XHLKVXQISHSBJZ-UHFFFAOYSA-N	1	0	264.354	1.259	50	0		CDAARO
Cc1c[nH]c(C(=O)N(C)C[C@@H]2CC[N@@H+](CC(C)C)C2)n1	ZINC000244873355	361868042	/nfs/dbraw/zinc/86/80/42/361868042.db2.gz	WOTIQBKAMDGEJF-ZDUSSCGKSA-N	1	0	278.400	1.768	50	0		CDAARO
c1ncn(CCN2CC[NH+](C3Cc4ccccc4C3)CC2)n1	ZINC000244884000	361869248	/nfs/dbraw/zinc/86/92/48/361869248.db2.gz	YDHFZYUFXLLWFR-UHFFFAOYSA-N	1	0	297.406	1.063	50	0		CDAARO
Cc1nnc([C@@]23COC[C@@H]2CN(c2cc[nH+]cc2C)C3)o1	ZINC000685941365	539045869	/nfs/dbraw/zinc/04/58/69/539045869.db2.gz	RZGNAEFDSLANOS-WFASDCNBSA-N	1	0	286.335	1.486	50	0		CDAARO
CC(C)(C[NH3+])NC(=O)c1cc(-c2ccccc2O)n[nH]1	ZINC000685942437	539045944	/nfs/dbraw/zinc/04/59/44/539045944.db2.gz	SPARZIZUBVYIOR-UHFFFAOYSA-N	1	0	274.324	1.249	50	0		CDAARO
NC(=O)[C@H]1CCN(Cc2ccncc2Br)C1	ZINC000585140570	342218685	/nfs/dbraw/zinc/21/86/85/342218685.db2.gz	HCVKVFFCVNJBAP-VIFPVBQESA-N	1	0	284.157	1.151	50	0		CDAARO
Cn1c(C[N@@H+]2CC[C@@H](C(N)=O)C2)cc2ccccc21	ZINC000585141290	342219050	/nfs/dbraw/zinc/21/90/50/342219050.db2.gz	SXVAWTPORTWCIU-GFCCVEGCSA-N	1	0	257.337	1.486	50	0		CDAARO
CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1[NH2+]Cc1cccnc1	ZINC000084736392	342268366	/nfs/dbraw/zinc/26/83/66/342268366.db2.gz	QQAFSBPWIABEJM-KGLIPLIRSA-N	1	0	297.424	1.231	50	0		CDAARO
CCCn1cc(C[NH2+][C@@H]2CCN(C(C)=O)C[C@H]2C)cn1	ZINC000084760618	342268759	/nfs/dbraw/zinc/26/87/59/342268759.db2.gz	RXGQZULKIGPIHH-IUODEOHRSA-N	1	0	278.400	1.640	50	0		CDAARO
O=C(N[C@H]1CC[NH2+]C1)c1csc(-c2ccoc2)n1	ZINC000127904431	342290227	/nfs/dbraw/zinc/29/02/27/342290227.db2.gz	ONLFPPSRXLZEMT-VIFPVBQESA-N	1	0	263.322	1.495	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNC(=O)N1CCSCC1	ZINC000078926060	362120654	/nfs/dbraw/zinc/12/06/54/362120654.db2.gz	NVIMMWDJULQHFD-GFCCVEGCSA-N	1	0	271.430	1.619	50	0		CDAARO
C[C@@H]1CCN(C(=O)[C@@H]2CN(C)CCO2)[C@@H]2CCCC[C@H]12	ZINC000081256588	342365869	/nfs/dbraw/zinc/36/58/69/342365869.db2.gz	JDFARXGDZGOPLD-TUVASFSCSA-N	1	0	280.412	1.744	50	0		CDAARO
COC(=O)[C@@H]1[C@@H]2CCC[N@@H+]2C[C@@]12c1ccccc1NC2=O	ZINC000036584753	362196381	/nfs/dbraw/zinc/19/63/81/362196381.db2.gz	SACUHBGXWYEFEY-HEHGZKQESA-N	1	0	286.331	1.144	50	0		CDAARO
c1cc(C[NH2+][C@@H]2CCSC2)cc(-c2nn[nH]n2)c1	ZINC000095220659	343658707	/nfs/dbraw/zinc/65/87/07/343658707.db2.gz	YLLHVGFGTBOLPF-LLVKDONJSA-N	1	0	261.354	1.462	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cccc(-n3cccn3)c2)C1	ZINC000178974242	362250752	/nfs/dbraw/zinc/25/07/52/362250752.db2.gz	NJUQNKOZGBSYQT-CYBMUJFWSA-N	1	0	284.363	1.554	50	0		CDAARO
Cc1ccn(CC[N@@H+](C)Cc2cccc(-c3nn[nH]n3)c2)n1	ZINC000252509515	362390389	/nfs/dbraw/zinc/39/03/89/362390389.db2.gz	YOXVVUXUBNDENG-UHFFFAOYSA-N	1	0	297.366	1.504	50	0		CDAARO
[NH3+]CCNS(=O)(=O)Cc1c(Cl)cccc1Cl	ZINC000097229251	185568156	/nfs/dbraw/zinc/56/81/56/185568156.db2.gz	RSNNRKGKAWAHRR-UHFFFAOYSA-N	1	0	283.180	1.372	50	0		CDAARO
C[C@H]1Cc2cc(S(=O)(=O)N[C@@H](C[NH3+])C3CC3)ccc2O1	ZINC000097229369	185569320	/nfs/dbraw/zinc/56/93/20/185569320.db2.gz	RIVZJDXJLOHCKN-ZANVPECISA-N	1	0	296.392	1.026	50	0		CDAARO
CCCc1ncncc1C(=O)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000097532489	185624341	/nfs/dbraw/zinc/62/43/41/185624341.db2.gz	HRFSSBYCNVGNAM-NEPJUHHUSA-N	1	0	274.368	1.396	50	0		CDAARO
Cc1ccc(C)c(CN2C(=O)N[C@]3(CC[NH2+]C3)C2=O)c1	ZINC000098212703	185699680	/nfs/dbraw/zinc/69/96/80/185699680.db2.gz	WQJYILVFHJHNBW-HNNXBMFYSA-N	1	0	273.336	1.087	50	0		CDAARO
Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)N2CCNC2=O)c(C)c1	ZINC000012852170	362780852	/nfs/dbraw/zinc/78/08/52/362780852.db2.gz	FVEULBGRAMRCOW-ZDUSSCGKSA-N	1	0	289.379	1.676	50	0		CDAARO
CC[C@H](CSc1ccccc1)NC(=O)C[NH2+]C	ZINC000193137337	362835958	/nfs/dbraw/zinc/83/59/58/362835958.db2.gz	WGWVEXBLJKBMIQ-LLVKDONJSA-N	1	0	252.383	1.893	50	0		CDAARO
CC(C)CC[N@@H+]1CCO[C@@H](CNc2cccnn2)C1	ZINC000089821152	347616015	/nfs/dbraw/zinc/61/60/15/347616015.db2.gz	SYONUQXRRVKAAX-ZDUSSCGKSA-N	1	0	264.373	1.635	50	0		CDAARO
Cc1cc(S(=O)(=O)N[C@H]2CCC[NH2+]C2)c(F)cc1F	ZINC000193351822	362907203	/nfs/dbraw/zinc/90/72/03/362907203.db2.gz	NEXLZURWDRHLCT-VIFPVBQESA-N	1	0	290.335	1.304	50	0		CDAARO
Cc1ccc([C@H]2CN(CC[NH2+]C(C)C)CCO2)o1	ZINC000193479693	362923283	/nfs/dbraw/zinc/92/32/83/362923283.db2.gz	WISURLULJPGZMB-CQSZACIVSA-N	1	0	252.358	1.959	50	0		CDAARO
CC(C)C1=NO[C@@H](C(=O)N(C)CC[NH+]2CCCC2)C1	ZINC000584896125	349357628	/nfs/dbraw/zinc/35/76/28/349357628.db2.gz	YURIABTYVOELFZ-CYBMUJFWSA-N	1	0	267.373	1.342	50	0		CDAARO
C[C@H](CC(=O)Nc1ccc(F)cc1)[NH2+]C[C@@]1(O)CCOC1	ZINC000090849544	180045955	/nfs/dbraw/zinc/04/59/55/180045955.db2.gz	WNKPCQCMIMSDMB-ABAIWWIYSA-N	1	0	296.342	1.284	50	0		CDAARO
C[C@@H]([NH2+]C[C@]1(O)CCOC1)c1ccc(F)cc1F	ZINC000090850234	180046040	/nfs/dbraw/zinc/04/60/40/180046040.db2.gz	QLEPXFNGJBUKCW-NOZJJQNGSA-N	1	0	257.280	1.767	50	0		CDAARO
Cc1cc(N[C@@H](C)c2nc(-c3ccncc3)no2)nc(N)[nH+]1	ZINC000091364921	180142298	/nfs/dbraw/zinc/14/22/98/180142298.db2.gz	ZWDPQTKPTXLJKA-VIFPVBQESA-N	1	0	297.322	1.985	50	0		CDAARO
CC(C)c1cc(C(=O)NCC[NH+]2CCCC2)on1	ZINC000091575130	180196984	/nfs/dbraw/zinc/19/69/84/180196984.db2.gz	PWSNSYNMYSWWBK-UHFFFAOYSA-N	1	0	251.330	1.624	50	0		CDAARO
COc1ccc(OCCN(C)C(=O)[C@@H]2CC[C@H]([NH3+])C2)cc1	ZINC000091545881	180186332	/nfs/dbraw/zinc/18/63/32/180186332.db2.gz	IIEFUGGXFSGTAZ-OLZOCXBDSA-N	1	0	292.379	1.660	50	0		CDAARO
CCC[C@H]1CN(CC(C)(C)[NH3+])C[C@@H]1NC(=O)c1ccco1	ZINC000091829482	180265508	/nfs/dbraw/zinc/26/55/08/180265508.db2.gz	HSEJJHZHVZTDRA-STQMWFEESA-N	1	0	293.411	1.847	50	0		CDAARO
CC[NH+](CC)CCN1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000110711599	350288976	/nfs/dbraw/zinc/28/89/76/350288976.db2.gz	WFJBSCWGXITUQX-RBSFLKMASA-N	1	0	270.417	1.597	50	0		CDAARO
Fc1ccccc1C[NH2+]C[C@@H]1CN(C2CC2)CCO1	ZINC000106380836	186111345	/nfs/dbraw/zinc/11/13/45/186111345.db2.gz	VFMYCXHGNCOCJK-CQSZACIVSA-N	1	0	264.344	1.779	50	0		CDAARO
COC[C@H](O)C[N@@H+]1C[C@H](c2ccsc2)C[C@@H]1C	ZINC000110618687	186306078	/nfs/dbraw/zinc/30/60/78/186306078.db2.gz	CEZFHQKVRBAQLO-CYZMBNFOSA-N	1	0	255.383	1.933	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)NC1CC[NH2+]CC1	ZINC000037116483	363396618	/nfs/dbraw/zinc/39/66/18/363396618.db2.gz	BIEJTLOCAJWSES-UHFFFAOYSA-N	1	0	272.345	1.164	50	0		CDAARO
C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1C[C@@H](O)CN1CCOCC1	ZINC000195531485	363456710	/nfs/dbraw/zinc/45/67/10/363456710.db2.gz	VMDZXINKFCTKOC-UGUYLWEFSA-N	1	0	282.428	1.333	50	0		CDAARO
C[N@H+](CCO)CCOCCOc1ccc(F)cc1	ZINC000002981055	355990167	/nfs/dbraw/zinc/99/01/67/355990167.db2.gz	LDZYRDGJCBOEON-UHFFFAOYSA-N	1	0	257.305	1.145	50	0		CDAARO
C[C@@H](c1nc2ccccc2c(=O)[nH]1)N1CC[NH+](C)CC1	ZINC000022806583	356199070	/nfs/dbraw/zinc/19/90/70/356199070.db2.gz	DLPUDSAKNIYXMX-NSHDSACASA-N	1	0	272.352	1.232	50	0		CDAARO
CC[C@@H](CNC(=O)c1cccnc1OC)[NH+]1CCCC1	ZINC000032661148	356329150	/nfs/dbraw/zinc/32/91/50/356329150.db2.gz	DWXADNQKDMSWJD-LBPRGKRZSA-N	1	0	277.368	1.694	50	0		CDAARO
COc1ccccc1C(=O)N(C)C1CC[NH+](C)CC1	ZINC000012976325	356334022	/nfs/dbraw/zinc/33/40/22/356334022.db2.gz	LWSXOPRIFOQOKH-UHFFFAOYSA-N	1	0	262.353	1.861	50	0		CDAARO
O[C@@H]1/C(=C/c2ccc3c(c2)OCO3)[NH+]2CCC1CC2	ZINC000013495536	356347977	/nfs/dbraw/zinc/34/79/77/356347977.db2.gz	GBJBJJSHFYGKAG-XCHKQJEOSA-N	1	0	259.305	1.843	50	0		CDAARO
CC[NH+]1CCC(CCNC(=O)c2cncnc2)CC1	ZINC000273590702	192218958	/nfs/dbraw/zinc/21/89/58/192218958.db2.gz	CKBOPJPBGVEATM-UHFFFAOYSA-N	1	0	262.357	1.328	50	0		CDAARO
O=C(CC[NH+]1CCC(O)CC1)Nc1ccc2c(c1)OCO2	ZINC000032870809	356402732	/nfs/dbraw/zinc/40/27/32/356402732.db2.gz	HNWYQHAVWLMIOC-UHFFFAOYSA-N	1	0	292.335	1.201	50	0		CDAARO
CC[NH+]1CCC(NC(=O)Cc2ccccc2F)CC1	ZINC000016580253	356442279	/nfs/dbraw/zinc/44/22/79/356442279.db2.gz	FNGYWEOKIDDPSP-UHFFFAOYSA-N	1	0	264.344	1.969	50	0		CDAARO
Fc1ccccc1N1CCN([C@H]2CCC[NH2+]C2)CC1	ZINC000037746631	356490831	/nfs/dbraw/zinc/49/08/31/356490831.db2.gz	BXUAAQNMWXBKFT-ZDUSSCGKSA-N	1	0	263.360	1.700	50	0		CDAARO
Cc1ccsc1C[NH+]1CCN(CCOCCO)CC1	ZINC000019892862	356514091	/nfs/dbraw/zinc/51/40/91/356514091.db2.gz	IHZGKJISMMSRAQ-UHFFFAOYSA-N	1	0	284.425	1.183	50	0		CDAARO
CCOc1ccc(CN2CC[NH2+]C[C@@H]2CCO)cc1	ZINC000019860706	356511222	/nfs/dbraw/zinc/51/12/22/356511222.db2.gz	QIHCCUFYBADKBX-AWEZNQCLSA-N	1	0	264.369	1.242	50	0		CDAARO
COc1ccc2c(C[N@@H+]3CCC[C@@H](O)C3)cc(=O)oc2c1	ZINC000023991925	356650842	/nfs/dbraw/zinc/65/08/42/356650842.db2.gz	SVVKXXSSYOLLDU-GFCCVEGCSA-N	1	0	289.331	1.758	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N[C@H]2C[N@@H+](C)C[C@@H]2C)c1	ZINC000078899134	538477159	/nfs/dbraw/zinc/47/71/59/538477159.db2.gz	COKIHFULKDPGPD-JQWIXIFHSA-N	1	0	286.372	1.363	50	0		CDAARO
C[N@H+]1C[C@H]2CN(C(=O)c3cccnc3C(F)(F)F)C[C@H]2C1	ZINC000192464552	283211662	/nfs/dbraw/zinc/21/16/62/283211662.db2.gz	UOCDBJNNDZBRGH-AOOOYVTPSA-N	1	0	299.296	1.734	50	0		CDAARO
CCc1ccccc1O[C@H](C)C(=O)N1CC[NH2+]CC1	ZINC000032023182	356773052	/nfs/dbraw/zinc/77/30/52/356773052.db2.gz	AZWBLZNZLMMIIN-GFCCVEGCSA-N	1	0	262.353	1.448	50	0		CDAARO
O=C(NCC1CC[NH2+]CC1)c1cccc2c1OCCO2	ZINC000034570624	356816692	/nfs/dbraw/zinc/81/66/92/356816692.db2.gz	GPCGWBDMPPASTD-UHFFFAOYSA-N	1	0	276.336	1.187	50	0		CDAARO
CCC[N@@H+]1CCCN(C(=O)C[C@@H]2CCOC2)CC1	ZINC000365470265	356824299	/nfs/dbraw/zinc/82/42/99/356824299.db2.gz	RAPRVWAJMRKPOB-ZDUSSCGKSA-N	1	0	254.374	1.357	50	0		CDAARO
O=C1CCCN1C[C@@H]1CCCN(c2cc[nH+]c(CO)c2)C1	ZINC000032517992	356781604	/nfs/dbraw/zinc/78/16/04/356781604.db2.gz	PGMHILJKKWFNLR-CYBMUJFWSA-N	1	0	289.379	1.413	50	0		CDAARO
CC[C@H](CO)N(Cc1cc(C)n[nH]1)Cc1ccccn1	ZINC000055242267	357330706	/nfs/dbraw/zinc/33/07/06/357330706.db2.gz	RWALCCNZFPGQTR-OAHLLOKOSA-N	1	0	274.368	1.886	50	0		CDAARO
CCC1(CC)[C@H](OC)C[C@@H]1[N@H+](C)CCC(=O)NC	ZINC000095424703	357349481	/nfs/dbraw/zinc/34/94/81/357349481.db2.gz	BDCJDKAZBMTGPU-NWDGAFQWSA-N	1	0	256.390	1.648	50	0		CDAARO
COc1ccc(CNC(=O)C[C@@H]2CC[NH2+]C2)c(OC)c1	ZINC000089748248	357503795	/nfs/dbraw/zinc/50/37/95/357503795.db2.gz	HGVLXSHVEUUFSP-NSHDSACASA-N	1	0	278.352	1.320	50	0		CDAARO
Cc1ccc(CN(CC[NH+](C)C)C(=O)c2cnon2)s1	ZINC000063847735	357517029	/nfs/dbraw/zinc/51/70/29/357517029.db2.gz	CHIYOVRJGPPCNY-UHFFFAOYSA-N	1	0	294.380	1.644	50	0		CDAARO
O=C(CSc1ccccn1)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000065405093	357538291	/nfs/dbraw/zinc/53/82/91/357538291.db2.gz	MXCRCEGXZCLMPW-NEPJUHHUSA-N	1	0	277.393	1.527	50	0		CDAARO
NC(=O)Cn1ccnc1-c1ccc(C[NH+]2CCCC2)s1	ZINC000065408646	357539135	/nfs/dbraw/zinc/53/91/35/357539135.db2.gz	XYQPSHCGVCBEHX-UHFFFAOYSA-N	1	0	290.392	1.693	50	0		CDAARO
CNC(=O)[C@H](C)[N@H+](C)C1CCN(Cc2cccnc2)CC1	ZINC000065435473	357541408	/nfs/dbraw/zinc/54/14/08/357541408.db2.gz	WPBRKXOJGJMCIB-ZDUSSCGKSA-N	1	0	290.411	1.112	50	0		CDAARO
Cn1ccnc1CN(C(=O)C[NH+]1CCCCCC1)C1CC1	ZINC000065452445	357542644	/nfs/dbraw/zinc/54/26/44/357542644.db2.gz	BGLAVEMWLFZAAT-UHFFFAOYSA-N	1	0	290.411	1.787	50	0		CDAARO
Cc1ccccc1C[C@]1(C2CC[NH2+]CC2)NC(=O)NC1=O	ZINC000067756958	357625246	/nfs/dbraw/zinc/62/52/46/357625246.db2.gz	AXQQNEBOYBBPBQ-MRXNPFEDSA-N	1	0	287.363	1.115	50	0		CDAARO
CC[NH+](CC)Cc1cnc2c(C(=O)NC3CC3)cnn2c1	ZINC000067447132	357609473	/nfs/dbraw/zinc/60/94/73/357609473.db2.gz	TUGMMZPBZCEJOI-UHFFFAOYSA-N	1	0	287.367	1.463	50	0		CDAARO
COC[C@H]([NH2+]C1CSCCSC1)c1ccnn1C	ZINC000067473081	357610115	/nfs/dbraw/zinc/61/01/15/357610115.db2.gz	JXEMVLATJZYOKG-NSHDSACASA-N	1	0	287.454	1.546	50	0		CDAARO
C[NH+]1CCC2(CCN(C(=O)c3n[nH]cc3Cl)C2)CC1	ZINC000067974565	357641435	/nfs/dbraw/zinc/64/14/35/357641435.db2.gz	IJDPHZXAYBDSDZ-UHFFFAOYSA-N	1	0	282.775	1.621	50	0		CDAARO
COC(=O)c1ccc(C(=O)NCCC[NH+](C)C)cc1	ZINC000068675260	357653483	/nfs/dbraw/zinc/65/34/83/357653483.db2.gz	JCYICELCRMFVBB-UHFFFAOYSA-N	1	0	264.325	1.155	50	0		CDAARO
CN(CC[NH+]1CCCCCC1)Cc1cnc(N)nc1	ZINC000067850508	357632841	/nfs/dbraw/zinc/63/28/41/357632841.db2.gz	LELNCNNJFDOICR-UHFFFAOYSA-N	1	0	263.389	1.367	50	0		CDAARO
C[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cccc(N)c1)C2	ZINC000067868145	357633380	/nfs/dbraw/zinc/63/33/80/357633380.db2.gz	QGDNNZCULLMWGV-MRXNPFEDSA-N	1	0	273.380	1.827	50	0		CDAARO
Cc1ncc(CO)c(CN2CC[C@]3(C2)CCC[NH2+]C3)c1O	ZINC000067895944	357635895	/nfs/dbraw/zinc/63/58/95/357635895.db2.gz	LWAVPRWBOFHXPM-MRXNPFEDSA-N	1	0	291.395	1.163	50	0		CDAARO
CCN1CC2(CC[NH+](Cc3cccnc3N)CC2)OC1=O	ZINC000072421145	357833569	/nfs/dbraw/zinc/83/35/69/357833569.db2.gz	ZUVAVBHPJNONBK-UHFFFAOYSA-N	1	0	290.367	1.471	50	0		CDAARO
COc1ccc(NC(=O)NC[C@@H]2CC[NH2+]C[C@H]2O)c(C)c1	ZINC000072425821	357835175	/nfs/dbraw/zinc/83/51/75/357835175.db2.gz	CXNXKQDRKCVEFP-SMDDNHRTSA-N	1	0	293.367	1.096	50	0		CDAARO
CSCCC[N@@H+]1CCCN(c2ncccn2)CC1	ZINC000072631948	357845900	/nfs/dbraw/zinc/84/59/00/357845900.db2.gz	WKBIAUVPGQVWBI-UHFFFAOYSA-N	1	0	266.414	1.742	50	0		CDAARO
COc1ccc(C[NH2+][C@H]2CCCC[C@H]2C(N)=O)cc1	ZINC000097113863	357982809	/nfs/dbraw/zinc/98/28/09/357982809.db2.gz	OULPPPPNOYNOFP-KGLIPLIRSA-N	1	0	262.353	1.829	50	0		CDAARO
COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2C(N)=O)cc1	ZINC000097113862	357982895	/nfs/dbraw/zinc/98/28/95/357982895.db2.gz	OULPPPPNOYNOFP-ZIAGYGMSSA-N	1	0	262.353	1.829	50	0		CDAARO
COC(=O)N1CCC([NH2+][C@@H](C)CCn2cccn2)CC1	ZINC000097234833	358050543	/nfs/dbraw/zinc/05/05/43/358050543.db2.gz	XGOGIYWNNZLAAN-LBPRGKRZSA-N	1	0	280.372	1.482	50	0		CDAARO
COCCN(CCN1CCCC1=O)Cc1cccnc1	ZINC000191241202	358121792	/nfs/dbraw/zinc/12/17/92/358121792.db2.gz	CTESGKKDOKFULN-UHFFFAOYSA-N	1	0	277.368	1.152	50	0		CDAARO
CCc1nn(C)cc1CN1CC[N@H+](C)C[C@@H]1C(C)C	ZINC000097059016	358138182	/nfs/dbraw/zinc/13/81/82/358138182.db2.gz	JHWVSVVHGWZGHL-OAHLLOKOSA-N	1	0	264.417	1.755	50	0		CDAARO
Cc1ccc(C)c(CC(=O)NC[C@@H]2C[C@H](F)C[NH2+]2)c1	ZINC000082098048	358147125	/nfs/dbraw/zinc/14/71/25/358147125.db2.gz	UMAQQJPWKFZOFM-KBPBESRZSA-N	1	0	264.344	1.662	50	0		CDAARO
COc1cc(C(=O)N2CCCC[C@H]([NH+](C)C)C2)ccn1	ZINC000082092662	358147230	/nfs/dbraw/zinc/14/72/30/358147230.db2.gz	JHEPEZXZANHJBQ-ZDUSSCGKSA-N	1	0	277.368	1.647	50	0		CDAARO
CC(=O)c1ccc(C(=O)NC[C@@H]2C[C@H](F)C[NH2+]2)s1	ZINC000082114497	358147592	/nfs/dbraw/zinc/14/75/92/358147592.db2.gz	NNVBYEZLOCPQOE-IUCAKERBSA-N	1	0	270.329	1.381	50	0		CDAARO
O=S(=O)(NC1CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000082164217	358150604	/nfs/dbraw/zinc/15/06/04/358150604.db2.gz	PNSNANVCEHGGFU-AWEZNQCLSA-N	1	0	280.393	1.343	50	0		CDAARO
CC[N@@H+]1CCC[C@H](NC(=O)c2ccnc(-n3ccnc3)c2)C1	ZINC000060638765	358254724	/nfs/dbraw/zinc/25/47/24/358254724.db2.gz	XVQKCWVRVCPVDG-AWEZNQCLSA-N	1	0	299.378	1.481	50	0		CDAARO
Cn1cc(C(=O)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)cn1	ZINC000194736286	358536445	/nfs/dbraw/zinc/53/64/45/358536445.db2.gz	DTSVXHIDFNELRT-HNNXBMFYSA-N	1	0	298.390	1.672	50	0		CDAARO
Cc1noc2ncnc(NCC3([NH+](C)C)CCOCC3)c12	ZINC000095369995	358687676	/nfs/dbraw/zinc/68/76/76/358687676.db2.gz	PGGPAFZMWQCPEK-UHFFFAOYSA-N	1	0	291.355	1.449	50	0		CDAARO
CC(C)c1ccnc(NC[C@H](C)N2CC[NH+](C)CC2)n1	ZINC000095390686	358692209	/nfs/dbraw/zinc/69/22/09/358692209.db2.gz	DGFMYOUHZOLGCK-ZDUSSCGKSA-N	1	0	277.416	1.648	50	0		CDAARO
COc1ccc(CN2C[C@H](O)[C@@H]([NH+](C)C)C2)c(C)c1C	ZINC000097076610	358750105	/nfs/dbraw/zinc/75/01/05/358750105.db2.gz	ALZNIOIICVJUDR-GJZGRUSLSA-N	1	0	278.396	1.419	50	0		CDAARO
CCN(CC)C(=O)[C@@H]1CCC[N@H+](Cc2c(C)cnn2C)C1	ZINC000215742805	358900820	/nfs/dbraw/zinc/90/08/20/358900820.db2.gz	QXAYOBJERCKRGQ-CQSZACIVSA-N	1	0	292.427	1.809	50	0		CDAARO
Cc1noc(C)c1C[N@@H+]1CCC[C@]2(CNC(=O)O2)CC1	ZINC000215833795	358905565	/nfs/dbraw/zinc/90/55/65/358905565.db2.gz	JQESIGDZBJYEGG-CQSZACIVSA-N	1	0	279.340	1.756	50	0		CDAARO
CN(CC(=O)NC1Cc2ccccc2C1)Cc1ccncc1	ZINC000216180925	358930299	/nfs/dbraw/zinc/93/02/99/358930299.db2.gz	AYBZYDZZOSHAKB-UHFFFAOYSA-N	1	0	295.386	1.797	50	0		CDAARO
CCC[C@H]([NH3+])C(=O)NCCCc1nc2cc(F)ccc2[nH]1	ZINC000219298426	359086433	/nfs/dbraw/zinc/08/64/33/359086433.db2.gz	ZOKYRWKAUOAYEK-NSHDSACASA-N	1	0	292.358	1.878	50	0		CDAARO
Nc1cc(C(=O)NCC2([NH+]3CCCC3)CCCCC2)[nH]n1	ZINC000219507357	359102013	/nfs/dbraw/zinc/10/20/13/359102013.db2.gz	DCWVPQSIBQZLPI-UHFFFAOYSA-N	1	0	291.399	1.520	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2cccc(SC)c2)CC1	ZINC000022943709	359143996	/nfs/dbraw/zinc/14/39/96/359143996.db2.gz	IENQIIQYJPWGJR-UHFFFAOYSA-N	1	0	293.436	1.985	50	0		CDAARO
COCCn1ccnc1CN1CC[NH+](C2CCCC2)CC1	ZINC000222267197	359330151	/nfs/dbraw/zinc/33/01/51/359330151.db2.gz	FGXNCYDIBUIGPQ-UHFFFAOYSA-N	1	0	292.427	1.590	50	0		CDAARO
O=C(C[NH2+]CC1CC1)N1CCN(c2ccccc2)CC1	ZINC000037611904	359418290	/nfs/dbraw/zinc/41/82/90/359418290.db2.gz	YYNWGJLKCGKGFK-UHFFFAOYSA-N	1	0	273.380	1.335	50	0		CDAARO
Nc1nc(NCc2[nH]nc3c2CCC3)cc(C2CC([NH3+])C2)n1	ZINC000223149866	359403564	/nfs/dbraw/zinc/40/35/64/359403564.db2.gz	DMHAPOQOXFOWTH-UHFFFAOYSA-N	1	0	299.382	1.087	50	0		CDAARO
CN(C)c1nc2c(c(=O)[nH]1)CC[N@H+](Cc1cccnc1)CC2	ZINC000257185983	359517772	/nfs/dbraw/zinc/51/77/72/359517772.db2.gz	YCLAVYGSOFXYAB-UHFFFAOYSA-N	1	0	299.378	1.244	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)O[C@@H](C)C(=O)N(C)C(C)C	ZINC000408525664	359935844	/nfs/dbraw/zinc/93/58/44/359935844.db2.gz	PFSWLFJVTJZEIP-STQMWFEESA-N	1	0	286.416	1.796	50	0		CDAARO
CC(C)[C@@H]1OCCC[C@@H]1CNC1=[NH+]CCCCN1	ZINC000521396963	359970229	/nfs/dbraw/zinc/97/02/29/359970229.db2.gz	WVUSBDGPCVXKRL-OLZOCXBDSA-N	1	0	253.390	1.767	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)C[C@@H]1CCCO1	ZINC000248105782	360363084	/nfs/dbraw/zinc/36/30/84/360363084.db2.gz	FUIKKEACYSUBOZ-BFHYXJOUSA-N	1	0	266.385	1.641	50	0		CDAARO
COc1cccc2c1OC[C@H]([NH2+]CCN1CCOC1=O)C2	ZINC000011874051	360385017	/nfs/dbraw/zinc/38/50/17/360385017.db2.gz	ORXZSNSZEDGPEZ-GFCCVEGCSA-N	1	0	292.335	1.041	50	0		CDAARO
[NH3+]C[C@@H]1CN(C(=O)Cc2ccc(Cl)cc2)CCO1	ZINC000011887305	360401269	/nfs/dbraw/zinc/40/12/69/360401269.db2.gz	ULXDHFGOEJCBCS-GFCCVEGCSA-N	1	0	268.744	1.069	50	0		CDAARO
CNc1ccc(C(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)cn1	ZINC000011946814	360462027	/nfs/dbraw/zinc/46/20/27/360462027.db2.gz	HNWQDCMSVCQCSF-ZDUSSCGKSA-N	1	0	290.411	1.831	50	0		CDAARO
Cc1cnccc1CCNC(=O)N1CC[C@H](C[NH+](C)C)C1	ZINC000130455678	360615779	/nfs/dbraw/zinc/61/57/79/360615779.db2.gz	HZENLQCWQSVPNG-CQSZACIVSA-N	1	0	290.411	1.526	50	0		CDAARO
COc1cc(F)ccc1CN1CCO[C@@H](CC[NH3+])C1	ZINC000426502874	360677420	/nfs/dbraw/zinc/67/74/20/360677420.db2.gz	IXNASXWVZBPNBV-ZDUSSCGKSA-N	1	0	268.332	1.384	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2cc(C(C)C)no2)n1C	ZINC000426541397	360682671	/nfs/dbraw/zinc/68/26/71/360682671.db2.gz	NOZWCSCICODSFU-UHFFFAOYSA-N	1	0	281.385	1.938	50	0		CDAARO
Cn1ccnc1-c1ccc(C(=O)NCC[C@H]2CCC[NH2+]2)cc1	ZINC000426431749	360669605	/nfs/dbraw/zinc/66/96/05/360669605.db2.gz	HHDVMCQYPUEZGU-OAHLLOKOSA-N	1	0	298.390	1.959	50	0		CDAARO
COc1ncc(C(=O)N2CC([N@@H+]3CCCC[C@H]3C)C2)cn1	ZINC000426488176	360674869	/nfs/dbraw/zinc/67/48/69/360674869.db2.gz	IHCLXUJPDPGABR-LLVKDONJSA-N	1	0	290.367	1.184	50	0		CDAARO
CN(C(=O)c1nc2ccccc2[nH]1)[C@@H]1CC[N@H+](C)C1	ZINC000426497159	360676338	/nfs/dbraw/zinc/67/63/38/360676338.db2.gz	HQIFHUCHKPDLDY-SNVBAGLBSA-N	1	0	258.325	1.339	50	0		CDAARO
CC(C)(C(=O)N1CC[C@@H](C[NH3+])C1)c1ccccc1F	ZINC000178552558	189126310	/nfs/dbraw/zinc/12/63/10/189126310.db2.gz	JCDSAUUDVRNVGW-NSHDSACASA-N	1	0	264.344	1.911	50	0		CDAARO
CC1=CCN(C(=O)Cc2ccc(OCC[NH3+])cc2)CC1	ZINC000426705689	360697593	/nfs/dbraw/zinc/69/75/93/360697593.db2.gz	LNKJTLQASRSBSD-UHFFFAOYSA-N	1	0	274.364	1.745	50	0		CDAARO
CC[C@@H](NC(=O)C(C)(C)[NH+]1CCCC1)c1ccnn1C	ZINC000426723891	360700248	/nfs/dbraw/zinc/70/02/48/360700248.db2.gz	OISQUUGOMUXQMR-GFCCVEGCSA-N	1	0	278.400	1.862	50	0		CDAARO
CCOC(=O)CNC(=O)C1CC[NH+]([C@@H]2C=CCCC2)CC1	ZINC000179105791	189170279	/nfs/dbraw/zinc/17/02/79/189170279.db2.gz	VZBNIBMVGLSZSH-CQSZACIVSA-N	1	0	294.395	1.486	50	0		CDAARO
COCCC[N@@H+](Cc1ccco1)C[C@H](O)COC(C)C	ZINC000036096451	360910924	/nfs/dbraw/zinc/91/09/24/360910924.db2.gz	NURDMHYLEPOZLJ-AWEZNQCLSA-N	1	0	285.384	1.904	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC2CC[NH2+]CC2)cc1F	ZINC000036286094	361425177	/nfs/dbraw/zinc/42/51/77/361425177.db2.gz	RNIFAJAXRVNMQR-UHFFFAOYSA-N	1	0	272.345	1.164	50	0		CDAARO
O=c1occ(C[NH+]2CCCCC2)c([O-])c1C[NH+]1CCCC1	ZINC000101408383	361493795	/nfs/dbraw/zinc/49/37/95/361493795.db2.gz	GVFGLUYCPCCNSY-UHFFFAOYSA-N	1	0	292.379	1.927	50	0		CDAARO
CC[NH+]1CCN(c2cncc(Br)c2)CC1	ZINC000157129433	363915919	/nfs/dbraw/zinc/91/59/19/363915919.db2.gz	CXNZVLGFWCYOBZ-UHFFFAOYSA-N	1	0	270.174	1.986	50	0		CDAARO
COc1ccc([C@@H]2CCCN2CC(=O)NC(N)=O)cc1	ZINC000017288533	364013496	/nfs/dbraw/zinc/01/34/96/364013496.db2.gz	ISRHSFRKZQSGNF-LBPRGKRZSA-N	1	0	277.324	1.027	50	0		CDAARO
C[NH+](C)CCCNC(=S)Nc1ccc2c(c1)OCCO2	ZINC000017450222	364064127	/nfs/dbraw/zinc/06/41/27/364064127.db2.gz	TYHIFKGLQQTCKG-UHFFFAOYSA-N	1	0	295.408	1.696	50	0		CDAARO
Cc1cnc(C[NH2+][C@@H]2CCc3nc(C(C)C)nn3C2)cn1	ZINC000089702256	366915522	/nfs/dbraw/zinc/91/55/22/366915522.db2.gz	PPNLWFUALMPBOP-GFCCVEGCSA-N	1	0	286.383	1.605	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1CC(=O)NCCCc1ccccc1	ZINC000089939009	366972710	/nfs/dbraw/zinc/97/27/10/366972710.db2.gz	TYRASEVEQAUZQF-HNNXBMFYSA-N	1	0	289.423	1.371	50	0		CDAARO
CCC[NH+]1CCN(C(=O)NCc2ccncc2)CC1	ZINC000089959089	366984479	/nfs/dbraw/zinc/98/44/79/366984479.db2.gz	YZVOBUISWVGLLF-UHFFFAOYSA-N	1	0	262.357	1.319	50	0		CDAARO
CCN(C)C(=O)CC[N@H+](C)Cc1cnc(C)s1	ZINC000089960819	366985531	/nfs/dbraw/zinc/98/55/31/366985531.db2.gz	JUMXLBZTGZWBIS-UHFFFAOYSA-N	1	0	255.387	1.752	50	0		CDAARO
C(c1nc(C2CCOCC2)no1)C1CC[NH2+]CC1	ZINC000093679614	367266356	/nfs/dbraw/zinc/26/63/56/367266356.db2.gz	DVWQJPDCZWNEBP-UHFFFAOYSA-N	1	0	251.330	1.506	50	0		CDAARO
O=C(NC[C@@]1(O)CCOC1)[C@H]1CCCC[N@@H+]1C1CCCC1	ZINC000252481731	367566114	/nfs/dbraw/zinc/56/61/14/367566114.db2.gz	CRAMCAPGZSYHPZ-ZBFHGGJFSA-N	1	0	296.411	1.051	50	0		CDAARO
CCCCNc1cc(N2CCO[C@@H](COC)C2)nc(N)n1	ZINC000252484481	367568301	/nfs/dbraw/zinc/56/83/01/367568301.db2.gz	FXMLSGVYCIZGJE-LLVKDONJSA-N	1	0	295.387	1.122	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CCCC[C@H]2C[NH3+])s1	ZINC000089107946	368997764	/nfs/dbraw/zinc/99/77/64/368997764.db2.gz	OKPKJKRHOAZBCS-WDEREUQCSA-N	1	0	288.438	1.852	50	0		CDAARO
O=C(N[C@H]1CC[N@@H+](C2CCCC2)C1)N1CCSCC1	ZINC000076983726	284195105	/nfs/dbraw/zinc/19/51/05/284195105.db2.gz	KHWSDLPSWZOUAN-LBPRGKRZSA-N	1	0	283.441	1.762	50	0		CDAARO
Cc1ncc(C(=O)N[C@H](C)C[NH+]2CCCCC2)c(C)n1	ZINC000179881244	372320478	/nfs/dbraw/zinc/32/04/78/372320478.db2.gz	GCXQRMLSEKRZLJ-LLVKDONJSA-N	1	0	276.384	1.698	50	0		CDAARO
Cc1cc(C)n(CCN(C)C(=O)[C@H]2[C@@H]([NH3+])[C@H]3C=C[C@@H]2C3)n1	ZINC000299801336	372771308	/nfs/dbraw/zinc/77/13/08/372771308.db2.gz	VOPZQEFKNXTGTN-BARDWOONSA-N	1	0	288.395	1.108	50	0		CDAARO
C[C@H]([NH3+])C(=O)N(Cc1cccs1)C[C@@H]1CCCO1	ZINC000037801384	373348522	/nfs/dbraw/zinc/34/85/22/373348522.db2.gz	HLFAVMHTEDFRFB-QWRGUYRKSA-N	1	0	268.382	1.603	50	0		CDAARO
CC(C)N1CC[C@H]([NH2+][C@@H]2[C@@H]3CCO[C@H]3C2(C)C)C1	ZINC000253371003	373679624	/nfs/dbraw/zinc/67/96/24/373679624.db2.gz	ZIRKEUWASJAMDP-IGQOVBAYSA-N	1	0	252.402	1.872	50	0		CDAARO
C[NH+](C)[C@@H]1CCN(C(=O)[C@@](C)(O)CCc2ccccc2)C1	ZINC000253392256	373681097	/nfs/dbraw/zinc/68/10/97/373681097.db2.gz	HHICDLAAOORSGV-WBVHZDCISA-N	1	0	290.407	1.533	50	0		CDAARO
CC1(C)CN(C(=O)c2cc(Cc3ccccc3)n[nH]2)CC[NH2+]1	ZINC000253415371	373725634	/nfs/dbraw/zinc/72/56/34/373725634.db2.gz	SAEIXFNRUZYVOM-UHFFFAOYSA-N	1	0	298.390	1.825	50	0		CDAARO
CN(C[C@H]1CCOC1)C(=O)C1([NH+]2CCCC2)CCCC1	ZINC000670453181	483021902	/nfs/dbraw/zinc/02/19/02/483021902.db2.gz	XJJDAIGFLQMOKC-CQSZACIVSA-N	1	0	280.412	1.890	50	0		CDAARO
C[C@@H]1Cc2cc(S(=O)(=O)NC(C)(C)C[NH3+])ccc2O1	ZINC000123731212	374695921	/nfs/dbraw/zinc/69/59/21/374695921.db2.gz	HQRXSAHWYTUQJQ-SECBINFHSA-N	1	0	284.381	1.026	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1n[nH]c2c1CCCCC2	ZINC000096232421	375065326	/nfs/dbraw/zinc/06/53/26/375065326.db2.gz	HIWMYSYXJQDMCB-LBPRGKRZSA-N	1	0	290.411	1.893	50	0		CDAARO
C[C@@H](CCc1cccc(F)c1)[N@@H+]1CCO[C@H](C(N)=O)C1	ZINC000097084347	375143898	/nfs/dbraw/zinc/14/38/98/375143898.db2.gz	OXSADRJXEUTUSC-FZMZJTMJSA-N	1	0	280.343	1.333	50	0		CDAARO
Cn1cc([C@@H](CO)[NH2+]C2CC(c3ccccc3)C2)cn1	ZINC000097084861	375146308	/nfs/dbraw/zinc/14/63/08/375146308.db2.gz	WXCKMFBBUVPPEG-AVVWSFFYSA-N	1	0	271.364	1.989	50	0		CDAARO
O=C(c1ccco1)N1CCN(C[C@@H](O)c2ccco2)CC1	ZINC000030534499	375612975	/nfs/dbraw/zinc/61/29/75/375612975.db2.gz	PTTOUJCTRVMIQJ-GFCCVEGCSA-N	1	0	290.319	1.364	50	0		CDAARO
COC[C@H]1CN(Cc2cnn(C(C)C)c2)C[C@@H](C)O1	ZINC000188366774	375710905	/nfs/dbraw/zinc/71/09/05/375710905.db2.gz	PMUKBZCKMOZVDL-TZMCWYRMSA-N	1	0	267.373	1.700	50	0		CDAARO
CCn1nccc1C[N@@H+]1CCC[C@H]1Cn1ccnc1	ZINC000188414268	375778583	/nfs/dbraw/zinc/77/85/83/375778583.db2.gz	DCTCVFFQUOVSLC-ZDUSSCGKSA-N	1	0	259.357	1.764	50	0		CDAARO
C[C@H](CN1C[C@@H](C)O[C@H](C)C1)C[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000241884820	376019610	/nfs/dbraw/zinc/01/96/10/376019610.db2.gz	SYBPFBQJBJGVKB-QCODTGAPSA-N	1	0	284.444	1.841	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)NCc2nc3cc(F)ccc3[nH]2)C1	ZINC000262658138	190059874	/nfs/dbraw/zinc/05/98/74/190059874.db2.gz	DOJHOCDOPDJSBN-WCBMZHEXSA-N	1	0	276.315	1.446	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCO[C@H](c2ccccc2C)C1	ZINC000129903038	377475594	/nfs/dbraw/zinc/47/55/94/377475594.db2.gz	PVKPNXUXSPULAV-KGLIPLIRSA-N	1	0	262.353	1.632	50	0		CDAARO
CCc1noc([C@H](C)[NH2+][C@@H]2CCN(C(C)=O)C[C@@H]2CC)n1	ZINC000089290035	377709074	/nfs/dbraw/zinc/70/90/74/377709074.db2.gz	JIZOCQKXXIGVTL-WCFLWFBJSA-N	1	0	294.399	1.930	50	0		CDAARO
CC[C@H](C(=O)N1CCC[C@H](C(C)(C)C(=O)OC)C1)[NH+](C)C	ZINC000089367533	377838300	/nfs/dbraw/zinc/83/83/00/377838300.db2.gz	PXXBVYUGBWZVCS-QWHCGFSZSA-N	1	0	298.427	1.764	50	0		CDAARO
CCC1(CC)[C@H](NC(=O)Cn2ccnc2)[C@@H](C)[C@H]1OC	ZINC000245289792	378047195	/nfs/dbraw/zinc/04/71/95/378047195.db2.gz	FEEMKSHXMUKGFH-MRVWCRGKSA-N	1	0	279.384	1.839	50	0		CDAARO
CNC(=O)C(=O)NC[C@H](c1cccc2ccccc21)[NH+](C)C	ZINC000010333732	379637178	/nfs/dbraw/zinc/63/71/78/379637178.db2.gz	FPKRHNXQPKULFW-OAHLLOKOSA-N	1	0	299.374	1.305	50	0		CDAARO
CNC(=O)C(=O)NC[C@@H](c1cccc2ccccc21)[NH+](C)C	ZINC000010333728	379638073	/nfs/dbraw/zinc/63/80/73/379638073.db2.gz	FPKRHNXQPKULFW-HNNXBMFYSA-N	1	0	299.374	1.305	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)/C=C\C1CCOCC1	ZINC000493619412	253508841	/nfs/dbraw/zinc/50/88/41/253508841.db2.gz	CKCIKWXBDOFRJB-ZFDPJTLLSA-N	1	0	252.358	1.180	50	0		CDAARO
O=c1c2c3c(sc2ncn1[C@H]1CC[NH2+]C1)CCC3	ZINC000032565343	285208801	/nfs/dbraw/zinc/20/88/01/285208801.db2.gz	DYRRECNFICSZCP-QMMMGPOBSA-N	1	0	261.350	1.481	50	0		CDAARO
O=S(=O)(NC1CC[NH2+]CC1)c1ccccc1Cl	ZINC000020272079	227376443	/nfs/dbraw/zinc/37/64/43/227376443.db2.gz	UCBXFLJLZWVCCP-UHFFFAOYSA-N	1	0	274.773	1.370	50	0		CDAARO
OCC[NH+]1CCN(CCOc2ccc3c(c2)CCC3)CC1	ZINC000033359708	390389481	/nfs/dbraw/zinc/38/94/81/390389481.db2.gz	SCJHNKXUQLGERX-UHFFFAOYSA-N	1	0	290.407	1.164	50	0		CDAARO
C([C@@H]1CCOC1)N1CCC[N@@H+](C2CCCC2)CC1	ZINC000336555941	390819988	/nfs/dbraw/zinc/81/99/88/390819988.db2.gz	NFFCVTRBWWZRMA-AWEZNQCLSA-N	1	0	252.402	1.973	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCC(=O)NCCNc2cccnc2)C1	ZINC000091503643	390889862	/nfs/dbraw/zinc/88/98/62/390889862.db2.gz	VXEBXCWOTRYIAK-CQSZACIVSA-N	1	0	290.411	1.732	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2ccc(CO)o2)C[C@@H]1[NH+](C)C	ZINC000091526489	390890476	/nfs/dbraw/zinc/89/04/76/390890476.db2.gz	YUDNTBAMIDGMLQ-AAEUAGOBSA-N	1	0	280.368	1.574	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)Cc2cc3ccccc3[nH]c2=O)C1	ZINC000191354323	391474024	/nfs/dbraw/zinc/47/40/24/391474024.db2.gz	QYTMGGPCISNSAZ-CYBMUJFWSA-N	1	0	285.347	1.020	50	0		CDAARO
CN(C)c1ncc2c(n1)CCC[C@@H]2[NH2+]C1CCOCC1	ZINC000012702252	391481635	/nfs/dbraw/zinc/48/16/35/391481635.db2.gz	YSJLSYBWLFOBHV-ZDUSSCGKSA-N	1	0	276.384	1.689	50	0		CDAARO
Cc1[nH]nc(C(=O)N2CCC[C@@H]([NH+](C)C)CC2)c1Cl	ZINC000426517785	533661269	/nfs/dbraw/zinc/66/12/69/533661269.db2.gz	FRPWHBKECNABMN-SNVBAGLBSA-N	1	0	284.791	1.928	50	0		CDAARO
CC(C)[N@@H+]1CC[C@@H](CN(C)C(=O)c2csnc2N)C1	ZINC000299773192	391721620	/nfs/dbraw/zinc/72/16/20/391721620.db2.gz	CZXAKCWAMURHHB-JTQLQIEISA-N	1	0	282.413	1.528	50	0		CDAARO
FC(F)(F)CN1CC[NH+](CC[C@H]2CCOC2)CC1	ZINC000437574254	392461834	/nfs/dbraw/zinc/46/18/34/392461834.db2.gz	AXBUOMBAAUQPFM-NSHDSACASA-N	1	0	266.307	1.593	50	0		CDAARO
CCN1CC[NH+](C[C@@H](C)CNc2nc(C)cnc2C)CC1	ZINC000195575053	393304490	/nfs/dbraw/zinc/30/44/90/393304490.db2.gz	KWPKFMFAXUPTGU-ZDUSSCGKSA-N	1	0	291.443	1.779	50	0		CDAARO
CCCS(=O)(=O)CCN1CCN(c2cc[nH+]cc2)CC1	ZINC000089960357	135061523	/nfs/dbraw/zinc/06/15/23/135061523.db2.gz	ODOJFYNHEVTPGL-UHFFFAOYSA-N	1	0	297.424	1.028	50	0		CDAARO
COC[C@H]([NH3+])C(=O)N[C@H](C)[C@@H]1Oc2ccccc2[C@@H]1C	ZINC000262241321	149038278	/nfs/dbraw/zinc/03/82/78/149038278.db2.gz	HTDWWWVNLRPXHL-HEQLZXTPSA-N	1	0	278.352	1.030	50	0		CDAARO
CN1N=[N+](c2ccccc2)C(=O)C1C(=O)Nc1ccccc1	ZINC000003765439	169911716	/nfs/dbraw/zinc/91/17/16/169911716.db2.gz	FYWAZZBGDCMHOT-UHFFFAOYSA-O	1	0	295.322	1.655	50	0		CDAARO
[NH3+]CC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000006746913	170239488	/nfs/dbraw/zinc/23/94/88/170239488.db2.gz	NXQOXZDEXRNDJU-UHFFFAOYSA-N	1	0	254.355	1.046	50	0		CDAARO
CCN(C(=O)C[NH+]1CCC(C(N)=O)CC1)C1=CCCCC1	ZINC000008317654	170330756	/nfs/dbraw/zinc/33/07/56/170330756.db2.gz	GWGDRYFRIQVZDE-UHFFFAOYSA-N	1	0	293.411	1.490	50	0		CDAARO
CN(CC[NH+](C)C)C(=O)c1ccc2sc(N)nc2c1	ZINC000020206898	171071458	/nfs/dbraw/zinc/07/14/58/171071458.db2.gz	BXQFZOUWBKBSSQ-UHFFFAOYSA-N	1	0	278.381	1.512	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000020294528	171135352	/nfs/dbraw/zinc/13/53/52/171135352.db2.gz	ICHMUGPGJJQWCL-CQSZACIVSA-N	1	0	264.369	1.064	50	0		CDAARO
[NH3+][C@H]1CCCN(S(=O)(=O)c2cccc(Cl)c2)C1	ZINC000020432363	171197337	/nfs/dbraw/zinc/19/73/37/171197337.db2.gz	BSSRXMXIPCTWMF-JTQLQIEISA-N	1	0	274.773	1.452	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2ccc(Cl)cn2)CC1	ZINC000020608839	171267391	/nfs/dbraw/zinc/26/73/91/171267391.db2.gz	IXIKQCBCQCODHK-UHFFFAOYSA-N	1	0	282.775	1.311	50	0		CDAARO
COc1ccc(OC)c(Nc2ncc3c(n2)CC[NH2+]C3)c1	ZINC000021778725	171322159	/nfs/dbraw/zinc/32/21/59/171322159.db2.gz	XYCUTYRRJVJEKZ-UHFFFAOYSA-N	1	0	286.335	1.883	50	0		CDAARO
CCc1ccccc1OCCOCC[N@H+](C)CCO	ZINC000022079101	171352641	/nfs/dbraw/zinc/35/26/41/171352641.db2.gz	GULSRPHCPNKDJT-UHFFFAOYSA-N	1	0	267.369	1.569	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1cccc2cccnc21	ZINC000022501005	171388563	/nfs/dbraw/zinc/38/85/63/171388563.db2.gz	UMJAKNCDDYESEY-UHFFFAOYSA-N	1	0	257.337	1.916	50	0		CDAARO
O=C(c1ccccc1)N1CCC(C[NH+]2CCOCC2)CC1	ZINC000036103375	172441616	/nfs/dbraw/zinc/44/16/16/172441616.db2.gz	LVDLZMXJADHNSI-UHFFFAOYSA-N	1	0	288.391	1.871	50	0		CDAARO
Cc1nc(N(C)C)cc(NCCNC(=O)C(C)C)[nH+]1	ZINC000044213689	175153692	/nfs/dbraw/zinc/15/36/92/175153692.db2.gz	NPUHHNIUNRYXNR-UHFFFAOYSA-N	1	0	265.361	1.035	50	0		CDAARO
CC(C)Cn1cncc1CNC(=O)[C@H]([NH3+])c1ccccc1	ZINC000071498135	176192056	/nfs/dbraw/zinc/19/20/56/176192056.db2.gz	MNLVWFNKDUYOEQ-OAHLLOKOSA-N	1	0	286.379	1.855	50	0		CDAARO
OCC(CO)[N@@H+]1CCC[C@H](CCc2ccccc2F)C1	ZINC000071707807	176248524	/nfs/dbraw/zinc/24/85/24/176248524.db2.gz	AGORSBWBZHMRIL-CYBMUJFWSA-N	1	0	281.371	1.824	50	0		CDAARO
C[C@@H]1CC[C@@H]([NH2+]CCCNS(C)(=O)=O)C[C@H]1C	ZINC000248648556	287706781	/nfs/dbraw/zinc/70/67/81/287706781.db2.gz	QTTDZFPKQLOFEQ-IJLUTSLNSA-N	1	0	262.419	1.340	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CN1CCN(c2ccc(O)cc2)CC1	ZINC000244626788	277046920	/nfs/dbraw/zinc/04/69/20/277046920.db2.gz	FSVMOSNTZYVOKD-INIZCTEOSA-N	1	0	289.423	1.999	50	0		CDAARO
CC(=O)Nc1sc2c(c1C(N)=O)CC(C)(C)[NH2+]C2(C)C	ZINC000004275251	277092126	/nfs/dbraw/zinc/09/21/26/277092126.db2.gz	FBOKFSSOLBZZHP-UHFFFAOYSA-N	1	0	295.408	1.965	50	0		CDAARO
CC(C)(C)OC(=O)N[C@@H]1CCN(C2CC[NH2+]CC2)C1	ZINC000022014981	277202570	/nfs/dbraw/zinc/20/25/70/277202570.db2.gz	FWXFHIGFBZXEOP-LLVKDONJSA-N	1	0	269.389	1.337	50	0		CDAARO
CC(C)(C)OC(=O)N[C@@H]1C[C@H]2COC[C@@H](C1)[C@H]2[NH3+]	ZINC000238855425	278441099	/nfs/dbraw/zinc/44/10/99/278441099.db2.gz	RSUOYMZSXZUASP-CKIJPRSSSA-N	1	0	256.346	1.263	50	0		CDAARO
CC[NH+](CC)CC(=O)NC(=O)NC1CCCCC1	ZINC000032682146	279089274	/nfs/dbraw/zinc/08/92/74/279089274.db2.gz	NKOYJNDOPCLEGE-UHFFFAOYSA-N	1	0	255.362	1.487	50	0		CDAARO
C[C@H](CO)[NH+]1CCC2(CC1)Nc1ccccc1NC2=O	ZINC000082146737	279357851	/nfs/dbraw/zinc/35/78/51/279357851.db2.gz	XACOOCQMADGGNQ-LLVKDONJSA-N	1	0	275.352	1.266	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCCN1C(=O)c1ccc2nccn2c1	ZINC000262758799	279404900	/nfs/dbraw/zinc/40/49/00/279404900.db2.gz	PVXXYQHDFPBGBJ-AAEUAGOBSA-N	1	0	272.352	1.676	50	0		CDAARO
[NH3+][C@H]1[C@H]2CCO[C@H]2[C@@H]1NC(=O)c1cnc2ccccc2c1	ZINC000252499324	279691806	/nfs/dbraw/zinc/69/18/06/279691806.db2.gz	RYTZLNHVMMXQCK-FAAHXZRKSA-N	1	0	283.331	1.079	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1CCN(C(=O)OC(C)(C)C)[C@@H](C)C1	ZINC000089279704	280205936	/nfs/dbraw/zinc/20/59/36/280205936.db2.gz	AVYBDDYSJFCLEG-NWDGAFQWSA-N	1	0	272.389	1.699	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)[C@H]2C1	ZINC000245305060	280209064	/nfs/dbraw/zinc/20/90/64/280209064.db2.gz	HXMAPJYHAWSQGG-RFQIPJPRSA-N	1	0	298.427	1.992	50	0		CDAARO
c1nnn2c1CO[C@H]1CN(c3cc[nH+]cc3)CC[C@@H]12	ZINC000299779892	280515016	/nfs/dbraw/zinc/51/50/16/280515016.db2.gz	QPVYWHDBOZJMEN-STQMWFEESA-N	1	0	257.297	1.023	50	0		CDAARO
CC1(C)CC(NC(=S)NC2CC2)CC(C)(C)[NH2+]1	ZINC000004702282	280912352	/nfs/dbraw/zinc/91/23/52/280912352.db2.gz	FEDRISSSMJJJHU-UHFFFAOYSA-N	1	0	255.431	1.922	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCN(C(=O)/C=C\c2cccnc2)C1	ZINC000255619934	289379788	/nfs/dbraw/zinc/37/97/88/289379788.db2.gz	ODENXLTXQIWLDF-SLBFPRPFSA-N	1	0	259.353	1.681	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCC[NH2+][C@H]2C)c(C)c1	ZINC000091496859	301695534	/nfs/dbraw/zinc/69/55/34/301695534.db2.gz	KYZNYRGCPAPKPY-STQMWFEESA-N	1	0	282.409	1.722	50	0		CDAARO
Nc1cc(N)[nH+]c(SCCC(=O)NC2CCCCC2)n1	ZINC000012644078	327783475	/nfs/dbraw/zinc/78/34/75/327783475.db2.gz	FJTFDHFVFVTNCP-UHFFFAOYSA-N	1	0	295.412	1.572	50	0		CDAARO
Cn1nccc1CSc1nnc([C@@H]2CCC[NH2+]C2)n1C	ZINC000534582445	328312322	/nfs/dbraw/zinc/31/23/22/328312322.db2.gz	FREQCVIJQHLTBG-SNVBAGLBSA-N	1	0	292.412	1.308	50	0		CDAARO
O=C(C[NH+]1CCCCCCC1)NCc1cc[nH]n1	ZINC000534590830	328318120	/nfs/dbraw/zinc/31/81/20/328318120.db2.gz	WQYREKCYSNPTNA-UHFFFAOYSA-N	1	0	250.346	1.292	50	0		CDAARO
C[C@H](CN(C)CCO)[NH2+]C1(Cc2ccccc2)CC1	ZINC000534648272	328343407	/nfs/dbraw/zinc/34/34/07/328343407.db2.gz	DXHPULMGMNWFOX-CQSZACIVSA-N	1	0	262.397	1.664	50	0		CDAARO
CO[C@H]1COC[C@@H]1NC(=O)c1ccc(C[NH+]2CCCC2)o1	ZINC000534664672	328344714	/nfs/dbraw/zinc/34/47/14/328344714.db2.gz	XUXHPZMNSRTREZ-JSGCOSHPSA-N	1	0	294.351	1.019	50	0		CDAARO
CN1CCCN(c2ncc(Cl)cn2)CC12CC[NH2+]CC2	ZINC000534670085	328346964	/nfs/dbraw/zinc/34/69/64/328346964.db2.gz	KMSHXLYLRMSLOG-UHFFFAOYSA-N	1	0	295.818	1.394	50	0		CDAARO
C[NH+]1CCC(OCCCNC(=O)CCC(F)(F)F)CC1	ZINC000534673776	328348702	/nfs/dbraw/zinc/34/87/02/328348702.db2.gz	WANUSUSFILMHTN-UHFFFAOYSA-N	1	0	296.333	1.946	50	0		CDAARO
CO[C@H]1CCN(C(=O)Cc2cc(F)ccc2F)[C@@H](C[NH3+])C1	ZINC000195557542	323571550	/nfs/dbraw/zinc/57/15/50/323571550.db2.gz	GDFHQBJBSVXZII-OLZOCXBDSA-N	1	0	298.333	1.472	50	0		CDAARO
CCn1nc(C(=O)NC)c2c1CC[C@@H]([NH2+]CC1CC1)C2	ZINC000019299803	326854706	/nfs/dbraw/zinc/85/47/06/326854706.db2.gz	QRQOKNOUIBULHM-LLVKDONJSA-N	1	0	276.384	1.120	50	0		CDAARO
CC(C)[N@@H+]1CC[C@@H](c2nc(-c3cccnn3)no2)C1	ZINC000091519413	482569423	/nfs/dbraw/zinc/56/94/23/482569423.db2.gz	WHRBRZPTPPXDSR-SNVBAGLBSA-N	1	0	259.313	1.724	50	0		CDAARO
c1cn2nc(N3CC[NH+]([C@@H]4CCSC4)CC3)ccc2n1	ZINC000670436112	482975460	/nfs/dbraw/zinc/97/54/60/482975460.db2.gz	UUAYZPANNVKRDC-GFCCVEGCSA-N	1	0	289.408	1.357	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CCc2noc(C3CC3)n2)n1	ZINC000670442286	482989503	/nfs/dbraw/zinc/98/95/03/482989503.db2.gz	GCLSXJDESUOGEY-NSHDSACASA-N	1	0	289.383	1.981	50	0		CDAARO
CCCc1cnc(N2CC[C@@H](N3CC[NH+](C)CC3)C2)nc1	ZINC000670446933	483000172	/nfs/dbraw/zinc/00/01/72/483000172.db2.gz	VPISEDIRDWXCLY-OAHLLOKOSA-N	1	0	289.427	1.255	50	0		CDAARO
CCN1C[C@@H](C[N@H+](C)Cc2cnc(N(C)C)s2)CC1=O	ZINC000670451541	483013056	/nfs/dbraw/zinc/01/30/56/483013056.db2.gz	GNWVUPGNOZMOIF-LLVKDONJSA-N	1	0	296.440	1.509	50	0		CDAARO
NC(=O)C1(NC(=O)[C@H]2CC23CC[NH2+]CC3)CCCCCC1	ZINC000670450971	483016541	/nfs/dbraw/zinc/01/65/41/483016541.db2.gz	LANQUQNBSKITTC-GFCCVEGCSA-N	1	0	293.411	1.071	50	0		CDAARO
COCC[NH+]1CCC(C(=O)N2C[C@@H]3CC[C@@H](C3)C2)CC1	ZINC000670456934	483035894	/nfs/dbraw/zinc/03/58/94/483035894.db2.gz	KZTXHYUONIAVRF-OKILXGFUSA-N	1	0	280.412	1.603	50	0		CDAARO
COc1nc(N2CCC[C@H]([NH+](C)C)C2)ncc1F	ZINC000670469748	483065702	/nfs/dbraw/zinc/06/57/02/483065702.db2.gz	OLELWMHWFWXXSK-VIFPVBQESA-N	1	0	254.309	1.155	50	0		CDAARO
CCC1CC[NH+](CCNC(=O)C[C@H]2CCOC2)CC1	ZINC000670470907	483074529	/nfs/dbraw/zinc/07/45/29/483074529.db2.gz	JYPHSBVAYUIXEG-CQSZACIVSA-N	1	0	268.401	1.651	50	0		CDAARO
Cc1cc([C@H]2CCC[N@H+](CCN3CCCC3=O)C2)[nH]n1	ZINC000084111201	483246904	/nfs/dbraw/zinc/24/69/04/483246904.db2.gz	KEAVEDCTDGDGRK-ZDUSSCGKSA-N	1	0	276.384	1.520	50	0		CDAARO
CCC[N@@H+]1CC[C@H](N(Cc2ncc(C)o2)C(C)=O)C1	ZINC000084755281	483323888	/nfs/dbraw/zinc/32/38/88/483323888.db2.gz	QKIUFJKMMHABDX-ZDUSSCGKSA-N	1	0	265.357	1.816	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)COCc2ccccc2Cl)C1	ZINC000178965719	522088550	/nfs/dbraw/zinc/08/85/50/522088550.db2.gz	ZGOAISHBFYATOP-GFCCVEGCSA-N	1	0	296.798	1.925	50	0		CDAARO
O=C(COc1cccc2ccccc21)N1CC[NH2+]CC1	ZINC000019427595	534630846	/nfs/dbraw/zinc/63/08/46/534630846.db2.gz	BUGOSOINZUJAEJ-UHFFFAOYSA-N	1	0	270.332	1.650	50	0		CDAARO
[NH3+][C@@H]1CCC[C@H]1C(=O)NC[C@H](O)c1ccccc1F	ZINC000299739478	527358709	/nfs/dbraw/zinc/35/87/09/527358709.db2.gz	OWYDTWTWLSRIER-RTXFEEFZSA-N	1	0	266.316	1.103	50	0		CDAARO
CC1CC[NH+](CC(=O)NC(=O)Cc2ccccc2)CC1	ZINC000014016410	528231215	/nfs/dbraw/zinc/23/12/15/528231215.db2.gz	KVIFSOJJNZSMCJ-UHFFFAOYSA-N	1	0	274.364	1.604	50	0		CDAARO
CC(CO)(CO)[NH2+]Cc1cc2ccccc2s1	ZINC000096501164	528709037	/nfs/dbraw/zinc/70/90/37/528709037.db2.gz	GXMFGTZWJDMFJS-UHFFFAOYSA-N	1	0	251.351	1.734	50	0		CDAARO
Cc1cccc(Cl)c1OCCOCC[NH2+]CCO	ZINC000002974963	538148964	/nfs/dbraw/zinc/14/89/64/538148964.db2.gz	PQMSRKYMYQJNML-UHFFFAOYSA-N	1	0	273.760	1.626	50	0		CDAARO
CC(C)C(=O)N1CCC[C@@H]([NH2+]Cc2cnc[nH]2)C1	ZINC000952986180	614360058	/nfs/dbraw/zinc/36/00/58/614360058.db2.gz	XKEDSOGNUFZMGJ-LLVKDONJSA-N	1	0	250.346	1.146	50	0		CDAARO
CCCN1C[C@H]([NH2+]Cc2ccnn2-c2ccccc2)CC1=O	ZINC000952981350	614813134	/nfs/dbraw/zinc/81/31/34/614813134.db2.gz	WEDFISWDPIXBNJ-CQSZACIVSA-N	1	0	298.390	1.973	50	0		CDAARO
CC1=C(C(=O)N2CCC([NH+]3CCCC3)CC2)OCCO1	ZINC000952989442	614942113	/nfs/dbraw/zinc/94/21/13/614942113.db2.gz	XCAYHAVSGUZCFW-UHFFFAOYSA-N	1	0	280.368	1.352	50	0		CDAARO
CC[C@@H](CNC(=O)/C=C/c1cc(CO)cs1)[NH+](C)C	ZINC000952976399	615481718	/nfs/dbraw/zinc/48/17/18/615481718.db2.gz	WGYHVEKIVDHXFS-FYJFLYSWSA-N	1	0	282.409	1.710	50	0		CDAARO
CCc1ccc(C[NH2+]CCN2CCC[C@H](CO)C2)nc1	ZINC000952970987	615674020	/nfs/dbraw/zinc/67/40/20/615674020.db2.gz	QZEARQXICOZDAB-HNNXBMFYSA-N	1	0	277.412	1.438	50	0		CDAARO
CCc1nc(C)c(C[NH2+]CCN2CCC[C@H](CO)C2)[nH]1	ZINC000952982468	615737527	/nfs/dbraw/zinc/73/75/27/615737527.db2.gz	XGMDJLRKNIUQSF-ZDUSSCGKSA-N	1	0	280.416	1.074	50	0		CDAARO
Cn1cc([C@@H](O)C[NH2+][C@H]2CC[C@H]3C[C@@H]2C3(C)C)cn1	ZINC000888098916	617762508	/nfs/dbraw/zinc/76/25/08/617762508.db2.gz	QWTVGVQKCSEMPI-XUXIUFHCSA-N	1	0	263.385	1.868	50	0		CDAARO
C[C@@H](c1nnc(-c2ccccc2)[nH]1)N1CC[NH+](C)CC1	ZINC000065408286	684540338	/nfs/dbraw/zinc/54/03/38/684540338.db2.gz	ZCBZZKHBQBKPOD-LBPRGKRZSA-N	1	0	271.368	1.780	50	0		CDAARO
O=C(C[C@H]1CCCOC1)N1CC[NH+](C2CCOCC2)CC1	ZINC000193430942	684745307	/nfs/dbraw/zinc/74/53/07/684745307.db2.gz	QDXSUNDBOQQVOI-CQSZACIVSA-N	1	0	296.411	1.126	50	0		CDAARO
CCCCN(Cc1cccnc1)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000952977982	684792686	/nfs/dbraw/zinc/79/26/86/684792686.db2.gz	ALOMIPPWPLVUCP-AWEZNQCLSA-N	1	0	259.353	1.738	50	0		CDAARO
COc1cccc(OCCOCCN2CC[NH+](C)CC2)c1	ZINC000022184806	685091583	/nfs/dbraw/zinc/09/15/83/685091583.db2.gz	UZDXEMGZDHPRLS-UHFFFAOYSA-N	1	0	294.395	1.338	50	0		CDAARO
C[C@@H](CC(F)(F)F)[NH2+]CC1(CO)CCOCC1	ZINC000090661832	685243028	/nfs/dbraw/zinc/24/30/28/685243028.db2.gz	HHMNFRMPTAVESW-VIFPVBQESA-N	1	0	255.280	1.706	50	0		CDAARO
CC[N@@H+]1CCN(C(=O)Nc2nc(C)n(C)n2)CC1(C)C	ZINC000063856587	686428055	/nfs/dbraw/zinc/42/80/55/686428055.db2.gz	GFUCERPPERLEQZ-UHFFFAOYSA-N	1	0	280.376	1.072	50	0		CDAARO
Cc1cc(F)cc(N2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)n1	ZINC000952992870	687003103	/nfs/dbraw/zinc/00/31/03/687003103.db2.gz	SIRQJNBZEMRSSZ-KGLIPLIRSA-N	1	0	279.359	1.565	50	0		CDAARO
Cc1n[nH]c(C)c1CCNC(=O)CC[C@H](C)[NH+]1CCCC1	ZINC000426443081	687003115	/nfs/dbraw/zinc/00/31/15/687003115.db2.gz	WQUORPYSHSBISX-LBPRGKRZSA-N	1	0	292.427	1.950	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2nccn2C2CC2)n1C	ZINC000426397443	688147070	/nfs/dbraw/zinc/14/70/70/688147070.db2.gz	PBDQHFDGWCHAGJ-UHFFFAOYSA-N	1	0	278.385	1.358	50	0		CDAARO
O[C@@H]1C[C@@H]2C[N@H+](Cc3nc(-c4ccccc4)no3)C[C@H]12	ZINC001772712540	1159446759	/nfs/dbraw/zinc/44/67/59/1159446759.db2.gz	OFBDVUNIBYFXJE-FRRDWIJNSA-N	1	0	271.320	1.549	50	0		CDAARO
CC(C)(C)CN1CC[N@H+](CC2CC2)[C@H](CCO)C1	ZINC000043139758	894575877	/nfs/dbraw/zinc/57/58/77/894575877.db2.gz	HDMYBNFBNLSKNI-CQSZACIVSA-N	1	0	254.418	1.811	50	0		CDAARO
c1cc(-c2nc(CO[C@@H]3CCC[NH2+]C3)no2)ccn1	ZINC000675016763	899872708	/nfs/dbraw/zinc/87/27/08/899872708.db2.gz	KNRAZHRGVMFDSD-LLVKDONJSA-N	1	0	260.297	1.400	50	0		CDAARO
OCc1csc(-c2ccc3c(c2)OCC[NH2+]C3)n1	ZINC000952848577	910404558	/nfs/dbraw/zinc/40/45/58/910404558.db2.gz	HYHUFVQBXIICPJ-UHFFFAOYSA-N	1	0	262.334	1.784	50	0		CDAARO
COc1ncc(C[N@H+](C)CCC[C@@H]2CCCO2)cn1	ZINC000824851996	925839398	/nfs/dbraw/zinc/83/93/98/925839398.db2.gz	MWBQFISYQSMNLA-CYBMUJFWSA-N	1	0	265.357	1.876	50	0		CDAARO
CC(C)N(C)C[C@H](C)[NH2+]Cc1cccc(CO)c1	ZINC000828827587	926194392	/nfs/dbraw/zinc/19/43/92/926194392.db2.gz	JNWQNCLNTKQRBR-ZDUSSCGKSA-N	1	0	250.386	1.997	50	0		CDAARO
Cc1ccc(C)c(-n2ncnc2[C@@H]2C[C@@H](O)C[NH2+]2)c1	ZINC000828901679	926201987	/nfs/dbraw/zinc/20/19/87/926201987.db2.gz	KPEACLRGIXGDPC-NEPJUHHUSA-N	1	0	258.325	1.279	50	0		CDAARO
C[C@H](O)[C@@H](O)CN(C)[C@@H](C)c1nc2cc(Cl)ccc2[nH]1	ZINC000585117049	930971617	/nfs/dbraw/zinc/97/16/17/930971617.db2.gz	PWBWDRJZJOMYTR-RVBZMBCESA-N	1	0	297.786	1.951	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)N[C@@H]1C[C@H]([NH+](C)C)C12CCC2	ZINC000585131307	931024686	/nfs/dbraw/zinc/02/46/86/931024686.db2.gz	RKBMJQCZPVQNFW-KGLIPLIRSA-N	1	0	290.411	1.558	50	0		CDAARO
C[NH+](C)CCc1nnc(NC(=O)C2CCOCC2)s1	ZINC001529196400	969011106	/nfs/dbraw/zinc/01/11/06/969011106.db2.gz	ZKSQHAKLYUMTFH-UHFFFAOYSA-N	1	0	284.385	1.007	50	0		CDAARO
Cc1nc(N2CC[C@@H]([NH+]3CCN(C)CC3)C2)ccc1Cl	ZINC001506404411	975151416	/nfs/dbraw/zinc/15/14/16/975151416.db2.gz	HNZAMZKTCVTEHS-CYBMUJFWSA-N	1	0	294.830	1.870	50	0		CDAARO
COc1cc(C(=O)N(C)C[C@@H](C)C[NH+]2CCCC2)ccn1	ZINC001506404969	975151686	/nfs/dbraw/zinc/15/16/86/975151686.db2.gz	SVBLTKDWBPHALN-CYBMUJFWSA-N	1	0	291.395	1.894	50	0		CDAARO
CC(C)Oc1cc(N[C@@H]2CCC[C@H]2[NH+](C)C)nc(N)n1	ZINC001506408528	975152838	/nfs/dbraw/zinc/15/28/38/975152838.db2.gz	ZBPAFAHISONWMU-GHMZBOCLSA-N	1	0	279.388	1.741	50	0		CDAARO
CC(C)=CCC[NH+]1CCN(CC(=O)NC(C)(C)C)CC1	ZINC001506418142	975157135	/nfs/dbraw/zinc/15/71/35/975157135.db2.gz	DYRVEFLVPOAPTM-UHFFFAOYSA-N	1	0	281.444	1.875	50	0		CDAARO
CN1CCC[N@@H+]([C@H]2CCN(c3ccccc3)C2)CC1	ZINC001506426410	975160659	/nfs/dbraw/zinc/16/06/59/975160659.db2.gz	GSNOIJCWWSGGME-INIZCTEOSA-N	1	0	259.397	1.903	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1CCNc1ncccc1Cl	ZINC001506427126	975160980	/nfs/dbraw/zinc/16/09/80/975160980.db2.gz	XANOXQWPAKCNGI-NSHDSACASA-N	1	0	269.776	1.994	50	0		CDAARO
COC(=O)c1ccc2nccn2c1Br	ZINC000307755743	342451581	/nfs/dbraw/zinc/45/15/81/342451581.db2.gz	FJFPQAWPVYYBDX-UHFFFAOYSA-N	1	0	255.071	1.883	50	0		CDAARO
Cc1ncc(/C=C/C(=O)NC2CC[NH+](C)CC2)s1	ZINC000096445220	230374438	/nfs/dbraw/zinc/37/44/38/230374438.db2.gz	PUFRXYKESCDUIG-ONEGZZNKSA-N	1	0	265.382	1.675	50	0		CDAARO
Cn1ccc(NC(=O)c2ccnc(OCC[NH+](C)C)c2)n1	ZINC000096500612	230384715	/nfs/dbraw/zinc/38/47/15/230384715.db2.gz	QJLHIYBHUDLRMT-UHFFFAOYSA-N	1	0	289.339	1.008	50	0		CDAARO
O=C(NC[C@]1(O)CC[NH2+]C1)Nc1cccc2ccccc21	ZINC000097910775	230387671	/nfs/dbraw/zinc/38/76/71/230387671.db2.gz	JSRGSWLXBLTFAC-INIZCTEOSA-N	1	0	285.347	1.686	50	0		CDAARO
CC[C@H](CNc1cc(C)[nH+]c(C)c1)N1CCOCC1	ZINC000584902967	341987074	/nfs/dbraw/zinc/98/70/74/341987074.db2.gz	IUACUWHTPDRWMI-OAHLLOKOSA-N	1	0	263.385	1.643	50	0		CDAARO
CC[C@H](COC)[NH2+][C@H](C)Cc1c(C)nn(C)c1C	ZINC000095968574	185047366	/nfs/dbraw/zinc/04/73/66/185047366.db2.gz	MCLHPUZVLMNTKN-ZWNOBZJWSA-N	1	0	253.390	1.983	50	0		CDAARO
O=C1[C@@H]([NH2+][C@H]2CCOC2)CCN1CCCc1ccccc1	ZINC000095983712	185053809	/nfs/dbraw/zinc/05/38/09/185053809.db2.gz	RPSWKEMQYYHKNI-HOTGVXAUSA-N	1	0	288.391	1.599	50	0		CDAARO
COC(=O)c1ccc(C(=O)N[C@@H]2CCC[N@H+](C)[C@@H]2C)cc1	ZINC000096009717	185064609	/nfs/dbraw/zinc/06/46/09/185064609.db2.gz	BOQPVRDYAIEFLT-BXUZGUMPSA-N	1	0	290.363	1.686	50	0		CDAARO
C[C@H]1CN(CC[N@@H+]2CCC[C@H](OCC3CC3)C2)CCO1	ZINC000241588056	361752607	/nfs/dbraw/zinc/75/26/07/361752607.db2.gz	OZFZLHWJQWUCMG-HOCLYGCPSA-N	1	0	282.428	1.598	50	0		CDAARO
CC(C)c1nc(CN2CC[N@@H+]3CCCC[C@@H]3C2)no1	ZINC000172802326	365619554	/nfs/dbraw/zinc/61/95/54/365619554.db2.gz	IYAIXZNKVAJVJV-GFCCVEGCSA-N	1	0	264.373	1.863	50	0		CDAARO
Cc1cccn2cc(C(=O)NCC[NH+]3CCCCC3)nc12	ZINC000097939106	342101542	/nfs/dbraw/zinc/10/15/42/342101542.db2.gz	RWZAQLQOYIUHNM-UHFFFAOYSA-N	1	0	286.379	1.858	50	0		CDAARO
CCOc1cc(C(=O)N2CC[NH2+]C[C@H]2C)ccc1C	ZINC000125183626	187173380	/nfs/dbraw/zinc/17/33/80/187173380.db2.gz	FKZMBZBCJKJDGB-GFCCVEGCSA-N	1	0	262.353	1.828	50	0		CDAARO
C[C@@H]1CCC[C@H](OCC(=O)N2CC[NH2+]C[C@H]2C)C1	ZINC000125182626	187173289	/nfs/dbraw/zinc/17/32/89/187173289.db2.gz	KKEMQGNZIQXDSG-UPJWGTAASA-N	1	0	254.374	1.402	50	0		CDAARO
C[C@]1(O)CC[N@H+](CCc2ccc(F)cc2)C[C@@H]1O	ZINC000096139409	185105523	/nfs/dbraw/zinc/10/55/23/185105523.db2.gz	AYVYKAJJSZYAEF-KBPBESRZSA-N	1	0	253.317	1.186	50	0		CDAARO
CC(C)OC1CCC(NC(=O)[C@@H]2CCC[NH2+]2)CC1	ZINC000195554713	342626200	/nfs/dbraw/zinc/62/62/00/342626200.db2.gz	FFHHQZLAAOZDEZ-BPCQOVAHSA-N	1	0	254.374	1.591	50	0		CDAARO
CCn1ccc(CN2CC[N@H+](CC3CC3)[C@H](CCO)C2)n1	ZINC000244633313	361855085	/nfs/dbraw/zinc/85/50/85/361855085.db2.gz	GAUWTTYQFGIKPD-MRXNPFEDSA-N	1	0	292.427	1.182	50	0		CDAARO
CN(Cc1ccc2nonc2c1)C[C@H]1CCC[N@@H+]1C	ZINC000244723931	361860632	/nfs/dbraw/zinc/86/06/32/361860632.db2.gz	MKLTVUVXQICGTE-GFCCVEGCSA-N	1	0	260.341	1.749	50	0		CDAARO
Cc1ccc(C[N@H+](CCO)CCn2cc[nH]c2=O)s1	ZINC000244774166	361862986	/nfs/dbraw/zinc/86/29/86/361862986.db2.gz	POYWAAIMSPMBRE-UHFFFAOYSA-N	1	0	281.381	1.041	50	0		CDAARO
Cc1nccn1CCC(=O)NCCC12CCC[NH+]1CCC2	ZINC000244708356	361859173	/nfs/dbraw/zinc/85/91/73/361859173.db2.gz	KSGUCUNPRMEWCZ-UHFFFAOYSA-N	1	0	290.411	1.716	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@H]2CCC[C@@H](C(N)=O)C2)cc1	ZINC000097034920	185157742	/nfs/dbraw/zinc/15/77/42/185157742.db2.gz	DYLDOWJPAVZMJG-KGLIPLIRSA-N	1	0	290.363	1.607	50	0		CDAARO
Cc1noc(C)c1CC(=O)N1CC[NH+](C(C)(C)C)CC1	ZINC000685945186	539046143	/nfs/dbraw/zinc/04/61/43/539046143.db2.gz	GGXFXPGJUGILLF-UHFFFAOYSA-N	1	0	279.384	1.777	50	0		CDAARO
Cn1ncnc1CNCC(C)(C)[N@@H+]1CCc2ccccc2C1	ZINC000585140333	342218707	/nfs/dbraw/zinc/21/87/07/342218707.db2.gz	CMEQLQZZEHGFGE-UHFFFAOYSA-N	1	0	299.422	1.742	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cn[nH]c2)C1	ZINC000262653568	362015498	/nfs/dbraw/zinc/01/54/98/362015498.db2.gz	BCYWSHSDIRJCOM-UHTWSYAYSA-N	1	0	262.357	1.591	50	0		CDAARO
Cc1nnc2n1C[C@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1C1CC1)CC2	ZINC000585123197	362052564	/nfs/dbraw/zinc/05/25/64/362052564.db2.gz	MPALWFUWACZIAY-VZLIPTOUSA-N	1	0	260.385	1.926	50	0		CDAARO
Cc1ncnc(N2CC[NH+](C[C@@H]3CCOC3)CC2)c1C	ZINC000097642283	282225253	/nfs/dbraw/zinc/22/52/53/282225253.db2.gz	PKBCVJNFRQQRLD-AWEZNQCLSA-N	1	0	276.384	1.252	50	0		CDAARO
COc1ncc(-c2cc(C)no2)c([C@H]2CCC[NH2+]C2)n1	ZINC000095629437	343654348	/nfs/dbraw/zinc/65/43/48/343654348.db2.gz	VUZWSDBNAQNONL-JTQLQIEISA-N	1	0	274.324	1.916	50	0		CDAARO
Cc1nn(CCNC(=O)C[N@@H+](C)C2CCCC2)c(C)c1C	ZINC000252483613	362384530	/nfs/dbraw/zinc/38/45/30/362384530.db2.gz	FFXGKYFFFIQRET-UHFFFAOYSA-N	1	0	292.427	1.799	50	0		CDAARO
Cn1c(CN2CC(c3ccncc3)C2)nnc1[C@H]1C[C@@H]([NH3+])C1	ZINC000252527579	362392001	/nfs/dbraw/zinc/39/20/01/362392001.db2.gz	CXLAISTWMDVFLG-XBXGTLAGSA-N	1	0	298.394	1.014	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1C(=O)NCCCc1ccco1	ZINC000097805653	530052700	/nfs/dbraw/zinc/05/27/00/530052700.db2.gz	XLQIEEZQAHTLIW-ZDUSSCGKSA-N	1	0	250.342	1.813	50	0		CDAARO
C[C@H](CCc1ccc(O)cc1)NC(=O)c1ccnc(C[NH3+])c1	ZINC000317488410	344958313	/nfs/dbraw/zinc/95/83/13/344958313.db2.gz	ZZVZPJKXELGZER-GFCCVEGCSA-N	1	0	299.374	1.997	50	0		CDAARO
CC[N@H+](CCNC(=O)N1CC[C@@H]([C@@H](C)O)C1)C(C)C	ZINC000097107930	185534925	/nfs/dbraw/zinc/53/49/25/185534925.db2.gz	ZRGZCBUHMRVFJE-CHWSQXEVSA-N	1	0	271.405	1.129	50	0		CDAARO
c1cncc(CCNc2cc(N3CCOCC3)ncn2)c1	ZINC000192272260	362600004	/nfs/dbraw/zinc/60/00/04/362600004.db2.gz	KLQVTWKQDSKIPO-UHFFFAOYSA-N	1	0	285.351	1.363	50	0		CDAARO
Cc1cc(S(=O)(=O)N2CC[C@H]([NH3+])C2)sc1C	ZINC000097234955	185570406	/nfs/dbraw/zinc/57/04/06/185570406.db2.gz	AOJJTGZVJACOEZ-VIFPVBQESA-N	1	0	260.384	1.087	50	0		CDAARO
c1c(-c2nc(-c3ccccc3)no2)nnn1[C@H]1CC[NH2+]C1	ZINC000582468969	346223763	/nfs/dbraw/zinc/22/37/63/346223763.db2.gz	SPPGPJJVEWPNET-NSHDSACASA-N	1	0	282.307	1.530	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@H]1CCC[C@H]1[NH3+]	ZINC000085375779	179044195	/nfs/dbraw/zinc/04/41/95/179044195.db2.gz	CNHBDSSILIVBOA-VHSXEESVSA-N	1	0	253.371	1.537	50	0		CDAARO
Cn1cc([C@H]2OCC[C@@H]2C[NH2+]Cc2ccco2)cn1	ZINC000089755330	347612266	/nfs/dbraw/zinc/61/22/66/347612266.db2.gz	XYQRVOAYRTXDFW-RISCZKNCSA-N	1	0	261.325	1.881	50	0		CDAARO
CCn1ccnc1CN1CCC(c2nnc[nH]2)CC1	ZINC000083444477	348748487	/nfs/dbraw/zinc/74/84/87/348748487.db2.gz	XPJPLHUHBRSWOT-UHFFFAOYSA-N	1	0	260.345	1.401	50	0		CDAARO
C[C@H](c1ccccc1)N(C)[C@H]1CS(=O)(=O)[C@@H]1C	ZINC000101036280	348749491	/nfs/dbraw/zinc/74/94/91/348749491.db2.gz	CZIHGSQIHZLMGD-WZRBSPASSA-N	1	0	253.367	1.865	50	0		CDAARO
c1c(CC[NH2+][C@H]2CN3CCC2CC3)nc2ccccn12	ZINC000584895977	349357236	/nfs/dbraw/zinc/35/72/36/349357236.db2.gz	HXRADYOAMWPOHC-HNNXBMFYSA-N	1	0	270.380	1.561	50	0		CDAARO
O=C(C[NH+]1CCCCCCC1)N1CC[C@@H](CO)C1	ZINC000584896722	349357981	/nfs/dbraw/zinc/35/79/81/349357981.db2.gz	ZAIZJCHOUZACQH-CYBMUJFWSA-N	1	0	254.374	1.093	50	0		CDAARO
CN(Cc1cccc(O)c1)C(=O)CC[NH+]1CCCC1	ZINC000584884387	349342437	/nfs/dbraw/zinc/34/24/37/349342437.db2.gz	RARXNRZXAZZJDW-UHFFFAOYSA-N	1	0	262.353	1.837	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H]1CN(C(=O)c1csc(N)n1)C2	ZINC000584893670	349353515	/nfs/dbraw/zinc/35/35/15/349353515.db2.gz	ZZQKISAANWUYDN-UWVGGRQHSA-N	1	0	280.397	1.112	50	0		CDAARO
CO[C@H]1[C@@H]2CC[C@H]1CN(C(=O)[C@@]1(C)CCC[NH2+]C1)C2	ZINC000584900428	349362456	/nfs/dbraw/zinc/36/24/56/349362456.db2.gz	NAYKBWVXPGZLDU-JLNYLFASSA-N	1	0	266.385	1.260	50	0		CDAARO
O[C@@H]1C[N@@H+](CCCSCc2ccccc2)C[C@@H]1O	ZINC000090551497	180002408	/nfs/dbraw/zinc/00/24/08/180002408.db2.gz	BJYIDEWREWDSSC-OKILXGFUSA-N	1	0	267.394	1.347	50	0		CDAARO
COc1ccc([C@@H](C)[NH2+]C[C@]2(O)CCOC2)c(F)c1	ZINC000090850216	180046461	/nfs/dbraw/zinc/04/64/61/180046461.db2.gz	RXCLZTASSAVEOI-QMTHXVAHSA-N	1	0	269.316	1.636	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2ccc(Cl)cc2O)C[C@@H]1C1CC1	ZINC000091427193	180151731	/nfs/dbraw/zinc/15/17/31/180151731.db2.gz	DTEMMTSVYGVXRE-NEPJUHHUSA-N	1	0	280.755	1.855	50	0		CDAARO
Cc1c2cc(C)ccc2[nH]c1C(=O)N[C@@H]1CC[NH2+]C1	ZINC000091595872	180202579	/nfs/dbraw/zinc/20/25/79/180202579.db2.gz	UPHWDHLXFCRNLB-LLVKDONJSA-N	1	0	257.337	1.876	50	0		CDAARO
O=C1CCC2(CC[NH+](Cc3ccoc3)CC2)CN1CCO	ZINC000091604535	180203588	/nfs/dbraw/zinc/20/35/88/180203588.db2.gz	FPZSOKPAZUTAFJ-UHFFFAOYSA-N	1	0	292.379	1.477	50	0		CDAARO
COc1ccc(C[NH2+]C[C@H]2CN(C)CCO2)c(OC)c1	ZINC000105472145	186059293	/nfs/dbraw/zinc/05/92/93/186059293.db2.gz	IPJSIXVJKMRERR-AWEZNQCLSA-N	1	0	280.368	1.124	50	0		CDAARO
CC[N@@H+]1CCn2nc(CCC(=O)N3CCCC3)cc2C1	ZINC000091915009	180285951	/nfs/dbraw/zinc/28/59/51/180285951.db2.gz	OJFVPXGGMLTFQR-UHFFFAOYSA-N	1	0	276.384	1.274	50	0		CDAARO
Cn1ccnc1CN1C[C@H]2CC[C@H](C[N@H+]2CC2CC2)C1	ZINC000092002104	180304263	/nfs/dbraw/zinc/30/42/63/180304263.db2.gz	XYHSTDKWUGGLJX-LSDHHAIUSA-N	1	0	274.412	1.726	50	0		CDAARO
CN(C)c1ccc(C[N@@H+]2CC[C@@]3(C2)CCCNC3=O)cn1	ZINC000092019761	180307684	/nfs/dbraw/zinc/30/76/84/180307684.db2.gz	PCMNPOGHGDRWGE-MRXNPFEDSA-N	1	0	288.395	1.250	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNc1cc(COC)ncn1	ZINC000092107251	180326271	/nfs/dbraw/zinc/32/62/71/180326271.db2.gz	LAUUUSWGLOZODC-LBPRGKRZSA-N	1	0	250.346	1.519	50	0		CDAARO
CC[C@H]1CN(Cc2c(C)noc2C)CC[N@@H+]1C[C@H](C)O	ZINC000106929183	186152630	/nfs/dbraw/zinc/15/26/30/186152630.db2.gz	OKCAQCOZLIWETM-FZMZJTMJSA-N	1	0	281.400	1.568	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H](O)[C@H]([N@H+](C)Cc2sccc2C)C1	ZINC000107148371	186160830	/nfs/dbraw/zinc/16/08/30/186160830.db2.gz	GTJUCDYXFCFRQE-QJPTWQEYSA-N	1	0	283.393	1.801	50	0		CDAARO
CC[N@@H+]1CCCN(CC(=O)N[C@H](C)c2ccccc2)CC1	ZINC000107496823	186176734	/nfs/dbraw/zinc/17/67/34/186176734.db2.gz	UUSQOZCASFZAPE-OAHLLOKOSA-N	1	0	289.423	1.891	50	0		CDAARO
C[C@H](C(=O)Nc1cnc(N(C)C)nc1)[N@H+]1[C@H](C)CC[C@@H]1C	ZINC000107534486	186177084	/nfs/dbraw/zinc/17/70/84/186177084.db2.gz	PVVAYOZJJOETQU-GRYCIOLGSA-N	1	0	291.399	1.742	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+]C[C@H]2CN(C3CC3)CCO2)C1(C)C	ZINC000108490555	186219842	/nfs/dbraw/zinc/21/98/42/186219842.db2.gz	ANBIQRZGIHBNDM-SOUVJXGZSA-N	1	0	282.428	1.643	50	0		CDAARO
CS[C@@H]1CCC[C@H]1[N@H+](C)CC(=O)NCc1cccnc1	ZINC000110642446	186308900	/nfs/dbraw/zinc/30/89/00/186308900.db2.gz	DWXKTPNKHXATGG-ZIAGYGMSSA-N	1	0	293.436	1.914	50	0		CDAARO
OC1(C[NH2+]Cc2cccc(Cl)c2)CCOCC1	ZINC000112717037	186524458	/nfs/dbraw/zinc/52/44/58/186524458.db2.gz	CFUSOIHSMRXXAU-UHFFFAOYSA-N	1	0	255.745	1.971	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N(C)C[C@@H]2COCCO2)c1C	ZINC000065397734	363042019	/nfs/dbraw/zinc/04/20/19/363042019.db2.gz	LWBCBHDVVICRCV-GFCCVEGCSA-N	1	0	280.372	1.011	50	0		CDAARO
CC(C)[C@H]([NH2+]Cc1cnc(N(C)C)nc1)C(C)(C)O	ZINC000276654798	366094167	/nfs/dbraw/zinc/09/41/67/366094167.db2.gz	UUNNAFYRJYSCAX-LBPRGKRZSA-N	1	0	266.389	1.428	50	0		CDAARO
COc1ccc([C@@H]2CC(=O)N(CCC[NH+](C)C)C2)cc1	ZINC000000211535	355896493	/nfs/dbraw/zinc/89/64/93/355896493.db2.gz	LGKBMODMSHIDTB-CQSZACIVSA-N	1	0	276.380	1.963	50	0		CDAARO
C[N@@H+]1CCC[C@H](OC(=O)COc2ccc(F)cc2)C1	ZINC000000249841	355899189	/nfs/dbraw/zinc/89/91/89/355899189.db2.gz	JJVMNOUACCFPSQ-ZDUSSCGKSA-N	1	0	267.300	1.842	50	0		CDAARO
COc1ccc(CCN2C[C@H]([NH2+]CC3CC3)CC2=O)cc1	ZINC000011879737	356281459	/nfs/dbraw/zinc/28/14/59/356281459.db2.gz	DXGXZYYBKMIEMC-OAHLLOKOSA-N	1	0	288.391	1.838	50	0		CDAARO
COCCNC(=O)NC[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000193921573	358501385	/nfs/dbraw/zinc/50/13/85/358501385.db2.gz	IDLKNFJVJNTPJG-OAHLLOKOSA-N	1	0	291.395	1.454	50	0		CDAARO
O=C1N(Cc2ccc(F)cc2)CCC[C@@]1(O)C[NH2+]C1CC1	ZINC000012592915	356310585	/nfs/dbraw/zinc/31/05/85/356310585.db2.gz	QLKLEGCSOGXXER-MRXNPFEDSA-N	1	0	292.354	1.431	50	0		CDAARO
CC[NH+]1CCC(NC(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000013326597	356344210	/nfs/dbraw/zinc/34/42/10/356344210.db2.gz	WOBWMSKFESCPGE-UHFFFAOYSA-N	1	0	290.363	1.672	50	0		CDAARO
COc1ccccc1C[NH2+]CCCN1CCCC1=O	ZINC000013727519	356354952	/nfs/dbraw/zinc/35/49/52/356354952.db2.gz	KZEOLPMQVJNFTN-UHFFFAOYSA-N	1	0	262.353	1.797	50	0		CDAARO
C[NH+]1CCC(NC(=O)c2ccc3c(c2)OCO3)CC1	ZINC000016603191	356442980	/nfs/dbraw/zinc/44/29/80/356442980.db2.gz	SUSANNMMKDUXET-UHFFFAOYSA-N	1	0	262.309	1.239	50	0		CDAARO
CC[NH+]1CCN(CCC(=O)Nc2ccccc2F)CC1	ZINC000019528188	356490783	/nfs/dbraw/zinc/49/07/83/356490783.db2.gz	FHDZXFVFFKRWTJ-UHFFFAOYSA-N	1	0	279.359	1.792	50	0		CDAARO
COc1cccc(OCCCN2CC[NH2+]CC2)c1	ZINC000019728646	356498483	/nfs/dbraw/zinc/49/84/83/356498483.db2.gz	BUHJPPXYZRKQBL-UHFFFAOYSA-N	1	0	250.342	1.369	50	0		CDAARO
CC1(C)CC(N2CCOCC2)=CC(=[N+]2CCOCC2)C1	ZINC000019809771	356506528	/nfs/dbraw/zinc/50/65/28/356506528.db2.gz	GIJYIOLGBVKZFU-UHFFFAOYSA-N	1	0	279.404	1.506	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COC2CCCCC2)CC1	ZINC000023114603	356628836	/nfs/dbraw/zinc/62/88/36/356628836.db2.gz	IWNOILKQPFIRQQ-CQSZACIVSA-N	1	0	270.417	1.334	50	0		CDAARO
[NH3+]C[C@@H]1CCN(Cc2coc3ccccc3c2=O)C1	ZINC000426382627	358508336	/nfs/dbraw/zinc/50/83/36/358508336.db2.gz	IENRKQRBKYHRGW-NSHDSACASA-N	1	0	258.321	1.574	50	0		CDAARO
C[C@H](C(=O)NC[C@@H]1COc2ccccc2O1)[NH+]1CCCC1	ZINC000028286245	356719083	/nfs/dbraw/zinc/71/90/83/356719083.db2.gz	UITYIZHPSJIEGD-CHWSQXEVSA-N	1	0	290.363	1.427	50	0		CDAARO
CC[N@H+](CCO)CC(=O)NCC1(c2ccccc2)CC1	ZINC000029841036	356744156	/nfs/dbraw/zinc/74/41/56/356744156.db2.gz	XWNCJKOJLKSFNH-UHFFFAOYSA-N	1	0	276.380	1.149	50	0		CDAARO
O=c1ccc(-c2ccccc2)nn1CC1CC[NH2+]CC1	ZINC000041630838	357043338	/nfs/dbraw/zinc/04/33/38/357043338.db2.gz	VRYPVCLQHHAILH-UHFFFAOYSA-N	1	0	269.348	1.910	50	0		CDAARO
CN(Cc1ccccc1)C(=O)c1[nH]nc2c1C[NH2+]CC2	ZINC000042783809	357080337	/nfs/dbraw/zinc/08/03/37/357080337.db2.gz	NHOLSAKPTSMESF-UHFFFAOYSA-N	1	0	270.336	1.328	50	0		CDAARO
CC(=O)N1CCC(CC[NH+]2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000095408760	357211006	/nfs/dbraw/zinc/21/10/06/357211006.db2.gz	OQFQHMCFCTWVLX-STQMWFEESA-N	1	0	268.401	1.744	50	0		CDAARO
COc1cc(C[NH3+])ccc1OCC1CCOCC1	ZINC000052170983	357269728	/nfs/dbraw/zinc/26/97/28/357269728.db2.gz	SKIKLRQQGGALAM-UHFFFAOYSA-N	1	0	251.326	1.959	50	0		CDAARO
CCCSc1ncc(C[NH2+]CCNC(C)=O)cn1	ZINC000055098772	357328388	/nfs/dbraw/zinc/32/83/88/357328388.db2.gz	QSUFFPADIDRMJC-UHFFFAOYSA-N	1	0	268.386	1.204	50	0		CDAARO
[NH3+]C[C@@H](CO)Cc1cc(Br)ccc1F	ZINC000063065165	357502512	/nfs/dbraw/zinc/50/25/12/357502512.db2.gz	FXMFLRPYJWJVET-ZETCQYMHSA-N	1	0	262.122	1.698	50	0		CDAARO
Cc1cccc([C@@H](C(=O)N2C[C@H]3CC[C@@H](C2)[NH2+]3)N(C)C)c1	ZINC000065375380	357533454	/nfs/dbraw/zinc/53/34/54/357533454.db2.gz	YMXMKVQFRRYDOY-XHSDSOJGSA-N	1	0	287.407	1.561	50	0		CDAARO
Cc1ccc([C@@H]([NH2+]C(CO)CO)c2ccncc2)cc1	ZINC000065383608	357534700	/nfs/dbraw/zinc/53/47/00/357534700.db2.gz	RJUQXWVYOYYWBT-MRXNPFEDSA-N	1	0	272.348	1.422	50	0		CDAARO
CC(=O)c1cc(CC(=O)N2CC[C@@H](C[NH3+])C2)cs1	ZINC000067784250	357625928	/nfs/dbraw/zinc/62/59/28/357625928.db2.gz	SWRRTVNDJZQPJZ-JTQLQIEISA-N	1	0	266.366	1.300	50	0		CDAARO
Cc1nc(CC[NH3+])cc(N(C)Cc2nncn2C(C)C)n1	ZINC000067540182	357611919	/nfs/dbraw/zinc/61/19/19/357611919.db2.gz	NBNUREKCINROSQ-UHFFFAOYSA-N	1	0	289.387	1.095	50	0		CDAARO
Cc1nonc1[C@@H]1CCCN1c1cc(CC[NH3+])nc(C)n1	ZINC000067691148	357619307	/nfs/dbraw/zinc/61/93/07/357619307.db2.gz	BLURMRHVLROWLO-LBPRGKRZSA-N	1	0	288.355	1.319	50	0		CDAARO
C[C@@H](NC(=O)C[NH+]1CCCCCCC1)c1nncn1C	ZINC000067851498	357632294	/nfs/dbraw/zinc/63/22/94/357632294.db2.gz	ZQADJXCMIUKAPV-GFCCVEGCSA-N	1	0	279.388	1.258	50	0		CDAARO
CCNC(=O)COc1ccc(C[NH2+][C@@H](C)[C@H](C)OC)cc1	ZINC000097104846	357968243	/nfs/dbraw/zinc/96/82/43/357968243.db2.gz	JZQATCPDCJMISS-STQMWFEESA-N	1	0	294.395	1.715	50	0		CDAARO
Cc1ccc(C)c(OC[C@@H](O)CN2CC[NH+](C)CC2)c1	ZINC000019790779	358142406	/nfs/dbraw/zinc/14/24/06/358142406.db2.gz	OXAYFJBTRHHFMY-HNNXBMFYSA-N	1	0	278.396	1.291	50	0		CDAARO
Cc1noc2nc(C)cc(C(=O)NC[C@@H]3C[C@H](F)C[NH2+]3)c12	ZINC000082109582	358147761	/nfs/dbraw/zinc/14/77/61/358147761.db2.gz	BFPTYFVJXHNTKI-UWVGGRQHSA-N	1	0	292.314	1.269	50	0		CDAARO
C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)NS(=O)(=O)c1cccnc1	ZINC000195574174	358567271	/nfs/dbraw/zinc/56/72/71/358567271.db2.gz	ZHHNCXTZCOTKBL-OLZOCXBDSA-N	1	0	297.424	1.480	50	0		CDAARO
CCc1cc(N2CCc3nc[nH]c3C2)nc(N2CCCC2)[nH+]1	ZINC000095352409	358682678	/nfs/dbraw/zinc/68/26/78/358682678.db2.gz	DFJBKRRLFITYLR-UHFFFAOYSA-N	1	0	298.394	1.925	50	0		CDAARO
CCc1nnc(N2CC[NH+](C3Cc4ccccc4C3)CC2)o1	ZINC000095359441	358684711	/nfs/dbraw/zinc/68/47/11/358684711.db2.gz	AQCJQRRNXVKIGY-UHFFFAOYSA-N	1	0	298.390	1.921	50	0		CDAARO
Cc1c[nH]c(CN(C)C(=O)C2CC[NH+](C(C)C)CC2)n1	ZINC000095364330	358685757	/nfs/dbraw/zinc/68/57/57/358685757.db2.gz	DCIGZIUFRSBEBC-UHFFFAOYSA-N	1	0	278.400	1.797	50	0		CDAARO
CCn1ccnc1C1CCN(C(=O)[C@H]2CC[N@H+](C)C2)CC1	ZINC000097775454	358798000	/nfs/dbraw/zinc/79/80/00/358798000.db2.gz	GSFXEYFTSOGJQV-AWEZNQCLSA-N	1	0	290.411	1.561	50	0		CDAARO
O=C(C[C@@H]1CCc2ccccc21)N1C[C@H]2C[NH2+]C[C@H]2C1	ZINC000097823497	358801425	/nfs/dbraw/zinc/80/14/25/358801425.db2.gz	SHDZTQIOVWDXAU-SOUVJXGZSA-N	1	0	270.376	1.784	50	0		CDAARO
CCNc1ncc(CN2CCN(c3cc[nH+]cc3)CC2)cn1	ZINC000214962553	358865528	/nfs/dbraw/zinc/86/55/28/358865528.db2.gz	SUXBGFCFCGCVRN-UHFFFAOYSA-N	1	0	298.394	1.626	50	0		CDAARO
CSc1ccccc1C[N@H+]1C[C@@H]2C[C@H](O)[C@@H](O)C[C@@H]2C1	ZINC000215966113	358912676	/nfs/dbraw/zinc/91/26/76/358912676.db2.gz	JUMVIKSFXCNVOC-XGUBFFRZSA-N	1	0	293.432	1.972	50	0		CDAARO
CS[C@@H](C)CC[NH+]1CCN(c2cnccn2)CC1	ZINC000215543014	358894217	/nfs/dbraw/zinc/89/42/17/358894217.db2.gz	XLVZVMGFQUWEOW-LBPRGKRZSA-N	1	0	266.414	1.740	50	0		CDAARO
Cc1n[nH]c(C)c1C[N@H+]1CCC[C@@]2(CN(C)C(=O)O2)CC1	ZINC000215714051	358900174	/nfs/dbraw/zinc/90/01/74/358900174.db2.gz	HGKFPKNAWPUNPX-HNNXBMFYSA-N	1	0	292.383	1.833	50	0		CDAARO
O=C(O[C@H]1C[NH+]2CCC1CC2)[C@@H]1COc2ccccc2O1	ZINC000000108978	359097018	/nfs/dbraw/zinc/09/70/18/359097018.db2.gz	MUWXMGFHWUUUDA-GJZGRUSLSA-N	1	0	289.331	1.464	50	0		CDAARO
CCOCCC(=O)N1CCN(c2cc[nH+]cc2C)CC1	ZINC000220337613	359165843	/nfs/dbraw/zinc/16/58/43/359165843.db2.gz	RAIWJEDJDFUHMH-UHFFFAOYSA-N	1	0	277.368	1.465	50	0		CDAARO
OC[C@H](O)c1cc2n(n1)CCC[N@@H+](C1CCCC1)C2	ZINC000221360141	359241142	/nfs/dbraw/zinc/24/11/42/359241142.db2.gz	KFXXMBMZJOWOIB-AWEZNQCLSA-N	1	0	265.357	1.057	50	0		CDAARO
CCO[C@H]1C[N@H+](Cc2c[nH]nc2-c2ccccc2)C[C@@H]1O	ZINC000223596377	359437467	/nfs/dbraw/zinc/43/74/67/359437467.db2.gz	FRSIKCFJEDLAGW-GJZGRUSLSA-N	1	0	287.363	1.658	50	0		CDAARO
O=C(c1ccoc1)N1CCC[C@H](C[NH+]2CCOCC2)CC1	ZINC000257184105	359501826	/nfs/dbraw/zinc/50/18/26/359501826.db2.gz	TXOQUZWWPGDSOL-AWEZNQCLSA-N	1	0	292.379	1.854	50	0		CDAARO
CCOC(=O)c1ccc(C[NH2+][C@H]2CCO[C@H]2C)o1	ZINC000095988516	359709718	/nfs/dbraw/zinc/70/97/18/359709718.db2.gz	DHIMOWMCXLTHOJ-ONGXEEELSA-N	1	0	253.298	1.723	50	0		CDAARO
CC(C)[C@H]([NH2+]CC(=O)NC1CC1)[C@H](O)c1ccccc1	ZINC000408516362	359899295	/nfs/dbraw/zinc/89/92/95/359899295.db2.gz	NCTBCRZQRYTQCU-JKSUJKDBSA-N	1	0	276.380	1.613	50	0		CDAARO
C[C@@H]1CCCN(C(=O)COc2cccc(F)c2)[C@@H]1C[NH3+]	ZINC000408519271	359911878	/nfs/dbraw/zinc/91/18/78/359911878.db2.gz	YUGBOCYKIZGLCF-BXUZGUMPSA-N	1	0	280.343	1.790	50	0		CDAARO
COc1ccc(C)cc1CCNC1=[NH+]CCCCN1	ZINC000521396971	359970569	/nfs/dbraw/zinc/97/05/69/359970569.db2.gz	ZBNGUJGKYIYQJQ-UHFFFAOYSA-N	1	0	261.369	1.875	50	0		CDAARO
Cc1ccccc1[C@@H](C)[NH2+]C[C@@H](O)CN1CCCC1=O	ZINC000089515074	360095269	/nfs/dbraw/zinc/09/52/69/360095269.db2.gz	NVHDEYIQPJKXHY-ZIAGYGMSSA-N	1	0	276.380	1.629	50	0		CDAARO
[NH3+]Cc1cc(I)ccc1F	ZINC000036533750	283527391	/nfs/dbraw/zinc/52/73/91/283527391.db2.gz	CBVLPPDEQWTZHI-UHFFFAOYSA-N	1	0	251.042	1.889	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@H]1CCN(C(=O)c2cnc(C)cn2)C1	ZINC000409421080	360230320	/nfs/dbraw/zinc/23/03/20/360230320.db2.gz	FIWWEODJIDBGHP-ZDUSSCGKSA-N	1	0	285.351	1.686	50	0		CDAARO
O=C(c1cccnc1N1CCCCC1)N1CCC[NH2+]CC1	ZINC000238170929	360246558	/nfs/dbraw/zinc/24/65/58/360246558.db2.gz	JWVNTQVZTIVWCD-UHFFFAOYSA-N	1	0	288.395	1.507	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)N1C[C@@H](C)O[C@H](C)C1)[C@@H](C)n1cccn1	ZINC000248245022	360472384	/nfs/dbraw/zinc/47/23/84/360472384.db2.gz	QADKZEOOKQKYHJ-AAVRWANBSA-N	1	0	294.399	1.058	50	0		CDAARO
Cn1c(C[NH3+])nnc1SCCC(F)(F)C(F)F	ZINC000426550064	360683442	/nfs/dbraw/zinc/68/34/42/360683442.db2.gz	PVKBARLMCSEQCX-UHFFFAOYSA-N	1	0	272.271	1.656	50	0		CDAARO
Cc1ncn(CCNC(=O)C[C@H]2CCCC[N@H+]2C)c1C	ZINC000426388110	360662618	/nfs/dbraw/zinc/66/26/18/360662618.db2.gz	DJIBSRQVDVSMCS-CQSZACIVSA-N	1	0	278.400	1.491	50	0		CDAARO
Cc1c(C(=O)N2CC[C@@H](C[NH3+])C2)cnn1C(C)(C)C	ZINC000178516994	189123292	/nfs/dbraw/zinc/12/32/92/189123292.db2.gz	DCQUXJPWHDUDMD-NSHDSACASA-N	1	0	264.373	1.367	50	0		CDAARO
O=C(Cn1ccc([C@@H]2CCC[NH2+]C2)n1)NCC(F)(F)F	ZINC000426465106	360673318	/nfs/dbraw/zinc/67/33/18/360673318.db2.gz	FTKRVOBSQULSOG-SECBINFHSA-N	1	0	290.289	1.029	50	0		CDAARO
COc1ccc(Cl)c(S(=O)(=O)NCC[C@H](C)[NH3+])c1	ZINC000178911251	189153950	/nfs/dbraw/zinc/15/39/50/189153950.db2.gz	NEBHJSLBBAYALA-QMMMGPOBSA-N	1	0	292.788	1.364	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C/C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179111037	189170739	/nfs/dbraw/zinc/17/07/39/189170739.db2.gz	BOKLMCMFAPPSGU-YEZKRMTDSA-N	1	0	282.775	1.215	50	0		CDAARO
O=C(c1cccs1)N1CC[C@@H]2[NH2+]CCC[C@@H]2C1	ZINC000299757083	200859549	/nfs/dbraw/zinc/85/95/49/200859549.db2.gz	MISAGURWIUMJSI-MNOVXSKESA-N	1	0	250.367	1.962	50	0		CDAARO
CCCC(=O)Nc1cccc(NC(=O)N2CC[C@@H]([NH3+])C2)c1	ZINC000299772625	200867054	/nfs/dbraw/zinc/86/70/54/200867054.db2.gz	AMRGVTXLWSDGCD-LLVKDONJSA-N	1	0	290.367	1.990	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)COCC(F)(F)F	ZINC000248150752	361285922	/nfs/dbraw/zinc/28/59/22/361285922.db2.gz	UBFZDVWMGFEZKJ-GHMZBOCLSA-N	1	0	294.317	1.651	50	0		CDAARO
CC(C)(C)CC[NH2+]CCS(=O)(=O)N1CCSCC1	ZINC000187840762	364839758	/nfs/dbraw/zinc/83/97/58/364839758.db2.gz	SCLIOTZIZMPRKC-UHFFFAOYSA-N	1	0	294.486	1.391	50	0		CDAARO
C[C@H](O)[C@H]1CC[N@@H+]([C@H]2CCN(c3ccccc3)C2=O)C1	ZINC000272578956	365302661	/nfs/dbraw/zinc/30/26/61/365302661.db2.gz	NYTFMPULJCINSJ-YDHLFZDLSA-N	1	0	274.364	1.495	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1CC(=O)NCCc1ccc(F)cc1	ZINC000089939044	366973063	/nfs/dbraw/zinc/97/30/63/366973063.db2.gz	SSELNAYRTBOBLY-CYBMUJFWSA-N	1	0	293.386	1.120	50	0		CDAARO
CCNC(=O)NC(=O)[C@H](C)[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000007590493	367285861	/nfs/dbraw/zinc/28/58/61/367285861.db2.gz	VOMLNBIKGLAHPU-RWMBFGLXSA-N	1	0	281.400	1.733	50	0		CDAARO
Cc1ccc(F)c(C(=O)N[C@H]2CC[NH2+]C[C@@H]2C)c1	ZINC000094345080	367413727	/nfs/dbraw/zinc/41/37/27/367413727.db2.gz	OMDOBBGSSMZZIT-GWCFXTLKSA-N	1	0	250.317	1.862	50	0		CDAARO
O=C([C@@H]1C[C@@H](O)C[NH2+]1)N1CC2(CCCC2)c2ccccc21	ZINC000252519017	367745626	/nfs/dbraw/zinc/74/56/26/367745626.db2.gz	AQXGWCXECJTIAE-OCCSQVGLSA-N	1	0	286.375	1.568	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNC(=O)c1cccc(=O)[nH]1	ZINC000282439763	367886277	/nfs/dbraw/zinc/88/62/77/367886277.db2.gz	IIMIPBJOSJLLOA-LLVKDONJSA-N	1	0	263.341	1.391	50	0		CDAARO
Cn1cc(C[NH2+]C[C@@H]2CCN(CC(F)(F)F)C2)cn1	ZINC000037648455	369521623	/nfs/dbraw/zinc/52/16/23/369521623.db2.gz	JMJLLXGIYHXKFZ-JTQLQIEISA-N	1	0	276.306	1.394	50	0		CDAARO
Cc1cccc2nc(C[NH+]3CCCCC3)cc(=O)n12	ZINC000025784960	371317351	/nfs/dbraw/zinc/31/73/51/371317351.db2.gz	CGDXGCLSZDAQES-UHFFFAOYSA-N	1	0	257.337	1.989	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(S(=O)(=O)CC2CCCC2)C1	ZINC000177748609	372118636	/nfs/dbraw/zinc/11/86/36/372118636.db2.gz	JYPWORPOMPSMHV-ZDUSSCGKSA-N	1	0	274.430	1.532	50	0		CDAARO
CN(C)C(=O)c1cccc(CNC(=O)[C@@H]2CCC[N@@H+]2C)c1	ZINC000299613264	372682012	/nfs/dbraw/zinc/68/20/12/372682012.db2.gz	ZCQLAQZQYOSEPY-AWEZNQCLSA-N	1	0	289.379	1.099	50	0		CDAARO
CO[C@]12CC[N@H+](Cc3cc(C)no3)[C@H]1C[C@@H](O)CC2	ZINC000299785496	372762448	/nfs/dbraw/zinc/76/24/48/372762448.db2.gz	SISPVXZRWFMICI-FPMFFAJLSA-N	1	0	266.341	1.487	50	0		CDAARO
Cc1c[nH]cc1C(=O)N1CCC[C@]2(CC[N@@H+](C)C2)C1	ZINC000581126005	372839471	/nfs/dbraw/zinc/83/94/71/372839471.db2.gz	RFTYOZBXWHIOGE-OAHLLOKOSA-N	1	0	261.369	1.881	50	0		CDAARO
Cc1cc(F)ccc1C(=O)N1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1	ZINC000241157324	189904023	/nfs/dbraw/zinc/90/40/23/189904023.db2.gz	JWVBMWDVCFRWJD-BPNCWPANSA-N	1	0	262.328	1.943	50	0		CDAARO
Cc1ncn(CCNC(=O)Cc2cccnc2)c1C	ZINC000670450043	483011300	/nfs/dbraw/zinc/01/13/00/483011300.db2.gz	DZDBSXLFOJBVHM-UHFFFAOYSA-N	1	0	258.325	1.254	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1C(=O)N[C@H]1C[C@H](CO)c2ccccc21	ZINC000253370972	373678995	/nfs/dbraw/zinc/67/89/95/373678995.db2.gz	YXNNMLJUGQECKL-BYCMXARLSA-N	1	0	274.364	1.418	50	0		CDAARO
Cc1noc([C@@H]2C[N@H+](Cc3ccccc3F)C[C@H]2CO)n1	ZINC000253414552	373722756	/nfs/dbraw/zinc/72/27/56/373722756.db2.gz	XTRNALYFJHKHTD-QWHCGFSZSA-N	1	0	291.326	1.725	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@]1(C)CCC[NH2+]C1	ZINC000111668793	374198701	/nfs/dbraw/zinc/19/87/01/374198701.db2.gz	BPPDUOHFXXCSPI-CYBMUJFWSA-N	1	0	267.398	1.800	50	0		CDAARO
O=C(CN1CCC[N@H+](CC2CC2)CC1)N1CCCC1	ZINC000095418500	374919240	/nfs/dbraw/zinc/91/92/40/374919240.db2.gz	FNGCYOFMOXEUKR-UHFFFAOYSA-N	1	0	265.401	1.027	50	0		CDAARO
C[C@H](CCc1cccc(F)c1)[NH2+]C[C@H]1CN(C)CCN1C	ZINC000095422306	374923855	/nfs/dbraw/zinc/92/38/55/374923855.db2.gz	WOMKCFSAAIHWEW-PBHICJAKSA-N	1	0	293.430	1.982	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1n[nH]c2c1CCC2	ZINC000095472583	374966271	/nfs/dbraw/zinc/96/62/71/374966271.db2.gz	PQMVPYQZRGYUOI-SNVBAGLBSA-N	1	0	262.357	1.113	50	0		CDAARO
CSc1ccc(NC[C@H]2C[N@H+](CC(C)C)CCO2)nn1	ZINC000095407715	374911466	/nfs/dbraw/zinc/91/14/66/374911466.db2.gz	POKDPNIIVFAWOY-LBPRGKRZSA-N	1	0	296.440	1.967	50	0		CDAARO
Nc1cccc2c1CCCN2C(=O)CC1([NH3+])CCC1	ZINC000095976743	375046745	/nfs/dbraw/zinc/04/67/45/375046745.db2.gz	NQRXDGHNRASLGO-UHFFFAOYSA-N	1	0	259.353	1.820	50	0		CDAARO
CSc1cc(NC(=O)NCC[NH+](C)C)ccn1	ZINC000096000226	375050309	/nfs/dbraw/zinc/05/03/09/375050309.db2.gz	YIPWEMZTUNWIKK-UHFFFAOYSA-N	1	0	254.359	1.487	50	0		CDAARO
C[C@@H](CCc1cccc(F)c1)[N@@H+]1C[C@@H](C)O[C@H](C(N)=O)C1	ZINC000097084479	375145106	/nfs/dbraw/zinc/14/51/06/375145106.db2.gz	HXTRVNDAGZZWNV-ZOWXZIJZSA-N	1	0	294.370	1.721	50	0		CDAARO
CC(C)[C@@H](Oc1ccc(F)cc1F)C(=O)N1CC[C@@H]([NH3+])C1	ZINC000299738954	375199575	/nfs/dbraw/zinc/19/95/75/375199575.db2.gz	ITXMYRGMCPTXMT-BXUZGUMPSA-N	1	0	298.333	1.928	50	0		CDAARO
Cc1nnc(CN(C)C(=O)[C@@H]2C[C@@H]3CCCC[C@H]3[NH2+]2)n1C	ZINC000299740174	375201474	/nfs/dbraw/zinc/20/14/74/375201474.db2.gz	WPIWLVYMQBTBNG-XQQFMLRXSA-N	1	0	291.399	1.003	50	0		CDAARO
COc1ccc(C)cc1/C=C\C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000493482509	375458422	/nfs/dbraw/zinc/45/84/22/375458422.db2.gz	JEMGXIUGYSJOBG-VSKVDJIOSA-N	1	0	274.364	1.837	50	0		CDAARO
NC(=O)c1ccc(/C=C\C(=O)N2CCCC[C@H]2C[NH3+])cc1	ZINC000493315503	375442699	/nfs/dbraw/zinc/44/26/99/375442699.db2.gz	CRFZZMRVAOSYSF-PIZKADEWSA-N	1	0	287.363	1.139	50	0		CDAARO
Cc1nc(/C=C\C(=O)N2C[C@H](C)[NH2+][C@@H](C)C2)cs1	ZINC000606441625	375823565	/nfs/dbraw/zinc/82/35/65/375823565.db2.gz	BNRYCODFTCGOGV-NDVXOHMPSA-N	1	0	265.382	1.674	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CC[C@H]([NH3+])C2)cc1F	ZINC000606441037	375822100	/nfs/dbraw/zinc/82/21/00/375822100.db2.gz	AFJHPTCAIMMPBA-MZBZXASESA-N	1	0	264.300	1.407	50	0		CDAARO
[NH3+]C[C@]1(O)CCN(C(=O)OCc2ccccc2)C[C@@H]1F	ZINC000261508914	190040636	/nfs/dbraw/zinc/04/06/36/190040636.db2.gz	YGOVYAMIHUJJDA-GXTWGEPZSA-N	1	0	282.315	1.057	50	0		CDAARO
CC[C@H]1CN(S(C)(=O)=O)CC[C@H]1[NH2+]Cc1cccnc1	ZINC000241719835	376019754	/nfs/dbraw/zinc/01/97/54/376019754.db2.gz	QQAFSBPWIABEJM-UONOGXRCSA-N	1	0	297.424	1.231	50	0		CDAARO
COc1ccc(C[N@H+](C)CCc2nnc(N)s2)cc1F	ZINC000089346520	377835709	/nfs/dbraw/zinc/83/57/09/377835709.db2.gz	MYXJTLKPMASZQY-UHFFFAOYSA-N	1	0	296.371	1.943	50	0		CDAARO
C[C@@H]1CCC(=O)N1CC(=O)NCC[NH+]1[C@@H](C)CCC[C@@H]1C	ZINC000040511632	296300370	/nfs/dbraw/zinc/30/03/70/296300370.db2.gz	SRENKLLCHKVTEE-MELADBBJSA-N	1	0	295.427	1.376	50	0		CDAARO
CCCCNC(=O)[C@H](C)[NH+]1CCC(C2N=NC(=O)O2)CC1	ZINC000450916620	390576626	/nfs/dbraw/zinc/57/66/26/390576626.db2.gz	VZTLHPOQUQKASF-JTQLQIEISA-N	1	0	296.371	1.259	50	0		CDAARO
CC(C)(C)OC(=O)N1CCCC[C@@H]1C1(O)C[NH2+]C1	ZINC000090411625	390884351	/nfs/dbraw/zinc/88/43/51/390884351.db2.gz	DBXFIYLGJDPVHA-SNVBAGLBSA-N	1	0	256.346	1.110	50	0		CDAARO
CO[C@H](C)C(=O)NC[C@@H](C1CCCCC1)[NH+](C)C	ZINC000089478448	391025770	/nfs/dbraw/zinc/02/57/70/391025770.db2.gz	WHJNOKYBUFZXHM-YPMHNXCESA-N	1	0	256.390	1.648	50	0		CDAARO
[NH3+][C@H]1CCOc2c(Br)cccc2[C@H]1O	ZINC000062626551	390968750	/nfs/dbraw/zinc/96/87/50/390968750.db2.gz	VDUBMHPWJFWWTE-DTWKUNHWSA-N	1	0	258.115	1.592	50	0		CDAARO
CCCC[C@H]([NH2+][C@H]1CCN(C(=O)CC)C[C@H]1C)C(N)=O	ZINC000240555653	391328293	/nfs/dbraw/zinc/32/82/93/391328293.db2.gz	GWXLRQAGFHGNNW-AGIUHOORSA-N	1	0	283.416	1.267	50	0		CDAARO
CCC(CC)[C@@H](O)CNC(=O)C[N@@H+]1CCC[C@@H]1C	ZINC000089943102	392522351	/nfs/dbraw/zinc/52/23/51/392522351.db2.gz	ALHFOLYQTHYDHP-AAEUAGOBSA-N	1	0	256.390	1.384	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)NCCOc1ccccc1F	ZINC000269053070	132104565	/nfs/dbraw/zinc/10/45/65/132104565.db2.gz	QVIFTUCQNVTBDS-NSHDSACASA-N	1	0	286.372	1.401	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC[C@H](C)[NH3+])cc1Cl	ZINC000195300168	393163625	/nfs/dbraw/zinc/16/36/25/393163625.db2.gz	VOMWSNCMSZLAPC-QMMMGPOBSA-N	1	0	262.762	1.274	50	0		CDAARO
CC[C@H](O)CN1C[C@@H](CC)[N@H+](CC(C)(C)O)C[C@@H]1CC	ZINC000252500413	393381967	/nfs/dbraw/zinc/38/19/67/393381967.db2.gz	SVBXLJRYOZVQCU-ZNMIVQPWSA-N	1	0	286.460	1.703	50	0		CDAARO
CSc1nc2c(cnn2CC[NH3+])c(N2CCCCC2)n1	ZINC000026421746	134748276	/nfs/dbraw/zinc/74/82/76/134748276.db2.gz	YNWFRLFWTYWGQZ-UHFFFAOYSA-N	1	0	292.412	1.497	50	0		CDAARO
CCc1cc(=O)[nH]c(CN2C[C@@H](c3ccccc3)[C@H]([NH3+])C2)n1	ZINC000261613415	140363657	/nfs/dbraw/zinc/36/36/57/140363657.db2.gz	CEPUEHFUAWYVIX-LSDHHAIUSA-N	1	0	298.390	1.671	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1cc(=O)[nH]c2ccccc21	ZINC000004809894	170020567	/nfs/dbraw/zinc/02/05/67/170020567.db2.gz	KDFVIAUORAJGAK-UHFFFAOYSA-N	1	0	287.363	1.600	50	0		CDAARO
O=C(COc1ccccc1F)OCC[NH+]1CCCC1	ZINC000004950524	170044899	/nfs/dbraw/zinc/04/48/99/170044899.db2.gz	UEVDMKFLKMYWAF-UHFFFAOYSA-N	1	0	267.300	1.844	50	0		CDAARO
C[NH+](C)CCCNS(=O)(=O)c1ccc(F)c(F)c1	ZINC000005659102	170124619	/nfs/dbraw/zinc/12/46/19/170124619.db2.gz	UIQDHTUKJRYNST-UHFFFAOYSA-N	1	0	278.324	1.195	50	0		CDAARO
Nc1cc(N)[nH+]c(SCC(=O)c2cccs2)n1	ZINC000006533382	170211115	/nfs/dbraw/zinc/21/11/15/170211115.db2.gz	QMPLSSPNPXWLAT-UHFFFAOYSA-N	1	0	266.351	1.678	50	0		CDAARO
CC(C)=CCC/C(C)=C/C[NH2+]C[C@H](O)CN1CCOCC1	ZINC000006651167	170222325	/nfs/dbraw/zinc/22/23/25/170222325.db2.gz	YDVLBLYSTSGULM-BNSMALCHSA-N	1	0	296.455	1.962	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)cc1C	ZINC000006667529	170224028	/nfs/dbraw/zinc/22/40/28/170224028.db2.gz	KMVYGYZLCYJKNI-ZDUSSCGKSA-N	1	0	262.353	1.701	50	0		CDAARO
CC[C@@H](CO)[NH2+]Cc1cc(OC)c(OC)c(OC)c1	ZINC000006702953	170230281	/nfs/dbraw/zinc/23/02/81/170230281.db2.gz	WSGWOFSWORQFQN-NSHDSACASA-N	1	0	269.341	1.573	50	0		CDAARO
Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)N2CCNC2=O)cc1	ZINC000006995916	170260898	/nfs/dbraw/zinc/26/08/98/170260898.db2.gz	VUYOTEKAIFNYCD-GFCCVEGCSA-N	1	0	275.352	1.367	50	0		CDAARO
CC1(C)CC(NC(=S)NC[C@@H]2CCCO2)CC(C)(C)[NH2+]1	ZINC000007570373	170290832	/nfs/dbraw/zinc/29/08/32/170290832.db2.gz	HIIQROULIDWTEP-LBPRGKRZSA-N	1	0	299.484	1.939	50	0		CDAARO
C[C@H](C(=O)Nc1ccccc1)[N@@H+]1CCC[C@H](C(N)=O)C1	ZINC000008171628	170322933	/nfs/dbraw/zinc/32/29/33/170322933.db2.gz	ROPNVYRSPYBUGY-NEPJUHHUSA-N	1	0	275.352	1.211	50	0		CDAARO
COc1ccc(C[NH2+]C[C@@H](C)O)c(OC)c1OC	ZINC000008535085	170339076	/nfs/dbraw/zinc/33/90/76/170339076.db2.gz	FLBKNWGFRDZFFX-SECBINFHSA-N	1	0	255.314	1.183	50	0		CDAARO
COc1ccc(Cl)cc1C[n+]1cccc(C(N)=O)c1	ZINC000015454978	170667857	/nfs/dbraw/zinc/66/78/57/170667857.db2.gz	XBXPIULKYGHPLC-UHFFFAOYSA-O	1	0	277.731	1.783	50	0		CDAARO
COc1ccnc(NCCCOC2CC[NH+](C)CC2)n1	ZINC000534589521	411828590	/nfs/dbraw/zinc/82/85/90/411828590.db2.gz	LFTOZBGAHBBPON-UHFFFAOYSA-N	1	0	280.372	1.398	50	0		CDAARO
C[C@@H]1[C@H]2CCC[N@@H+]2CCN1C(=O)c1ccc2c(c1)nnn2C	ZINC000020540862	171241478	/nfs/dbraw/zinc/24/14/78/171241478.db2.gz	HNLONUROJMOWNB-BXUZGUMPSA-N	1	0	299.378	1.277	50	0		CDAARO
CC[NH+]1CCN(Cc2ccc(O)c(OC)c2)CC1	ZINC000022586432	171392920	/nfs/dbraw/zinc/39/29/20/171392920.db2.gz	DXGAFNQGMZEQTL-UHFFFAOYSA-N	1	0	250.342	1.538	50	0		CDAARO
Cn1cc(CCC(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cn1	ZINC000035670750	172343439	/nfs/dbraw/zinc/34/34/39/172343439.db2.gz	VNQBNXHJVZVCLA-UHFFFAOYSA-N	1	0	292.427	1.778	50	0		CDAARO
C[NH+]1CCC2(CCN(C(=O)c3ncccc3O)C2)CC1	ZINC000065490197	413883838	/nfs/dbraw/zinc/88/38/38/413883838.db2.gz	KNUUPFXZJZJTGG-UHFFFAOYSA-N	1	0	275.352	1.345	50	0		CDAARO
C[NH2+]C1CCN(C(=O)c2cc(F)ccc2F)CC1	ZINC000037536482	173255100	/nfs/dbraw/zinc/25/51/00/173255100.db2.gz	HMCKJYSNQCIMOQ-UHFFFAOYSA-N	1	0	254.280	1.789	50	0		CDAARO
CCC[C@@H](Nc1cc(CC[NH3+])ncn1)c1nccn1C	ZINC000039500806	174169173	/nfs/dbraw/zinc/16/91/73/174169173.db2.gz	HICVKMYLKFTCTO-GFCCVEGCSA-N	1	0	274.372	1.665	50	0		CDAARO
CC[C@@H]1CCCCN1C(=O)[C@H](C)[NH+]1CCC(O)CC1	ZINC000043302524	175002322	/nfs/dbraw/zinc/00/23/22/175002322.db2.gz	OHODJYRRCHOAHZ-QWHCGFSZSA-N	1	0	268.401	1.623	50	0		CDAARO
Cc1cc(C(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)[nH]n1	ZINC000067956411	175804126	/nfs/dbraw/zinc/80/41/26/175804126.db2.gz	MBGQAGWSRDTSCZ-GFCCVEGCSA-N	1	0	264.373	1.426	50	0		CDAARO
CCCc1cnc(C)nc1N1CCOC[C@@H](C[NH+](C)C)C1	ZINC000072130963	176321870	/nfs/dbraw/zinc/32/18/70/176321870.db2.gz	HKSWFXCUKJZBDJ-AWEZNQCLSA-N	1	0	292.427	1.752	50	0		CDAARO
O[C@@H]1COCC[N@H+](CCCOCc2ccccc2)C1	ZINC000077505620	177276297	/nfs/dbraw/zinc/27/62/97/177276297.db2.gz	YXOYLBVUQPQDPQ-HNNXBMFYSA-N	1	0	265.353	1.286	50	0		CDAARO
CC(C)=CC[NH+]1CCN(CCNC(=O)c2ccco2)CC1	ZINC000032804109	260146060	/nfs/dbraw/zinc/14/60/60/260146060.db2.gz	GDQOKTLGJQOTGA-UHFFFAOYSA-N	1	0	291.395	1.593	50	0		CDAARO
Nc1cc(C(=O)N[C@H]2CCC[N@@H+](C3CCCC3)C2)[nH]n1	ZINC000218932181	262348053	/nfs/dbraw/zinc/34/80/53/262348053.db2.gz	WVAWPCXEKRIIHI-JTQLQIEISA-N	1	0	277.372	1.129	50	0		CDAARO
COCCn1ccnc1CN1CCC(CCO)CC1	ZINC000218940658	262348321	/nfs/dbraw/zinc/34/83/21/262348321.db2.gz	IKHMYWJFHPXWFN-UHFFFAOYSA-N	1	0	267.373	1.124	50	0		CDAARO
CO[C@]1(C)C[C@@H](NC(=O)C2([NH+](C)C)CCC2)C1(C)C	ZINC000119491990	424546129	/nfs/dbraw/zinc/54/61/29/424546129.db2.gz	SNOAXNGKAPAXDL-BXUZGUMPSA-N	1	0	268.401	1.791	50	0		CDAARO
[NH3+][C@H]1CCN(c2cccc(Br)c2)C1=O	ZINC000049648327	274962925	/nfs/dbraw/zinc/96/29/25/274962925.db2.gz	CRPVKUNCTUOQFQ-VIFPVBQESA-N	1	0	255.115	1.513	50	0		CDAARO
COc1ccnc(N2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)n1	ZINC000095971016	274164178	/nfs/dbraw/zinc/16/41/78/274164178.db2.gz	YBGRACOVWSIJLV-NEPJUHHUSA-N	1	0	262.357	1.406	50	0		CDAARO
O=C(NC1c2ccccc2-c2ccccc21)[C@@H]1C[NH2+]CCO1	ZINC000072130691	274980338	/nfs/dbraw/zinc/98/03/38/274980338.db2.gz	GOPXEBOHDNFGPU-INIZCTEOSA-N	1	0	294.354	1.861	50	0		CDAARO
CC[N@@H+]1CCC[C@H]([C@@H]2NCCc3nc(N)sc32)C1	ZINC000106954634	276179231	/nfs/dbraw/zinc/17/92/31/276179231.db2.gz	UZMGXJDDFLOXRZ-ONGXEEELSA-N	1	0	266.414	1.644	50	0		CDAARO
CCOC(=O)c1c(N)sc2c1CC[N@H+](CC)C2	ZINC000003195827	276296779	/nfs/dbraw/zinc/29/67/79/276296779.db2.gz	HLWOSVMLHPRGML-UHFFFAOYSA-N	1	0	254.355	1.885	50	0		CDAARO
CN(N)c1nc(N2CCCCC2)nc(N2CCCCC2)[nH+]1	ZINC000000315276	277001172	/nfs/dbraw/zinc/00/11/72/277001172.db2.gz	XKWVWXGSXCTSQD-UHFFFAOYSA-N	1	0	291.403	1.162	50	0		CDAARO
COC(=O)CC[N@@H+]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000002548817	277056711	/nfs/dbraw/zinc/05/67/11/277056711.db2.gz	SRZLAHPSBSPHPW-UHFFFAOYSA-N	1	0	286.372	1.492	50	0		CDAARO
COCC[N@@H+]1C[C@H](NC(=O)CC(F)(F)F)[C@@H](C(C)C)C1	ZINC000091645699	277227588	/nfs/dbraw/zinc/22/75/88/277227588.db2.gz	OSVJTXNHKPTYCQ-MNOVXSKESA-N	1	0	296.333	1.658	50	0		CDAARO
CC(C)(C)OC(=O)N[C@@H]1COC2(C1)CC[NH2+]CC2	ZINC000072362063	278440341	/nfs/dbraw/zinc/44/03/41/278440341.db2.gz	ACUKKOFVWISMOI-JTQLQIEISA-N	1	0	256.346	1.422	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2cnc(NC)nc2)C[C@@H]1[NH+](C)C	ZINC000091656151	278956849	/nfs/dbraw/zinc/95/68/49/278956849.db2.gz	ZBVPXGXCQBVCQS-AAEUAGOBSA-N	1	0	291.399	1.321	50	0		CDAARO
[NH3+][C@H]1c2ccccc2C[C@@H]1NC(=O)c1cn2ccsc2n1	ZINC000091616690	279692208	/nfs/dbraw/zinc/69/22/08/279692208.db2.gz	PBLRJKBFXVSJQD-AAEUAGOBSA-N	1	0	298.371	1.750	50	0		CDAARO
CCS(=O)(=O)N1CCC([NH+]2C[C@H](C)C[C@@H](C)C2)CC1	ZINC000004745389	280010457	/nfs/dbraw/zinc/01/04/57/280010457.db2.gz	BAXBNFXLWWMJOV-CHWSQXEVSA-N	1	0	288.457	1.778	50	0		CDAARO
Cc1ccccc1OCCN(C)C(=O)[C@@H]1CCC[NH2+]1	ZINC000037497958	281352811	/nfs/dbraw/zinc/35/28/11/281352811.db2.gz	XCRWBHPCRJQLDY-ZDUSSCGKSA-N	1	0	262.353	1.584	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)/C=C\c2ccc3c(c2)CCO3)C1	ZINC000254968853	289347338	/nfs/dbraw/zinc/34/73/38/289347338.db2.gz	BHYPGSGXADFGHN-ZQMJAJRESA-N	1	0	286.375	1.845	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)/C=C\c2c(C)nn(C)c2Cl)C1	ZINC000254991627	289348653	/nfs/dbraw/zinc/34/86/53/289348653.db2.gz	OIDHXNNPLYTURJ-DOGVGXBMSA-N	1	0	296.802	1.463	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]1NC(=O)C1(c2ccc(F)cc2)CCOCC1	ZINC000072149668	303471094	/nfs/dbraw/zinc/47/10/94/303471094.db2.gz	OCTLPWHXBVUGEP-KGLIPLIRSA-N	1	0	292.354	1.480	50	0		CDAARO
CC(C)(C(=O)NCC[C@@H]1CCOC1)[NH+]1CCCC1	ZINC000534580366	328311537	/nfs/dbraw/zinc/31/15/37/328311537.db2.gz	MCJXFFPMSUKGET-GFCCVEGCSA-N	1	0	254.374	1.404	50	0		CDAARO
C[NH+](C)CC[C@@H](NC(=O)c1cn[nH]c1)c1ccccc1	ZINC000534581924	328312237	/nfs/dbraw/zinc/31/22/37/328312237.db2.gz	JYWGTJMDENBXIO-CQSZACIVSA-N	1	0	272.352	1.833	50	0		CDAARO
[NH3+]CC[C@@H]1CN(Cc2ccc(C(F)(F)F)nc2)CCO1	ZINC000534591373	328318421	/nfs/dbraw/zinc/31/84/21/328318421.db2.gz	ZRWMUVGQOKYMNO-LLVKDONJSA-N	1	0	289.301	1.650	50	0		CDAARO
CC1(C(=O)NC[C@H]2CC[N@@H+](C3CCCC3)C2)COC1	ZINC000534645394	328330706	/nfs/dbraw/zinc/33/07/06/328330706.db2.gz	IHTWONXPVNACEP-GFCCVEGCSA-N	1	0	266.385	1.404	50	0		CDAARO
O=C(NCC[C@@H]1CCCC[NH2+]1)[C@H]1CC[C@@H](O)CC1	ZINC000534637779	328334481	/nfs/dbraw/zinc/33/44/81/328334481.db2.gz	IVBWGYAYPYGKPP-RWMBFGLXSA-N	1	0	254.374	1.186	50	0		CDAARO
Cc1ccc2c(c1C)NC(=O)[C@@H]1C[C@@H]([NH+](C)C)CN1C2=O	ZINC000534651784	328337635	/nfs/dbraw/zinc/33/76/35/328337635.db2.gz	GZXMYHXYMOCANE-YPMHNXCESA-N	1	0	287.363	1.400	50	0		CDAARO
Cc1cnc(C)c(NCC[NH+]2CCC(CO)CC2)n1	ZINC000534647308	328342882	/nfs/dbraw/zinc/34/28/82/328342882.db2.gz	KCNQIOVSWDWRER-UHFFFAOYSA-N	1	0	264.373	1.210	50	0		CDAARO
O=C(c1csc2c1CCCC2)N1C[C@@H]2[NH2+]CCO[C@H]2C1	ZINC000534655909	328339640	/nfs/dbraw/zinc/33/96/40/328339640.db2.gz	KCERXLCHBZINTK-STQMWFEESA-N	1	0	292.404	1.440	50	0		CDAARO
COCCC1CCN(C(=O)[C@H]2CCC[NH2+]CC2)CC1	ZINC000534663382	328351161	/nfs/dbraw/zinc/35/11/61/328351161.db2.gz	SMNJLFFCXBLSTK-AWEZNQCLSA-N	1	0	268.401	1.651	50	0		CDAARO
COC(=O)CCCC(=O)N1CCCC[C@H]([NH+]2CCCC2)C1	ZINC000097378093	323208108	/nfs/dbraw/zinc/20/81/08/323208108.db2.gz	ZDHRRNHVJVXGHH-AWEZNQCLSA-N	1	0	296.411	1.807	50	0		CDAARO
C[NH2+]C[C@H](C)CNS(=O)(=O)c1cc(C)oc1C	ZINC000195555239	323571816	/nfs/dbraw/zinc/57/18/16/323571816.db2.gz	AQRIZWGJBAXBRK-QMMMGPOBSA-N	1	0	260.359	1.030	50	0		CDAARO
COc1ccc(S(=O)(=O)NC2CC[NH2+]CC2)c(C)c1	ZINC000020272033	326902739	/nfs/dbraw/zinc/90/27/39/326902739.db2.gz	OYQYVDHBSGKEMV-UHFFFAOYSA-N	1	0	284.381	1.034	50	0		CDAARO
Brc1cnc2ccc(N3CC[NH2+]CC3)cn12	ZINC001772572595	1159118036	/nfs/dbraw/zinc/11/80/36/1159118036.db2.gz	QTYMTWYQVMKFGI-UHFFFAOYSA-N	1	0	281.157	1.506	50	0		CDAARO
Cc1cccn2ncc(C(=O)NC[C@@H](C(C)C)[NH+](C)C)c12	ZINC001772709410	1159443433	/nfs/dbraw/zinc/44/34/33/1159443433.db2.gz	JOGGQILXUAORSD-AWEZNQCLSA-N	1	0	288.395	1.959	50	0		CDAARO
CC(C)C[N@@H+]1Cc2cccc(NC(=O)Cn3ccnn3)c2C1	ZINC000092406411	482619515	/nfs/dbraw/zinc/61/95/15/482619515.db2.gz	ZQKOVGCCLYTXBG-UHFFFAOYSA-N	1	0	299.378	1.888	50	0		CDAARO
Cn1ncc2c1ncnc2N[C@H]1C[C@H]([NH+](C)C)C1(C)C	ZINC000585092409	482828899	/nfs/dbraw/zinc/82/88/99/482828899.db2.gz	VJRQKINAHPVSQX-QWRGUYRKSA-N	1	0	274.372	1.504	50	0		CDAARO
O=C(CCC(F)(F)F)NCC[N@H+]1CCC[C@@H](CO)C1	ZINC000670455431	483028302	/nfs/dbraw/zinc/02/83/02/483028302.db2.gz	WTIPOEXXQXDSLA-SNVBAGLBSA-N	1	0	282.306	1.149	50	0		CDAARO
Cc1csc(CN(C)Cc2cn(CCO)nc2C)n1	ZINC000670459576	483041237	/nfs/dbraw/zinc/04/12/37/483041237.db2.gz	LMNATUZHIOVTQK-UHFFFAOYSA-N	1	0	280.397	1.581	50	0		CDAARO
C[N@H+](CCCOc1ccc(C(N)=O)cc1)C[C@@H]1CCCO1	ZINC000670459837	483043590	/nfs/dbraw/zinc/04/35/90/483043590.db2.gz	KZYPWMYTUNYKTK-HNNXBMFYSA-N	1	0	292.379	1.665	50	0		CDAARO
COc1nc(NCC[C@@H]2CCCC[N@@H+]2C)ncc1F	ZINC000670462625	483050952	/nfs/dbraw/zinc/05/09/52/483050952.db2.gz	RYDPQZJMIRMJNR-JTQLQIEISA-N	1	0	268.336	1.911	50	0		CDAARO
Cc1nccn1C[C@H]1CCC[N@H+](CCN2CCCC2=O)C1	ZINC000670463536	483052920	/nfs/dbraw/zinc/05/29/20/483052920.db2.gz	ITJQAWSRIIMWML-HNNXBMFYSA-N	1	0	290.411	1.526	50	0		CDAARO
CC[N@@H+]1CC[C@H](NC(=O)CCC(=O)N2CCCCCC2)C1	ZINC000670467815	483060441	/nfs/dbraw/zinc/06/04/41/483060441.db2.gz	GTOWJZISZIVWCC-AWEZNQCLSA-N	1	0	295.427	1.380	50	0		CDAARO
COc1nc(N2CCC[C@@H]([NH+](C)C)C2)ncc1F	ZINC000670469747	483065396	/nfs/dbraw/zinc/06/53/96/483065396.db2.gz	OLELWMHWFWXXSK-SECBINFHSA-N	1	0	254.309	1.155	50	0		CDAARO
CC(C)(O)[C@H]1CCN(C(=O)C[NH+]2CCCCCC2)C1	ZINC000670473272	483082632	/nfs/dbraw/zinc/08/26/32/483082632.db2.gz	NZVLWZVQHWYQMT-ZDUSSCGKSA-N	1	0	268.401	1.482	50	0		CDAARO
COc1ccccc1C/C(C)=C/C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178542959	524367329	/nfs/dbraw/zinc/36/73/29/524367329.db2.gz	BRVIVNNVNXMSHI-JWAFFJSPSA-N	1	0	288.391	1.991	50	0		CDAARO
Cc1csc(C[NH2+]C[C@@H]2COC3(CCOCC3)O2)n1	ZINC000096494778	534815383	/nfs/dbraw/zinc/81/53/83/534815383.db2.gz	BSQRGNWMBOPOFK-LLVKDONJSA-N	1	0	284.381	1.463	50	0		CDAARO
NC[C@@H]1C[C@H]([C@@H]2CC[C@H](C(F)(F)F)NC2)CC[NH2+]1	ZINC000757207438	577035803	/nfs/dbraw/zinc/03/58/03/577035803.db2.gz	BEYZMBORRMATFB-CHWFTXMASA-N	1	0	265.323	1.244	50	0		CDAARO
CC(C)[C@H]([NH3+])[C@@]1(O)CCCN(C(=O)OC(C)(C)C)C1	ZINC000958528201	614228655	/nfs/dbraw/zinc/22/86/55/614228655.db2.gz	NWVYDGZVAUNTTK-SMDDNHRTSA-N	1	0	272.389	1.732	50	0		CDAARO
NC(=O)[C@H]1CCC[N@@H+]([C@H]2CCc3ccccc3C2)C1	ZINC000002498837	694045441	/nfs/dbraw/zinc/04/54/41/694045441.db2.gz	KAFBBKJAOLFKCB-GJZGRUSLSA-N	1	0	258.365	1.741	50	0		CDAARO
CC(C)[N@@H+]1CCCN(C(=O)C[C@H]2CCCOC2)CC1	ZINC000793390202	688323537	/nfs/dbraw/zinc/32/35/37/688323537.db2.gz	LUCLSPXNRYKVBE-CQSZACIVSA-N	1	0	268.401	1.746	50	0		CDAARO
Cc1cc[nH]c(=O)c1C(=O)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000181048076	688874206	/nfs/dbraw/zinc/87/42/06/688874206.db2.gz	AITXWUFGSWTUGB-NSHDSACASA-N	1	0	261.325	1.016	50	0		CDAARO
CCOC(=O)N1CCC([N@@H+]2CCC[C@@H](CO)C2)CC1	ZINC000003683469	692513645	/nfs/dbraw/zinc/51/36/45/692513645.db2.gz	AVSAELGUBFEEIM-GFCCVEGCSA-N	1	0	270.373	1.312	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc3nsnc3c2)C[C@@H]1CCO	ZINC000020992996	692571862	/nfs/dbraw/zinc/57/18/62/692571862.db2.gz	QEURVGYMJXYKSJ-LBPRGKRZSA-N	1	0	292.408	1.190	50	0		CDAARO
O[C@@H]1COCCN(Cc2cc(C[NH+]3CCCC3)cs2)C1	ZINC000077408214	692832379	/nfs/dbraw/zinc/83/23/79/692832379.db2.gz	KHZSPZGLMRGUIY-AWEZNQCLSA-N	1	0	296.436	1.537	50	0		CDAARO
Cn1ccnc1C[NH2+]CCc1cnn(-c2ccccc2)c1	ZINC000952970675	694669255	/nfs/dbraw/zinc/66/92/55/694669255.db2.gz	WGPZUYOECBPFLH-UHFFFAOYSA-N	1	0	281.363	1.938	50	0		CDAARO
Cc1cc2c(c(-c3ccc(C(N)=O)o3)c1)O[C@@H](C[NH3+])C2	ZINC000067649988	694683717	/nfs/dbraw/zinc/68/37/17/694683717.db2.gz	ZCTCLFGQCUNSRT-SNVBAGLBSA-N	1	0	272.304	1.616	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)c1cncnc1N)c1cccs1	ZINC000185395801	694666359	/nfs/dbraw/zinc/66/63/59/694666359.db2.gz	MXKRJNPWCPPYPK-JTQLQIEISA-N	1	0	291.380	1.153	50	0		CDAARO
Cc1nn(C)c(C)c1C[N@@H+]1CC[C@H](OC(F)F)C1	ZINC000952962957	695106658	/nfs/dbraw/zinc/10/66/58/695106658.db2.gz	LZWLEEPXLZTNPR-JTQLQIEISA-N	1	0	259.300	1.850	50	0		CDAARO
CC(=O)c1cnc(NC[C@H](O)C[NH+]2CCCCC2)nc1C	ZINC001772710478	1159444559	/nfs/dbraw/zinc/44/45/59/1159444559.db2.gz	ROMPQQWXXUQEKX-ZDUSSCGKSA-N	1	0	292.383	1.246	50	0		CDAARO
CC(=O)c1cnc(N2CCC[C@H]([NH+](C)C)CC2)nc1C	ZINC001772711300	1159445916	/nfs/dbraw/zinc/44/59/16/1159445916.db2.gz	XIXYYSLUFPETES-ZDUSSCGKSA-N	1	0	276.384	1.908	50	0		CDAARO
COC1CC(C[NH+]2CCC(c3nc(C)no3)CC2)C1	ZINC000859089318	723329499	/nfs/dbraw/zinc/32/94/99/723329499.db2.gz	CBPMUPZRVSVVBN-UHFFFAOYSA-N	1	0	265.357	1.982	50	0		CDAARO
O=C1CCCN1CCC[NH2+]C1CSCCSC1	ZINC000952981992	723435830	/nfs/dbraw/zinc/43/58/30/723435830.db2.gz	PZJFSJUCPKUQGN-UHFFFAOYSA-N	1	0	274.455	1.437	50	0		CDAARO
Cc1cc(NCC2(N3CCOCC3)CCCC2)nc(N)[nH+]1	ZINC000032598445	723532171	/nfs/dbraw/zinc/53/21/71/723532171.db2.gz	OVLYERYPRRDXRP-UHFFFAOYSA-N	1	0	291.399	1.424	50	0		CDAARO
O=C(C[C@@H](O)c1cccc(F)c1)NC[C@H]1CCC[NH2+]1	ZINC000864092205	723180596	/nfs/dbraw/zinc/18/05/96/723180596.db2.gz	NFDSXKWCNRHJLN-CHWSQXEVSA-N	1	0	266.316	1.117	50	0		CDAARO
Cc1nc2c(c(NCc3ccc(CO)cc3)n1)CC[NH2+]CC2	ZINC000072417985	723324850	/nfs/dbraw/zinc/32/48/50/723324850.db2.gz	UREFXBTUHCQPFL-UHFFFAOYSA-N	1	0	298.390	1.578	50	0		CDAARO
CCc1nccn1CCCNC(=O)c1cc(=O)cc(C)[nH]1	ZINC000426551911	902600623	/nfs/dbraw/zinc/60/06/23/902600623.db2.gz	BQWYFIJDRHZDQK-UHFFFAOYSA-N	1	0	288.351	1.262	50	0		CDAARO
CC1(C)CN(Cc2cnc3cnccn23)CC(C)(C)[NH2+]1	ZINC000952847900	910404341	/nfs/dbraw/zinc/40/43/41/910404341.db2.gz	IXVAJUNIELBRKD-UHFFFAOYSA-N	1	0	273.384	1.692	50	0		CDAARO
CCO[C@H](CC[NH+](C)C)CNC(=O)NCc1nocc1C	ZINC000952883718	910455882	/nfs/dbraw/zinc/45/58/82/910455882.db2.gz	OXDQYJUWRDFBOH-GFCCVEGCSA-N	1	0	298.387	1.139	50	0		CDAARO
C[C@@H](CN1CCc2ccccc2C1)[NH2+]Cc1ncc[nH]1	ZINC000952989607	920112914	/nfs/dbraw/zinc/11/29/14/920112914.db2.gz	WLGGEECVGJUUGF-ZDUSSCGKSA-N	1	0	270.380	1.946	50	0		CDAARO
C[N@H+](CC[C@@H]1CCS(=O)(=O)C1)CCC1(O)CCCC1	ZINC000823693061	925723109	/nfs/dbraw/zinc/72/31/09/925723109.db2.gz	NWZQIBLOLXRXOM-CYBMUJFWSA-N	1	0	289.441	1.438	50	0		CDAARO
Cc1cnccc1C(=O)NCC1([NH+](C)C)CCN(C)CC1	ZINC000823759473	925724617	/nfs/dbraw/zinc/72/46/17/925724617.db2.gz	LFHDCNKWZNFWNQ-UHFFFAOYSA-N	1	0	290.411	1.146	50	0		CDAARO
COc1cccc(CC(=O)NCCNc2cc[nH+]cc2C)c1	ZINC000824775254	925835054	/nfs/dbraw/zinc/83/50/54/925835054.db2.gz	HOIHZSMOVICRQI-UHFFFAOYSA-N	1	0	299.374	1.591	50	0		CDAARO
COc1ncc(CN2CCC[C@@H]([NH+](C)C)CC2)cn1	ZINC000824852022	925839712	/nfs/dbraw/zinc/83/97/12/925839712.db2.gz	NRLPIHNPKKFBHO-CYBMUJFWSA-N	1	0	264.373	1.401	50	0		CDAARO
COc1ncc(CN2CC([N@@H+]3CCCC[C@@H]3C)C2)cn1	ZINC000824851792	925840438	/nfs/dbraw/zinc/84/04/38/925840438.db2.gz	HJORMADWDUQLEL-LBPRGKRZSA-N	1	0	276.384	1.544	50	0		CDAARO
O=C1OC[C@H]2C[N@@H+](C3Cc4ccccc4C3)CCN12	ZINC000828322837	926109395	/nfs/dbraw/zinc/10/93/95/926109395.db2.gz	KHWXTUIIFPDQRZ-CQSZACIVSA-N	1	0	258.321	1.290	50	0		CDAARO
C[NH+](C)[C@@H]1CN(Cc2ccc(O)cc2)CC[C@@H]1CO	ZINC000581799173	927201077	/nfs/dbraw/zinc/20/10/77/927201077.db2.gz	KRMWJPPOOQOPLG-UKRRQHHQSA-N	1	0	264.369	1.137	50	0		CDAARO
C[C@@H]1NC(=O)[C@H](C)N(CCO[C@H]2CCCCO2)[C@H]1C	ZINC000585116150	930967227	/nfs/dbraw/zinc/96/72/27/930967227.db2.gz	JEKDMRYBXRSVPJ-CYDGBPFRSA-N	1	0	270.373	1.127	50	0		CDAARO
Cc1ncc(C[NH2+]C[C@H]2COCO2)n1-c1ccccc1	ZINC000585116962	930968738	/nfs/dbraw/zinc/96/87/38/930968738.db2.gz	NLSVLBBMJWQHLY-HNNXBMFYSA-N	1	0	273.336	1.643	50	0		CDAARO
C[N@H+](CCCO)C[C@@H]1CN(c2cccc(Cl)c2)C(=O)O1	ZINC000585116774	930969196	/nfs/dbraw/zinc/96/91/96/930969196.db2.gz	IBPGZIUCJKBOCN-CYBMUJFWSA-N	1	0	298.770	1.979	50	0		CDAARO
O=C(NC1(CO)CCSCC1)[C@@H]1CC[C@H]2CCCC[N@@H+]21	ZINC000585122212	930988332	/nfs/dbraw/zinc/98/83/32/930988332.db2.gz	QWNZUBFGTWXJAR-OLZOCXBDSA-N	1	0	298.452	1.378	50	0		CDAARO
Cc1ccc(=O)n(CC2C[NH+](C[C@@H]3CCCCO3)C2)n1	ZINC000585603247	932835169	/nfs/dbraw/zinc/83/51/69/932835169.db2.gz	LWHDAQNZGXAISL-AWEZNQCLSA-N	1	0	277.368	1.053	50	0		CDAARO
Cc1cccc(C[N@H+]2C[C@@H](Cc3ccncc3)[C@H](O)C2)n1	ZINC001529167736	968999424	/nfs/dbraw/zinc/99/94/24/968999424.db2.gz	NIDJELBCUJIVQZ-NVXWUHKLSA-N	1	0	283.375	1.820	50	0		CDAARO
CC(C)c1ccc(N2CCC(O)(C[NH+](C)C)CC2)nn1	ZINC001506399994	975149123	/nfs/dbraw/zinc/14/91/23/975149123.db2.gz	GNTVMJPQKLWVIG-UHFFFAOYSA-N	1	0	278.400	1.493	50	0		CDAARO
Cn1ccnc1CCN1CCC([NH+]2CCCC2)CC1	ZINC001506407873	975152733	/nfs/dbraw/zinc/15/27/33/975152733.db2.gz	SNCCKRNNFFLPNR-UHFFFAOYSA-N	1	0	262.401	1.523	50	0		CDAARO
CCc1nn(C)c(NC(=O)[C@H]2CC[N@H+](CCOC)C2)c1C	ZINC001506407973	975153212	/nfs/dbraw/zinc/15/32/12/975153212.db2.gz	LSVHKBQTPTXJGE-LBPRGKRZSA-N	1	0	294.399	1.198	50	0		CDAARO
CC[C@@H]1CN(C(=O)c2cccc(=O)[nH]2)CC[N@@H+]1C(C)C	ZINC001506428734	975162212	/nfs/dbraw/zinc/16/22/12/975162212.db2.gz	QADVPJBPDIDVIP-GFCCVEGCSA-N	1	0	277.368	1.732	50	0		CDAARO
C[NH+](C)CCC1CCN(S(=O)(=O)CCCF)CC1	ZINC000096502868	230385503	/nfs/dbraw/zinc/38/55/03/230385503.db2.gz	YLWBBKRSVNZRDM-UHFFFAOYSA-N	1	0	280.409	1.340	50	0		CDAARO
O=C(COC1CCCCC1)NC[C@H]1C[N@@H+]2CCC[C@H]2CO1	ZINC000107319604	398138978	/nfs/dbraw/zinc/13/89/78/398138978.db2.gz	VAJGPFWVKOSYDU-ZFWWWQNUSA-N	1	0	296.411	1.315	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@H]1[NH2+][C@H](C)C(=O)NCC(C)C	ZINC000107504592	398150192	/nfs/dbraw/zinc/15/01/92/398150192.db2.gz	VMLJGRRQELUCBT-BPLDGKMQSA-N	1	0	297.443	1.384	50	0		CDAARO
Cc1cc([C@H]2CCC[N@@H+](Cc3ccn(C)c(=O)c3)C2)[nH]n1	ZINC000084111335	539086162	/nfs/dbraw/zinc/08/61/62/539086162.db2.gz	OGQFUKJFUOGDIM-AWEZNQCLSA-N	1	0	286.379	1.796	50	0		CDAARO
NC(=[NH2+])NCCN1CC=C(Oc2ccccc2)CC1	ZINC000095918179	185030775	/nfs/dbraw/zinc/03/07/75/185030775.db2.gz	GAZNYHZUXSDLPK-UHFFFAOYSA-N	1	0	260.341	1.138	50	0		CDAARO
C[C@H](O)[C@H](C)[NH+]1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000095964835	185045595	/nfs/dbraw/zinc/04/55/95/185045595.db2.gz	STCDWRMUHCPXON-DZKIICNBSA-N	1	0	278.396	1.107	50	0		CDAARO
Cc1c[nH]c(NC(=O)c2ccnc(OCC[NH+](C)C)c2)n1	ZINC000096004813	185063362	/nfs/dbraw/zinc/06/33/62/185063362.db2.gz	BDBWPHNMQKAXRP-UHFFFAOYSA-N	1	0	289.339	1.306	50	0		CDAARO
O=C(NCCn1cccc1)[C@@H]1COCCN1CC1CCC1	ZINC000239667853	361746936	/nfs/dbraw/zinc/74/69/36/361746936.db2.gz	BRSFEENOEIYHPS-HNNXBMFYSA-N	1	0	291.395	1.105	50	0		CDAARO
O=C(O[C@H]1C[C@@H](N2CCOCC2)C1)c1ccoc1	ZINC000242191365	361754691	/nfs/dbraw/zinc/75/46/91/361754691.db2.gz	XEZLIRYPEKGFIE-TXEJJXNPSA-N	1	0	251.282	1.300	50	0		CDAARO
COc1ccccc1/C=C/C[NH+](C[C@@H](C)O)C[C@@H](C)O	ZINC000012383467	342050856	/nfs/dbraw/zinc/05/08/56/342050856.db2.gz	OJFZEASPESTSEJ-RTIZMKJZSA-N	1	0	279.380	1.772	50	0		CDAARO
CCOC(=O)N1CCC([N@@H+]2CCCN(C)CC2)CC1	ZINC000022456127	342089154	/nfs/dbraw/zinc/08/91/54/342089154.db2.gz	XXXNSYICFXDMQB-UHFFFAOYSA-N	1	0	269.389	1.245	50	0		CDAARO
CC[NH+]1CCC(N2CCN(c3ncccn3)CC2)CC1	ZINC000023282783	342089204	/nfs/dbraw/zinc/08/92/04/342089204.db2.gz	HRNRSDYBPPKZTH-UHFFFAOYSA-N	1	0	275.400	1.083	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1	ZINC000125198867	187173978	/nfs/dbraw/zinc/17/39/78/187173978.db2.gz	IAYLPRPKBUVVHJ-YUSALJHKSA-N	1	0	280.318	1.889	50	0		CDAARO
COCCc1noc(CC2CC[NH+](C(C)C)CC2)n1	ZINC000096140653	185105781	/nfs/dbraw/zinc/10/57/81/185105781.db2.gz	UIQPEAAJWHZNTC-UHFFFAOYSA-N	1	0	267.373	1.921	50	0		CDAARO
CC(C)(C)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[NH2+]CCO1	ZINC000195543498	342626613	/nfs/dbraw/zinc/62/66/13/342626613.db2.gz	BZEKFIQWLNOSJM-CABCVRRESA-N	1	0	290.407	1.748	50	0		CDAARO
C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)C[C@@H]1CSCCS1	ZINC000095440460	539088106	/nfs/dbraw/zinc/08/81/06/539088106.db2.gz	RFGFFKOVVZHFNM-GRYCIOLGSA-N	1	0	288.482	1.776	50	0		CDAARO
CO[C@H]1CC[N@H+](CCN2CCN(c3ccccc3)CC2)C1	ZINC000244595070	361853998	/nfs/dbraw/zinc/85/39/98/361853998.db2.gz	DOCUDDMQMLNTBY-KRWDZBQOSA-N	1	0	289.423	1.529	50	0		CDAARO
CCCNC(=O)N1C[C@H](C[NH+](C)C)C2(C1)CCOCC2	ZINC000097942816	342160774	/nfs/dbraw/zinc/16/07/74/342160774.db2.gz	SYYBMTFXWLFDOB-ZDUSSCGKSA-N	1	0	283.416	1.396	50	0		CDAARO
CC[N@H+](CCN1CCCC1=O)C[C@@H](O)c1cccc(O)c1	ZINC000244764069	361861825	/nfs/dbraw/zinc/86/18/25/361861825.db2.gz	PAWMVOAHFJSOOQ-OAHLLOKOSA-N	1	0	292.379	1.370	50	0		CDAARO
c1cnc(N2CCC[N@@H+](C[C@H]3CCCOC3)CC2)nc1	ZINC000244742155	361862219	/nfs/dbraw/zinc/86/22/19/361862219.db2.gz	OCSGRUQIFBNIME-CQSZACIVSA-N	1	0	276.384	1.415	50	0		CDAARO
COCCC[C@H]1CCC[N@H+](CCn2cncn2)C1	ZINC000244840313	361866552	/nfs/dbraw/zinc/86/65/52/361866552.db2.gz	UKWOBQQHHHMJIA-CYBMUJFWSA-N	1	0	252.362	1.417	50	0		CDAARO
Cc1ccccc1[C@]1(O)CC[N@H+](CCn2cncn2)C1	ZINC000244718886	361859102	/nfs/dbraw/zinc/85/91/02/361859102.db2.gz	LSSUBFMFACMUEO-HNNXBMFYSA-N	1	0	272.352	1.180	50	0		CDAARO
[NH3+]CCN1CCN(C(=O)c2cc3occc3s2)CC1	ZINC000263073625	361917520	/nfs/dbraw/zinc/91/75/20/361917520.db2.gz	WTOJBHSEJGTXMY-UHFFFAOYSA-N	1	0	279.365	1.211	50	0		CDAARO
C[C@@](CO)([NH2+]CCO)c1cccc(C(F)(F)F)c1	ZINC000097011832	185151506	/nfs/dbraw/zinc/15/15/06/185151506.db2.gz	ABFXWCDHAQRPSH-NSHDSACASA-N	1	0	263.259	1.495	50	0		CDAARO
O=C(OCc1ccc2n[nH]nc2c1)c1ccn2c[nH+]cc2c1	ZINC000097034300	185157444	/nfs/dbraw/zinc/15/74/44/185157444.db2.gz	OKTYSQOEJUWOOY-UHFFFAOYSA-N	1	0	293.286	1.963	50	0		CDAARO
CCO[C@H]1C[C@@H]([NH2+]CC2(OC)CCOCC2)C1(C)C	ZINC000097034775	185157850	/nfs/dbraw/zinc/15/78/50/185157850.db2.gz	WCGAEYDDDLHWHX-OLZOCXBDSA-N	1	0	271.401	1.975	50	0		CDAARO
Cc1cc(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@H]2CCCO2)on1	ZINC000248582420	342273090	/nfs/dbraw/zinc/27/30/90/342273090.db2.gz	IWXGZJSLNAVWTI-GARJFASQSA-N	1	0	267.329	1.467	50	0		CDAARO
Cc1cnccc1CC[NH2+][C@@H](C)Cc1cnccn1	ZINC000585116544	362045504	/nfs/dbraw/zinc/04/55/04/362045504.db2.gz	AHEROMDJEJGYDX-ZDUSSCGKSA-N	1	0	256.353	1.943	50	0		CDAARO
C[C@H](NCc1ncnn1C)[C@@H](c1ccccc1)[NH+](C)C	ZINC000585117758	362046339	/nfs/dbraw/zinc/04/63/39/362046339.db2.gz	VVLIFFBBSFKVTK-WFASDCNBSA-N	1	0	273.384	1.596	50	0		CDAARO
CNC1=[NH+]P(NC)(NC)=NC(c2ccccc2)=N1	ZINC000005248254	343461269	/nfs/dbraw/zinc/46/12/69/343461269.db2.gz	JHEVTEQFGSBRSP-UHFFFAOYSA-N	1	0	264.273	1.407	50	0		CDAARO
CNC(=O)CC[NH+]1CCC(OC[C@@H]2CCCCO2)CC1	ZINC000096455936	529857243	/nfs/dbraw/zinc/85/72/43/529857243.db2.gz	DRZCCTFVRZBYLL-AWEZNQCLSA-N	1	0	284.400	1.173	50	0		CDAARO
C[NH+](C)CCN(Cc1cccs1)C(=O)[C@@H]1CCOC1	ZINC000084250893	362259191	/nfs/dbraw/zinc/25/91/91/362259191.db2.gz	JOVMGCUKQREMHN-GFCCVEGCSA-N	1	0	282.409	1.675	50	0		CDAARO
Cc1cnccc1C[NH+]1CCC2(CC1)OCCC[C@@H]2O	ZINC000252479969	362383772	/nfs/dbraw/zinc/38/37/72/362383772.db2.gz	BQXYTMKNEZRXAQ-HNNXBMFYSA-N	1	0	276.380	1.896	50	0		CDAARO
O=C(Nc1ccncn1)N1CC[C@@H](C[NH+]2CCCC2)C1	ZINC000190709036	362379971	/nfs/dbraw/zinc/37/99/71/362379971.db2.gz	FAHOGIHBLNMJOG-LBPRGKRZSA-N	1	0	275.356	1.426	50	0		CDAARO
CCOC(=O)[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1O	ZINC000252487413	362387584	/nfs/dbraw/zinc/38/75/84/362387584.db2.gz	XEPZKCVKBIJDII-ZIAGYGMSSA-N	1	0	263.337	1.433	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C[C@@H](O)c1ccc(F)cc1	ZINC000097159521	185551332	/nfs/dbraw/zinc/55/13/32/185551332.db2.gz	ALEALCCKQCAEBK-CQSZACIVSA-N	1	0	263.316	1.989	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C[C@H](O)COCC(C)C	ZINC000097160026	185551934	/nfs/dbraw/zinc/55/19/34/185551934.db2.gz	SQZQLGVHCHUJJU-LBPRGKRZSA-N	1	0	255.362	1.150	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](Nc2nccc(C)c2[N+](=O)[O-])C1	ZINC000399528248	346134131	/nfs/dbraw/zinc/13/41/31/346134131.db2.gz	SXVBARCGGMGGFK-GFCCVEGCSA-N	1	0	294.355	1.821	50	0		CDAARO
[NH3+]CC[C@@H]1CCCCN1C(=O)c1ccncc1F	ZINC000086316840	179269805	/nfs/dbraw/zinc/26/98/05/179269805.db2.gz	CRULGVWFEUIRGC-JTQLQIEISA-N	1	0	251.305	1.564	50	0		CDAARO
CC(=O)c1ccc(NC(=S)NN2CCN(C)CC2)cc1	ZINC000013577414	365940066	/nfs/dbraw/zinc/94/00/66/365940066.db2.gz	MYBZXVYQHUNACB-UHFFFAOYSA-N	1	0	292.408	1.338	50	0		CDAARO
CCc1cccc(S(=O)(=O)N[C@H]2CCC[NH2+][C@@H]2C)c1	ZINC000193454376	362924171	/nfs/dbraw/zinc/92/41/71/362924171.db2.gz	LWXQGQWHZHHIOO-RISCZKNCSA-N	1	0	282.409	1.668	50	0		CDAARO
CCCn1nccc1C(=O)NCC(C)(C)[NH+]1CCCC1	ZINC000584896868	349358051	/nfs/dbraw/zinc/35/80/51/349358051.db2.gz	ZRWXMLYSGYOQMQ-UHFFFAOYSA-N	1	0	278.400	1.897	50	0		CDAARO
[NH3+]CCc1ccc(C(=O)N[C@@H]2CCc3c[nH]nc3C2)cc1	ZINC000584885848	349344364	/nfs/dbraw/zinc/34/43/64/349344364.db2.gz	RWTDAKCNWBLAIL-CQSZACIVSA-N	1	0	284.363	1.198	50	0		CDAARO
C[N@@H+]1CC[C@](C)(Cn2cnc3cccc(F)c3c2=O)C1	ZINC000584897167	349358412	/nfs/dbraw/zinc/35/84/12/349358412.db2.gz	HAIJTHKWSIFTIZ-HNNXBMFYSA-N	1	0	275.327	1.877	50	0		CDAARO
CCC[N@@H+]1CCCN(C(=O)COC[C@H]2CCCCO2)CC1	ZINC000584889462	349348037	/nfs/dbraw/zinc/34/80/37/349348037.db2.gz	ZWEOCGPEPDGIOH-OAHLLOKOSA-N	1	0	298.427	1.516	50	0		CDAARO
COc1ccc2ncn(C[C@]3(C)CC[N@H+](C)C3)c(=O)c2c1	ZINC000584892323	349351688	/nfs/dbraw/zinc/35/16/88/349351688.db2.gz	NJGFUBMJKCZBNG-MRXNPFEDSA-N	1	0	287.363	1.747	50	0		CDAARO
CN(C[C@H]1CCCC[N@@H+]1C)C(=O)c1csc(N)n1	ZINC000584894128	349354092	/nfs/dbraw/zinc/35/40/92/349354092.db2.gz	MNIGQIHWIAOUPR-SECBINFHSA-N	1	0	268.386	1.112	50	0		CDAARO
COc1ccc([C@H](C)[NH2+]C[C@@]2(O)CCOC2)c(F)c1	ZINC000090850217	180046482	/nfs/dbraw/zinc/04/64/82/180046482.db2.gz	RXCLZTASSAVEOI-HZMBPMFUSA-N	1	0	269.316	1.636	50	0		CDAARO
CC1=CC[N@H+](Cc2cc(=O)c3cc(C(N)=O)ccc3[nH]2)CC1	ZINC000091586251	180199431	/nfs/dbraw/zinc/19/94/31/180199431.db2.gz	VVSBKTWXBPNHBZ-UHFFFAOYSA-N	1	0	297.358	1.779	50	0		CDAARO
COc1cccc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)c1C	ZINC000091616286	180208110	/nfs/dbraw/zinc/20/81/10/180208110.db2.gz	CFSBYIDBZYZSJW-KGLIPLIRSA-N	1	0	274.364	1.813	50	0		CDAARO
Cc1[nH+]c(N)nc(N[C@H]2CCCN(C(=O)C3CC3)C2)c1C	ZINC000091621110	180208436	/nfs/dbraw/zinc/20/84/36/180208436.db2.gz	CPCCKVADZOHFIG-LBPRGKRZSA-N	1	0	289.383	1.489	50	0		CDAARO
CCCCc1c(C)[nH+]c(N)nc1NCc1nc(N)n[nH]1	ZINC000091550616	180189100	/nfs/dbraw/zinc/18/91/00/180189100.db2.gz	KDQUSYNPCQXJGM-UHFFFAOYSA-N	1	0	276.348	1.022	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)cc1F	ZINC000091650036	180216348	/nfs/dbraw/zinc/21/63/48/180216348.db2.gz	IMWLPUYITJRYBH-OCCSQVGLSA-N	1	0	298.383	1.492	50	0		CDAARO
COCCC[C@@]1(CO)CCC[N@H+](Cc2cncnc2)C1	ZINC000091997287	180303238	/nfs/dbraw/zinc/30/32/38/180303238.db2.gz	MFKINGQAKQCGHD-HNNXBMFYSA-N	1	0	279.384	1.478	50	0		CDAARO
CCC[C@H]1CN(c2cc(C(=O)NC)ccn2)C[C@@H]1[NH+](C)C	ZINC000092028002	180309306	/nfs/dbraw/zinc/30/93/06/180309306.db2.gz	KDNNSFZZQOKUEZ-KBPBESRZSA-N	1	0	290.411	1.608	50	0		CDAARO
C[C@H](CNC(=O)Cn1cccn1)[N@@H+]1CCCC[C@@H]1C	ZINC000106069393	186101780	/nfs/dbraw/zinc/10/17/80/186101780.db2.gz	NYEWHTOOULEIJI-QWHCGFSZSA-N	1	0	264.373	1.262	50	0		CDAARO
C[C@@H](c1ccc(F)cc1F)N1CCN(C(=O)CC[NH3+])CC1	ZINC000107275143	186165323	/nfs/dbraw/zinc/16/53/23/186165323.db2.gz	WXFWHSGIDQABFH-NSHDSACASA-N	1	0	297.349	1.519	50	0		CDAARO
O=C(c1ncccc1O)N1CC[C@@H]([NH+]2CCCCC2)C1	ZINC000110325619	186291336	/nfs/dbraw/zinc/29/13/36/186291336.db2.gz	IUCPGPQRJUBBGT-GFCCVEGCSA-N	1	0	275.352	1.488	50	0		CDAARO
Cc1noc([C@H]2C[N@@H+](C[C@]3(C)CCCS3)CCN2C)n1	ZINC000583651489	366012610	/nfs/dbraw/zinc/01/26/10/366012610.db2.gz	NQTHMCMBEXTWSL-OCCSQVGLSA-N	1	0	296.440	1.952	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1cc(Cl)ccn1	ZINC000036804828	363163583	/nfs/dbraw/zinc/16/35/83/363163583.db2.gz	WFLBKDWKBBBRFK-LLVKDONJSA-N	1	0	267.760	1.949	50	0		CDAARO
COc1ccc(C[NH2+]C[C@@H]2CCCO2)c(OC)c1OC	ZINC000000268574	355900061	/nfs/dbraw/zinc/90/00/61/355900061.db2.gz	IOTCZIWATHDQAE-LBPRGKRZSA-N	1	0	281.352	1.981	50	0		CDAARO
COc1ccccc1CC(=O)NCCC[NH+](C)C	ZINC000002746922	355981171	/nfs/dbraw/zinc/98/11/71/355981171.db2.gz	XIQBLQVQANBTEI-UHFFFAOYSA-N	1	0	250.342	1.306	50	0		CDAARO
CN(C)c1cccc2c1cccc2S(=O)(=O)NCC[NH3+]	ZINC000001642348	355943924	/nfs/dbraw/zinc/94/39/24/355943924.db2.gz	CSJXLKVNKAXFSI-UHFFFAOYSA-N	1	0	293.392	1.143	50	0	in-vitro	CDAARO
CCOc1ccc(/C=C\C(=O)N2CC[C@@H](C[NH3+])C2)cc1	ZINC000255301519	356036026	/nfs/dbraw/zinc/03/60/26/356036026.db2.gz	YKOHHEYTEIWHCJ-PODYEWJSSA-N	1	0	274.364	1.906	50	0		CDAARO
C[NH+](C)CCCn1c(=O)c2ccccc2[n-]c1=S	ZINC000003886683	356012188	/nfs/dbraw/zinc/01/21/88/356012188.db2.gz	UDWVTSOGRLGGFY-UHFFFAOYSA-N	1	0	263.366	1.637	50	0		CDAARO
OC[C@@H](Cc1ccccc1)[NH2+]C[C@H](O)C(F)(F)F	ZINC000004092330	356018064	/nfs/dbraw/zinc/01/80/64/356018064.db2.gz	SJSOKMKUAWKDDB-MNOVXSKESA-N	1	0	263.259	1.103	50	0		CDAARO
CCCCCCc1c(C)nc(N2CC[NH+](C)CC2)[nH]c1=O	ZINC000009303511	356217932	/nfs/dbraw/zinc/21/79/32/356217932.db2.gz	ZDDZUIFKLVUZNA-UHFFFAOYSA-N	1	0	292.427	1.953	50	0		CDAARO
[NH3+][C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCCC1	ZINC000011754554	356279277	/nfs/dbraw/zinc/27/92/77/356279277.db2.gz	JBIVCFFCONEPDR-ZDUSSCGKSA-N	1	0	257.337	1.660	50	0		CDAARO
CN1CCC([N@@H+]2CCC[C@@H](C(=O)NC3CCCC3)C2)CC1	ZINC000012706813	356319190	/nfs/dbraw/zinc/31/91/90/356319190.db2.gz	LVOMTRKEHLVGDJ-CQSZACIVSA-N	1	0	293.455	1.851	50	0		CDAARO
C[C@H](CN1CC[NH+](C)CC1)OC(=O)c1cccc(F)c1	ZINC000019360940	356483306	/nfs/dbraw/zinc/48/33/06/356483306.db2.gz	ODMNRTFCRVSWLT-GFCCVEGCSA-N	1	0	280.343	1.618	50	0		CDAARO
Brc1cccc(C[NH2+]CCN2CCOCC2)c1	ZINC000019872138	356512597	/nfs/dbraw/zinc/51/25/97/356512597.db2.gz	ZSZMJPXLLDZZQS-UHFFFAOYSA-N	1	0	299.212	1.871	50	0		CDAARO
O=C1C[C@H]([NH2+]C[C@H]2CCCO2)C(=O)N1c1ccc(F)cc1	ZINC000019720184	356496594	/nfs/dbraw/zinc/49/65/94/356496594.db2.gz	JWUKCIQEXQYHGG-OLZOCXBDSA-N	1	0	292.310	1.226	50	0		CDAARO
Nc1nnc(CC[N@@H+]2CCc3ccccc3C2)s1	ZINC000019735656	356498052	/nfs/dbraw/zinc/49/80/52/356498052.db2.gz	NTDWZCMAWKRRKD-UHFFFAOYSA-N	1	0	260.366	1.721	50	0		CDAARO
Nc1nc(Cl)cc(NC2CC[NH+](C3CC3)CC2)n1	ZINC000024056912	356651563	/nfs/dbraw/zinc/65/15/63/356651563.db2.gz	TVBPZVYSHMUOGU-UHFFFAOYSA-N	1	0	267.764	1.751	50	0		CDAARO
C[C@@H]1CCC[N@H+](CCOc2ccc(S(N)(=O)=O)cc2)C1	ZINC000027342104	356705871	/nfs/dbraw/zinc/70/58/71/356705871.db2.gz	UWXWPPFNGMCMRF-GFCCVEGCSA-N	1	0	298.408	1.445	50	0		CDAARO
C[C@@H]1C[C@@H]1C(=O)NCC[N@@H+]1CCc2ccccc2C1	ZINC000030363238	356749302	/nfs/dbraw/zinc/74/93/02/356749302.db2.gz	HRWDPCVTBZSRBY-DOMZBBRYSA-N	1	0	258.365	1.817	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)CCc2ccsc2)CC1	ZINC000032722037	356786078	/nfs/dbraw/zinc/78/60/78/356786078.db2.gz	RBPRWGWNXTZKOF-UHFFFAOYSA-N	1	0	252.383	1.845	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)NC1CC1)c1ccc2c(c1)OCO2	ZINC000036075822	356858437	/nfs/dbraw/zinc/85/84/37/356858437.db2.gz	QDNNWRHLWDTEGE-GFCCVEGCSA-N	1	0	291.351	1.480	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H](O)[C@H]([NH+]2CCc3ccccc3CC2)C1	ZINC000079437113	538753708	/nfs/dbraw/zinc/75/37/08/538753708.db2.gz	ALBKJDCBTBGXHD-ARFHVFGLSA-N	1	0	289.375	1.400	50	0		CDAARO
Cc1cn2c(n1)[C@@H](C[NH2+]Cc1ccc(C(N)=O)cc1)CCC2	ZINC000084257770	357121023	/nfs/dbraw/zinc/12/10/23/357121023.db2.gz	LGXQDCOBIBFFOI-OAHLLOKOSA-N	1	0	298.390	1.958	50	0		CDAARO
COc1cc(C[NH2+]C2CCN(C)CC2)cc2c1OCO2	ZINC000015525091	357454901	/nfs/dbraw/zinc/45/49/01/357454901.db2.gz	WKSAPBMCINNQDO-UHFFFAOYSA-N	1	0	278.352	1.608	50	0		CDAARO
CCOC(=O)c1nn(CCC(F)(F)F)c2c1C[NH2+]CC2	ZINC000065394171	357535792	/nfs/dbraw/zinc/53/57/92/357535792.db2.gz	PTFNEBWBBMNLGT-UHFFFAOYSA-N	1	0	291.273	1.658	50	0		CDAARO
C[N@@H+]1CCC2(C1)CCN(C(=O)NCc1ccco1)CC2	ZINC000065395564	357536426	/nfs/dbraw/zinc/53/64/26/357536426.db2.gz	RORBNSITJDXKGL-UHFFFAOYSA-N	1	0	277.368	1.907	50	0		CDAARO
CNc1ccnc(N(C)C[C@H]2CCC[N@H+](CCOC)C2)n1	ZINC000065396812	357536971	/nfs/dbraw/zinc/53/69/71/357536971.db2.gz	JYUKITHCNMJTRX-CYBMUJFWSA-N	1	0	293.415	1.313	50	0		CDAARO
Cc1c(CN(C)c2nc(N(C)C)[nH+]c(C)c2C)cnn1C	ZINC000065428699	357541617	/nfs/dbraw/zinc/54/16/17/357541617.db2.gz	IQXNGNMRXSWLLN-UHFFFAOYSA-N	1	0	288.399	1.838	50	0		CDAARO
CCCn1nccc1C(=O)NC[C@@H]1CCC[N@H+](CC)C1	ZINC000067673218	357617719	/nfs/dbraw/zinc/61/77/19/357617719.db2.gz	BUMNZRLQQAFOFZ-ZDUSSCGKSA-N	1	0	278.400	1.755	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)O[C@H](C(=O)N(C)C)C(C)C	ZINC000408525645	357643613	/nfs/dbraw/zinc/64/36/13/357643613.db2.gz	NLQFVRDPQWXXCB-JSGCOSHPSA-N	1	0	286.416	1.654	50	0		CDAARO
CN(CCc1ccccc1)c1cc(CC[NH3+])ncn1	ZINC000067855251	357632536	/nfs/dbraw/zinc/63/25/36/357632536.db2.gz	ARYREXDNNWXXLM-UHFFFAOYSA-N	1	0	256.353	1.657	50	0		CDAARO
CC(C)c1cc(C(=O)NCC[C@H]2CCC[N@@H+]2C)n(C)n1	ZINC000072422296	357834050	/nfs/dbraw/zinc/83/40/50/357834050.db2.gz	DGIIHZLSNSFFMC-GFCCVEGCSA-N	1	0	278.400	1.758	50	0		CDAARO
COC(=O)C1(C[NH2+]Cc2nccn2C)CCCCC1	ZINC000097108669	357984385	/nfs/dbraw/zinc/98/43/85/357984385.db2.gz	IJYUPQNFTZAABY-UHFFFAOYSA-N	1	0	265.357	1.633	50	0		CDAARO
CC[C@]1(C)NC(=O)N(CCCNc2cccc(C)[nH+]2)C1=O	ZINC000097163304	358004924	/nfs/dbraw/zinc/00/49/24/358004924.db2.gz	ALFLQVDYYGOBNP-HNNXBMFYSA-N	1	0	290.367	1.913	50	0		CDAARO
Cc1c[nH]c(C(=O)N2CCCC[C@H]([NH+](C)C)C2)n1	ZINC000082120945	358148002	/nfs/dbraw/zinc/14/80/02/358148002.db2.gz	AMXKCEBPSAZDSU-NSHDSACASA-N	1	0	250.346	1.274	50	0		CDAARO
O=C(NCc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc[nH]1	ZINC000097081787	358164705	/nfs/dbraw/zinc/16/47/05/358164705.db2.gz	TYLANFSVIJPHOK-OAHLLOKOSA-N	1	0	299.374	1.511	50	0		CDAARO
Cc1cc(N2CC[C@H](CNc3ccccn3)C2)nc(N)[nH+]1	ZINC000097200867	358188707	/nfs/dbraw/zinc/18/87/07/358188707.db2.gz	SJBSXYWSINWTSP-GFCCVEGCSA-N	1	0	284.367	1.701	50	0		CDAARO
COC(=O)CN1CCC([NH2+][C@@H](C)c2cccc(O)c2)CC1	ZINC000195023725	358547883	/nfs/dbraw/zinc/54/78/83/358547883.db2.gz	ZJCODRHSFBLVCL-LBPRGKRZSA-N	1	0	292.379	1.680	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNc1ncc(F)c(N(C)C)n1	ZINC000095365585	358686330	/nfs/dbraw/zinc/68/63/30/358686330.db2.gz	UCDWVUZKRYHKFS-JTQLQIEISA-N	1	0	267.352	1.578	50	0		CDAARO
COc1ccc2c(c1)CC[N@H+]([C@@H](C)C(=O)NC1CC1)CC2	ZINC000095368490	358687474	/nfs/dbraw/zinc/68/74/74/358687474.db2.gz	JEEMTAKLOBNSNV-LBPRGKRZSA-N	1	0	288.391	1.763	50	0		CDAARO
Cc1nnc(CCNC(=O)CC[C@@H]2CCC[N@@H+](C)C2)s1	ZINC000095371978	358687816	/nfs/dbraw/zinc/68/78/16/358687816.db2.gz	XLPUHCZSMQTJAD-LBPRGKRZSA-N	1	0	296.440	1.627	50	0		CDAARO
Cc1nonc1OCCNC(=O)CC[C@H]1CCCC[N@H+]1C	ZINC000095372923	358688343	/nfs/dbraw/zinc/68/83/43/358688343.db2.gz	NPGDANDYTQCBKH-GFCCVEGCSA-N	1	0	296.371	1.138	50	0		CDAARO
CCCCSc1nc(N)cc(N2CC[C@H](C[NH3+])C2)n1	ZINC000095379932	358689506	/nfs/dbraw/zinc/68/95/06/358689506.db2.gz	ZTNLADYXNAAHPR-SNVBAGLBSA-N	1	0	281.429	1.736	50	0		CDAARO
CN(C)c1ccc(C(=O)N2CCC[N@H+](C)CC2)c(F)c1	ZINC000095433467	358694084	/nfs/dbraw/zinc/69/40/84/358694084.db2.gz	RRCIWHVJMZEHGS-UHFFFAOYSA-N	1	0	279.359	1.669	50	0		CDAARO
COc1nccnc1N1CC([N@@H+]2CCCC[C@@H]2C)C1	ZINC000096138474	358709557	/nfs/dbraw/zinc/70/95/57/358709557.db2.gz	NYIHCTMWRCCUKH-NSHDSACASA-N	1	0	262.357	1.548	50	0		CDAARO
O[C@@H](Cn1cccn1)C[N@@H+]1CCC[C@H]1Cc1ccccc1	ZINC000247798309	358784427	/nfs/dbraw/zinc/78/44/27/358784427.db2.gz	SVAPIBULUZOITC-DLBZAZTESA-N	1	0	285.391	1.951	50	0		CDAARO
CC(C)c1ocnc1C(=O)NCc1cc2n(n1)CC[NH2+]C2	ZINC000097601037	358787368	/nfs/dbraw/zinc/78/73/68/358787368.db2.gz	QTQGHSKMZHQWNK-UHFFFAOYSA-N	1	0	289.339	1.028	50	0		CDAARO
Cc1cccc2[nH]c(CCNC(=O)C[NH+]3CCCC3)nc21	ZINC000214981371	358866701	/nfs/dbraw/zinc/86/67/01/358866701.db2.gz	YOHDYOOWNBFDPM-UHFFFAOYSA-N	1	0	286.379	1.626	50	0		CDAARO
Cc1n[nH]c(C)c1C[N@H+]1C[C@H]2CC[C@@H](C1)N(C)C2=O	ZINC000215947102	358911310	/nfs/dbraw/zinc/91/13/10/358911310.db2.gz	AEVXTMMYMJMDBS-NEPJUHHUSA-N	1	0	262.357	1.079	50	0		CDAARO
Cc1ocnc1C(=O)N1CC([N@H+]2CCCC[C@H]2C)C1	ZINC000216067549	358921948	/nfs/dbraw/zinc/92/19/48/358921948.db2.gz	ASNXDZXTHLWBOB-SNVBAGLBSA-N	1	0	263.341	1.682	50	0		CDAARO
O=C(c1ccnnc1)N1CC[C@H]([NH+]2CCCCC2)C1	ZINC000219117199	359078660	/nfs/dbraw/zinc/07/86/60/359078660.db2.gz	ZHOVXNJCNWRRCJ-ZDUSSCGKSA-N	1	0	260.341	1.177	50	0		CDAARO
CC[C@@H](NC(=O)CCC[NH+]1CCCC1)c1ccnn1C	ZINC000219370497	359092303	/nfs/dbraw/zinc/09/23/03/359092303.db2.gz	CPULGNGIYXAEPB-CYBMUJFWSA-N	1	0	278.400	1.863	50	0		CDAARO
CC(C)[NH2+]C[C@H](O)COc1ccc2c(c1)OCO2	ZINC000032107820	359186431	/nfs/dbraw/zinc/18/64/31/359186431.db2.gz	IMTBFKDWVMMLFN-JTQLQIEISA-N	1	0	253.298	1.153	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)C(=O)c1cccnc1	ZINC000221228957	359219178	/nfs/dbraw/zinc/21/91/78/359219178.db2.gz	COSUCZXCNKSPNQ-UHFFFAOYSA-N	1	0	284.319	1.196	50	0		CDAARO
Cc1ccnn1CCC(=O)N1CC([NH+]2CCCCC2)C1	ZINC000223801638	359458445	/nfs/dbraw/zinc/45/84/45/359458445.db2.gz	DFXROCBYEZIOFB-UHFFFAOYSA-N	1	0	276.384	1.278	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)c2nccc3ccccc32)C[C@H]1CO	ZINC000257192015	359590636	/nfs/dbraw/zinc/59/06/36/359590636.db2.gz	QDROBGSQRPBVOX-DZGCQCFKSA-N	1	0	299.374	1.229	50	0		CDAARO
Cc1ccc(C[N@@H+]2CCCOCCNC(=O)CC2)o1	ZINC000257197003	359629223	/nfs/dbraw/zinc/62/92/23/359629223.db2.gz	ZGWNQWVDWJEULA-UHFFFAOYSA-N	1	0	266.341	1.317	50	0		CDAARO
Nc1nc2c(c(NCCCc3ccccn3)n1)CC[NH2+]CC2	ZINC000072422117	359893625	/nfs/dbraw/zinc/89/36/25/359893625.db2.gz	WQAVAUIJPYQKRU-UHFFFAOYSA-N	1	0	298.394	1.187	50	0		CDAARO
CCOC[C@H]1CCN(C(=O)CC[NH+](CC)CC)C1	ZINC000408522256	359922303	/nfs/dbraw/zinc/92/23/03/359922303.db2.gz	GGYFTRMSAKKERP-ZDUSSCGKSA-N	1	0	256.390	1.603	50	0		CDAARO
Cc1nc(C)n(C[C@@H]2CCCN2[C@H](C)c2nnc(C)o2)n1	ZINC000257365698	359946367	/nfs/dbraw/zinc/94/63/67/359946367.db2.gz	HCGXFYATIPCHGH-RNCFNFMXSA-N	1	0	290.371	1.812	50	0		CDAARO
NC(=O)[C@@H]1C[C@H](Oc2ccccc2)C[N@@H+]1C1CCCC1	ZINC000409421532	360231478	/nfs/dbraw/zinc/23/14/78/360231478.db2.gz	VRHSHDXYVNZNAD-GJZGRUSLSA-N	1	0	274.364	1.936	50	0		CDAARO
c1cc(COC[C@@H]2C[NH2+]CC23CCOCC3)ccn1	ZINC000409421629	360231933	/nfs/dbraw/zinc/23/19/33/360231933.db2.gz	RJFAIEXJSRJYFR-AWEZNQCLSA-N	1	0	262.353	1.614	50	0		CDAARO
CC[C@H]1CN(C(=O)CO)CC[N@@H+]1Cc1ccccc1	ZINC000274125306	363712508	/nfs/dbraw/zinc/71/25/08/363712508.db2.gz	BLOQCUITSAGGST-AWEZNQCLSA-N	1	0	262.353	1.102	50	0		CDAARO
O=C1NCC[C@@H]1[NH+]1CCC(COc2ccccc2)CC1	ZINC000178192966	189096700	/nfs/dbraw/zinc/09/67/00/189096700.db2.gz	GEZNEAQQNJNSOD-HNNXBMFYSA-N	1	0	274.364	1.666	50	0		CDAARO
CC[C@H](O)CSc1nnc(C[NH3+])n1Cc1ccccc1	ZINC000426503487	360677845	/nfs/dbraw/zinc/67/78/45/360677845.db2.gz	JUDXQHANOLGIRN-LBPRGKRZSA-N	1	0	292.408	1.648	50	0		CDAARO
C[NH2+]Cc1nnc(SC[C@@H]2CC(F)(F)C2(F)F)n1C	ZINC000426530794	360680875	/nfs/dbraw/zinc/68/08/75/360680875.db2.gz	KBGJQVTZNUNNOC-LURJTMIESA-N	1	0	298.309	1.917	50	0		CDAARO
CCCC[C@H](Sc1nnc(C[NH3+])n1C)C(=O)OC	ZINC000426599477	360687828	/nfs/dbraw/zinc/68/78/28/360687828.db2.gz	DHSWAXVCQADYNG-QMMMGPOBSA-N	1	0	272.374	1.098	50	0		CDAARO
CC[C@H](Sc1nnc(C[NH3+])n1C)C(=O)NC(C)(C)C	ZINC000426634053	360691714	/nfs/dbraw/zinc/69/17/14/360691714.db2.gz	UCLGRLPDFYOKPO-QMMMGPOBSA-N	1	0	285.417	1.059	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1ccc2ncsc2c1	ZINC000178498209	189120860	/nfs/dbraw/zinc/12/08/60/189120860.db2.gz	PUTVAYRKXNKFEM-VIFPVBQESA-N	1	0	261.350	1.730	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2cccc(OC)c2)n1C	ZINC000426430748	360669019	/nfs/dbraw/zinc/66/90/19/360669019.db2.gz	OIHDHHWHPWMFIW-UHFFFAOYSA-N	1	0	278.381	1.835	50	0		CDAARO
Cc1csc(CCCNC(=O)[C@@H](C)[NH+](C)C)n1	ZINC000426443393	360670577	/nfs/dbraw/zinc/67/05/77/360670577.db2.gz	ODSMHJQSBQWCEU-SNVBAGLBSA-N	1	0	255.387	1.450	50	0		CDAARO
Cc1ccc(C)c(OCCC(=O)N2CC[C@@H](C[NH3+])C2)c1	ZINC000178546375	189125931	/nfs/dbraw/zinc/12/59/31/189125931.db2.gz	XWLOUNUQTHGTNW-AWEZNQCLSA-N	1	0	276.380	1.880	50	0		CDAARO
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[C@@H](C[NH3+])C2)c1	ZINC000246662990	360907449	/nfs/dbraw/zinc/90/74/49/360907449.db2.gz	DPRVYRVTQLZBDW-TUKIKUTGSA-N	1	0	274.364	1.606	50	0		CDAARO
COCCC[N@@H+](Cc1cccn1C)C[C@@H](O)COC(C)C	ZINC000036098181	360908913	/nfs/dbraw/zinc/90/89/13/360908913.db2.gz	LNTDZPJXXDDNDI-MRXNPFEDSA-N	1	0	298.427	1.650	50	0		CDAARO
COCCC[N@@H+](Cc1ccco1)C[C@@H](O)COC(C)C	ZINC000036096449	360911399	/nfs/dbraw/zinc/91/13/99/360911399.db2.gz	NURDMHYLEPOZLJ-CQSZACIVSA-N	1	0	285.384	1.904	50	0		CDAARO
Cc1ccc(F)cc1C[N@@H+]1CCCN(C(N)=O)CC1	ZINC000180023538	189233478	/nfs/dbraw/zinc/23/34/78/189233478.db2.gz	PTVDQYKAWPEDFK-UHFFFAOYSA-N	1	0	265.332	1.721	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2[nH]cc(C)c(=O)c2C)n1C	ZINC000426641533	361330493	/nfs/dbraw/zinc/33/04/93/361330493.db2.gz	MOARWYUMSCKFMM-UHFFFAOYSA-N	1	0	293.396	1.132	50	0		CDAARO
OCC[NH2+]CCOc1ccc(Cl)cc1Cl	ZINC000002932754	364656617	/nfs/dbraw/zinc/65/66/17/364656617.db2.gz	RKZYAOUKGOGLMR-UHFFFAOYSA-N	1	0	250.125	1.954	50	0		CDAARO
O[C@H]1CCCC[C@@H]1[NH+]1CCN(Cc2cscn2)CC1	ZINC000089764774	366930636	/nfs/dbraw/zinc/93/06/36/366930636.db2.gz	CXDOATPSQASQCR-KBPBESRZSA-N	1	0	281.425	1.564	50	0		CDAARO
c1cc(CC[N@@H+]2CCOC3(CCOCC3)C2)ccn1	ZINC000089884941	366955260	/nfs/dbraw/zinc/95/52/60/366955260.db2.gz	SKGKQBFQXWEMTK-UHFFFAOYSA-N	1	0	262.353	1.506	50	0		CDAARO
O=C1C[C@H]([NH2+]C[C@@H](c2ccco2)N2CCCC2)CCCN1	ZINC000630060068	366974386	/nfs/dbraw/zinc/97/43/86/366974386.db2.gz	GZHQSVKNUQZXHR-KGLIPLIRSA-N	1	0	291.395	1.675	50	0		CDAARO
CCC(=O)N1CC[C@@H]([NH2+]Cc2ncc[nH]2)[C@H](CC)C1	ZINC000089948781	366977354	/nfs/dbraw/zinc/97/73/54/366977354.db2.gz	UOVWEDSHSYVXLW-VXGBXAGGSA-N	1	0	264.373	1.536	50	0		CDAARO
C[C@H](CNC(=O)Cn1cccn1)[N@@H+]1CCCC[C@H]1C	ZINC000252463421	367474885	/nfs/dbraw/zinc/47/48/85/367474885.db2.gz	NYEWHTOOULEIJI-CHWSQXEVSA-N	1	0	264.373	1.262	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1C(=O)NCCC[C@@H]1CCCC[C@H]1O	ZINC000252515170	367734072	/nfs/dbraw/zinc/73/40/72/367734072.db2.gz	HSRYAQWTUWNIRM-BFHYXJOUSA-N	1	0	268.401	1.528	50	0		CDAARO
C[N@H+](CCNC(=O)N[C@@H]1[C@H]2CCO[C@H]2C1(C)C)C1CC1	ZINC000252517857	367743042	/nfs/dbraw/zinc/74/30/42/367743042.db2.gz	SWCPTBHNEWPFRO-JHJVBQTASA-N	1	0	281.400	1.193	50	0		CDAARO
O[C@@H]1CC[N@@H+](C2CCN(c3nccs3)CC2)C1	ZINC000575607227	370617472	/nfs/dbraw/zinc/61/74/72/370617472.db2.gz	XCCTURGRSCMEET-LLVKDONJSA-N	1	0	253.371	1.179	50	0		CDAARO
Cc1n[nH]nc1C(=O)N1CCC([C@H](C)[NH+]2CCCC2)CC1	ZINC000299770328	372750498	/nfs/dbraw/zinc/75/04/98/372750498.db2.gz	RUOAAJGYEXJXPJ-LBPRGKRZSA-N	1	0	291.399	1.450	50	0		CDAARO
COc1ccc(OCCC[NH3+])c(C(=O)NC2(C)CC2)c1	ZINC000299774225	372752336	/nfs/dbraw/zinc/75/23/36/372752336.db2.gz	AHDPXRBCWWORBU-UHFFFAOYSA-N	1	0	278.352	1.705	50	0		CDAARO
COCCN(Cc1nnc(C)s1)C[C@@H]1CCCO1	ZINC000299778858	372755244	/nfs/dbraw/zinc/75/52/44/372755244.db2.gz	IBDNGWGNVOITEQ-NSHDSACASA-N	1	0	271.386	1.474	50	0		CDAARO
CO[C@]12CC[N@H+](Cc3cc(C)no3)[C@H]1C[C@H](O)CC2	ZINC000299786996	372761300	/nfs/dbraw/zinc/76/13/00/372761300.db2.gz	SISPVXZRWFMICI-KWCYVHTRSA-N	1	0	266.341	1.487	50	0		CDAARO
COc1cccnc1C[N@@H+]1CC[C@]2(OC)CC[C@@H](O)C[C@H]12	ZINC000299785891	372761613	/nfs/dbraw/zinc/76/16/13/372761613.db2.gz	OJSLMVSIRZYMNT-UHOFOFEASA-N	1	0	292.379	1.595	50	0		CDAARO
COC(=O)c1cc(C[NH3+])cc(NC(=O)c2ccco2)c1	ZINC000299793136	372767249	/nfs/dbraw/zinc/76/72/49/372767249.db2.gz	KLXXOMJIPXESIR-UHFFFAOYSA-N	1	0	274.276	1.777	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@@H](CNC(=O)CCc2cn[nH]c2)C1	ZINC000299798393	372769217	/nfs/dbraw/zinc/76/92/17/372769217.db2.gz	RODJATATOMVEQO-ZDUSSCGKSA-N	1	0	278.400	1.579	50	0		CDAARO
Cc1nc(C(=O)NC[C@@H]2CCC3(CC[NH2+]CC3)O2)cs1	ZINC000299799356	372771238	/nfs/dbraw/zinc/77/12/38/372771238.db2.gz	RAKHPSWREJZJKR-NSHDSACASA-N	1	0	295.408	1.483	50	0		CDAARO
C[C@H](c1nc2ccccc2c(=O)[nH]1)N1CC[NH2+][C@H](C)C1	ZINC000299804311	372773365	/nfs/dbraw/zinc/77/33/65/372773365.db2.gz	RSFRCTXPXJXUMD-GHMZBOCLSA-N	1	0	272.352	1.690	50	0		CDAARO
CCCC(=O)N1CCC([NH2+][C@@H](CC)[C@H]2C[C@H](O)C2)CC1	ZINC000244873444	189914109	/nfs/dbraw/zinc/91/41/09/189914109.db2.gz	WQNSZHXBHQPTLZ-QEJZJMRPSA-N	1	0	282.428	1.917	50	0		CDAARO
C[C@H](C[NH2+][C@@H]1[C@@H]2CCCO[C@H]2C1(C)C)N1CCOC[C@@H]1C	ZINC000253370238	373679650	/nfs/dbraw/zinc/67/96/50/373679650.db2.gz	OCUWOJHJGIJUTM-LYYZXLFJSA-N	1	0	296.455	1.889	50	0		CDAARO
CC(C)N1CC[C@H]([NH2+][C@@H]2[C@H]3CCO[C@H]3C2(C)C)C1=O	ZINC000253370693	373679758	/nfs/dbraw/zinc/67/97/58/373679758.db2.gz	UYKYTYGNRCVPIW-YVECIDJPSA-N	1	0	266.385	1.399	50	0		CDAARO
C[NH+](C)[C@@H]1CCN(C(=O)[C@](C)(O)CCc2ccccc2)C1	ZINC000253392251	373681193	/nfs/dbraw/zinc/68/11/93/373681193.db2.gz	HHICDLAAOORSGV-NVXWUHKLSA-N	1	0	290.407	1.533	50	0		CDAARO
C[C@H]1CN(CC[N@@H+]2CCCC[C@H]2c2ccnn2C)CCO1	ZINC000253398430	373685353	/nfs/dbraw/zinc/68/53/53/373685353.db2.gz	POSADKDFIMECRH-HOCLYGCPSA-N	1	0	292.427	1.668	50	0		CDAARO
COc1cccc(C[NH2+]CC2(O)CCOCC2)c1OC	ZINC000112717016	374227218	/nfs/dbraw/zinc/22/72/18/374227218.db2.gz	HTMPKXBCUQRQMF-UHFFFAOYSA-N	1	0	281.352	1.335	50	0		CDAARO
Cn1c(C[NH2+][C@H]2CCCC[C@@H]2O)nc2ccccc21	ZINC000104313580	374267547	/nfs/dbraw/zinc/26/75/47/374267547.db2.gz	OJLPVMGSZNPXDL-JSGCOSHPSA-N	1	0	259.353	1.966	50	0		CDAARO
CC(C)c1cccc(S(=O)(=O)N[C@@H](C[NH3+])C2CC2)c1	ZINC000124649486	374833573	/nfs/dbraw/zinc/83/35/73/374833573.db2.gz	SGSRAEFHOKHKES-AWEZNQCLSA-N	1	0	282.409	1.826	50	0		CDAARO
Cc1cc(C(=O)N2CCN(c3cc[nH+]cc3)CC2)on1	ZINC000095957209	375040994	/nfs/dbraw/zinc/04/09/94/375040994.db2.gz	QRBTVSFNBFWMAZ-UHFFFAOYSA-N	1	0	272.308	1.340	50	0		CDAARO
CNc1cc(N2CCC([C@H](C)[NH+](C)C)CC2)nc(N)n1	ZINC000096152861	375060410	/nfs/dbraw/zinc/06/04/10/375060410.db2.gz	OSBBKYSNYKZRDF-JTQLQIEISA-N	1	0	278.404	1.267	50	0		CDAARO
COC1(CNC(=O)N[C@@H]2CC[C@H]([NH+](C)C)C2)CCC1	ZINC000097055301	375142679	/nfs/dbraw/zinc/14/26/79/375142679.db2.gz	HZIBXRDLVHMJDC-NEPJUHHUSA-N	1	0	269.389	1.337	50	0		CDAARO
[NH3+][C@@H]1CCC[C@@H]1C(=O)N1CCO[C@H](c2ccccc2F)C1	ZINC000299738760	375199393	/nfs/dbraw/zinc/19/93/93/375199393.db2.gz	GBYRNDBEYGRGGH-CFVMTHIKSA-N	1	0	292.354	1.853	50	0		CDAARO
[NH3+][C@@H]1CCC[C@H]1C(=O)N1CCO[C@H](c2ccccc2F)C1	ZINC000299738761	375199852	/nfs/dbraw/zinc/19/98/52/375199852.db2.gz	GBYRNDBEYGRGGH-YUELXQCFSA-N	1	0	292.354	1.853	50	0		CDAARO
O=C(NC[C@H](O)c1ccccc1Cl)[C@H]1CCCC[NH2+]1	ZINC000299738871	375199857	/nfs/dbraw/zinc/19/98/57/375199857.db2.gz	HMLSDTNZZCDABP-OLZOCXBDSA-N	1	0	282.771	1.632	50	0		CDAARO
C[C@@H]1CN(C(=O)CO[C@H]2CCC[C@@H](C)C2)C[C@H]1[NH+](C)C	ZINC000299753990	375208607	/nfs/dbraw/zinc/20/86/07/375208607.db2.gz	FSLIQTBXLQIBFL-APIJFGDWSA-N	1	0	282.428	1.990	50	0		CDAARO
C[C@@H]1CN(CCSc2nnnn2C(C)(C)C)CCO1	ZINC000188275491	375663143	/nfs/dbraw/zinc/66/31/43/375663143.db2.gz	QXDRWHNRCGNWBN-SNVBAGLBSA-N	1	0	285.417	1.241	50	0		CDAARO
C[C@H]([NH2+]CCO)C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000004311027	375961886	/nfs/dbraw/zinc/96/18/86/375961886.db2.gz	ZAGOLSFRPKKKEZ-OWWVKFPZSA-N	1	0	251.370	1.742	50	0		CDAARO
[NH2+]=C1S[C@H]2CS(=O)(=O)C[C@H]2N1Cc1ccccc1	ZINC000004226903	376699863	/nfs/dbraw/zinc/69/98/63/376699863.db2.gz	YWVLQFWRKMBPBJ-MNOVXSKESA-N	1	0	282.390	1.336	50	0		CDAARO
Cc1ccc(CS(=O)(=O)N(C)CC[NH+]2CCCC2)cc1	ZINC000074917826	376921227	/nfs/dbraw/zinc/92/12/27/376921227.db2.gz	LXITXAAGIPIRCX-UHFFFAOYSA-N	1	0	296.436	1.852	50	0		CDAARO
CC(C)C(=O)N[C@H]1CCC[N@H+](CCOC[C@H]2CCCO2)C1	ZINC000245289733	378047392	/nfs/dbraw/zinc/04/73/92/378047392.db2.gz	DSVMEOMJTYDWEQ-LSDHHAIUSA-N	1	0	298.427	1.419	50	0		CDAARO
O=C1CC[C@@H]([NH2+][C@H]2CCCOc3ccc(F)cc32)CN1	ZINC000098020490	296326020	/nfs/dbraw/zinc/32/60/20/296326020.db2.gz	SAQAQIVVWOIHAD-YPMHNXCESA-N	1	0	278.327	1.908	50	0		CDAARO
CCOc1c(CNC(=O)C2([NH3+])CC2)cccc1OC	ZINC000071753854	256878609	/nfs/dbraw/zinc/87/86/09/256878609.db2.gz	IVYZVUOOBQCWQS-UHFFFAOYSA-N	1	0	264.325	1.201	50	0		CDAARO
O[C@H](C[NH+]1CCC2(CC1)OCCO2)c1ccc(F)cc1	ZINC000026936788	285349831	/nfs/dbraw/zinc/34/98/31/285349831.db2.gz	IOMVXYCMCCYMHH-CQSZACIVSA-N	1	0	281.327	1.698	50	0		CDAARO
CCC(=O)Nc1nc2ccccc2n1CC[NH+](C)C	ZINC000000186879	390134994	/nfs/dbraw/zinc/13/49/94/390134994.db2.gz	JOGLKQVOQFGULA-UHFFFAOYSA-N	1	0	260.341	1.946	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1cc(F)c(F)cc1F	ZINC000095432154	184982322	/nfs/dbraw/zinc/98/23/22/184982322.db2.gz	KHYWGRNRJXBATI-SSDOTTSWSA-N	1	0	296.314	1.510	50	0		CDAARO
Cc1ccc(N2CC[C@H]([N@@H+]3CC[C@H](CCO)C3)C2=O)cc1	ZINC000096424550	390516434	/nfs/dbraw/zinc/51/64/34/390516434.db2.gz	HIDISNYLAILDFY-ZBFHGGJFSA-N	1	0	288.391	1.805	50	0		CDAARO
COCc1ccc([C@@H]2CCCN2C(=O)C[NH+](C)C)o1	ZINC000097095571	390676654	/nfs/dbraw/zinc/67/66/54/390676654.db2.gz	MQPJHJPFLNWVSM-LBPRGKRZSA-N	1	0	266.341	1.651	50	0		CDAARO
CC(C)NC(=O)C[NH2+]Cc1cn(C)nc1-c1cccnc1	ZINC000097159688	390801028	/nfs/dbraw/zinc/80/10/28/390801028.db2.gz	FLVZHNXHVHXRMI-UHFFFAOYSA-N	1	0	287.367	1.096	50	0		CDAARO
O=C(N[C@@H]1CC[NH2+]C1)c1cnc(-c2ccncc2)s1	ZINC000178452842	390912358	/nfs/dbraw/zinc/91/23/58/390912358.db2.gz	ZFSWSQCZPWUQCY-SNVBAGLBSA-N	1	0	274.349	1.297	50	0		CDAARO
C[C@@H](C[NH+]1CCCC1)c1nc(C2CC2)nn1CCO	ZINC000096151056	390912921	/nfs/dbraw/zinc/91/29/21/390912921.db2.gz	IYSXGNNZEBZPGG-NSHDSACASA-N	1	0	264.373	1.347	50	0		CDAARO
C[C@@H]1CCCC[C@H]1C[NH2+]C1CCN(CC(N)=O)CC1	ZINC000096502303	533600132	/nfs/dbraw/zinc/60/01/32/533600132.db2.gz	DABRLKDINQQCDA-OLZOCXBDSA-N	1	0	267.417	1.352	50	0		CDAARO
OC[C@@]1([NH2+]C2CCN(Cc3ccccc3)CC2)CCOC1	ZINC000186650230	391345462	/nfs/dbraw/zinc/34/54/62/391345462.db2.gz	RXRCMIWNOFYDQK-KRWDZBQOSA-N	1	0	290.407	1.392	50	0		CDAARO
C[C@@H]1C[C@@H](NCc2ccnc(N(C)C)n2)C[N@@H+]1C1CC1	ZINC000096493539	533652067	/nfs/dbraw/zinc/65/20/67/533652067.db2.gz	MWEFLYOLNIMECG-DGCLKSJQSA-N	1	0	275.400	1.257	50	0		CDAARO
C[C@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)N[C@@H]1CCCC[C@H]1C	ZINC000241157319	391680653	/nfs/dbraw/zinc/68/06/53/391680653.db2.gz	JWTQRGCFTWKXTK-BARDWOONSA-N	1	0	282.428	1.917	50	0		CDAARO
OCC[NH+]1CCC(CNc2ncccc2F)CC1	ZINC000439600598	392099359	/nfs/dbraw/zinc/09/93/59/392099359.db2.gz	WIVFBORGROMTDT-UHFFFAOYSA-N	1	0	253.321	1.337	50	0		CDAARO
Cc1nc2ccccc2c(=O)n1CCCn1ccnc1	ZINC000000181323	392724592	/nfs/dbraw/zinc/72/45/92/392724592.db2.gz	HPXWBMAYHXJEHQ-UHFFFAOYSA-N	1	0	268.320	1.992	50	0	biogenic	CDAARO
C[NH+](C)C[C@@H]1CCN(CCn2cc(Cl)cn2)C1	ZINC000459345586	393103831	/nfs/dbraw/zinc/10/38/31/393103831.db2.gz	NUISUICWTBTFBL-NSHDSACASA-N	1	0	256.781	1.420	50	0		CDAARO
CC(C)N1CC[C@@H]([N@H+](C)C[C@@H]2CCCOC2)C1=O	ZINC000095406531	393148421	/nfs/dbraw/zinc/14/84/21/393148421.db2.gz	QZQVVSPQQYPQHH-QWHCGFSZSA-N	1	0	254.374	1.354	50	0		CDAARO
Cc1nc2ncnn2c(N2CCC([NH2+]C3CC3)CC2)c1C	ZINC000084057747	135031320	/nfs/dbraw/zinc/03/13/20/135031320.db2.gz	CXBJCSHRMMFPHS-UHFFFAOYSA-N	1	0	286.383	1.462	50	0		CDAARO
O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCCO1	ZINC000093066123	135078915	/nfs/dbraw/zinc/07/89/15/135078915.db2.gz	UUJBHGOGIPLHGK-OAHLLOKOSA-N	1	0	289.379	1.593	50	0		CDAARO
Cc1cc(=O)c(C(=O)N2CC[C@H]([NH+]3CCCCC3)C2)c[nH]1	ZINC000220001313	140168443	/nfs/dbraw/zinc/16/84/43/140168443.db2.gz	YMZJYXGQCRMXBP-ZDUSSCGKSA-N	1	0	289.379	1.384	50	0		CDAARO
[NH3+]CCN(CCc1ccccc1)C(=O)[C@@H]1CCOC1	ZINC000261625036	140365556	/nfs/dbraw/zinc/36/55/56/140365556.db2.gz	ADORGRZGZRVJPF-CQSZACIVSA-N	1	0	262.353	1.053	50	0		CDAARO
Cc1ccc(CC(=O)NCC[N@@H+]2CCCC[C@@H]2CO)cc1	ZINC000067540868	292092003	/nfs/dbraw/zinc/09/20/03/292092003.db2.gz	LUPXBIGULNWEFZ-MRXNPFEDSA-N	1	0	290.407	1.501	50	0		CDAARO
Cc1c(NC(=O)C[C@@H]([NH3+])c2ccccc2)cnn1C	ZINC000178815299	148090315	/nfs/dbraw/zinc/09/03/15/148090315.db2.gz	MPBPJAQMTWFCJM-GFCCVEGCSA-N	1	0	258.325	1.757	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+]C[C@H](O)COC)C12CCCCC2	ZINC000087301415	286285127	/nfs/dbraw/zinc/28/51/27/286285127.db2.gz	CMLARJRSBFUGMT-BFHYXJOUSA-N	1	0	271.401	1.711	50	0		CDAARO
CCC[NH+]1CCC(N(C)C(=O)C[C@@H]2CCCC(=O)N2)CC1	ZINC000367298158	159466438	/nfs/dbraw/zinc/46/64/38/159466438.db2.gz	BEXQPIQQDMZBLA-ZDUSSCGKSA-N	1	0	295.427	1.378	50	0		CDAARO
CN(C(=O)c1ccc2nccnc2c1)C1CC[NH+](C)CC1	ZINC000004821192	170023233	/nfs/dbraw/zinc/02/32/33/170023233.db2.gz	ACQDFSSIKDIHCT-UHFFFAOYSA-N	1	0	284.363	1.796	50	0		CDAARO
CCOC(=O)CC[N@@H+]1CCC[C@H]1CC(=O)OCC	ZINC000004973180	170047187	/nfs/dbraw/zinc/04/71/87/170047187.db2.gz	RSMIWMXMSGRQMM-NSHDSACASA-N	1	0	257.330	1.357	50	0		CDAARO
COc1ccc(OC[C@@H](O)C[NH2+]C2CCCC2)cc1	ZINC000005050858	170061196	/nfs/dbraw/zinc/06/11/96/170061196.db2.gz	AVAOEPBPSCNXFA-ZDUSSCGKSA-N	1	0	265.353	1.967	50	0		CDAARO
COc1cccc(C[NH+]2CCC(C(N)=O)CC2)c1OC	ZINC000006458197	170202750	/nfs/dbraw/zinc/20/27/50/170202750.db2.gz	XUUYBTUFJSRVEZ-UHFFFAOYSA-N	1	0	278.352	1.401	50	0		CDAARO
Cc1cccc(O[C@H](C)C(=O)NCCC[NH+](C)C)c1	ZINC000008320851	170330848	/nfs/dbraw/zinc/33/08/48/170330848.db2.gz	DOAJKIRXCVNLKR-CYBMUJFWSA-N	1	0	264.369	1.830	50	0		CDAARO
CCOc1cc2c(cc1C[NH2+]CCCO)O[C@H](C)C2	ZINC000020187736	171052604	/nfs/dbraw/zinc/05/26/04/171052604.db2.gz	DNGYHOIHJWYJPN-LLVKDONJSA-N	1	0	265.353	1.881	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNS(=O)(=O)c1ccc(N)cc1	ZINC000020281509	171132646	/nfs/dbraw/zinc/13/26/46/171132646.db2.gz	XWUHLWBFLJYXIV-LBPRGKRZSA-N	1	0	283.397	1.031	50	0		CDAARO
Cc1ccc(CN2CCN(C3CC[NH2+]CC3)C2=O)cc1	ZINC000021925730	171337262	/nfs/dbraw/zinc/33/72/62/171337262.db2.gz	YUWFJGCPCGBSSR-UHFFFAOYSA-N	1	0	273.380	1.985	50	0		CDAARO
O=c1c(CN2CC[NH2+]CC2)cc2cccc3c2n1CCC3	ZINC000022465692	171389014	/nfs/dbraw/zinc/38/90/14/171389014.db2.gz	INSZZUWSTXKVCC-UHFFFAOYSA-N	1	0	283.375	1.353	50	0		CDAARO
O=C(NCCN1CC[NH2+]CC1)Nc1cccc2ccccc21	ZINC000022594668	171393727	/nfs/dbraw/zinc/39/37/27/171393727.db2.gz	WJEIGWDCBQHYGM-UHFFFAOYSA-N	1	0	298.390	1.867	50	0		CDAARO
[NH3+][C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2Cl)C1	ZINC000036297000	172590206	/nfs/dbraw/zinc/59/02/06/172590206.db2.gz	QEIGVIMXQDLBBR-VIFPVBQESA-N	1	0	292.763	1.591	50	0		CDAARO
COc1ccccc1[C@H]1C[C@H]1C(=O)N1CC[NH2+]CC1	ZINC000038478364	174141998	/nfs/dbraw/zinc/14/19/98/174141998.db2.gz	GHTGTRWTBIXSFW-CHWSQXEVSA-N	1	0	260.337	1.231	50	0		CDAARO
Cc1nccn1C[C@@H](C)[NH2+]CCn1c(C)cc(C)nc1=O	ZINC000067819232	175794893	/nfs/dbraw/zinc/79/48/93/175794893.db2.gz	FONPFQPZMHPHGC-GFCCVEGCSA-N	1	0	289.383	1.043	50	0		CDAARO
CN1C[C@]2(CCC[N@H+](CCc3ccccn3)C2)OC1=O	ZINC000072125611	176320755	/nfs/dbraw/zinc/32/07/55/176320755.db2.gz	DRVIKEKMASYGFU-HNNXBMFYSA-N	1	0	275.352	1.541	50	0		CDAARO
CCCc1cnc(C)nc1NC[C@H]1C[NH2+]CCOC1	ZINC000072134720	176322170	/nfs/dbraw/zinc/32/21/70/176322170.db2.gz	HRBPQSXWJAXJFS-GFCCVEGCSA-N	1	0	264.373	1.385	50	0		CDAARO
O=C(C[C@H]1COCC[NH2+]1)Nc1ccc2ncsc2c1	ZINC000072150291	176326332	/nfs/dbraw/zinc/32/63/32/176326332.db2.gz	ZLPCDNNGIKGMJU-JTQLQIEISA-N	1	0	277.349	1.613	50	0		CDAARO
OCCNc1cc(-c2cccc3c2CC[NH2+]C3)ncn1	ZINC000072156782	176328902	/nfs/dbraw/zinc/32/89/02/176328902.db2.gz	MPFSQHBNARWQBL-UHFFFAOYSA-N	1	0	270.336	1.194	50	0		CDAARO
O=c1[nH]c(NCCCCc2ccccc2)nc2c1CC[NH2+]C2	ZINC000077320331	177252826	/nfs/dbraw/zinc/25/28/26/177252826.db2.gz	RUIGDKCUPFROCA-UHFFFAOYSA-N	1	0	298.390	1.850	50	0		CDAARO
COCc1cc(C[N@@H+]2CCOC[C@@H](CO)C2)ccc1OC	ZINC000077555739	177280755	/nfs/dbraw/zinc/28/07/55/177280755.db2.gz	MZEJDMIWBGBYTO-CQSZACIVSA-N	1	0	295.379	1.282	50	0		CDAARO
C[C@@H]1CN(C)c2ccccc2CN1C(=O)[C@H]1CC[NH2+]C1	ZINC000299738456	274341596	/nfs/dbraw/zinc/34/15/96/274341596.db2.gz	BACNUXLKWWPVLG-OLZOCXBDSA-N	1	0	273.380	1.463	50	0		CDAARO
CC1(C)C[N@H+](CCN2CCNC2=O)Cc2ccccc2O1	ZINC000289153178	276132354	/nfs/dbraw/zinc/13/23/54/276132354.db2.gz	ZRBASGOXHVVKFZ-UHFFFAOYSA-N	1	0	289.379	1.685	50	0		CDAARO
COC(=O)C1CC[NH+]([C@H]2COc3ccccc3C2)CC1	ZINC000012074576	277313638	/nfs/dbraw/zinc/31/36/38/277313638.db2.gz	QILXOKNFUYTIBO-CQSZACIVSA-N	1	0	275.348	1.875	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+]1C[C@@H]1CCCC[C@H]1C	ZINC000097108452	277370204	/nfs/dbraw/zinc/37/02/04/277370204.db2.gz	LHCNCBJSZGOJCB-VOAKCMCISA-N	1	0	255.358	1.421	50	0		CDAARO
C[C@@H](CCn1cncn1)[NH2+]C[C@@H]1COc2ccccc2O1	ZINC000095419260	278237250	/nfs/dbraw/zinc/23/72/50/278237250.db2.gz	UOIJTRKIQGUMGO-QWHCGFSZSA-N	1	0	288.351	1.486	50	0		CDAARO
CC1(C)CCC[C@H]1[NH2+]CC1CCS(=O)(=O)CC1	ZINC000090883122	278247936	/nfs/dbraw/zinc/24/79/36/278247936.db2.gz	SICMGVWAPRQZHK-GFCCVEGCSA-N	1	0	259.415	1.980	50	0		CDAARO
CC[N@H+](C)C[C@@]1(O)CCCN(CC2CCCCC2)C1=O	ZINC000012205481	279037810	/nfs/dbraw/zinc/03/78/10/279037810.db2.gz	AGWUNTCOTMTNGO-INIZCTEOSA-N	1	0	282.428	1.872	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+][C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000245629520	279045170	/nfs/dbraw/zinc/04/51/70/279045170.db2.gz	ZPCLXIWDZKCOCF-BPUTZDHNSA-N	1	0	288.391	1.945	50	0		CDAARO
CC[N@H+](CC(=O)N1CCC[C@@H](C2(C)OCCO2)C1)C1CC1	ZINC000097108135	279049711	/nfs/dbraw/zinc/04/97/11/279049711.db2.gz	XVSDCMBYINKCEQ-CYBMUJFWSA-N	1	0	296.411	1.472	50	0		CDAARO
CCOC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1[NH3+]	ZINC000072187474	279620641	/nfs/dbraw/zinc/62/06/41/279620641.db2.gz	ORRVKLSXTZZGJV-UWVGGRQHSA-N	1	0	272.345	1.134	50	0		CDAARO
CC[C@@H]([NH2+]C[C@H]1CCCO1)C(=O)Nc1cc(C)on1	ZINC000028624080	280190154	/nfs/dbraw/zinc/19/01/54/280190154.db2.gz	RPVQLHHCGROIMC-GHMZBOCLSA-N	1	0	267.329	1.469	50	0		CDAARO
C[C@@H]1CCCN(C(=O)CC[C@H]2CCOC2)[C@@H]1C[NH3+]	ZINC000247295626	280326468	/nfs/dbraw/zinc/32/64/68/280326468.db2.gz	ODOCEXYEGKZSBT-FRRDWIJNSA-N	1	0	254.374	1.389	50	0		CDAARO
Cc1cc(C(=O)N2CCC[C@H]2C[NH+]2CCCC2)no1	ZINC000066944728	280327422	/nfs/dbraw/zinc/32/74/22/280327422.db2.gz	SWOSDVOLRPSLTO-LBPRGKRZSA-N	1	0	263.341	1.683	50	0		CDAARO
Cc1cccc(C)c1NC(=O)N[C@@H]1C[NH2+]CC[C@H]1O	ZINC000299764183	281209063	/nfs/dbraw/zinc/20/90/63/281209063.db2.gz	XUJZZWYTEVUXFA-VXGBXAGGSA-N	1	0	263.341	1.148	50	0		CDAARO
CN(C(=O)[C@@H]1COc2ccccc2C1)C1CC[NH+](C)CC1	ZINC000032820018	281834834	/nfs/dbraw/zinc/83/48/34/281834834.db2.gz	ZAGLZZAQWNZNLU-AWEZNQCLSA-N	1	0	288.391	1.790	50	0		CDAARO
CS(=O)(=O)[C@H]1CCCC[C@H]1[NH2+]C1CCOCC1	ZINC000096491583	295552285	/nfs/dbraw/zinc/55/22/85/295552285.db2.gz	DIHOLVIIIOJXNL-NEPJUHHUSA-N	1	0	261.387	1.111	50	0		CDAARO
CCS(=O)(=O)NC[C@H](C)[NH2+]C1(c2cccc(C)c2)CC1	ZINC000534574562	328309650	/nfs/dbraw/zinc/30/96/50/328309650.db2.gz	LAXSNJBCZQNQLI-ZDUSSCGKSA-N	1	0	296.436	1.902	50	0		CDAARO
Cc1nc(NCC[C@@H](C)[NH+]2CCN(C)CC2)sc1C	ZINC000534579040	328311139	/nfs/dbraw/zinc/31/11/39/328311139.db2.gz	OLIBTBIRHLGBFY-LLVKDONJSA-N	1	0	282.457	1.620	50	0		CDAARO
O=C(NC[C@H]1CC[N@@H+](C2CCCC2)C1)c1cncnc1	ZINC000534588998	328317095	/nfs/dbraw/zinc/31/70/95/328317095.db2.gz	BRYNZQPZXXRQMM-GFCCVEGCSA-N	1	0	274.368	1.471	50	0		CDAARO
C[C@@H]1C[C@@H]([NH3+])CCN1S(=O)(=O)CCOc1ccccc1	ZINC000534633661	328332672	/nfs/dbraw/zinc/33/26/72/328332672.db2.gz	JZGDREJERWCIJN-OLZOCXBDSA-N	1	0	298.408	1.207	50	0		CDAARO
Cc1cc(C(N)=O)c(N(C)C[C@H]2CCC[NH2+]C2)nc1C	ZINC000534670146	328346981	/nfs/dbraw/zinc/34/69/81/328346981.db2.gz	JYWMKXNTTXTSAJ-LBPRGKRZSA-N	1	0	276.384	1.233	50	0		CDAARO
C[C@H](NC(=O)C[NH2+][C@@H]1CCC(C)(C)C[C@@H]1C)C(=O)N(C)C	ZINC000097099872	323207370	/nfs/dbraw/zinc/20/73/70/323207370.db2.gz	UFBRVSPVLCKVAZ-RWMBFGLXSA-N	1	0	297.443	1.384	50	0		CDAARO
CNCc1nnc(NCC2([NH+]3CCCCC3)CCCC2)o1	ZINC001772703471	1159438897	/nfs/dbraw/zinc/43/88/97/1159438897.db2.gz	XLUPEFWNRLNBCL-UHFFFAOYSA-N	1	0	293.415	2.000	50	0		CDAARO
CCCCNC(=O)N1CCC(CO)(C[NH+](C)C)CC1	ZINC001772709956	1159444082	/nfs/dbraw/zinc/44/40/82/1159444082.db2.gz	NEBSANUUSDZNNM-UHFFFAOYSA-N	1	0	271.405	1.132	50	0		CDAARO
C[C@@H]1C(=O)N2CCC[C@@H]2CN1C(=O)C[NH+]1CCCCCC1	ZINC001772710147	1159445190	/nfs/dbraw/zinc/44/51/90/1159445190.db2.gz	MIQNKFSOWFQOMP-ZIAGYGMSSA-N	1	0	293.411	1.084	50	0		CDAARO
CCc1nsc(N2CCc3[nH+]ccc(N)c3C2)n1	ZINC000585092197	482827668	/nfs/dbraw/zinc/82/76/68/482827668.db2.gz	JCCLGERZYUMAQV-UHFFFAOYSA-N	1	0	261.354	1.640	50	0		CDAARO
CC(C)NS(=O)(=O)CC[NH2+]CCc1ccccc1	ZINC000670419531	482937409	/nfs/dbraw/zinc/93/74/09/482937409.db2.gz	KGUPEQXWECNCIO-UHFFFAOYSA-N	1	0	270.398	1.147	50	0		CDAARO
OC[C@@H]1CCC[N@H+](CCNc2cnc3ccccc3n2)C1	ZINC000670439350	482983560	/nfs/dbraw/zinc/98/35/60/482983560.db2.gz	GTHNVFBVWKBFDQ-CYBMUJFWSA-N	1	0	286.379	1.746	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1CCCNc1ncnc2[nH]ccc21	ZINC000670465163	483055443	/nfs/dbraw/zinc/05/54/43/483055443.db2.gz	GPSFSPMCMRTTJO-LBPRGKRZSA-N	1	0	289.383	1.558	50	0		CDAARO
Cc1ccc(N2CC[N@H+](CCn3cnnc3)[C@H](C)C2)cc1	ZINC000670472618	483081854	/nfs/dbraw/zinc/08/18/54/483081854.db2.gz	GFRRHYCIZYMDJD-OAHLLOKOSA-N	1	0	285.395	1.797	50	0		CDAARO
Cn1cc([C@H]2OCC[C@@H]2C[NH2+]Cc2cscn2)cn1	ZINC000084317614	483272122	/nfs/dbraw/zinc/27/21/22/483272122.db2.gz	GCCSGSNBCQKYOG-MFKMUULPSA-N	1	0	278.381	1.744	50	0		CDAARO
CCCC[C@H]([NH2+][C@H]1CCN(C(=O)C2CC2)C[C@@H]1C)C(N)=O	ZINC000084742903	483322270	/nfs/dbraw/zinc/32/22/70/483322270.db2.gz	VLLIJJKZNOCNLT-UBHSHLNASA-N	1	0	295.427	1.267	50	0		CDAARO
CC1(C[N@@H+]2CCC[C@H](c3nnc[nH]3)C2)CCOCC1	ZINC000822307026	1161927902	/nfs/dbraw/zinc/92/79/02/1161927902.db2.gz	WHLCWFSBCNYMDA-LBPRGKRZSA-N	1	0	264.373	1.801	50	0		CDAARO
COc1ccc(C[C@@H](C)[NH2+]C2CCN(C)CC2)cn1	ZINC000414058009	536499769	/nfs/dbraw/zinc/49/97/69/536499769.db2.gz	GOCRLGKKPPKBML-GFCCVEGCSA-N	1	0	263.385	1.705	50	0		CDAARO
CC(C)NS(=O)(=O)CC[NH2+]Cc1ccccc1	ZINC000221131739	545497591	/nfs/dbraw/zinc/49/75/91/545497591.db2.gz	IJUVSGIMJZQYHY-UHFFFAOYSA-N	1	0	256.371	1.104	50	0		CDAARO
Cn1cc(N2CC[C@H]([NH2+]CCC(C)(C)C)C2=O)cn1	ZINC000097164470	567905468	/nfs/dbraw/zinc/90/54/68/567905468.db2.gz	KMASRMGMZMQLRL-LBPRGKRZSA-N	1	0	264.373	1.551	50	0		CDAARO
CC[C@H](C(=O)NCc1cccc(C(=O)NC)c1)[N@H+](C)CC	ZINC000952976176	615607262	/nfs/dbraw/zinc/60/72/62/615607262.db2.gz	DYULECAQZCNCOU-CQSZACIVSA-N	1	0	291.395	1.393	50	0		CDAARO
CC1([NH3+])CN(C(=O)/C=C\c2cnn(-c3ccccc3)c2)C1	ZINC000888096777	617759602	/nfs/dbraw/zinc/75/96/02/617759602.db2.gz	QHILHPFKSLENGE-FPLPWBNLSA-N	1	0	282.347	1.445	50	0		CDAARO
Cn1cc([C@H](O)C[NH2+][C@H]2CC[C@H]3C[C@@H]2C3(C)C)cn1	ZINC000888098915	617762665	/nfs/dbraw/zinc/76/26/65/617762665.db2.gz	QWTVGVQKCSEMPI-XDQVBPFNSA-N	1	0	263.385	1.868	50	0		CDAARO
COC(=O)c1cccc(-c2cccc(N3CC[NH2+]CC3)n2)c1	ZINC000032541155	695381504	/nfs/dbraw/zinc/38/15/04/695381504.db2.gz	NABUQFNTPCHEOD-UHFFFAOYSA-N	1	0	297.358	1.945	50	0		CDAARO
CCn1cc(C[N@@H+]2CCC[C@@H](c3cc(=O)[nH]cn3)C2)cn1	ZINC000023541104	695441331	/nfs/dbraw/zinc/44/13/31/695441331.db2.gz	UCZJHVJPATYTEX-CYBMUJFWSA-N	1	0	287.367	1.366	50	0		CDAARO
O=C(Nc1ccc(-n2cncn2)c(F)c1)[C@@H]1CCC[NH2+]C1	ZINC000037771226	695791665	/nfs/dbraw/zinc/79/16/65/695791665.db2.gz	KXDXZSTXDJJBLO-SNVBAGLBSA-N	1	0	289.314	1.345	50	0		CDAARO
Cn1ccnc1CC[NH+]1CCC(N2CCCC2=O)CC1	ZINC000585565932	1160092763	/nfs/dbraw/zinc/09/27/63/1160092763.db2.gz	CHZQPFWXXULVCA-UHFFFAOYSA-N	1	0	276.384	1.049	50	0		CDAARO
CCN1CCC([NH2+][C@@H]2COC[C@H]2Cc2ccncc2)CC1	ZINC001704348271	1177697835	/nfs/dbraw/zinc/69/78/35/1177697835.db2.gz	DXIJKUGESOPUER-NVXWUHKLSA-N	1	0	289.423	1.713	50	0		CDAARO
COc1c[nH]c(C[N@H+](C)CCc2ccccn2)cc1=O	ZINC001704357366	1177700342	/nfs/dbraw/zinc/70/03/42/1177700342.db2.gz	REYWWCAPNCPIPJ-UHFFFAOYSA-N	1	0	273.336	1.453	50	0		CDAARO
O=c1c2c(Cl)cccc2ncn1C[C@H]1C[NH2+]CCO1	ZINC000032529800	723695031	/nfs/dbraw/zinc/69/50/31/723695031.db2.gz	SDCLIQHOTNHFSD-SECBINFHSA-N	1	0	279.727	1.038	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1CCNc1ncc(Cl)cn1	ZINC000952968752	724038266	/nfs/dbraw/zinc/03/82/66/724038266.db2.gz	DBJGIJJCNMQRPF-NSHDSACASA-N	1	0	270.764	1.389	50	0		CDAARO
CCOC(=O)N1CCC([NH2+][C@H]2COC[C@@H]2OCC)CC1	ZINC000065387316	724220955	/nfs/dbraw/zinc/22/09/55/724220955.db2.gz	LQPMBDBUEOYOBS-STQMWFEESA-N	1	0	286.372	1.001	50	0		CDAARO
Cc1cccc(CC[NH2+][C@H](C)CN(C)CCO)c1	ZINC000952974493	724229115	/nfs/dbraw/zinc/22/91/15/724229115.db2.gz	JAUMMRRSPYXYDQ-CQSZACIVSA-N	1	0	250.386	1.440	50	0		CDAARO
CC(C)(C)C[C@@H]([NH3+])C1(O)CCC2(CC1)OCCO2	ZINC000958528932	724375276	/nfs/dbraw/zinc/37/52/76/724375276.db2.gz	YVQLLQWDJSUHHA-LLVKDONJSA-N	1	0	257.374	1.798	50	0		CDAARO
COc1ccc(C[NH2+][C@@H]2CN3CCC2CC3)cc1OC	ZINC000019946013	724471718	/nfs/dbraw/zinc/47/17/18/724471718.db2.gz	LQULSYSPTUXELV-CQSZACIVSA-N	1	0	276.380	1.888	50	0		CDAARO
COC[C@@H](C)[NH2+]Cc1cc2cc(C)ccc2n(C)c1=O	ZINC000012182247	724488643	/nfs/dbraw/zinc/48/86/43/724488643.db2.gz	XGNQLXVTWOKPAJ-GFCCVEGCSA-N	1	0	274.364	1.971	50	0		CDAARO
c1nnc2n1CC[N@@H+](Cc1ccc3nccnc3c1)CC2	ZINC000020773858	723739794	/nfs/dbraw/zinc/73/97/94/723739794.db2.gz	RCSKTKRMKAKVNA-UHFFFAOYSA-N	1	0	280.335	1.280	50	0		CDAARO
Cc1cc(C)c2ncn([C@H]3CCC[NH2+]C3)c(=O)c2c1	ZINC000757176120	725110022	/nfs/dbraw/zinc/11/00/22/725110022.db2.gz	AOFJXNMQRYWSHR-LBPRGKRZSA-N	1	0	257.337	1.938	50	0		CDAARO
Cc1cc[nH]c(=O)c1C(=O)N1CC[N@@H+]2CCCC[C@H]2C1	ZINC000183647010	725321338	/nfs/dbraw/zinc/32/13/38/725321338.db2.gz	YUGBFDAJSHJWGM-LBPRGKRZSA-N	1	0	275.352	1.406	50	0		CDAARO
Cc1c(C(=O)NC[C@@H](c2cnn(C)c2)N(C)C)ccn1C	ZINC000195269165	726002435	/nfs/dbraw/zinc/00/24/35/726002435.db2.gz	KNRZTBWHXUKKTE-AWEZNQCLSA-N	1	0	289.383	1.100	50	0		CDAARO
[NH3+][C@@H](Cc1cnc[nH]1)C(=O)Nc1cccc(-n2cccn2)c1	ZINC000952981543	726005152	/nfs/dbraw/zinc/00/51/52/726005152.db2.gz	IGODACGIPBJBOT-AWEZNQCLSA-N	1	0	296.334	1.104	50	0		CDAARO
CC(C)(C(=O)N[C@H]1CCc2c[nH]nc2C1)[NH+]1CCCC1	ZINC000426517543	902595138	/nfs/dbraw/zinc/59/51/38/902595138.db2.gz	GOWYNXRBKWRACS-LBPRGKRZSA-N	1	0	276.384	1.258	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CCCN2CCOCC2)n1	ZINC001506424709	909186461	/nfs/dbraw/zinc/18/64/61/909186461.db2.gz	LCUBIYCOMWNJGR-CQSZACIVSA-N	1	0	280.416	1.200	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](Nc2ncc(F)c(OC)n2)C1	ZINC000952862169	910415744	/nfs/dbraw/zinc/41/57/44/910415744.db2.gz	MVBUQUCIJOWYRA-SNVBAGLBSA-N	1	0	268.336	1.911	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1CCCNc1nnc2ccccn21	ZINC000952872574	910428070	/nfs/dbraw/zinc/42/80/70/910428070.db2.gz	RIBNWNDKGSPYPH-ZDUSSCGKSA-N	1	0	289.383	1.378	50	0		CDAARO
O[C@@H]1CCC[N@H+](CCCNCc2cnccc2Cl)C1	ZINC000952872594	910428723	/nfs/dbraw/zinc/42/87/23/910428723.db2.gz	PNXPQYYXTUJVNM-CYBMUJFWSA-N	1	0	283.803	1.671	50	0		CDAARO
CNC(=O)CC[NH+]1CCC(CNC(=O)C2CCCC2)CC1	ZINC000952873146	910429895	/nfs/dbraw/zinc/42/98/95/910429895.db2.gz	VXRXJYYUDGFRTQ-UHFFFAOYSA-N	1	0	295.427	1.141	50	0		CDAARO
Cc1nnc(SCC(=O)N2CC[NH+](CC(C)C)CC2)o1	ZINC000821270873	925577394	/nfs/dbraw/zinc/57/73/94/925577394.db2.gz	GCKVUWDVOCAWPC-UHFFFAOYSA-N	1	0	298.412	1.270	50	0		CDAARO
Cc1n[nH]c(C2CC[NH+]([C@@H](C)Cn3cccn3)CC2)n1	ZINC000821746055	925594982	/nfs/dbraw/zinc/59/49/82/925594982.db2.gz	PFYOPNZNUXNGKS-NSHDSACASA-N	1	0	274.372	1.578	50	0		CDAARO
CC[N@H+](C)C1(CNS(=O)(=O)C2CC2)CCCC1	ZINC000823067845	925667545	/nfs/dbraw/zinc/66/75/45/925667545.db2.gz	MXTRZZFMGYTCFX-UHFFFAOYSA-N	1	0	260.403	1.333	50	0		CDAARO
C[N@H+](CC[C@H]1CCS(=O)(=O)C1)CCC1(O)CCCC1	ZINC000823693062	925722420	/nfs/dbraw/zinc/72/24/20/925722420.db2.gz	NWZQIBLOLXRXOM-ZDUSSCGKSA-N	1	0	289.441	1.438	50	0		CDAARO
CNC(=O)C[C@H]1CC[N@H+](Cc2cc(C(C)C)no2)C1	ZINC000823821036	925731735	/nfs/dbraw/zinc/73/17/35/925731735.db2.gz	PDTLKHFGCHNMHP-LLVKDONJSA-N	1	0	265.357	1.756	50	0		CDAARO
C/C=C(\C)C[N@H+]1CCC[C@@H]2CN(C(=O)COC)CC[C@@H]21	ZINC000824313485	925815693	/nfs/dbraw/zinc/81/56/93/925815693.db2.gz	HUZZBYFWINUJQK-KWMMQKOZSA-N	1	0	280.412	1.912	50	0		CDAARO
COCC1(CNC(=O)[C@@H](C)C[NH+]2CCCC2)CCC1	ZINC000824346706	925816681	/nfs/dbraw/zinc/81/66/81/925816681.db2.gz	BXCHJVUDAYYNCV-ZDUSSCGKSA-N	1	0	268.401	1.651	50	0		CDAARO
CO[C@H]1COC[C@@H]1[NH2+]C1CCN(Cc2ccco2)CC1	ZINC000824506329	925828633	/nfs/dbraw/zinc/82/86/33/925828633.db2.gz	AXVRFSAPYQJESJ-GJZGRUSLSA-N	1	0	280.368	1.247	50	0		CDAARO
Fc1cccc(-c2cnnc(N3CC[N@@H+]4CCC[C@H]4C3)n2)c1	ZINC000826621374	925909813	/nfs/dbraw/zinc/90/98/13/925909813.db2.gz	UGKVAUSPYFPDCS-AWEZNQCLSA-N	1	0	299.353	1.962	50	0		CDAARO
O=C(NCC1CC[NH+](Cc2ccoc2)CC1)[C@H]1CCOC1	ZINC000827778564	925964248	/nfs/dbraw/zinc/96/42/48/925964248.db2.gz	KHGRLIBEZYVKGO-HNNXBMFYSA-N	1	0	292.379	1.644	50	0		CDAARO
Cc1nncn1CC[N@@H+](C)CC1(CO)CCCC1	ZINC000828686778	926164705	/nfs/dbraw/zinc/16/47/05/926164705.db2.gz	VHTXCAWJNUUOCE-UHFFFAOYSA-N	1	0	252.362	1.071	50	0		CDAARO
COCC[N@@H+]1CCOC[C@H]2CCN(C(=O)CC(C)C)C[C@H]21	ZINC000581782144	927196397	/nfs/dbraw/zinc/19/63/97/927196397.db2.gz	XJMAWLLVEGRLHX-HUUCEWRRSA-N	1	0	298.427	1.228	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)CC2CCCCC2)CC[C@@H]1CO	ZINC000581798784	927199759	/nfs/dbraw/zinc/19/97/59/927199759.db2.gz	XLQCFWCTKKBBEX-HUUCEWRRSA-N	1	0	282.428	1.728	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@@H]1C[N@@H+]1CC[C@@H](C(N)=O)C1	ZINC000585086170	930888477	/nfs/dbraw/zinc/88/84/77/930888477.db2.gz	UUVXUBXEHSIRJW-VXGBXAGGSA-N	1	0	297.399	1.193	50	0		CDAARO
c1nnc(C[NH2+]C[C@@H]2CCCCO2)n1-c1ccccc1	ZINC000585117030	930971865	/nfs/dbraw/zinc/97/18/65/930971865.db2.gz	PKMCBALGMFYJIP-AWEZNQCLSA-N	1	0	272.352	1.926	50	0		CDAARO
CC[N@H+](C[C@H](O)[C@H](C)O)[C@H](C)c1cccc(OC)c1	ZINC000585117092	930977467	/nfs/dbraw/zinc/97/74/67/930977467.db2.gz	QODUOPBZWMCNTC-XUJVJEKNSA-N	1	0	267.369	1.820	50	0		CDAARO
CCOc1cccc(CNC(=O)[C@@]2(C)C[C@@H](O)C[N@@H+]2C)c1	ZINC000585121923	930988622	/nfs/dbraw/zinc/98/86/22/930988622.db2.gz	GHQFWKTVQWXFEP-CZUORRHYSA-N	1	0	292.379	1.157	50	0		CDAARO
O[C@@H]1C[N@@H+](C2Cc3ccccc3C2)C[C@H]1Cc1cnccn1	ZINC001529133811	968989197	/nfs/dbraw/zinc/98/91/97/968989197.db2.gz	JIPZORAMENMSLM-CRAIPNDOSA-N	1	0	295.386	1.479	50	0		CDAARO
CC[N@@H+](Cc1cc(=O)[nH]c(C)n1)C[C@H]1CCCCO1	ZINC001529150915	968995087	/nfs/dbraw/zinc/99/50/87/968995087.db2.gz	BCCLJULMCBYYRY-CYBMUJFWSA-N	1	0	265.357	1.882	50	0		CDAARO
CN(C)c1nc(N[C@H]2CC[N@@H+](C(C)(C)C)C2)ncc1F	ZINC001506412480	975154008	/nfs/dbraw/zinc/15/40/08/975154008.db2.gz	DLIFEQFLXOPYEF-JTQLQIEISA-N	1	0	281.379	1.966	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]Cc1nnc2ccccn21	ZINC001506420144	975158385	/nfs/dbraw/zinc/15/83/85/975158385.db2.gz	VZACJDMJCCKCFS-GFCCVEGCSA-N	1	0	284.367	1.667	50	0		CDAARO
CC(C)c1ccc(N2C[C@H](O)[C@@H]([NH+]3CCCC3)C2)nn1	ZINC001506429147	975162173	/nfs/dbraw/zinc/16/21/73/975162173.db2.gz	VPYSBHLWDOUAAO-KBPBESRZSA-N	1	0	276.384	1.245	50	0		CDAARO
O=C(NC[C@@H]1C[N@@H+]2CCC[C@H]2CO1)Nc1cccnc1	ZINC000107319686	398138839	/nfs/dbraw/zinc/13/88/39/398138839.db2.gz	AWIRCKFDCISURP-QWHCGFSZSA-N	1	0	276.340	1.066	50	0		CDAARO
Cc1nccn1C[C@@H](C)[NH2+]CCc1noc(C2CC2)n1	ZINC000584902824	341987014	/nfs/dbraw/zinc/98/70/14/341987014.db2.gz	BCXYOUZERIVZSI-SNVBAGLBSA-N	1	0	275.356	1.673	50	0		CDAARO
CN(CC1([NH+](C)C)CCC1)C(=O)NCc1ccnn1C	ZINC000189663931	230396117	/nfs/dbraw/zinc/39/61/17/230396117.db2.gz	JBLOZOLVYHZHTF-UHFFFAOYSA-N	1	0	279.388	1.046	50	0		CDAARO
C[C@H](C(=O)NCCOCC1CC1)[NH+]1CCCCCC1	ZINC000095962386	185044959	/nfs/dbraw/zinc/04/49/59/185044959.db2.gz	HKXZOZVGKKUISU-CYBMUJFWSA-N	1	0	268.401	1.794	50	0		CDAARO
CCc1ccc([C@@H]([NH2+]CC(=O)NC(=O)NC)C(C)(C)C)o1	ZINC000095985196	185055514	/nfs/dbraw/zinc/05/55/14/185055514.db2.gz	HNPOOLPIUIOURV-CYBMUJFWSA-N	1	0	295.383	1.974	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)c1cccc2nonc21	ZINC000124776391	187153448	/nfs/dbraw/zinc/15/34/48/187153448.db2.gz	OKSDYRMHXMYGMQ-UHFFFAOYSA-N	1	0	298.368	1.019	50	0		CDAARO
C[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)[C@@H](N)c1ccccc1	ZINC000251831572	361821350	/nfs/dbraw/zinc/82/13/50/361821350.db2.gz	POSFYXUKUUMCSE-SNPRPXQTSA-N	1	0	273.380	1.382	50	0		CDAARO
Cc1nc(C(=O)N(CC[NH+](C)C)C[C@H]2CCCO2)cs1	ZINC000096133163	185104953	/nfs/dbraw/zinc/10/49/53/185104953.db2.gz	ZRCACDBFOAARRP-GFCCVEGCSA-N	1	0	297.424	1.634	50	0		CDAARO
Cc1cc(C[NH2+][C@H]2CCCCC[C@@H]2C(N)=O)no1	ZINC000195571241	342628842	/nfs/dbraw/zinc/62/88/42/342628842.db2.gz	MZGASURYIROXQG-RYUDHWBXSA-N	1	0	251.330	1.507	50	0		CDAARO
Cc1ccn2cc(CN3CC[N@@H+]4CCC[C@H]4C3)nc2c1	ZINC000243892547	361828960	/nfs/dbraw/zinc/82/89/60/361828960.db2.gz	AIPBCIWEHWSCNH-HNNXBMFYSA-N	1	0	270.380	1.923	50	0		CDAARO
CCO[C@@H]1C[C@](O)(C[NH2+]Cc2c(C)nn(C)c2C)C1(C)C	ZINC000188903365	342204071	/nfs/dbraw/zinc/20/40/71/342204071.db2.gz	CCIFIINIYUFDEQ-ZBFHGGJFSA-N	1	0	295.427	1.693	50	0		CDAARO
CCN1C[C@@H](COC(=O)c2ccn3c[nH+]cc3c2)CC1=O	ZINC000097034317	185157239	/nfs/dbraw/zinc/15/72/39/185157239.db2.gz	ALNPKEPIIGXITG-NSHDSACASA-N	1	0	287.319	1.360	50	0		CDAARO
Cc1cc(S(=O)(=O)N[C@H]2C[N@@H+](C)C[C@H]2C)ccc1F	ZINC000685939525	539045657	/nfs/dbraw/zinc/04/56/57/539045657.db2.gz	XKNJIQIIMXAVOD-MFKMUULPSA-N	1	0	286.372	1.363	50	0		CDAARO
CC1(C)CC(Cn2cc(O[C@@H]3COC[C@@H]3[NH3+])cn2)C1	ZINC000685941904	539045958	/nfs/dbraw/zinc/04/59/58/539045958.db2.gz	CYMJAUNKORCLTH-QWHCGFSZSA-N	1	0	265.357	1.424	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](C(=O)N(C)CC(=O)OCC)C1	ZINC000685944966	539046096	/nfs/dbraw/zinc/04/60/96/539046096.db2.gz	LLJPAGKTXDPXRQ-GFCCVEGCSA-N	1	0	270.373	1.130	50	0		CDAARO
CCOc1ccc(/C=C/C(=O)N2CC[NH2+]C[C@@H]2C)cc1	ZINC000125684098	187195863	/nfs/dbraw/zinc/19/58/63/187195863.db2.gz	RRWTYSBNNHQSMV-PPGNKHEKSA-N	1	0	274.364	1.919	50	0		CDAARO
CC(C)O[C@@H](C[N@@H+]1CC[C@H](C(N)=O)C1)c1ccccc1	ZINC000585085634	362013573	/nfs/dbraw/zinc/01/35/73/362013573.db2.gz	AYRKUGJELCTNCV-GJZGRUSLSA-N	1	0	276.380	1.960	50	0		CDAARO
C[C@H]([NH2+][C@H]1CCCNC(=O)C1)[C@@H](c1ccccc1)N(C)C	ZINC000585116906	362045196	/nfs/dbraw/zinc/04/51/96/362045196.db2.gz	MCGGYGOXRBGGHZ-QRTARXTBSA-N	1	0	289.423	1.936	50	0		CDAARO
CSC1(C[N@@H+]2CC[C@H](N(C)C(=O)N(C)C)C2)CCC1	ZINC000597224246	343486148	/nfs/dbraw/zinc/48/61/48/343486148.db2.gz	BHKZXFGJGZNMFK-LBPRGKRZSA-N	1	0	285.457	1.960	50	0		CDAARO
C[N@H+](CCC(=O)N1CCOCC1)Cc1ccc(Cl)nc1	ZINC000096444942	529870648	/nfs/dbraw/zinc/87/06/48/529870648.db2.gz	HEXSCESSZRMLAD-UHFFFAOYSA-N	1	0	297.786	1.416	50	0		CDAARO
Cc1ncc(C(=O)N2C[C@H](C)[NH2+][C@@H](C)C2)c(C(C)C)n1	ZINC000179162226	362253236	/nfs/dbraw/zinc/25/32/36/362253236.db2.gz	KBTJNVCMDVOYFG-QWRGUYRKSA-N	1	0	276.384	1.731	50	0		CDAARO
C[C@@H]1C[N@H+](CC(C)(C)O)CCN1C(=O)N[C@@H]1C=CCCC1	ZINC000249132253	362348032	/nfs/dbraw/zinc/34/80/32/362348032.db2.gz	STDZHEPWMFWTBY-ZIAGYGMSSA-N	1	0	295.427	1.582	50	0		CDAARO
O=C(CC[NH+]1CCC2(CCO2)CC1)Nc1cccnc1	ZINC000252480258	362383066	/nfs/dbraw/zinc/38/30/66/362383066.db2.gz	BZBULUPLISEETR-UHFFFAOYSA-N	1	0	275.352	1.665	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000127232279	187290889	/nfs/dbraw/zinc/29/08/89/187290889.db2.gz	OZZUYPFAUTVLHI-DOTOQJQBSA-N	1	0	292.423	1.590	50	0		CDAARO
CC(C)C(=O)N1CCC(CCC[NH+]2CCOCC2)CC1	ZINC000097057303	185518369	/nfs/dbraw/zinc/51/83/69/185518369.db2.gz	QSMYLURRGCOMKA-UHFFFAOYSA-N	1	0	282.428	1.993	50	0		CDAARO
Cc1cc(S(=O)(=O)NCC[NH3+])sc1Br	ZINC000087022491	179381018	/nfs/dbraw/zinc/38/10/18/179381018.db2.gz	LRXWUQUNZVKRTD-UHFFFAOYSA-N	1	0	299.215	1.056	50	0		CDAARO
O=C(NCC1CCOCC1)[C@@H]1Cc2ccccc2C[NH2+]1	ZINC000111174493	349221684	/nfs/dbraw/zinc/22/16/84/349221684.db2.gz	CZAMLULGKGXBNU-HNNXBMFYSA-N	1	0	274.364	1.244	50	0		CDAARO
COCC1(C(=O)NC[C@H]2CCCC[N@@H+]2C)CCC1	ZINC000584886227	349343962	/nfs/dbraw/zinc/34/39/62/349343962.db2.gz	BRDHJNIILIVASE-GFCCVEGCSA-N	1	0	254.374	1.404	50	0		CDAARO
O=C([C@H]1CCOC1)N1CCC[N@@H+](C2CCCCC2)CC1	ZINC000584886685	349344540	/nfs/dbraw/zinc/34/45/40/349344540.db2.gz	XAYDRIDEVNRAJH-AWEZNQCLSA-N	1	0	280.412	1.890	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CCNC(=O)c1cnc(N)s1	ZINC000584896620	349358284	/nfs/dbraw/zinc/35/82/84/349358284.db2.gz	UFNMQILJUSSAQO-VIFPVBQESA-N	1	0	268.386	1.160	50	0		CDAARO
CC[N@H+](C)C[C@H](C)CNC(=O)N1CC(c2ccccn2)C1	ZINC000584889120	349347869	/nfs/dbraw/zinc/34/78/69/349347869.db2.gz	IPSJAYADPGKBIO-CYBMUJFWSA-N	1	0	290.411	1.778	50	0		CDAARO
C[C@H](CC(=O)N(C)Cc1cccc(O)c1)[NH+](C)C	ZINC000584889843	349348735	/nfs/dbraw/zinc/34/87/35/349348735.db2.gz	QQNPSULBRUGLGE-LLVKDONJSA-N	1	0	250.342	1.691	50	0		CDAARO
CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)[C@H]1C=CC[NH2+]1	ZINC000584890570	349349536	/nfs/dbraw/zinc/34/95/36/349349536.db2.gz	RPIZCGGJMARRNZ-CQSZACIVSA-N	1	0	273.311	1.793	50	0		CDAARO
Cc1nccn1CC[C@H](C)[NH2+]CCN1CCCCC1=O	ZINC000584891775	349350900	/nfs/dbraw/zinc/35/09/00/349350900.db2.gz	LZRYRHKOJPIIGX-ZDUSSCGKSA-N	1	0	278.400	1.572	50	0		CDAARO
c1ncn(-c2ncccc2C[NH2+][C@@H]2CCSC2)n1	ZINC000584894067	349354249	/nfs/dbraw/zinc/35/42/49/349354249.db2.gz	GDNKJZUPUDRGFO-LLVKDONJSA-N	1	0	261.354	1.257	50	0		CDAARO
CC(C)Cc1cc(C(=O)N2CC[N@@H+]3CCC[C@H]3C2)n(C)n1	ZINC000091440755	180156826	/nfs/dbraw/zinc/15/68/26/180156826.db2.gz	PWSDXVRCNGNDML-AWEZNQCLSA-N	1	0	290.411	1.539	50	0		CDAARO
CC1(C)C[N@H+](Cc2ccc(C(N)=O)cc2)C[C@]1(C)O	ZINC000091459918	180161670	/nfs/dbraw/zinc/16/16/70/180161670.db2.gz	XWKYBYDKEYTUFU-HNNXBMFYSA-N	1	0	262.353	1.378	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2cccnn2)C[C@@H]1c1ccccc1	ZINC000091595565	180201143	/nfs/dbraw/zinc/20/11/43/180201143.db2.gz	SBDDHVTWWYCIAA-OLZOCXBDSA-N	1	0	268.320	1.044	50	0		CDAARO
O[C@@H](CNc1ncccn1)C[NH+]1CCCCCC1	ZINC000091593596	180201684	/nfs/dbraw/zinc/20/16/84/180201684.db2.gz	QVPUOCAIGGDZEK-LBPRGKRZSA-N	1	0	250.346	1.125	50	0		CDAARO
COc1ccc(OCCN(C)C(=O)[C@H]2CC[C@H]([NH3+])C2)cc1	ZINC000091545882	180186535	/nfs/dbraw/zinc/18/65/35/180186535.db2.gz	IIEFUGGXFSGTAZ-STQMWFEESA-N	1	0	292.379	1.660	50	0		CDAARO
COCC[C@@]1(CO)CCC[N@H+](CCC(=O)N2CCCC2)C1	ZINC000091656638	180217655	/nfs/dbraw/zinc/21/76/55/180217655.db2.gz	BWRXUTLSMWTXEP-INIZCTEOSA-N	1	0	298.427	1.110	50	0		CDAARO
CN(C(=O)OCc1ccccc1)[C@H](CO)C[NH+]1CCCC1	ZINC000002581000	169813373	/nfs/dbraw/zinc/81/33/73/169813373.db2.gz	CQVKXKBHQQPCCC-HNNXBMFYSA-N	1	0	292.379	1.712	50	0		CDAARO
CCn1nc(CC(C)C)cc1C(=O)NC[C@@H]1CCC[NH2+]1	ZINC000091859473	180275669	/nfs/dbraw/zinc/27/56/69/180275669.db2.gz	NQMHLZYFVAKUFN-LBPRGKRZSA-N	1	0	278.400	1.583	50	0		CDAARO
CC(C)Cc1cc(C(=O)NC[C@@H]2C[C@H](F)C[NH2+]2)on1	ZINC000091915250	180286225	/nfs/dbraw/zinc/28/62/25/180286225.db2.gz	YVKNKPRFUYZTJH-ONGXEEELSA-N	1	0	269.320	1.303	50	0		CDAARO
Oc1cccc(CN2CC[NH+]([C@@H]3CCOC3)CC2)c1	ZINC000271359528	191095979	/nfs/dbraw/zinc/09/59/79/191095979.db2.gz	NAGHNBKKEKZMRT-CQSZACIVSA-N	1	0	262.353	1.299	50	0		CDAARO
O=C(COC1CC[NH2+]CC1)N[C@@H]1C[C@H]1c1ccccc1	ZINC000111797108	186458224	/nfs/dbraw/zinc/45/82/24/186458224.db2.gz	ZJLRJVUUOZSKCQ-LSDHHAIUSA-N	1	0	274.364	1.427	50	0		CDAARO
CC(=O)N1CCN([C@@H]2C[N@@H+](CC3CCCC3)C[C@@H]2C)CC1	ZINC000257366217	350964711	/nfs/dbraw/zinc/96/47/11/350964711.db2.gz	ODMOHLZKSATKAX-WMLDXEAASA-N	1	0	293.455	1.661	50	0		CDAARO
C[NH+](C)CCNC(=O)Cc1cc(-c2ccccc2)on1	ZINC000012861477	363250585	/nfs/dbraw/zinc/25/05/85/363250585.db2.gz	LXPJJZFACUZUCA-UHFFFAOYSA-N	1	0	273.336	1.562	50	0		CDAARO
CCSCC[N@@H+]1CC[C@@](C(N)=O)(c2ccccc2)C1	ZINC000411959283	363388321	/nfs/dbraw/zinc/38/83/21/363388321.db2.gz	CXSNFELNKOZYTF-HNNXBMFYSA-N	1	0	278.421	1.869	50	0		CDAARO
CC(C)C(=O)Nc1ccc(N2CCC[NH2+]CC2)nc1	ZINC000034680519	355980912	/nfs/dbraw/zinc/98/09/12/355980912.db2.gz	HTHOSEBFFVEQBL-UHFFFAOYSA-N	1	0	262.357	1.476	50	0		CDAARO
OCC[NH2+]CCOc1cccc(Cl)c1Cl	ZINC000002931971	355988203	/nfs/dbraw/zinc/98/82/03/355988203.db2.gz	UTVVOCXJAMDRTM-UHFFFAOYSA-N	1	0	250.125	1.954	50	0		CDAARO
[NH3+]CCN1C(=O)S/C(=C\c2ccc(F)cc2)C1=O	ZINC000003194382	355996107	/nfs/dbraw/zinc/99/61/07/355996107.db2.gz	SWPLPGAZGUFJJB-YFHOEESVSA-N	1	0	266.297	1.821	50	0		CDAARO
COc1cc(C(C)=O)ccc1OC[C@@H](O)C[NH+]1CCCC1	ZINC000004487272	356031344	/nfs/dbraw/zinc/03/13/44/356031344.db2.gz	DMBFUPPDJYCILS-AWEZNQCLSA-N	1	0	293.363	1.733	50	0		CDAARO
COC(=O)c1ccc(OC[C@H](O)C[NH2+]C(C)(C)C)cc1	ZINC000004279619	356025223	/nfs/dbraw/zinc/02/52/23/356025223.db2.gz	SZAYMQLNVXIKNC-GFCCVEGCSA-N	1	0	281.352	1.601	50	0		CDAARO
CCOC(=O)[C@@H]1CCC[N@H+](Cc2c(C)nn(C)c2C)C1	ZINC000012396447	356297960	/nfs/dbraw/zinc/29/79/60/356297960.db2.gz	GOIRYYLSXYPTOE-CYBMUJFWSA-N	1	0	279.384	1.812	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1nc(-c2ccccn2)no1	ZINC000012409095	356298819	/nfs/dbraw/zinc/29/88/19/356298819.db2.gz	NDNXXKYMQQMCQI-UHFFFAOYSA-N	1	0	289.339	1.203	50	0		CDAARO
COc1ccc(C(=O)NCCC[NH+]2CCCC2)cc1OC	ZINC000013649506	356351324	/nfs/dbraw/zinc/35/13/24/356351324.db2.gz	XEKTVQZPHFZOII-UHFFFAOYSA-N	1	0	292.379	1.920	50	0		CDAARO
CCOc1ccccc1C(=O)NC1CC[NH+](C)CC1	ZINC000016602655	356442955	/nfs/dbraw/zinc/44/29/55/356442955.db2.gz	HKMWOQNIJSGQEV-UHFFFAOYSA-N	1	0	262.353	1.909	50	0		CDAARO
CC[NH+]1CCN(CCC(=O)Nc2ccccc2OC)CC1	ZINC000019528189	356490266	/nfs/dbraw/zinc/49/02/66/356490266.db2.gz	RYJFUURSRXAMAY-UHFFFAOYSA-N	1	0	291.395	1.661	50	0		CDAARO
Cc1ccccc1C(=O)O[C@H](C)CN1CC[NH+](C)CC1	ZINC000019236900	356477925	/nfs/dbraw/zinc/47/79/25/356477925.db2.gz	UKAOAYWIJJXODB-CQSZACIVSA-N	1	0	276.380	1.788	50	0		CDAARO
Fc1ccc(Br)cc1CN1CC[NH2+]CC1	ZINC000019265647	356478786	/nfs/dbraw/zinc/47/87/86/356478786.db2.gz	BCMIUYNDQDVYPU-UHFFFAOYSA-N	1	0	273.149	1.993	50	0		CDAARO
Cc1ccc2c(CN3CC[NH2+]CC3)cc(=O)oc2c1	ZINC000019804924	356506717	/nfs/dbraw/zinc/50/67/17/356506717.db2.gz	OKJVOMAJPDVZJV-UHFFFAOYSA-N	1	0	258.321	1.507	50	0	biogenic,in-vitro	CDAARO
CC(C)CC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000019866626	356510882	/nfs/dbraw/zinc/51/08/82/356510882.db2.gz	QNFFCBLGIKTDFI-UHFFFAOYSA-N	1	0	261.369	1.772	50	0		CDAARO
Cc1ccc(CC23CN4CC(C[N@H+](C2)CC4)[C@@H]3O)c(C)c1	ZINC000019858337	356511101	/nfs/dbraw/zinc/51/11/01/356511101.db2.gz	ZCEHQAIPDAYTJE-ADKAHSJRSA-N	1	0	286.419	1.454	50	0		CDAARO
Cc1ccc(C)c(NC(=O)CC[NH+]2CCN(C)CC2)c1	ZINC000019889763	356514690	/nfs/dbraw/zinc/51/46/90/356514690.db2.gz	DHCLELBUESKXDB-UHFFFAOYSA-N	1	0	275.396	1.879	50	0		CDAARO
CCC(=O)N1CCC([NH2+][C@@H]2CCN3CCCC[C@H]23)CC1	ZINC000089941633	538444286	/nfs/dbraw/zinc/44/42/86/538444286.db2.gz	XJBXDRNIQXEHLD-HUUCEWRRSA-N	1	0	279.428	1.604	50	0		CDAARO
Cc1ccc(C(=O)NCCCN2CC[NH+](C)CC2)cc1	ZINC000022935060	356624810	/nfs/dbraw/zinc/62/48/10/356624810.db2.gz	JNPFBOOSIRTOOT-UHFFFAOYSA-N	1	0	275.396	1.362	50	0		CDAARO
CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)N2CCC(O)CC2)c1C	ZINC000026859493	356700019	/nfs/dbraw/zinc/70/00/19/356700019.db2.gz	JXZAVXNUQKMOBL-LLVKDONJSA-N	1	0	292.379	1.862	50	0		CDAARO
Cc1ccc(C[N@H+](CC(=O)NC(N)=O)C2CC2)cc1	ZINC000027593524	356711127	/nfs/dbraw/zinc/71/11/27/356711127.db2.gz	QDEXFNNBRPTIFJ-UHFFFAOYSA-N	1	0	261.325	1.154	50	0		CDAARO
C[NH+]1CCN(c2ccc(NC(N)=S)cc2)CC1	ZINC000031933598	356772346	/nfs/dbraw/zinc/77/23/46/356772346.db2.gz	IBFHROBTGMPOGS-UHFFFAOYSA-N	1	0	250.371	1.094	50	0		CDAARO
CCOC(=O)[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1O	ZINC000034184470	356810672	/nfs/dbraw/zinc/81/06/72/356810672.db2.gz	XEPZKCVKBIJDII-KGLIPLIRSA-N	1	0	263.337	1.433	50	0		CDAARO
CC(C)=CCC[C@@H](C)[NH2+]C[C@@H]1CCN(S(C)(=O)=O)C1	ZINC000090797112	356831510	/nfs/dbraw/zinc/83/15/10/356831510.db2.gz	WFOCDXJNMLLWDI-KGLIPLIRSA-N	1	0	288.457	1.992	50	0		CDAARO
Cc1cc(N2CCC(O)(c3ccccn3)CC2)nc(N)[nH+]1	ZINC000032587220	356783946	/nfs/dbraw/zinc/78/39/46/356783946.db2.gz	QLAIELDHQCJUCQ-UHFFFAOYSA-N	1	0	285.351	1.250	50	0		CDAARO
[NH3+][C@H](Cc1ccccc1)C(=O)NCC1CCOCC1	ZINC000042784079	357080299	/nfs/dbraw/zinc/08/02/99/357080299.db2.gz	BYBFCRJFKPIKHG-CQSZACIVSA-N	1	0	262.353	1.099	50	0		CDAARO
CC[NH+]1CCN(C(=O)/C=C/c2ccc(OC)cc2)CC1	ZINC000054559785	357321681	/nfs/dbraw/zinc/32/16/81/357321681.db2.gz	OQOFSEYJTKEWTE-RMKNXTFCSA-N	1	0	274.364	1.873	50	0		CDAARO
C[NH+]1CCC2(CC1)NC(=S)N(c1ccc(Cl)cc1)N2	ZINC000334160480	357550364	/nfs/dbraw/zinc/55/03/64/357550364.db2.gz	FQNQRCCSMMQAPS-UHFFFAOYSA-N	1	0	296.827	1.961	50	0		CDAARO
CC[N@@H+]1CCO[C@@H](CCNC(=O)c2sccc2C)C1	ZINC000067432652	357608148	/nfs/dbraw/zinc/60/81/48/357608148.db2.gz	XPENADUKKMQLEB-LBPRGKRZSA-N	1	0	282.409	1.897	50	0		CDAARO
CC(C)(C)[C@H](O)C[C@H](CO)[NH2+]Cc1cccs1	ZINC000283897467	357609218	/nfs/dbraw/zinc/60/92/18/357609218.db2.gz	HSHABHJEJDPIQO-ZYHUDNBSSA-N	1	0	257.399	1.996	50	0		CDAARO
COCc1c(C)onc1C(=O)N1CCC[C@@]2(CC[NH2+]C2)C1	ZINC000067821686	357630172	/nfs/dbraw/zinc/63/01/72/357630172.db2.gz	UPLMOGKWULHUOL-HNNXBMFYSA-N	1	0	293.367	1.345	50	0		CDAARO
COCC(=O)NC[C@@H]1CCC[N@H+](Cc2cccc(O)c2)C1	ZINC000067869178	357633906	/nfs/dbraw/zinc/63/39/06/357633906.db2.gz	PGZRSXCKGBEHNU-AWEZNQCLSA-N	1	0	292.379	1.367	50	0		CDAARO
Cc1cccn2c(CNC(=O)C[N@@H+]3C[C@@H]4CC[C@H]3C4)cnc12	ZINC000071754618	357779708	/nfs/dbraw/zinc/77/97/08/357779708.db2.gz	XCODODUINJTSLA-KGLIPLIRSA-N	1	0	298.390	1.743	50	0		CDAARO
[NH3+]C[C@H](NS(=O)(=O)c1cc(F)ccc1Cl)C1CC1	ZINC000097229377	358043493	/nfs/dbraw/zinc/04/34/93/358043493.db2.gz	BHATWXGUNAQCEE-JTQLQIEISA-N	1	0	292.763	1.495	50	0		CDAARO
Cc1ccc(NC[C@H]2CCN([C@@H]3CCOC3=O)C2)nc1	ZINC000097200786	358188662	/nfs/dbraw/zinc/18/86/62/358188662.db2.gz	QPPMUVPGNCNURM-CHWSQXEVSA-N	1	0	275.352	1.439	50	0		CDAARO
COC[C@@H]1CCC[N@@H+]([C@@H](C(N)=O)c2ccccc2)C1	ZINC000195530219	358559354	/nfs/dbraw/zinc/55/93/54/358559354.db2.gz	DFOPSTJBNIXSRJ-TZMCWYRMSA-N	1	0	262.353	1.571	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCC(=O)NCCc2c[nH]cn2)C1	ZINC000095356770	358683297	/nfs/dbraw/zinc/68/32/97/358683297.db2.gz	PYYPDJKGVJEYSI-GFCCVEGCSA-N	1	0	264.373	1.190	50	0		CDAARO
Cc1cc(C)nc(CNC(=O)CCC[NH+]2CCCCC2)n1	ZINC000095359959	358684524	/nfs/dbraw/zinc/68/45/24/358684524.db2.gz	MYFDCPVNVOLLAU-UHFFFAOYSA-N	1	0	290.411	1.976	50	0		CDAARO
O=C(NCc1ccncn1)c1cccc([C@@H]2CCC[NH2+]C2)c1	ZINC000095362759	358685400	/nfs/dbraw/zinc/68/54/00/358685400.db2.gz	SDPGBIOUPYXGBB-OAHLLOKOSA-N	1	0	296.374	1.874	50	0		CDAARO
CS[C@H](CO)[C@H](C)NC(=O)C1CC[NH+](C(C)C)CC1	ZINC000095445641	358693905	/nfs/dbraw/zinc/69/39/05/358693905.db2.gz	FMWWRLULHVWRFJ-WCQYABFASA-N	1	0	288.457	1.335	50	0		CDAARO
c1cnnc(-c2noc(CSCC[NH+]3CCCC3)n2)c1	ZINC000095497080	358695416	/nfs/dbraw/zinc/69/54/16/358695416.db2.gz	PBBLJRXTIJCNLL-UHFFFAOYSA-N	1	0	291.380	1.856	50	0		CDAARO
Cc1cc(C)cc(O[C@@H](C)C(=O)NCC[NH+](C)C)c1	ZINC000098086245	358812785	/nfs/dbraw/zinc/81/27/85/358812785.db2.gz	DCDWQQQWBFZCJB-ZDUSSCGKSA-N	1	0	264.369	1.749	50	0		CDAARO
Cc1nccn1CC1(CNC(=O)[C@H]2CCCC[N@H+]2C)CC1	ZINC000097413391	358774390	/nfs/dbraw/zinc/77/43/90/358774390.db2.gz	XOCVSAORZYXODT-CQSZACIVSA-N	1	0	290.411	1.572	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1C(=O)NCCNc1cccnc1	ZINC000097492403	358780904	/nfs/dbraw/zinc/78/09/04/358780904.db2.gz	BBJZMQNHQITNTF-AWEZNQCLSA-N	1	0	276.384	1.484	50	0		CDAARO
COC(=O)CC[N@@H+]1CCc2cc(OC)c(OC)cc2C1	ZINC000000517158	366489098	/nfs/dbraw/zinc/48/90/98/366489098.db2.gz	NZTPFJUDDHETGE-UHFFFAOYSA-N	1	0	279.336	1.625	50	0	biogenic	CDAARO
O=c1[nH]c(CSC2=[NH+]CCN2)nc2ccccc21	ZINC000014086727	366526654	/nfs/dbraw/zinc/52/66/54/366526654.db2.gz	XWMSQVZWWLDEKM-UHFFFAOYSA-N	1	0	260.322	1.116	50	0		CDAARO
C[N@H+](CC[C@@H](O)c1ccccc1)CCn1cncn1	ZINC000219580513	359106718	/nfs/dbraw/zinc/10/67/18/359106718.db2.gz	QMOVZMPDMVMFSN-CQSZACIVSA-N	1	0	260.341	1.334	50	0		CDAARO
OC[C@@H]1C[N@H+](CC2CC2)C[C@H]1c1nc(C2CC2)no1	ZINC000257187697	359528739	/nfs/dbraw/zinc/52/87/39/359528739.db2.gz	LZFIVGGIIQBORV-NWDGAFQWSA-N	1	0	263.341	1.365	50	0		CDAARO
O[C@@H]1CCOC2(CC[NH+](Cc3ccncc3F)CC2)C1	ZINC000257192125	359591219	/nfs/dbraw/zinc/59/12/19/359591219.db2.gz	SMBWYQZPKUTRNW-CYBMUJFWSA-N	1	0	280.343	1.727	50	0		CDAARO
COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)C(=O)NC(N)=O	ZINC000012781962	359660194	/nfs/dbraw/zinc/66/01/94/359660194.db2.gz	FKKBGXLWSHSIKZ-UWVGGRQHSA-N	1	0	279.340	1.238	50	0		CDAARO
CCC(=O)N(C)CCN(CC[NH+]1CCCC1)C(=O)CC	ZINC000408516422	359899244	/nfs/dbraw/zinc/89/92/44/359899244.db2.gz	PTWBEYJXFZBXJJ-UHFFFAOYSA-N	1	0	283.416	1.189	50	0		CDAARO
O=C(CC[NH+]1CCN(c2ccc(F)cc2)CC1)NC1CC1	ZINC000035818967	359967572	/nfs/dbraw/zinc/96/75/72/359967572.db2.gz	RVJHITFUDYVBJV-UHFFFAOYSA-N	1	0	291.370	1.616	50	0		CDAARO
Cc1cc2cn[nH]c2c(C(=O)N2CCN(C)C[C@H]2C)c1	ZINC000089610706	360183355	/nfs/dbraw/zinc/18/33/55/360183355.db2.gz	CMWJFEHRBGCJIC-LLVKDONJSA-N	1	0	272.352	1.647	50	0		CDAARO
Cc1c[nH]c(CNC(=O)CC[C@H](C)[NH+]2CCCC2)n1	ZINC000426489392	360570630	/nfs/dbraw/zinc/57/06/30/360570630.db2.gz	RDGMNXXEQUEALB-LBPRGKRZSA-N	1	0	264.373	1.599	50	0		CDAARO
Cc1nn(C[C@H](C)N2CCC[NH2+]CC2)c(C)c1Cl	ZINC000426500107	360677299	/nfs/dbraw/zinc/67/72/99/360677299.db2.gz	MUKGNDAPVDARKQ-JTQLQIEISA-N	1	0	270.808	1.837	50	0		CDAARO
CC(C)c1nccc(C(=O)NCC[NH+]2CCCC2)n1	ZINC000426575175	360685483	/nfs/dbraw/zinc/68/54/83/360685483.db2.gz	WZJOCVNRWINDNK-UHFFFAOYSA-N	1	0	262.357	1.426	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1ccc2ncsc2c1	ZINC000178498199	189120911	/nfs/dbraw/zinc/12/09/11/189120911.db2.gz	PUTVAYRKXNKFEM-SECBINFHSA-N	1	0	261.350	1.730	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2sc(C)nc2C)n1C	ZINC000426382797	360660922	/nfs/dbraw/zinc/66/09/22/360660922.db2.gz	QWDLDDBYCIXXNB-UHFFFAOYSA-N	1	0	283.426	1.900	50	0		CDAARO
CCCN(CC)C(=O)Cn1ccc([C@H]2CCC[NH2+]C2)n1	ZINC000426698226	360697994	/nfs/dbraw/zinc/69/79/94/360697994.db2.gz	KVXBDMAIMIENGP-ZDUSSCGKSA-N	1	0	278.400	1.609	50	0		CDAARO
COc1ccc(CCC(=O)N(C)[C@H]2CC[NH2+]C2)cc1F	ZINC000179057230	189165520	/nfs/dbraw/zinc/16/55/20/189165520.db2.gz	ARRBXYIEUGDLKZ-LBPRGKRZSA-N	1	0	280.343	1.587	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)COc1cccnc1	ZINC000248150740	361286631	/nfs/dbraw/zinc/28/66/31/361286631.db2.gz	UBARREXRIDERRP-HUUCEWRRSA-N	1	0	289.379	1.546	50	0		CDAARO
CCN1C(=O)COc2ccc(C(=O)C3CC[NH2+]CC3)cc21	ZINC000036244090	361345472	/nfs/dbraw/zinc/34/54/72/361345472.db2.gz	GSALCZFNVXTDGN-UHFFFAOYSA-N	1	0	288.347	1.614	50	0		CDAARO
[NH3+][C@@H]1CC[C@H]2CN(C(=O)Cc3ccc(F)cc3)C[C@@H]12	ZINC000185185615	189405870	/nfs/dbraw/zinc/40/58/70/189405870.db2.gz	VDEYYPIKJPANTB-IACUBPJLSA-N	1	0	262.328	1.564	50	0		CDAARO
CC(=O)Nc1ccc(C[NH2+]CCCN2CCOCC2)cc1	ZINC000017309937	364023027	/nfs/dbraw/zinc/02/30/27/364023027.db2.gz	FMYBATOLMYVJEU-UHFFFAOYSA-N	1	0	291.395	1.457	50	0		CDAARO
CCOc1ccc(NC(=O)CSC2=[NH+]CCN2)cc1	ZINC000001009662	364275032	/nfs/dbraw/zinc/27/50/32/364275032.db2.gz	RQVSIKWERMKORZ-UHFFFAOYSA-N	1	0	279.365	1.716	50	0		CDAARO
O=S(=O)(NC1CC[NH+](C2CC2)CC1)c1cccc(F)c1	ZINC000012908452	364376673	/nfs/dbraw/zinc/37/66/73/364376673.db2.gz	ZDCYIGJYKDOQRU-UHFFFAOYSA-N	1	0	298.383	1.731	50	0		CDAARO
CCN1C(=O)N(C)C(=O)C12CC[NH+]([C@H](C)CSC)CC2	ZINC000014742620	364962858	/nfs/dbraw/zinc/96/28/58/364962858.db2.gz	DKUFCEDXYALKCD-LLVKDONJSA-N	1	0	299.440	1.486	50	0		CDAARO
C[NH2+]CCN(C)C(=O)Cc1ccc(O)c(Cl)c1	ZINC000219906996	189721308	/nfs/dbraw/zinc/72/13/08/189721308.db2.gz	BBLOCJRYAFYCEW-UHFFFAOYSA-N	1	0	256.733	1.266	50	0		CDAARO
Cc1ncn(CC(=O)N2CCC[C@H]([NH+](C)C)CC2)c1C	ZINC000221189275	189725247	/nfs/dbraw/zinc/72/52/47/189725247.db2.gz	WKLFJDMHOGUZFC-AWEZNQCLSA-N	1	0	278.400	1.443	50	0		CDAARO
COc1ccc(C[NH+]2CCC(O)CC2)c(OC)c1	ZINC000000042941	367326019	/nfs/dbraw/zinc/32/60/19/367326019.db2.gz	PSQWLTDDOBMKGG-UHFFFAOYSA-N	1	0	251.326	1.661	50	0		CDAARO
COc1cc(C(=O)N[C@H]2CC[NH2+]C[C@@H]2C)ccc1C	ZINC000094345028	367409455	/nfs/dbraw/zinc/40/94/55/367409455.db2.gz	ABCBDASMFUUMIT-AAEUAGOBSA-N	1	0	262.353	1.731	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CC[NH2+]C[C@H]2C)cc1C	ZINC000094345760	367524710	/nfs/dbraw/zinc/52/47/10/367524710.db2.gz	LPKFTHHJNNUUHS-OCCSQVGLSA-N	1	0	282.409	1.580	50	0		CDAARO
CC[N@@H+]1CCCN(C(=O)NCC[NH+]2CCCC[C@H]2C)CC1	ZINC000252497896	367646954	/nfs/dbraw/zinc/64/69/54/367646954.db2.gz	HHBGMXMXWGAFMK-OAHLLOKOSA-N	1	0	296.459	1.598	50	0		CDAARO
NC(=O)C[C@@H]1CCCC[N@@H+]1C[C@H](O)CC1CCCC1	ZINC000252515378	367734334	/nfs/dbraw/zinc/73/43/34/367734334.db2.gz	JETPGZPPIZDIOF-UONOGXRCSA-N	1	0	268.401	1.658	50	0		CDAARO
O=C(N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(C2CC2)on1	ZINC000252527968	367786013	/nfs/dbraw/zinc/78/60/13/367786013.db2.gz	DVQNAUDUYWZIEJ-VXGBXAGGSA-N	1	0	275.352	1.909	50	0		CDAARO
CCc1ccc(CN2CC[N@H+](C[C@H](C)O)C[C@H]2C)o1	ZINC000252537673	367802106	/nfs/dbraw/zinc/80/21/06/367802106.db2.gz	MAIUAAOVLDGJSY-OLZOCXBDSA-N	1	0	266.385	1.729	50	0		CDAARO
CC1CCN(c2ccc(N3CC[NH2+]CC3)nn2)CC1	ZINC000026444424	370565787	/nfs/dbraw/zinc/56/57/87/370565787.db2.gz	NXIFOAFRANLJBK-UHFFFAOYSA-N	1	0	261.373	1.123	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@@H](CNc2ncnc(N)c2Cl)C1	ZINC000192268920	371837664	/nfs/dbraw/zinc/83/76/64/371837664.db2.gz	LWJMQQWRERJTGM-JTQLQIEISA-N	1	0	299.806	1.481	50	0		CDAARO
O=C(NC[C@H]1CCC2(CC[NH2+]CC2)O1)C1CCCCC1	ZINC000299768405	372750796	/nfs/dbraw/zinc/75/07/96/372750796.db2.gz	JFTMDEWSWUDWQY-CQSZACIVSA-N	1	0	280.412	1.984	50	0		CDAARO
COc1ccc(-c2ccc3c(c2)C[C@H](C[NH3+])O3)nn1	ZINC000299773989	372752961	/nfs/dbraw/zinc/75/29/61/372752961.db2.gz	DGMJDGLYAWEILU-LLVKDONJSA-N	1	0	257.293	1.414	50	0		CDAARO
Cc1nn[nH]c1C(=O)N[C@H]1CCC[N@@H+](C2CCCC2)C1	ZINC000299778945	372756966	/nfs/dbraw/zinc/75/69/66/372756966.db2.gz	QVZIKLBWYKJRNI-NSHDSACASA-N	1	0	277.372	1.250	50	0		CDAARO
c1coc(CCC[N@@H+]2CC[C@@H]3OCc4cnnn4[C@H]3C2)c1	ZINC000299788087	372762726	/nfs/dbraw/zinc/76/27/26/372762726.db2.gz	RMZNYHRRLMBWON-GJZGRUSLSA-N	1	0	288.351	1.650	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1NC(=O)Nc1ccc[nH]c1=O	ZINC000299802403	372773609	/nfs/dbraw/zinc/77/36/09/372773609.db2.gz	ZJEXWKHIXNGGFD-RYUDHWBXSA-N	1	0	294.355	1.016	50	0		CDAARO
CCC[C@@H](C)NC(=O)[C@H]1CCC[N@H+](Cc2cncn2C)C1	ZINC000177271100	372837835	/nfs/dbraw/zinc/83/78/35/372837835.db2.gz	WSPGUDKBQVTECW-KGLIPLIRSA-N	1	0	292.427	1.937	50	0		CDAARO
COC(=O)CN1CC[NH+](CCCc2ccccc2)CC1	ZINC000354885029	373815960	/nfs/dbraw/zinc/81/59/60/373815960.db2.gz	CWRKJSFKCJZDCW-UHFFFAOYSA-N	1	0	276.380	1.410	50	0		CDAARO
CCNC(=O)C[NH+]1CCC(O)(Cc2cccc(C)c2)CC1	ZINC000280636637	375008941	/nfs/dbraw/zinc/00/89/41/375008941.db2.gz	XVGCTQMVBKPGLN-UHFFFAOYSA-N	1	0	290.407	1.501	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)[C@@H]2CSc3ccccc3O2)C1	ZINC000299739035	375199562	/nfs/dbraw/zinc/19/95/62/375199562.db2.gz	JRVGTEPZXFIWPB-PWSUYJOCSA-N	1	0	278.377	1.347	50	0		CDAARO
COCCC[NH2+]C[C@H](O)COc1ccccc1F	ZINC000002651839	375287330	/nfs/dbraw/zinc/28/73/30/375287330.db2.gz	IRBVFBDRQAMZGW-NSHDSACASA-N	1	0	257.305	1.192	50	0		CDAARO
CCOC(=O)C1=C(C[N@@H+]2CCC[C@H](CC)C2)NC(=O)NC1	ZINC000030143113	375560941	/nfs/dbraw/zinc/56/09/41/375560941.db2.gz	XJNSOIFGKQSYDB-NSHDSACASA-N	1	0	295.383	1.238	50	0		CDAARO
CSc1ccc(CNC(=O)NC[C@H]2C[NH2+]CCO2)cc1	ZINC000417250772	375741569	/nfs/dbraw/zinc/74/15/69/375741569.db2.gz	GMEAEHAOVPAFAN-GFCCVEGCSA-N	1	0	295.408	1.196	50	0		CDAARO
Cc1ccc(CC(=O)N2CCC[C@H](C)[C@@H]2C[NH3+])cn1	ZINC000429139018	247423225	/nfs/dbraw/zinc/42/32/25/247423225.db2.gz	WWWKSUIDENSBJO-FZMZJTMJSA-N	1	0	261.369	1.518	50	0		CDAARO
CCCC[C@H]([NH2+][C@H]1CCN(C(C)=O)C[C@H]1CC)C(N)=O	ZINC000239654142	376016617	/nfs/dbraw/zinc/01/66/17/376016617.db2.gz	BMPWBKARDJXSBE-RDBSUJKOSA-N	1	0	283.416	1.267	50	0		CDAARO
[NH3+]CC1(NC(=O)c2cc(F)cc3[nH]cnc32)CCCC1	ZINC000262607321	190058452	/nfs/dbraw/zinc/05/84/52/190058452.db2.gz	UESUJNLHBUISMZ-UHFFFAOYSA-N	1	0	276.315	1.703	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@@H](CCNC(=O)c2ccc[nH]2)C1	ZINC000067804575	377239658	/nfs/dbraw/zinc/23/96/58/377239658.db2.gz	JPZWZLJLTBKUHH-ZDUSSCGKSA-N	1	0	279.384	1.491	50	0		CDAARO
C[N@@H+]1CCN2CCN(C/C=C/c3ccc(F)cc3)C[C@H]2C1	ZINC000248114252	377199433	/nfs/dbraw/zinc/19/94/33/377199433.db2.gz	IGKFSSCAKVZJFG-RCAFFNEUSA-N	1	0	289.398	1.771	50	0		CDAARO
COCCC1(CNC(=O)NC[C@@H]2CCC[N@H+](C)C2)CCC1	ZINC000089375295	377848145	/nfs/dbraw/zinc/84/81/45/377848145.db2.gz	LSRINMGTNZZBEC-AWEZNQCLSA-N	1	0	297.443	1.834	50	0		CDAARO
CC(C)(C[NH2+]C[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000022030118	184536443	/nfs/dbraw/zinc/53/64/43/184536443.db2.gz	WSVKPFGFYGKJMK-OAHLLOKOSA-N	1	0	278.396	1.420	50	0		CDAARO
COc1ccccc1/C=C\C(=O)N(C)C1CC[NH2+]CC1	ZINC000493101969	253370965	/nfs/dbraw/zinc/37/09/65/253370965.db2.gz	ZQCXTFJFBJAIDJ-FPLPWBNLSA-N	1	0	274.364	1.919	50	0		CDAARO
OC[C@H]1CN(c2ncccn2)C[C@H]1C[NH+]1CCCCC1	ZINC000092065299	285293126	/nfs/dbraw/zinc/29/31/26/285293126.db2.gz	OQMDJGCTGOQOJK-ZIAGYGMSSA-N	1	0	276.384	1.007	50	0		CDAARO
CC(C)(C)[NH2+]C[C@H](O)COc1cccc2c1CCC(=O)N2	ZINC000000896463	169682412	/nfs/dbraw/zinc/68/24/12/169682412.db2.gz	LWAFSWPYPHEXKX-NSHDSACASA-N	1	0	292.379	1.699	50	0	fda	CDAARO
CC1(C)CC(NC(=O)C(F)(F)F)CC(C)(C)[NH2+]1	ZINC000004672846	390154738	/nfs/dbraw/zinc/15/47/38/390154738.db2.gz	KHSBEFUAAXINMS-UHFFFAOYSA-N	1	0	252.280	1.974	50	0		CDAARO
CC(C)CC[N@H+](CCN1C(=O)CNC1=O)C1CC1	ZINC000032804058	390209996	/nfs/dbraw/zinc/20/99/96/390209996.db2.gz	JYFQZQLBGUZDRE-UHFFFAOYSA-N	1	0	253.346	1.049	50	0		CDAARO
O=S(=O)(NCC[NH2+]C[C@@H]1CC=CCC1)c1ccccc1	ZINC000095433926	184983437	/nfs/dbraw/zinc/98/34/37/184983437.db2.gz	WZJYMTFYICMBCE-CQSZACIVSA-N	1	0	294.420	1.911	50	0		CDAARO
CO[C@@H]1CC[C@@]2(OC)CC[N@H+](Cc3cnc[nH]3)[C@H]2C1	ZINC000426712251	391859959	/nfs/dbraw/zinc/85/99/59/391859959.db2.gz	XAEYPAHZUPTAMF-HZSPNIEDSA-N	1	0	265.357	1.568	50	0		CDAARO
CCCCc1nc(CN2CCO[C@@H](CC[NH3+])C2)c[nH]1	ZINC000426715923	391860047	/nfs/dbraw/zinc/86/00/47/391860047.db2.gz	MJLWCOBAEOKGOB-ZDUSSCGKSA-N	1	0	266.389	1.302	50	0		CDAARO
CC(=O)N1CC[C@]([NH3+])(C(=O)Nc2cnc3ccccc3c2)C1	ZINC000649284471	393318902	/nfs/dbraw/zinc/31/89/02/393318902.db2.gz	AIUDWVMOQPLNJP-MRXNPFEDSA-N	1	0	298.346	1.123	50	0		CDAARO
CC[C@H](O)CN1C[C@@H](CC)[N@H+](CC(C)(C)O)C[C@H]1CC	ZINC000252500411	393381910	/nfs/dbraw/zinc/38/19/10/393381910.db2.gz	SVBXLJRYOZVQCU-KFWWJZLASA-N	1	0	286.460	1.703	50	0		CDAARO
CCN(C)C(=O)c1ccccc1N1CCC([NH3+])CC1	ZINC000037263329	134837346	/nfs/dbraw/zinc/83/73/46/134837346.db2.gz	ORBVJGYRCPMIRU-UHFFFAOYSA-N	1	0	261.369	1.706	50	0		CDAARO
NC(=O)[C@H](c1ccccc1)N1C[C@@H](c2ccccc2)[C@H]([NH3+])C1	ZINC000261743536	140384032	/nfs/dbraw/zinc/38/40/32/140384032.db2.gz	MUBHZVWEYAZQJY-BBWFWOEESA-N	1	0	295.386	1.640	50	0		CDAARO
C[C@@H](NC(=O)[C@@H]([NH3+])CC1CCCCC1)c1cnn(C)c1	ZINC000261827544	140395926	/nfs/dbraw/zinc/39/59/26/140395926.db2.gz	UKYIQNQIHNZSGT-RISCZKNCSA-N	1	0	278.400	1.895	50	0		CDAARO
C(=C\c1ccccc1)\C[NH2+][C@H]1CCc2ncnn2C1	ZINC000104060945	397930714	/nfs/dbraw/zinc/93/07/14/397930714.db2.gz	ZLJRSBDHTLDCES-ZBKLQPJUSA-N	1	0	254.337	1.896	50	0		CDAARO
CCC[C@](C)([NH3+])C(=O)Nc1ccc(NC(=O)C2CC2)nc1	ZINC000262674874	149094413	/nfs/dbraw/zinc/09/44/13/149094413.db2.gz	RKNSDQITNOTQNT-HNNXBMFYSA-N	1	0	290.367	1.886	50	0		CDAARO
Cc1ccn2cc(C(=O)N(C)CC[NH+]3CCCC3)nc2c1	ZINC000343477999	152196647	/nfs/dbraw/zinc/19/66/47/152196647.db2.gz	HZANEBZISAVLBR-UHFFFAOYSA-N	1	0	286.379	1.811	50	0		CDAARO
CCO[C@@H]1C[C@H](O)C12CC[NH+](C[C@@H](O)CC)CC2	ZINC000195530807	286410622	/nfs/dbraw/zinc/41/06/22/286410622.db2.gz	OEOHHUKMKDUVPJ-RWMBFGLXSA-N	1	0	257.374	1.009	50	0		CDAARO
COCCC1([NH3+])CCN(C(=O)OC(C)(C)C)CC1	ZINC000098213807	292309449	/nfs/dbraw/zinc/30/94/49/292309449.db2.gz	GXZMDYIRVQYTJY-UHFFFAOYSA-N	1	0	258.362	1.751	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1nc(-c2cccs2)no1	ZINC000004721571	170004930	/nfs/dbraw/zinc/00/49/30/170004930.db2.gz	FVHJTRNDJQENIT-UHFFFAOYSA-N	1	0	294.380	1.870	50	0		CDAARO
Cc1cccc(O[C@@H](C)C(=O)NCCC[NH+](C)C)c1	ZINC000008320847	170330851	/nfs/dbraw/zinc/33/08/51/170330851.db2.gz	DOAJKIRXCVNLKR-ZDUSSCGKSA-N	1	0	264.369	1.830	50	0		CDAARO
Cc1cccc(NC(=S)NN2CCN(C)CC2)c1	ZINC000008581771	170341877	/nfs/dbraw/zinc/34/18/77/170341877.db2.gz	WBVXPQGODRXOME-UHFFFAOYSA-N	1	0	264.398	1.444	50	0		CDAARO
CC[NH2+]C[C@]1(O)CCCN(Cc2ccc(F)cc2)C1=O	ZINC000012712185	170504985	/nfs/dbraw/zinc/50/49/85/170504985.db2.gz	YPOBBJUJZRGHEW-OAHLLOKOSA-N	1	0	280.343	1.289	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCCCC[NH3+])c(C)c1	ZINC000020224274	171086748	/nfs/dbraw/zinc/08/67/48/171086748.db2.gz	ZVOZOVFBNJDRCX-UHFFFAOYSA-N	1	0	256.371	1.321	50	0		CDAARO
FC(F)(F)c1cccc(OCCN2CC[NH2+]CC2)c1	ZINC000020272511	171127661	/nfs/dbraw/zinc/12/76/61/171127661.db2.gz	FICXBCGWGHSDJM-UHFFFAOYSA-N	1	0	274.286	1.989	50	0		CDAARO
CCN1C(=O)N(C)C(=O)C12CC[NH+](C(C)C)CC2	ZINC000020998706	171283987	/nfs/dbraw/zinc/28/39/87/171283987.db2.gz	FOYZYCCUXLAALI-UHFFFAOYSA-N	1	0	253.346	1.143	50	0		CDAARO
Cc1cccc(OC[C@H](O)CN2CC[NH+](C)CC2)c1C	ZINC000022467378	171388675	/nfs/dbraw/zinc/38/86/75/171388675.db2.gz	NQNHKGNRUYUGQN-OAHLLOKOSA-N	1	0	278.396	1.291	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2c(C)cccc2C)CC1	ZINC000023471852	171422503	/nfs/dbraw/zinc/42/25/03/171422503.db2.gz	GADXWBPBCWETTR-UHFFFAOYSA-N	1	0	275.396	1.879	50	0		CDAARO
C[C@H](C(=O)N1C[C@H](C)C[C@H](C)C1)[NH+]1CCC(O)CC1	ZINC000040460091	174270174	/nfs/dbraw/zinc/27/01/74/174270174.db2.gz	JERNGNIEVLLHNX-FRRDWIJNSA-N	1	0	268.401	1.336	50	0		CDAARO
CNc1ccccc1C(=O)NC[C@@H]1CCC[N@H+](C)C1	ZINC000044559392	175204088	/nfs/dbraw/zinc/20/40/88/175204088.db2.gz	SQGFDXDOPPRBQH-LBPRGKRZSA-N	1	0	261.369	1.800	50	0		CDAARO
NC(=[NH2+])NCCCOc1ccccc1Br	ZINC000071611479	176231882	/nfs/dbraw/zinc/23/18/82/176231882.db2.gz	LTRLQINXJOICIB-UHFFFAOYSA-N	1	0	272.146	1.701	50	0		CDAARO
CS(=O)(=O)c1cnc(CC2CC2)nc1[C@H]1CCC[NH2+]C1	ZINC000071748761	176259710	/nfs/dbraw/zinc/25/97/10/176259710.db2.gz	BINVJJKPBXOXTA-NSHDSACASA-N	1	0	295.408	1.300	50	0		CDAARO
NC(=O)CC[N@@H+]1C[C@@H](c2ccccc2)[C@@H]2[C@H]1C1CCN2CC1	ZINC000072157673	176329381	/nfs/dbraw/zinc/32/93/81/176329381.db2.gz	PRBUURCNPHQCHB-CGTJXYLNSA-N	1	0	299.418	1.424	50	0		CDAARO
CSc1cccc(C[N@@H+]2CCOC[C@@H](O)C2)c1	ZINC000077286565	177249431	/nfs/dbraw/zinc/24/94/31/177249431.db2.gz	QEHKZPDLHHHLQH-LBPRGKRZSA-N	1	0	253.367	1.602	50	0		CDAARO
[NH3+]C[C@@H](O)CC(=O)N1CCC(Cc2ccc(F)cc2)CC1	ZINC000077453560	177270162	/nfs/dbraw/zinc/27/01/62/177270162.db2.gz	NBASUJHSFUYIER-HNNXBMFYSA-N	1	0	294.370	1.317	50	0		CDAARO
C[NH2+][C@@H](CO)C(=O)N1CCC(Cc2ccccc2F)CC1	ZINC000077504194	177276098	/nfs/dbraw/zinc/27/60/98/177276098.db2.gz	RALLAMOCEKXKRL-HNNXBMFYSA-N	1	0	294.370	1.187	50	0		CDAARO
CC(C)NC(=O)C[C@H](C)[NH2+]Cc1cccc2c[nH]nc21	ZINC000084048420	273539273	/nfs/dbraw/zinc/53/92/73/273539273.db2.gz	LXGXZUOQWUUOOT-NSHDSACASA-N	1	0	274.368	1.956	50	0		CDAARO
C([NH2+]C(C1CC1)C1CC1)[C@H]1COC2(CCOCC2)O1	ZINC000097039014	275394490	/nfs/dbraw/zinc/39/44/90/275394490.db2.gz	KVFHWXRFGMIOOV-ZDUSSCGKSA-N	1	0	267.369	1.687	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N1CCC[NH2+]CC1	ZINC000193231682	276680104	/nfs/dbraw/zinc/68/01/04/276680104.db2.gz	KWRMQWJQSOLIQA-UHFFFAOYSA-N	1	0	268.382	1.233	50	0		CDAARO
COC(=O)C[C@H]1[NH2+]CCc2cc(OC)c(OC)cc21	ZINC000019892512	277330759	/nfs/dbraw/zinc/33/07/59/277330759.db2.gz	NVXHORURRXLOGZ-LLVKDONJSA-N	1	0	265.309	1.454	50	0		CDAARO
COc1cc2c(c(OC)c1OC)C[C@H]([NH3+])CCC2	ZINC000005248864	277844519	/nfs/dbraw/zinc/84/45/19/277844519.db2.gz	ALQILQWUPQNHCC-SNVBAGLBSA-N	1	0	251.326	1.919	50	0		CDAARO
C[C@@H]1CSC[C@@H]1[NH2+][C@H]1CCCN(c2ccn(C)n2)C1=O	ZINC000285118298	278870716	/nfs/dbraw/zinc/87/07/16/278870716.db2.gz	NBAXENSERLTGBO-WOPDTQHZSA-N	1	0	294.424	1.257	50	0		CDAARO
C[N@@H+]1CC[C@@H](CNC(=O)c2cccc3c2OCO3)C1	ZINC000109849383	279312744	/nfs/dbraw/zinc/31/27/44/279312744.db2.gz	AVWHPQJOOHTQCA-JTQLQIEISA-N	1	0	262.309	1.097	50	0		CDAARO
c1cncc(C[NH2+]C[C@@H]2COC3(CCOCC3)O2)c1	ZINC000095991137	280501807	/nfs/dbraw/zinc/50/18/07/280501807.db2.gz	XVCOQUZNZWFKRN-CYBMUJFWSA-N	1	0	264.325	1.093	50	0		CDAARO
Cc1ccc(C[NH2+][C@H](C)CCN2CCOCC2)nc1	ZINC000095416686	280831874	/nfs/dbraw/zinc/83/18/74/280831874.db2.gz	CHYXMWMPJPPXPG-CQSZACIVSA-N	1	0	263.385	1.590	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N(C)[C@@H]1CCC[C@@H]1SC	ZINC000095971183	295604440	/nfs/dbraw/zinc/60/44/40/295604440.db2.gz	UWBOVYWDRFBPHV-AXFHLTTASA-N	1	0	276.471	1.809	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@H]1CCC[NH2+][C@@H]1C	ZINC000091496977	301318459	/nfs/dbraw/zinc/31/84/59/301318459.db2.gz	AAYHRVOVMJWPEO-PWSUYJOCSA-N	1	0	286.372	1.553	50	0		CDAARO
O[C@@]1(CNc2cccc(C(F)(F)F)n2)CCC[NH2+]C1	ZINC000534582596	328312587	/nfs/dbraw/zinc/31/25/87/328312587.db2.gz	BCUULGFYDKHTFO-NSHDSACASA-N	1	0	275.274	1.627	50	0		CDAARO
O=C(NCCc1ncc[nH]1)c1cccc2c1CCC2=O	ZINC000534585942	328315252	/nfs/dbraw/zinc/31/52/52/328315252.db2.gz	UKWZLPHUHZJJOX-UHFFFAOYSA-N	1	0	269.304	1.511	50	0		CDAARO
O=C(C[NH+]1CCCC1)NCCOc1cccc2cccnc21	ZINC000534589136	328317380	/nfs/dbraw/zinc/31/73/80/328317380.db2.gz	UPQNGAVPHDVLDU-UHFFFAOYSA-N	1	0	299.374	1.826	50	0		CDAARO
Cc1ccccc1N1CCC([NH2+]CCn2ccnn2)CC1	ZINC000534636344	328333703	/nfs/dbraw/zinc/33/37/03/328333703.db2.gz	MCZHCOKEMFZXSK-UHFFFAOYSA-N	1	0	285.395	1.845	50	0		CDAARO
CCCOc1ccccc1CCNC(=O)[C@H]1C=CC[NH2+]1	ZINC000534653603	328338491	/nfs/dbraw/zinc/33/84/91/328338491.db2.gz	SABKWWJJPWDIPH-CQSZACIVSA-N	1	0	274.364	1.662	50	0		CDAARO
C[NH+]1CCC(OCCCNC(=O)[C@@]2(C)CCCCO2)CC1	ZINC000534651802	328337621	/nfs/dbraw/zinc/33/76/21/328337621.db2.gz	WNNMOWJTWBAKPB-MRXNPFEDSA-N	1	0	298.427	1.563	50	0		CDAARO
C[C@@H](CCC(=O)NCC1(CO)CCCC1)[NH+]1CCOCC1	ZINC000534652286	328338029	/nfs/dbraw/zinc/33/80/29/328338029.db2.gz	UNOLVEBLWKHPBV-AWEZNQCLSA-N	1	0	298.427	1.156	50	0		CDAARO
C[C@@H](CN(C)CCO)[NH2+]C1(Cc2ccccc2)CC1	ZINC000534648271	328343372	/nfs/dbraw/zinc/34/33/72/328343372.db2.gz	DXHPULMGMNWFOX-AWEZNQCLSA-N	1	0	262.397	1.664	50	0		CDAARO
CC(=O)N1CCC([NH2+][C@@H](c2ncnn2C)C(C)C)CC1	ZINC000534660574	328339560	/nfs/dbraw/zinc/33/95/60/328339560.db2.gz	SXLXPLNWRLLZTC-CYBMUJFWSA-N	1	0	279.388	1.113	50	0		CDAARO
COc1ccc2c(c1)C[C@@H]([NH2+]CCn1cncn1)CC2	ZINC000382035637	328450485	/nfs/dbraw/zinc/45/04/85/328450485.db2.gz	SXFAMCMREFOWAR-AWEZNQCLSA-N	1	0	272.352	1.434	50	0		CDAARO
Cc1cnc(NC[C@@H](O)C[NH+]2CCCCC2)nc1	ZINC000095352463	327202535	/nfs/dbraw/zinc/20/25/35/327202535.db2.gz	ZSNULFDDRAGXTR-GFCCVEGCSA-N	1	0	250.346	1.044	50	0		CDAARO
CCOC(=O)N1CC[C@@H]([NH2+]CCCn2ccccc2=O)C1	ZINC000670461662	483045062	/nfs/dbraw/zinc/04/50/62/483045062.db2.gz	VQAPRTWOVLUIBD-CYBMUJFWSA-N	1	0	293.367	1.059	50	0		CDAARO
Cc1[nH]ccc1C(=O)NCCNc1cc[nH+]cc1C	ZINC000670470905	483074580	/nfs/dbraw/zinc/07/45/80/483074580.db2.gz	GLWOGOQERVLPFT-UHFFFAOYSA-N	1	0	258.325	1.290	50	0		CDAARO
CC(C)[C@H](Cc1ccccc1)C(=O)NC[C@@H](O)C[NH+](C)C	ZINC000084410513	483276758	/nfs/dbraw/zinc/27/67/58/483276758.db2.gz	ZYGSNLNBXIOWLY-CVEARBPZSA-N	1	0	292.423	1.540	50	0		CDAARO
C[C@@H]1CN(C(=O)NC2CC[NH+](C3CC3)CC2)CC(C)(C)O1	ZINC000068543199	524804564	/nfs/dbraw/zinc/80/45/64/524804564.db2.gz	HSMKCTNPAFBIBO-GFCCVEGCSA-N	1	0	295.427	1.822	50	0		CDAARO
CC(C)C[N@H+](CCN1C(=O)CNC1=O)CC(C)(C)C	ZINC000096474707	527940103	/nfs/dbraw/zinc/94/01/03/527940103.db2.gz	ASZINOGCVFPDKG-UHFFFAOYSA-N	1	0	269.389	1.542	50	0		CDAARO
CC[C@@H]([NH2+]CC(=O)NC(=O)NC)C(C)(C)c1ccccc1	ZINC000096493176	529153706	/nfs/dbraw/zinc/15/37/06/529153706.db2.gz	LJDQSCPEGBXEPP-CYBMUJFWSA-N	1	0	291.395	1.788	50	0		CDAARO
C[C@@H]1C[NH2+][C@H]([C@@H]2CC[C@H](C(F)(F)F)NC2)[C@@H](N)C1	ZINC000757209117	577035898	/nfs/dbraw/zinc/03/58/98/577035898.db2.gz	FYDKCBZQGYYGEM-OGBGREFGSA-N	1	0	265.323	1.242	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@H]1c1ccc(NS(C)(=O)=O)cc1	ZINC000757215125	577036246	/nfs/dbraw/zinc/03/62/46/577036246.db2.gz	VAGOQANJCNJSJX-GXFFZTMASA-N	1	0	268.382	1.914	50	0		CDAARO
COc1cccc2ccc(C[N@H+](C)[C@@H](C)CC(N)=O)nc21	ZINC000952976448	617312040	/nfs/dbraw/zinc/31/20/40/617312040.db2.gz	SDDVMTLAQUHDGY-NSHDSACASA-N	1	0	287.363	1.939	50	0		CDAARO
CCc1nccn1CCNC(=O)[C@@H]1CCCCC[N@@H+]1C	ZINC000952977588	615777374	/nfs/dbraw/zinc/77/73/74/615777374.db2.gz	IXGZGNVQJFBHCM-ZDUSSCGKSA-N	1	0	278.400	1.436	50	0		CDAARO
CON(C)C(=O)CC[N@@H+]1CCCC[C@H]1c1cc(C)n[nH]1	ZINC000952995021	617004647	/nfs/dbraw/zinc/00/46/47/617004647.db2.gz	AKAQWPXZLCCAMC-ZDUSSCGKSA-N	1	0	280.372	1.655	50	0		CDAARO
COC[C@H](C)[N@@H+]1CCCN(C(=O)C2(C)CC2)CC1	ZINC000981215608	617059023	/nfs/dbraw/zinc/05/90/23/617059023.db2.gz	HUIVCCXMPCKTJD-LBPRGKRZSA-N	1	0	254.374	1.356	50	0		CDAARO
COCc1nccc(N2CC[C@H]([NH+](C)C)[C@@H]2C)n1	ZINC000928995733	620829841	/nfs/dbraw/zinc/82/98/41/620829841.db2.gz	IYNHGTIAPYEZJA-QWRGUYRKSA-N	1	0	250.346	1.152	50	0		CDAARO
CNCc1nnc(NCCC2CC[NH+](C(C)C)CC2)o1	ZINC001772702374	1159437592	/nfs/dbraw/zinc/43/75/92/1159437592.db2.gz	SALDGRKAGMYKOB-UHFFFAOYSA-N	1	0	281.404	1.711	50	0		CDAARO
O[C@H](Cn1cc(C[C@H]2CC[NH2+]C2)nn1)c1ccccc1	ZINC000585135455	1164217706	/nfs/dbraw/zinc/21/77/06/1164217706.db2.gz	KSSICCQUBFAYRH-IUODEOHRSA-N	1	0	272.352	1.164	50	0		CDAARO
CCc1cc(NCc2cc(=O)[nH]cn2)nc(N(C)C)[nH+]1	ZINC001704342348	1177695533	/nfs/dbraw/zinc/69/55/33/1177695533.db2.gz	NIZYKWQCQNESHF-UHFFFAOYSA-N	1	0	274.328	1.213	50	0		CDAARO
COc1cc(CN2CC[N@H+](C)[C@@H](CCO)C2)ccc1F	ZINC000020271448	726131568	/nfs/dbraw/zinc/13/15/68/726131568.db2.gz	VFCXKQVIVZDEQC-ZDUSSCGKSA-N	1	0	282.359	1.333	50	0		CDAARO
Cc1ncn(C)c1C(=O)N1CCC[C@H](c2nccn2C)C1	ZINC000299773260	726876976	/nfs/dbraw/zinc/87/69/76/726876976.db2.gz	BXUPLYAERQOLQC-LBPRGKRZSA-N	1	0	287.367	1.482	50	0		CDAARO
Cc1nc([C@@H]([NH3+])C2(O)CC(CF)(CF)C2)cn1C	ZINC000958527537	727013635	/nfs/dbraw/zinc/01/36/35/727013635.db2.gz	BZWOJBTZFIGKTM-SNVBAGLBSA-N	1	0	259.300	1.179	50	0		CDAARO
O=c1cc(C2CC[NH2+]CC2)nc(Cc2cccs2)[nH]1	ZINC000023619854	727142259	/nfs/dbraw/zinc/14/22/59/727142259.db2.gz	SODKFIGYXUTGFG-UHFFFAOYSA-N	1	0	275.377	1.889	50	0		CDAARO
C[NH+]1CCC(C)(c2nc(-c3cccnn3)no2)CC1	ZINC000091305123	727221037	/nfs/dbraw/zinc/22/10/37/727221037.db2.gz	HFXSPPFNNVUKRU-UHFFFAOYSA-N	1	0	259.313	1.510	50	0		CDAARO
COc1ccccc1OC1CN(CC(C)(C)[NH3+])C1	ZINC000072146112	727393020	/nfs/dbraw/zinc/39/30/20/727393020.db2.gz	RUIPLXNITBIPKI-UHFFFAOYSA-N	1	0	250.342	1.496	50	0		CDAARO
Nc1nc(NCc2ncc3c(n2)CCC3)c2c([nH+]1)CCCC2	ZINC000095353668	727394804	/nfs/dbraw/zinc/39/48/04/727394804.db2.gz	WJUHIRHQUYSUPX-UHFFFAOYSA-N	1	0	296.378	1.828	50	0		CDAARO
C[C@H](Cc1ccccc1F)[NH+]1CCC(C(N)=O)CC1	ZINC000000216031	727433611	/nfs/dbraw/zinc/43/36/11/727433611.db2.gz	VKPHURPXJFTRQJ-LLVKDONJSA-N	1	0	264.344	1.954	50	0		CDAARO
CS(=O)(=O)Nc1ccc([C@H]2CCCC[NH2+]2)cc1	ZINC000258710965	727471107	/nfs/dbraw/zinc/47/11/07/727471107.db2.gz	RUPZEAYWIIWCGS-GFCCVEGCSA-N	1	0	254.355	1.873	50	0		CDAARO
CCc1ccccc1OCC[NH2+]C[C@H]1CCS(=O)(=O)C1	ZINC000065405626	728217190	/nfs/dbraw/zinc/21/71/90/728217190.db2.gz	OXRJNKNLVGBCJZ-CYBMUJFWSA-N	1	0	297.420	1.652	50	0		CDAARO
CC(C)=CC[NH+]1CCC(CNC(=O)[C@H]2CCOC2)CC1	ZINC000952961858	910471963	/nfs/dbraw/zinc/47/19/63/910471963.db2.gz	DFUDSZFWQNKOJR-HNNXBMFYSA-N	1	0	280.412	1.817	50	0		CDAARO
C[NH2+]C1CC(C(=O)N(Cc2ccccn2)C2CC2)C1	ZINC000693560947	920131069	/nfs/dbraw/zinc/13/10/69/920131069.db2.gz	JTVJLZURMHLCAS-UHFFFAOYSA-N	1	0	259.353	1.571	50	0		CDAARO
CCS(=O)(=O)NC[C@H](C)[NH+]1CCC(CCOC)CC1	ZINC000824384123	925033807	/nfs/dbraw/zinc/03/38/07/925033807.db2.gz	MGAUNRLJNJNWCO-LBPRGKRZSA-N	1	0	292.445	1.063	50	0		CDAARO
CC(C)(O)Cn1ncnc1CCC[NH+]1CCCCCC1	ZINC000821529036	925587019	/nfs/dbraw/zinc/58/70/19/925587019.db2.gz	YWPJPOIUKDLIOA-UHFFFAOYSA-N	1	0	280.416	1.858	50	0		CDAARO
CCN(C)C1(C[NH2+][C@H](C)CS(C)(=O)=O)CCCC1	ZINC000823067837	925666958	/nfs/dbraw/zinc/66/69/58/925666958.db2.gz	LFKJPQSBNLRRQT-GFCCVEGCSA-N	1	0	276.446	1.274	50	0		CDAARO
C[N@@H+]1CC[C@](C)(CNS(=O)(=O)CC2CCCC2)C1	ZINC000823754912	925724358	/nfs/dbraw/zinc/72/43/58/925724358.db2.gz	ACNNUAQFEOLLHM-CYBMUJFWSA-N	1	0	274.430	1.438	50	0		CDAARO
CNC(=O)[C@H]1CC[C@H](CNc2cc(C)[nH+]c(NC)n2)CC1	ZINC000823830656	925736146	/nfs/dbraw/zinc/73/61/46/925736146.db2.gz	CDYRICGSLVKUTR-HAQNSBGRSA-N	1	0	291.399	1.791	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNC(=O)CCC2CCC2)C1	ZINC000824412399	925820505	/nfs/dbraw/zinc/82/05/05/925820505.db2.gz	NMQRRYFIMCQODF-AWEZNQCLSA-N	1	0	268.401	1.651	50	0		CDAARO
CS(=O)(=O)NC[C@H]1CC[N@@H+](C2CCCCC2)C1	ZINC000824864408	925838655	/nfs/dbraw/zinc/83/86/55/925838655.db2.gz	BCKMWBMRVTVNFF-LLVKDONJSA-N	1	0	260.403	1.190	50	0		CDAARO
Cc1nncn1CC[N@@H+]1CCC[C@H](C(C)(C)O)C1	ZINC000825297050	925862142	/nfs/dbraw/zinc/86/21/42/925862142.db2.gz	NIBYSASWGVONFJ-LBPRGKRZSA-N	1	0	252.362	1.069	50	0		CDAARO
O=C(NCC[N@H+]1CCCC[C@H]1CO)NCC1CCCCC1	ZINC000828710749	926168591	/nfs/dbraw/zinc/16/85/91/926168591.db2.gz	ACNCTIGBPKGVTO-HNNXBMFYSA-N	1	0	297.443	1.713	50	0		CDAARO
Cc1cc(=O)c(C(=O)N[C@@H]2C[C@H]([NH+](C)C)C23CCC3)c[nH]1	ZINC000585127795	931011611	/nfs/dbraw/zinc/01/16/11/931011611.db2.gz	JNXCZDPKIRMKPX-KGLIPLIRSA-N	1	0	289.379	1.286	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1CCCN(C(=O)C2CCC2)CC1	ZINC001251774169	950813813	/nfs/dbraw/zinc/81/38/13/950813813.db2.gz	SRFWMOXWVXSJTP-CYBMUJFWSA-N	1	0	254.374	1.092	50	0		CDAARO
CC(C)[NH+]1CCC(Nc2cc(NCCO)ncn2)CC1	ZINC001506399311	975149518	/nfs/dbraw/zinc/14/95/18/975149518.db2.gz	LXJIJXDIXIRJJU-UHFFFAOYSA-N	1	0	279.388	1.166	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN(c2ccc(Cl)cn2)C1	ZINC001506407309	975151778	/nfs/dbraw/zinc/15/17/78/975151778.db2.gz	QUQPKOXTLCPHQV-LLVKDONJSA-N	1	0	269.776	1.749	50	0		CDAARO
Fc1cnccc1N1CCN([C@H]2C[NH+]3CCC2CC3)CC1	ZINC001506408478	975153192	/nfs/dbraw/zinc/15/31/92/975153192.db2.gz	YIZMLFALKVTVHV-INIZCTEOSA-N	1	0	290.386	1.437	50	0		CDAARO
C[C@@H](CCN(C)C(=O)c1cncn1C)[NH+]1CCCC1	ZINC001506420164	975158123	/nfs/dbraw/zinc/15/81/23/975158123.db2.gz	WOOLEYXCOPOHTD-LBPRGKRZSA-N	1	0	264.373	1.367	50	0		CDAARO
c1cn(CC[N@@H+]2CCCN(Cc3ccccn3)CC2)cn1	ZINC001506422317	975158141	/nfs/dbraw/zinc/15/81/41/975158141.db2.gz	NWPPPHBGVKGHJG-UHFFFAOYSA-N	1	0	285.395	1.486	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](CNCc2cnc(C)nc2)C1	ZINC001506426385	975160702	/nfs/dbraw/zinc/16/07/02/975160702.db2.gz	GNWJAIRXXJTYJV-CQSZACIVSA-N	1	0	278.400	1.233	50	0		CDAARO
CCCNC(=O)N1CC[N@H+](CC(C)C)[C@@H](CCO)C1	ZINC001506426435	975160839	/nfs/dbraw/zinc/16/08/39/975160839.db2.gz	OOJGIJQQTVSGBN-ZDUSSCGKSA-N	1	0	271.405	1.131	50	0		CDAARO
CCC[N@@H+]1CC[C@@H](Nc2nc(N)nc(C)c2Cl)C1	ZINC001506428408	975161836	/nfs/dbraw/zinc/16/18/36/975161836.db2.gz	PSVKWUXWVSJMFY-SECBINFHSA-N	1	0	269.780	1.917	50	0		CDAARO
CN(CC1([NH+](C)C)CCC1)C(=O)NCCC1CC1	ZINC000189927761	342453018	/nfs/dbraw/zinc/45/30/18/342453018.db2.gz	LIZMKKBFHCMTQF-UHFFFAOYSA-N	1	0	253.390	1.912	50	0		CDAARO
C[C@H]1CCCC[C@@H]1C[NH2+]C1CCN(CC(N)=O)CC1	ZINC000096502302	230385073	/nfs/dbraw/zinc/38/50/73/230385073.db2.gz	DABRLKDINQQCDA-QWHCGFSZSA-N	1	0	267.417	1.352	50	0		CDAARO
COCCC(=O)N1CC[NH+](C2Cc3ccccc3C2)CC1	ZINC000222859486	230398785	/nfs/dbraw/zinc/39/87/85/230398785.db2.gz	TVIJWZQIMGKBII-UHFFFAOYSA-N	1	0	288.391	1.335	50	0		CDAARO
Cc1csc(C[NH2+][C@@H]2CCCCC[C@H]2C(N)=O)n1	ZINC000097375077	342002762	/nfs/dbraw/zinc/00/27/62/342002762.db2.gz	WJNJEGXBLSJXOI-GHMZBOCLSA-N	1	0	267.398	1.975	50	0		CDAARO
COc1ccc([C@@H](C)[NH2+]CCN2C(=O)CNC2=O)cc1C	ZINC000095940755	185035641	/nfs/dbraw/zinc/03/56/41/185035641.db2.gz	NXOUQHCPEOJFBD-LLVKDONJSA-N	1	0	291.351	1.206	50	0		CDAARO
COCc1nc(C)cc(N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)n1	ZINC000095962818	185044822	/nfs/dbraw/zinc/04/48/22/185044822.db2.gz	GWQJRYQPRPJXTE-CHWSQXEVSA-N	1	0	276.384	1.970	50	0		CDAARO
Cc1ccc(C)c(C(=O)N2CCC([N@H+](C)CCO)CC2)c1	ZINC000095976443	185051058	/nfs/dbraw/zinc/05/10/58/185051058.db2.gz	CQYGYDXBEHUGGX-UHFFFAOYSA-N	1	0	290.407	1.832	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)N1CCC[C@H](C)C1)C1CCOCC1	ZINC000095985399	185054960	/nfs/dbraw/zinc/05/49/60/185054960.db2.gz	YYRTWGYDLFDMRU-QWHCGFSZSA-N	1	0	268.401	1.650	50	0		CDAARO
O[C@H](C[NH+]1CCC(n2ccnn2)CC1)c1ccc(F)cc1	ZINC000095994227	185059059	/nfs/dbraw/zinc/05/90/59/185059059.db2.gz	YWOQQAHOVZPLNE-OAHLLOKOSA-N	1	0	290.342	1.788	50	0		CDAARO
COCC(C)(C)CNC(=O)[C@@H]1CC12CC[NH2+]CC2	ZINC000310947308	342089805	/nfs/dbraw/zinc/08/98/05/342089805.db2.gz	MTXSFHDMOFNMTP-NSHDSACASA-N	1	0	254.374	1.165	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1	ZINC000125199531	187174072	/nfs/dbraw/zinc/17/40/72/187174072.db2.gz	IAYLPRPKBUVVHJ-USWWRNFRSA-N	1	0	280.318	1.889	50	0		CDAARO
CNC(=O)CC1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1	ZINC000089907622	539087666	/nfs/dbraw/zinc/08/76/66/539087666.db2.gz	CFGNGTQDDKPSCG-STQMWFEESA-N	1	0	254.374	1.138	50	0		CDAARO
Cc1nc(C(=O)N(CC[NH+](C)C)C[C@@H]2CCCO2)cs1	ZINC000096133162	185104295	/nfs/dbraw/zinc/10/42/95/185104295.db2.gz	ZRCACDBFOAARRP-LBPRGKRZSA-N	1	0	297.424	1.634	50	0		CDAARO
CCC(CC)([NH2+]Cc1cccc2c1OCO2)C(N)=O	ZINC000195577896	342628953	/nfs/dbraw/zinc/62/89/53/342628953.db2.gz	IOCKKSSXEQIOKA-UHFFFAOYSA-N	1	0	264.325	1.549	50	0		CDAARO
O=C(NC1CC[NH+](Cc2cccnc2)CC1)c1cnc[nH]1	ZINC000244884392	361869030	/nfs/dbraw/zinc/86/90/30/361869030.db2.gz	YLOCDZCOHCWSBU-UHFFFAOYSA-N	1	0	285.351	1.199	50	0		CDAARO
Cc1ccccc1[C@@H]1C[C@@H]1C(=O)N1CC[NH2+]C[C@@H]1C	ZINC000125438883	187184609	/nfs/dbraw/zinc/18/46/09/187184609.db2.gz	GDUAESQXMLIFOG-QEJZJMRPSA-N	1	0	258.365	1.919	50	0		CDAARO
Cc1cc(S(=O)(=O)NC[C@H]2CCCC[NH2+]2)c(C)o1	ZINC000097235005	342205572	/nfs/dbraw/zinc/20/55/72/342205572.db2.gz	MAJXISLAJUKTQP-LLVKDONJSA-N	1	0	272.370	1.317	50	0		CDAARO
CC(C)CO[C@@H]1C[C@@H]([NH2+]C[C@]2(O)CCOC2)C1(C)C	ZINC000097034790	185156935	/nfs/dbraw/zinc/15/69/35/185156935.db2.gz	FPBCOBZJHWOKAE-UMVBOHGHSA-N	1	0	271.401	1.567	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)Nc1cccc2nonc21	ZINC000585136528	342216032	/nfs/dbraw/zinc/21/60/32/342216032.db2.gz	JPRQDFVUYYTITL-UHFFFAOYSA-N	1	0	260.297	1.551	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](C(=O)N(C)CC(=O)OCC)C1	ZINC000685944967	539046101	/nfs/dbraw/zinc/04/61/01/539046101.db2.gz	LLJPAGKTXDPXRQ-LBPRGKRZSA-N	1	0	270.373	1.130	50	0		CDAARO
O=C(Cc1cccs1)N1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1	ZINC000084442206	342262892	/nfs/dbraw/zinc/26/28/92/342262892.db2.gz	QMXDIABSLMXMQG-KGLIPLIRSA-N	1	0	294.420	1.348	50	0		CDAARO
C[C@@H]1CN(C(=O)CN2CCc3ccccc3C2)CCO1	ZINC000032863642	539135456	/nfs/dbraw/zinc/13/54/56/539135456.db2.gz	NDCHFHMBNZBACI-CYBMUJFWSA-N	1	0	274.364	1.292	50	0		CDAARO
CC[C@@H]1C(=O)NCCN1Cc1c(C)cccc1OC	ZINC000585117046	362044718	/nfs/dbraw/zinc/04/47/18/362044718.db2.gz	PVZJSMSRPQVTSA-CYBMUJFWSA-N	1	0	262.353	1.714	50	0		CDAARO
C[C@@]1(C[N@@H+]2CC[C@@H](C(N)=O)C2)C[C@H]1c1ccccc1	ZINC000585117444	362046368	/nfs/dbraw/zinc/04/63/68/362046368.db2.gz	CRZGYVHUPSMUJK-YCPHGPKFSA-N	1	0	258.365	1.987	50	0		CDAARO
CO[C@@H](C[NH2+]CCc1ccncc1C)[C@H]1CCOC1	ZINC000585117411	362046837	/nfs/dbraw/zinc/04/68/37/362046837.db2.gz	BKKSGWQSUHKYSX-GJZGRUSLSA-N	1	0	264.369	1.574	50	0		CDAARO
CC[C@@H]1[C@@H](C(=O)NCc2cnn(C)c2C)CC[N@@H+]1C	ZINC000585131121	362055597	/nfs/dbraw/zinc/05/55/97/362055597.db2.gz	MGDYDCWCJOPOQF-QWHCGFSZSA-N	1	0	264.373	1.075	50	0		CDAARO
C[NH+](C)CC[C@@H]1CN(C(=O)CCc2ccsc2)CCO1	ZINC000012835511	362113789	/nfs/dbraw/zinc/11/37/89/362113789.db2.gz	NVYCHDDFDGSATC-CQSZACIVSA-N	1	0	296.436	1.860	50	0		CDAARO
COC(=O)[C@H](O)C(C)(C)[NH2+]Cc1ccc(Cl)c(F)c1	ZINC000252488101	342382183	/nfs/dbraw/zinc/38/21/83/342382183.db2.gz	IJMMTEUQROHKDL-NSHDSACASA-N	1	0	289.734	1.881	50	0		CDAARO
COc1cccc([C@@H](C)[N@@H+]2CCCN(C(N)=O)CC2)c1	ZINC000079756573	362182187	/nfs/dbraw/zinc/18/21/87/362182187.db2.gz	KZMZAJNWJXQFLZ-GFCCVEGCSA-N	1	0	277.368	1.843	50	0		CDAARO
CNC(=O)NC(=O)C[NH2+][C@H](C)c1ccc(F)c(Cl)c1	ZINC000096491154	529880205	/nfs/dbraw/zinc/88/02/05/529880205.db2.gz	AFJGRVLKPGPMPC-SSDOTTSWSA-N	1	0	287.722	1.585	50	0		CDAARO
Cc1cc(CNC(=O)C2(C)CC[NH+](C)CC2)n(C)n1	ZINC000097402519	185597995	/nfs/dbraw/zinc/59/79/95/185597995.db2.gz	NOTNHKCLRVQGGC-UHFFFAOYSA-N	1	0	264.373	1.077	50	0		CDAARO
CC(C)COC(=O)N1CCC([NH2+]Cc2ncnn2C)CC1	ZINC000089157881	346155038	/nfs/dbraw/zinc/15/50/38/346155038.db2.gz	IPBOZSZWOWTRCL-UHFFFAOYSA-N	1	0	295.387	1.162	50	0		CDAARO
CS(=O)(=O)[C@@H]1CCCC[C@@H]1[NH2+]C1CCOCC1	ZINC000096491579	362874268	/nfs/dbraw/zinc/87/42/68/362874268.db2.gz	DIHOLVIIIOJXNL-NWDGAFQWSA-N	1	0	261.387	1.111	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNC(=O)c1cnc(N)s1	ZINC000584886036	349344269	/nfs/dbraw/zinc/34/42/69/349344269.db2.gz	RIEFDGVDCBDULP-SECBINFHSA-N	1	0	268.386	1.160	50	0		CDAARO
Cc1cnc(NCC[C@H]2CCC[N@H+](C)C2)nc1N(C)C	ZINC000584888601	349347480	/nfs/dbraw/zinc/34/74/80/349347480.db2.gz	ZEXKPBAMOPTDGA-CYBMUJFWSA-N	1	0	277.416	1.417	50	0		CDAARO
O[C@H]1C[N@@H+](C2Cc3ccccc3C2)C[C@@H]1N1CCCC1	ZINC000584893208	349352872	/nfs/dbraw/zinc/35/28/72/349352872.db2.gz	NPDDIGLVMYNLEO-IRXDYDNUSA-N	1	0	272.392	1.295	50	0		CDAARO
CC(C)(C[NH+]1CCCCC1)NC(=O)c1cnc(N)s1	ZINC000584899176	349361541	/nfs/dbraw/zinc/36/15/41/349361541.db2.gz	JGBWXZWTPXRXCR-UHFFFAOYSA-N	1	0	282.413	1.550	50	0		CDAARO
C[C@@H](C[NH+]1CCCC1)C(=O)N(C)CCC1(O)CCCC1	ZINC000584899667	349361549	/nfs/dbraw/zinc/36/15/49/349361549.db2.gz	OMFPTPHOQRUVLH-AWEZNQCLSA-N	1	0	282.428	1.872	50	0		CDAARO
C[N@@H+]1CCC[C@H]1CCn1cnc2cccnc2c1=O	ZINC000584900150	349362306	/nfs/dbraw/zinc/36/23/06/349362306.db2.gz	USWKLKAWXBJFLV-NSHDSACASA-N	1	0	258.325	1.276	50	0		CDAARO
CC(C)[N@@H+]1C[C@H](NC(=O)CCO)[C@@H](c2ccccc2)C1	ZINC000091289286	180122134	/nfs/dbraw/zinc/12/21/34/180122134.db2.gz	ZDHVKAMYEWCYGI-CABCVRRESA-N	1	0	276.380	1.361	50	0		CDAARO
O=C1COC2(CC[NH2+]CC2)CN1Cc1ccccc1	ZINC000091297450	180125259	/nfs/dbraw/zinc/12/52/59/180125259.db2.gz	PJVBHRPXYZGPBQ-UHFFFAOYSA-N	1	0	260.337	1.168	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1F	ZINC000091496838	180172740	/nfs/dbraw/zinc/17/27/40/180172740.db2.gz	MQBPSBGQDSAOIF-KCJUWKMLSA-N	1	0	290.335	1.384	50	0		CDAARO
CCOc1ccccc1CN1C[C@H](CO)[C@H](C[NH+](C)C)C1	ZINC000091411046	180148690	/nfs/dbraw/zinc/14/86/90/180148690.db2.gz	FIYWZXGMCDPTAU-HZPDHXFCSA-N	1	0	292.423	1.687	50	0		CDAARO
Cc1nnc(C[N@H+]2CC[C@]3(C2)CCCN(C)C3=O)s1	ZINC000091416972	180149697	/nfs/dbraw/zinc/14/96/97/180149697.db2.gz	KXRQBMSDQISHQO-ZDUSSCGKSA-N	1	0	280.397	1.291	50	0		CDAARO
COCc1ccc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)o1	ZINC000091808447	180260474	/nfs/dbraw/zinc/26/04/74/180260474.db2.gz	AGPLLNMGIGONLX-NEPJUHHUSA-N	1	0	264.325	1.235	50	0		CDAARO
CCCn1cc(C(=O)N2C[C@H]([NH3+])[C@@H](C(C)C)C2)c(C)n1	ZINC000091877146	180278707	/nfs/dbraw/zinc/27/87/07/180278707.db2.gz	DKLMSABBPIZDFX-OCCSQVGLSA-N	1	0	278.400	1.657	50	0		CDAARO
CN(C[C@H]1Cc2ccccc2C[N@@H+]1C)c1ccncn1	ZINC000091876924	180279141	/nfs/dbraw/zinc/27/91/41/180279141.db2.gz	YBYZTHMPAVXXHO-OAHLLOKOSA-N	1	0	268.364	1.970	50	0		CDAARO
CC[N@H+](CCNC(=O)N1CC[C@@H]([C@H](C)O)C1)C(C)C	ZINC000108468674	186219132	/nfs/dbraw/zinc/21/91/32/186219132.db2.gz	ZRGZCBUHMRVFJE-QWHCGFSZSA-N	1	0	271.405	1.129	50	0		CDAARO
Cc1ccc(CC(=O)N[C@@H](C)[C@H]2CCCC[NH2+]2)cn1	ZINC000583651842	366017928	/nfs/dbraw/zinc/01/79/28/366017928.db2.gz	UGDHREFFTITJIN-GXTWGEPZSA-N	1	0	261.369	1.579	50	0		CDAARO
CCc1ccccc1S(=O)(=O)NCC1([NH+](C)C)CC1	ZINC000583651968	366018384	/nfs/dbraw/zinc/01/83/84/366018384.db2.gz	WMGRMTNSVNOMOQ-UHFFFAOYSA-N	1	0	282.409	1.622	50	0		CDAARO
COc1cccc(C(=O)NC[C@H](C)C[NH+](C)C)c1	ZINC000292417502	198280935	/nfs/dbraw/zinc/28/09/35/198280935.db2.gz	PQCJQUDBQDGYEB-NSHDSACASA-N	1	0	250.342	1.623	50	0		CDAARO
CC1CC[NH+](CCCNc2ncnc3c2cnn3C)CC1	ZINC000014268835	366144830	/nfs/dbraw/zinc/14/48/30/366144830.db2.gz	LKYZEFLAHORILN-UHFFFAOYSA-N	1	0	288.399	1.897	50	0		CDAARO
CS(=O)(=O)Cc1cc[n+](Cc2ccc(F)cc2)cc1	ZINC000000398866	355908597	/nfs/dbraw/zinc/90/85/97/355908597.db2.gz	OMOAXAGJEOQVBL-UHFFFAOYSA-N	1	0	280.344	1.706	50	0		CDAARO
COc1cccc(OC)c1C(=O)c1cc[n+](C)cc1	ZINC000000142983	355890573	/nfs/dbraw/zinc/89/05/73/355890573.db2.gz	QVWZOCWUIPZDTA-UHFFFAOYSA-N	1	0	258.297	1.759	50	0		CDAARO
Cc1cc(C)c2cc(C[NH2+]CCCO)c(=O)[nH]c2c1	ZINC000002597398	355977370	/nfs/dbraw/zinc/97/73/70/355977370.db2.gz	AEWRUAXBRKKOMS-UHFFFAOYSA-N	1	0	260.337	1.617	50	0		CDAARO
Nc1cc(N)[nH+]c(SCCOc2ccccc2)n1	ZINC000002993616	355989558	/nfs/dbraw/zinc/98/95/58/355989558.db2.gz	HGEZYFPZCBLTMZ-UHFFFAOYSA-N	1	0	262.338	1.812	50	0		CDAARO
COCCC[NH2+]CCOCCOc1ccccc1F	ZINC000002981137	355989609	/nfs/dbraw/zinc/98/96/09/355989609.db2.gz	UNJFSZLGQXWANS-UHFFFAOYSA-N	1	0	271.332	1.847	50	0		CDAARO
O=C(NCCC[NH2+]Cc1ccccc1)c1cccnc1	ZINC000001888785	355954835	/nfs/dbraw/zinc/95/48/35/355954835.db2.gz	ZSPOJVVBIKEBIU-UHFFFAOYSA-N	1	0	269.348	1.991	50	0		CDAARO
CS(=O)(=O)N[C@H](c1ccccc1)[C@H]([NH3+])c1ccccc1	ZINC000002511779	355972093	/nfs/dbraw/zinc/97/20/93/355972093.db2.gz	FSRRNSLQEDUDTP-HUUCEWRRSA-N	1	0	290.388	1.977	50	0		CDAARO
[NH3+][C@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccco1	ZINC000003894433	356012756	/nfs/dbraw/zinc/01/27/56/356012756.db2.gz	FQLXKOCHDBPFLL-CQSZACIVSA-N	1	0	283.331	1.947	50	0	biogenic	CDAARO
CN(C(=O)c1cccc(Nc2cnccn2)c1)[C@H]1CC[NH2+]C1	ZINC000299738462	356262494	/nfs/dbraw/zinc/26/24/94/356262494.db2.gz	BBDVLNQPJPLFJE-AWEZNQCLSA-N	1	0	297.362	1.654	50	0		CDAARO
COc1ccc(CC(=O)N2CC[C@@H](C[NH3+])C2)c(Cl)c1	ZINC000299739977	356275614	/nfs/dbraw/zinc/27/56/14/356275614.db2.gz	UJDWQKMABMGFJI-JTQLQIEISA-N	1	0	282.771	1.698	50	0		CDAARO
COc1cc(C[NH2+]CCC(C)C)ccc1OCC(N)=O	ZINC000012382217	356296488	/nfs/dbraw/zinc/29/64/88/356296488.db2.gz	CGVQUJJSMNZCBU-UHFFFAOYSA-N	1	0	280.368	1.695	50	0		CDAARO
CCOC(=O)[C@@]1(CCOC)CCC[N@@H+](C2CCOCC2)C1	ZINC000012587694	356310025	/nfs/dbraw/zinc/31/00/25/356310025.db2.gz	UYAJZLWXXNNSCU-MRXNPFEDSA-N	1	0	299.411	1.847	50	0		CDAARO
C[NH2+]CC[C@H]1CCC(=O)N1Cc1cc(OC)ccc1OC	ZINC000014883134	356399568	/nfs/dbraw/zinc/39/95/68/356399568.db2.gz	HFOMXCVFKOCNKR-CYBMUJFWSA-N	1	0	292.379	1.804	50	0		CDAARO
O=c1cc2c(nn1Cc1cccc(Cl)c1)CC[NH2+]C2	ZINC000015106810	356406937	/nfs/dbraw/zinc/40/69/37/356406937.db2.gz	ITXKTAZIHZDFAQ-UHFFFAOYSA-N	1	0	275.739	1.591	50	0		CDAARO
NS(=O)(=O)c1ccc(CC[NH2+]Cc2cccs2)cc1	ZINC000019871789	356512565	/nfs/dbraw/zinc/51/25/65/356512565.db2.gz	CKENRSWSAPAZNX-UHFFFAOYSA-N	1	0	296.417	1.728	50	0		CDAARO
O=C(CN1CC[NH2+]CC1)Nc1cc(Cl)cc(Cl)c1	ZINC000019797594	356505684	/nfs/dbraw/zinc/50/56/84/356505684.db2.gz	YAIHPCDXAIWAIR-UHFFFAOYSA-N	1	0	288.178	1.837	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc(Cl)cc2)C[C@@H]1CCO	ZINC000019842317	356509797	/nfs/dbraw/zinc/50/97/97/356509797.db2.gz	OLZBNJCHCJDTMH-AWEZNQCLSA-N	1	0	268.788	1.838	50	0		CDAARO
CC(C)NC(=O)NC(=O)C[N@H+](C)[C@@H](C)C(C)(C)C	ZINC000027133691	356704144	/nfs/dbraw/zinc/70/41/44/356704144.db2.gz	AVZCVFWHUXCWBR-JTQLQIEISA-N	1	0	257.378	1.587	50	0		CDAARO
CCCC(=O)NCC1([NH+]2CCOCC2)CCCCC1	ZINC000027579843	356710753	/nfs/dbraw/zinc/71/07/53/356710753.db2.gz	IARLFSSGABTZPC-UHFFFAOYSA-N	1	0	268.401	1.938	50	0		CDAARO
NNc1cc(N2CCN(c3ccccc3)CC2)nc[nH+]1	ZINC000032951447	356792134	/nfs/dbraw/zinc/79/21/34/356792134.db2.gz	PWAYOGTYDMKHKF-UHFFFAOYSA-N	1	0	270.340	1.089	50	0		CDAARO
CCN1CCC([N@H+](CCO)Cc2ccccc2)CC1	ZINC000000227139	356813928	/nfs/dbraw/zinc/81/39/28/356813928.db2.gz	YQUVMZLPCPKABT-UHFFFAOYSA-N	1	0	262.397	1.965	50	0		CDAARO
Cc1cc(N2CCN(c3ccccc3)C(=O)[C@H]2C)nc(N)[nH+]1	ZINC000032519412	356781553	/nfs/dbraw/zinc/78/15/53/356781553.db2.gz	JHVYPKQLDJRPNG-GFCCVEGCSA-N	1	0	297.362	1.609	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)CCn2cnc3ccccc32)CC1	ZINC000032768150	356786646	/nfs/dbraw/zinc/78/66/46/356786646.db2.gz	IIGHUPXBIHZVMR-UHFFFAOYSA-N	1	0	286.379	1.591	50	0		CDAARO
C[NH2+][C@H](C)c1ccc(N2CCCS2(=O)=O)cc1	ZINC000036880987	356888946	/nfs/dbraw/zinc/88/89/46/356888946.db2.gz	BZFLJRBUFXSNDN-SNVBAGLBSA-N	1	0	254.355	1.507	50	0		CDAARO
C[C@@H]1CCC[N@H+](CCNc2ncnc3c2cnn3C)C1	ZINC000048560085	356906831	/nfs/dbraw/zinc/90/68/31/356906831.db2.gz	YMMCHFRWRQYHSW-LLVKDONJSA-N	1	0	274.372	1.507	50	0		CDAARO
Cc1ccc(C)c([C@@H]2CN(C(=O)[C@H](C)[NH3+])[C@H](C)CO2)c1	ZINC000119065434	357252038	/nfs/dbraw/zinc/25/20/38/357252038.db2.gz	FUKXZIYTYDHLJE-IPYPFGDCSA-N	1	0	276.380	1.939	50	0		CDAARO
Cc1ncc(-c2nnnn2-c2ccccc2)c(C[NH+](C)C)n1	ZINC000055157332	357329726	/nfs/dbraw/zinc/32/97/26/357329726.db2.gz	CYPOIVGXVHDQEA-UHFFFAOYSA-N	1	0	295.350	1.489	50	0		CDAARO
COc1ccc(CCNC(=O)C[C@H]2CC[NH2+]C2)cc1OC	ZINC000089717466	357507620	/nfs/dbraw/zinc/50/76/20/357507620.db2.gz	IGDHREUULWOCHS-CYBMUJFWSA-N	1	0	292.379	1.362	50	0		CDAARO
Cn1cccc1C[N@H+]1C[C@@H](c2ccncc2)[C@H](CO)C1	ZINC000253412983	357445700	/nfs/dbraw/zinc/44/57/00/357445700.db2.gz	SQQDMKYWQQYZMN-HOCLYGCPSA-N	1	0	271.364	1.628	50	0		CDAARO
CCC/C=C/C[N@@H+]1CCc2nc(C)n(C)c(=O)c2CC1	ZINC000065493114	357544846	/nfs/dbraw/zinc/54/48/46/357544846.db2.gz	ROJPEGBWUPBHIW-VOTSOKGWSA-N	1	0	275.396	1.846	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H]([NH+](C)C)CN1Cc1cc(C(C)C)no1	ZINC000065499294	357545451	/nfs/dbraw/zinc/54/54/51/357545451.db2.gz	RHNNGCUMIWKUIZ-RISCZKNCSA-N	1	0	295.383	1.476	50	0		CDAARO
C/C=C/C[N@H+]1CC=C([C@@H](CC)NC(=O)COC)CC1	ZINC000067724301	357621728	/nfs/dbraw/zinc/62/17/28/357621728.db2.gz	DZQZXSOYODXIKT-YVARQFDVSA-N	1	0	266.385	1.736	50	0		CDAARO
O=C(CO)NCC[C@@H]1CCC[N@H+](Cc2cccc(O)c2)C1	ZINC000067803833	357628322	/nfs/dbraw/zinc/62/83/22/357628322.db2.gz	AEPFIHJGCUHVDO-ZDUSSCGKSA-N	1	0	292.379	1.103	50	0		CDAARO
C[C@H](CC1CCCCC1)[NH2+]CCS(=O)(=O)N(C)C	ZINC000067472944	357610783	/nfs/dbraw/zinc/61/07/83/357610783.db2.gz	RTDIYZLEEWNLAP-GFCCVEGCSA-N	1	0	276.446	1.826	50	0		CDAARO
CCc1ccccc1NC(=O)C(=O)NC[C@H]1CC[N@H+](C)C1	ZINC000067559546	357612621	/nfs/dbraw/zinc/61/26/21/357612621.db2.gz	XELLVUDMMYZLEC-GFCCVEGCSA-N	1	0	289.379	1.255	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CCc2nnc(N)s2)n1	ZINC000067819122	357630189	/nfs/dbraw/zinc/63/01/89/357630189.db2.gz	LVAOGPHVDIOSKA-SECBINFHSA-N	1	0	280.401	1.154	50	0		CDAARO
Cc1nc(N(C)C)cc(NCCNC(=O)CC(C)C)[nH+]1	ZINC000067613521	357613876	/nfs/dbraw/zinc/61/38/76/357613876.db2.gz	FLHBLGVZDPICSI-UHFFFAOYSA-N	1	0	279.388	1.425	50	0		CDAARO
CC(C)OCCN1CC[NH+](CCOC(C)C)CC1	ZINC000067630398	357615404	/nfs/dbraw/zinc/61/54/04/357615404.db2.gz	VOKQPNQYUUUDFI-UHFFFAOYSA-N	1	0	258.406	1.454	50	0		CDAARO
CSC(C)(C)C[C@@H](C)[NH2+]CCS(=O)(=O)N(C)C	ZINC000067642895	357616222	/nfs/dbraw/zinc/61/62/22/357616222.db2.gz	SNMYCPAFCLWRJH-SNVBAGLBSA-N	1	0	282.475	1.388	50	0		CDAARO
CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)c2ccc(N)nc2)C1	ZINC000067935386	357638147	/nfs/dbraw/zinc/63/81/47/357638147.db2.gz	QSCWRBNHEDBUOU-ZDUSSCGKSA-N	1	0	290.411	1.762	50	0		CDAARO
Cc1cccc(-n2cc(C(=O)N3CC[NH2+][C@H](C)C3)nn2)c1	ZINC000188473308	357694024	/nfs/dbraw/zinc/69/40/24/357694024.db2.gz	RFLBROJXWGRZGV-GFCCVEGCSA-N	1	0	285.351	1.010	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)CC[NH2+]1	ZINC000188471338	357694409	/nfs/dbraw/zinc/69/44/09/357694409.db2.gz	WQAFDAMNCVCIHL-ADEWGFFLSA-N	1	0	280.318	1.889	50	0		CDAARO
C[NH+](C)CC[C@@H]1CN(C(=O)c2ccc(Cl)cn2)CCO1	ZINC000071775792	357780891	/nfs/dbraw/zinc/78/08/91/357780891.db2.gz	UMVAPDGDXYQEQL-GFCCVEGCSA-N	1	0	297.786	1.528	50	0		CDAARO
C[C@H]([NH2+][C@@H]1CCCN(CC(F)(F)F)C1=O)[C@H]1CCCO1	ZINC000097108876	357984440	/nfs/dbraw/zinc/98/44/40/357984440.db2.gz	ULSNMHGOMUEZJE-HBNTYKKESA-N	1	0	294.317	1.697	50	0		CDAARO
C[C@@H]([NH2+]CCNC(=O)c1ccn[nH]1)c1ccc(F)cc1	ZINC000097236299	358048799	/nfs/dbraw/zinc/04/87/99/358048799.db2.gz	QDGTYSYOJAKHOF-SNVBAGLBSA-N	1	0	276.315	1.629	50	0		CDAARO
C[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)c1cccc(F)c1F	ZINC000195554980	358557483	/nfs/dbraw/zinc/55/74/83/358557483.db2.gz	PKJNRXYXNUDCSW-KCJUWKMLSA-N	1	0	254.280	1.894	50	0		CDAARO
C[NH+]1CCC(OCCCNc2nnc(C3CC3)o2)CC1	ZINC000095359008	358684305	/nfs/dbraw/zinc/68/43/05/358684305.db2.gz	OHTQINMSUPLRHV-UHFFFAOYSA-N	1	0	280.372	1.860	50	0		CDAARO
O=c1cc(C[NH2+]C[C@H]2COCCO2)[nH]c2ccc(F)cc12	ZINC000095358044	358684765	/nfs/dbraw/zinc/68/47/65/358684765.db2.gz	AVWOISGBGUHERG-LBPRGKRZSA-N	1	0	292.310	1.172	50	0		CDAARO
c1cc(CN2CCOCC2)cc(-c2nc3c([nH]2)C[NH2+]CC3)c1	ZINC000095373161	358688456	/nfs/dbraw/zinc/68/84/56/358688456.db2.gz	OXGPBIPGVZKCON-UHFFFAOYSA-N	1	0	298.390	1.555	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CC(=O)NCCc1ccc(O)cc1	ZINC000215593820	358895333	/nfs/dbraw/zinc/89/53/33/358895333.db2.gz	PLRMAQQWPOZBRY-AWEZNQCLSA-N	1	0	276.380	1.925	50	0		CDAARO
Cn1ccnc1C1CCN(C(=O)[C@H]2CC[C@@H]([NH3+])C2)CC1	ZINC000216087262	358923553	/nfs/dbraw/zinc/92/35/53/358923553.db2.gz	UZDSVXKYSHQJMK-QWHCGFSZSA-N	1	0	276.384	1.254	50	0		CDAARO
CN(C(=O)[C@@H](C[NH3+])c1ccc(F)cc1)[C@H]1CCOC1	ZINC000262048657	358999331	/nfs/dbraw/zinc/99/93/31/358999331.db2.gz	HBMDBNFNGXXBKE-STQMWFEESA-N	1	0	266.316	1.115	50	0		CDAARO
CN1Cc2cccn2C[C@H]1CNC(=O)NC1CCCCC1	ZINC000257176290	359070054	/nfs/dbraw/zinc/07/00/54/359070054.db2.gz	CEEIVDVEEAKOLH-OAHLLOKOSA-N	1	0	290.411	1.934	50	0		CDAARO
CCO[C@H]1C[N@H+](CCCOc2ccc(F)cc2)C[C@@H]1O	ZINC000219427936	359096344	/nfs/dbraw/zinc/09/63/44/359096344.db2.gz	LIJCWPIYFBYDQT-GJZGRUSLSA-N	1	0	283.343	1.676	50	0		CDAARO
Cc1nnc(CN(C)C(=O)C[N@H+](C)C2CCCC2)o1	ZINC000221183541	359215722	/nfs/dbraw/zinc/21/57/22/359215722.db2.gz	UCEBULYVEXJLEG-UHFFFAOYSA-N	1	0	266.345	1.211	50	0		CDAARO
c1nc2ncnc(N3CCN(Cc4ccccn4)CC3)c2[nH]1	ZINC000032587184	359219440	/nfs/dbraw/zinc/21/94/40/359219440.db2.gz	XXJLDCDNTWXKHZ-UHFFFAOYSA-N	1	0	295.350	1.070	50	0		CDAARO
Cc1ccccc1C[N@H+]1CC[C@@]2(C1)C(=O)N(C)C(=O)N2C	ZINC000257197423	359630204	/nfs/dbraw/zinc/63/02/04/359630204.db2.gz	GPSFYFBVSNIJAZ-MRXNPFEDSA-N	1	0	287.363	1.463	50	0		CDAARO
O[C@@]1(C[N@@H+]2CCc3cccc(F)c3C2)CCCOC1	ZINC000585094386	482828906	/nfs/dbraw/zinc/82/89/06/482828906.db2.gz	VKWIGXBWNFZAHH-OAHLLOKOSA-N	1	0	265.328	1.725	50	0		CDAARO
C[C@@H]1CCC[C@H](OCC(=O)N2CC[C@H]([NH3+])C[C@H]2C)C1	ZINC000408519193	359911953	/nfs/dbraw/zinc/91/19/53/359911953.db2.gz	QAECIQOSFMQBCA-MQYQWHSLSA-N	1	0	268.401	1.920	50	0		CDAARO
CC1=CCC[C@H](C)[C@H]1C[N@H+](C)C[C@H](O)CN1CCOCC1	ZINC000191076299	360074099	/nfs/dbraw/zinc/07/40/99/360074099.db2.gz	SLFDQKPTHQTVGG-ULQDDVLXSA-N	1	0	296.455	1.604	50	0		CDAARO
Cc1cccn2c(CN3CCC[C@@H]3C(=O)NC3CC3)cnc12	ZINC000121484883	360243264	/nfs/dbraw/zinc/24/32/64/360243264.db2.gz	BKNVDWUTCKSPMJ-OAHLLOKOSA-N	1	0	298.390	1.886	50	0		CDAARO
CC[C@H](NC(=O)N(CCO)CC[NH+](C)C)c1ccccc1	ZINC000426488297	360573936	/nfs/dbraw/zinc/57/39/36/360573936.db2.gz	RBZTZBDFWSAANV-HNNXBMFYSA-N	1	0	293.411	1.703	50	0		CDAARO
C[C@H]1C[NH2+]CCN1Cc1cc(=O)oc2cc(O)ccc12	ZINC000054373243	360679881	/nfs/dbraw/zinc/67/98/81/360679881.db2.gz	NRYFWNOUZYJWOW-JTQLQIEISA-N	1	0	274.320	1.292	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2noc(C(C)C)n2)n1C	ZINC000426674262	360694015	/nfs/dbraw/zinc/69/40/15/360694015.db2.gz	MXVUKKDOFXQFAR-UHFFFAOYSA-N	1	0	282.373	1.333	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@@H](CNC(=O)CCc2cnccn2)C1	ZINC000426370520	360660056	/nfs/dbraw/zinc/66/00/56/360660056.db2.gz	MQVYTJBRPUDTLG-ZDUSSCGKSA-N	1	0	290.411	1.646	50	0		CDAARO
COc1cc(CSc2nnc(C[NH3+])n2C)cc(OC)c1	ZINC000426380728	360661113	/nfs/dbraw/zinc/66/11/13/360661113.db2.gz	UGQRLNGWKQSXFQ-UHFFFAOYSA-N	1	0	294.380	1.583	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1C(=O)NCCCOc1cccnc1	ZINC000426382779	360661630	/nfs/dbraw/zinc/66/16/30/360661630.db2.gz	OFKACDFFOQCJEP-HNNXBMFYSA-N	1	0	291.395	1.841	50	0		CDAARO
COc1ncc(C(=O)N2CC([N@@H+]3CCCC[C@@H]3C)C2)cn1	ZINC000426488177	360674947	/nfs/dbraw/zinc/67/49/47/360674947.db2.gz	IHCLXUJPDPGABR-NSHDSACASA-N	1	0	290.367	1.184	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)c1ccncc1Cl	ZINC000122608082	283599706	/nfs/dbraw/zinc/59/97/06/283599706.db2.gz	CYQGMOSGLOZRIW-SECBINFHSA-N	1	0	253.733	1.559	50	0		CDAARO
CN(C)c1ccc(C[NH+]2CCC(c3nnc[nH]3)CC2)cn1	ZINC000130719248	360991731	/nfs/dbraw/zinc/99/17/31/360991731.db2.gz	JLTYSEYFEMSYKO-UHFFFAOYSA-N	1	0	286.383	1.645	50	0		CDAARO
CC[C@H](O)C[N@H+](C)C[C@@H]1CC(c2ccccc2)=NO1	ZINC000036146526	361138600	/nfs/dbraw/zinc/13/86/00/361138600.db2.gz	PGUBUSZXBGFZBV-KBPBESRZSA-N	1	0	262.353	1.882	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)CCc3cscn3)C[C@H]12	ZINC000248564814	361214745	/nfs/dbraw/zinc/21/47/45/361214745.db2.gz	BLVIOZXPUQQPNT-ADEWGFFLSA-N	1	0	265.382	1.271	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H]1CC(C)(C)OC1(C)C	ZINC000183840581	189369025	/nfs/dbraw/zinc/36/90/25/189369025.db2.gz	YTIMDUYUMKPAPT-SNVBAGLBSA-N	1	0	256.390	1.694	50	0		CDAARO
CNC(=O)c1cccnc1NCC[NH+]1CCCCC1	ZINC000301382349	364243511	/nfs/dbraw/zinc/24/35/11/364243511.db2.gz	UZPLYGUGBSTCTO-UHFFFAOYSA-N	1	0	262.357	1.339	50	0		CDAARO
OCC[NH2+]CCOc1ccc(Cl)c(Cl)c1	ZINC000003003763	364675133	/nfs/dbraw/zinc/67/51/33/364675133.db2.gz	KHWUJADXGWCNNV-UHFFFAOYSA-N	1	0	250.125	1.954	50	0		CDAARO
O=c1onc(-c2ncccn2)n1CCC[NH+]1CCCCC1	ZINC000187684538	364803330	/nfs/dbraw/zinc/80/33/30/364803330.db2.gz	BCXFHYRBDSRYER-UHFFFAOYSA-N	1	0	289.339	1.169	50	0		CDAARO
CCCNC(=O)[C@@H](C)[NH2+]Cc1ccc(-n2cccn2)cc1	ZINC000035046182	364813529	/nfs/dbraw/zinc/81/35/29/364813529.db2.gz	RNEYWVPADGISHX-CYBMUJFWSA-N	1	0	286.379	1.877	50	0		CDAARO
Cc1ccc(C(=O)N2CC[C@@H](N3CC[NH+](C)CC3)C2)s1	ZINC000215534664	189695447	/nfs/dbraw/zinc/69/54/47/189695447.db2.gz	POLHKLAJFBICMI-CYBMUJFWSA-N	1	0	293.436	1.518	50	0		CDAARO
Cn1cc(CCC[NH2+]C2(C(N)=O)CCCCC2)cn1	ZINC000088544944	365437893	/nfs/dbraw/zinc/43/78/93/365437893.db2.gz	XABALPSPPISWBO-UHFFFAOYSA-N	1	0	264.373	1.131	50	0		CDAARO
NC(=O)c1ccc(C[N@@H+]2CCC[C@H](c3ccncn3)C2)cc1	ZINC000089787659	366933477	/nfs/dbraw/zinc/93/34/77/366933477.db2.gz	MMKMKQZLEIBMPN-HNNXBMFYSA-N	1	0	296.374	1.955	50	0		CDAARO
O=C(C[N@H+](C[C@@H]1CCCO1)C1CCCC1)NCC1CC1	ZINC000089818116	366938805	/nfs/dbraw/zinc/93/88/05/366938805.db2.gz	ZZKJPGUAIOFMGT-HNNXBMFYSA-N	1	0	280.412	1.936	50	0		CDAARO
CCC(CC)[C@@H](O)CNC(=O)C[N@@H+]1CCC[C@H]1C	ZINC000252510588	367662736	/nfs/dbraw/zinc/66/27/36/367662736.db2.gz	ALHFOLYQTHYDHP-YPMHNXCESA-N	1	0	256.390	1.384	50	0		CDAARO
CCCC(=O)NC[C@@H]1CCC[N@@H+]([C@H]2CCCC[C@@H]2O)C1	ZINC000252513054	367716168	/nfs/dbraw/zinc/71/61/68/367716168.db2.gz	XBULBUGNXGBABS-KKUMJFAQSA-N	1	0	282.428	1.918	50	0		CDAARO
CC(C)COCC[N@@H+]1CCCC[C@H]1[C@H]1CNC(=O)C1	ZINC000252537788	367812122	/nfs/dbraw/zinc/81/21/22/367812122.db2.gz	MJDLPRBDNUHYGN-KGLIPLIRSA-N	1	0	268.401	1.650	50	0		CDAARO
CCC[C@H]1C[C@H]1C(=O)NCC1CC[NH+](CCO)CC1	ZINC000360382826	368262819	/nfs/dbraw/zinc/26/28/19/368262819.db2.gz	VBYYBZXINDGWIY-UONOGXRCSA-N	1	0	268.401	1.243	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N[C@@H]2CCC[C@H]2C[NH3+])c1	ZINC000089091971	368833750	/nfs/dbraw/zinc/83/37/50/368833750.db2.gz	JSCNBGUWLKZFAG-CMPLNLGQSA-N	1	0	286.372	1.540	50	0		CDAARO
Cc1c[nH+]c(C)n1CCNC(=O)COc1ccc(F)cc1	ZINC000575555387	369132547	/nfs/dbraw/zinc/13/25/47/369132547.db2.gz	LYFLWXCHADUXSL-UHFFFAOYSA-N	1	0	291.326	1.834	50	0		CDAARO
NC(=O)c1ccc(-c2ccc3c(c2)C[C@@H](C[NH3+])O3)cc1	ZINC000299778791	372755409	/nfs/dbraw/zinc/75/54/09/372755409.db2.gz	HHTKFPZQNUZYAU-AWEZNQCLSA-N	1	0	268.316	1.715	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@@H]([NH3+])CN1Cc1ccccc1Cl	ZINC000299787193	372762233	/nfs/dbraw/zinc/76/22/33/372762233.db2.gz	ZRFYSZDYQGKMOB-YPMHNXCESA-N	1	0	281.787	1.378	50	0		CDAARO
Nc1nc(C(=O)NCC2CC[NH+](CC3CC3)CC2)cs1	ZINC000299789787	372764556	/nfs/dbraw/zinc/76/45/56/372764556.db2.gz	ALSHHRJFDZTMIB-UHFFFAOYSA-N	1	0	294.424	1.577	50	0		CDAARO
[NH3+]C[C@@H]1CCC2(CC[NH+](Cc3cccnc3)CC2)O1	ZINC000299799997	372771223	/nfs/dbraw/zinc/77/12/23/372771223.db2.gz	YMNXKPZHXHPYLF-AWEZNQCLSA-N	1	0	261.369	1.554	50	0		CDAARO
C[C@H]1CC[NH2+]C[C@@H]1NS(=O)(=O)CCc1cccs1	ZINC000241277707	189904183	/nfs/dbraw/zinc/90/41/83/189904183.db2.gz	LILLJUFVGRCLPS-JQWIXIFHSA-N	1	0	288.438	1.208	50	0		CDAARO
O=C(Cc1ccc(F)c(F)c1)NC[C@H]1CCC[NH2+]C1	ZINC000095045344	373692183	/nfs/dbraw/zinc/69/21/83/373692183.db2.gz	UVSVCABXDGLJRP-NSHDSACASA-N	1	0	268.307	1.623	50	0		CDAARO
C[N@H+]1C[C@H]2CN(C(=O)c3ccoc3C3CC3)C[C@H]2C1	ZINC000253431995	373744453	/nfs/dbraw/zinc/74/44/53/373744453.db2.gz	VYAFQHUHVINFJO-TXEJJXNPSA-N	1	0	260.337	1.791	50	0		CDAARO
CNC(=O)c1ccc(C[N@H+](C)CC2(C(=O)OC)CC2)cc1	ZINC000253433486	373748204	/nfs/dbraw/zinc/74/82/04/373748204.db2.gz	XNKWXWCLYOEQFR-UHFFFAOYSA-N	1	0	290.363	1.431	50	0		CDAARO
C1CCC(c2nnc(N3CC[NH2+]CC3)s2)CC1	ZINC000031978346	373940735	/nfs/dbraw/zinc/94/07/35/373940735.db2.gz	KDSRCSDQAZPMNT-UHFFFAOYSA-N	1	0	252.387	1.995	50	0		CDAARO
CCn1cnnc1C[NH2+][C@H]1CCc2ccccc2C1	ZINC000095420374	374922121	/nfs/dbraw/zinc/92/21/21/374922121.db2.gz	FIGKBZODYVTUSH-AWEZNQCLSA-N	1	0	256.353	1.945	50	0		CDAARO
COCc1nc2n(n1)CCC[C@H]2N[C@@H]1CC[N@@H+](C2CC2)C1	ZINC000095423839	374923836	/nfs/dbraw/zinc/92/38/36/374923836.db2.gz	IQFPQVSJNAGNIU-DGCLKSJQSA-N	1	0	291.399	1.086	50	0		CDAARO
Cn1cc(N2CCC[C@@H]([NH2+]C3CCSCC3)C2)cn1	ZINC000095403002	374908306	/nfs/dbraw/zinc/90/83/06/374908306.db2.gz	WOAIJKBSXWJICE-CYBMUJFWSA-N	1	0	280.441	1.874	50	0		CDAARO
[NH3+]CCCSc1nnnn1-c1ccc(Cl)cc1	ZINC000002626363	375275947	/nfs/dbraw/zinc/27/59/47/375275947.db2.gz	MMAZMSKOMNPDQG-UHFFFAOYSA-N	1	0	269.761	1.757	50	0		CDAARO
Cn1cc(-c2cc(CN3CC[N@@H+]4CCC[C@H]4C3)on2)cn1	ZINC000248988801	375525827	/nfs/dbraw/zinc/52/58/27/375525827.db2.gz	KPSHTDKFWUDMJW-ZDUSSCGKSA-N	1	0	287.367	1.355	50	0		CDAARO
Cc1nn(C)c(C)c1C[NH2+][C@H]([C@H](CO)C1CC1)C1CC1	ZINC000449498942	375891130	/nfs/dbraw/zinc/89/11/30/375891130.db2.gz	BVDMEIBAEOZKKX-CVEARBPZSA-N	1	0	277.412	1.924	50	0		CDAARO
C[NH+](C)CCCNC(=O)COc1ccc2c(c1)CCC2	ZINC000032502486	375959240	/nfs/dbraw/zinc/95/92/40/375959240.db2.gz	KIOQMHKAZYNQGD-UHFFFAOYSA-N	1	0	276.380	1.622	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N[C@@H]1CC[NH2+]C[C@H]1C	ZINC000262811705	190063404	/nfs/dbraw/zinc/06/34/04/190063404.db2.gz	YFUYOUUCPCWPGO-DGCLKSJQSA-N	1	0	282.409	1.525	50	0		CDAARO
CN1C(=O)[C@@H]2[C@H](C1=O)[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H]21	ZINC000248050607	377194458	/nfs/dbraw/zinc/19/44/58/377194458.db2.gz	QZZNCEYZNMCPSB-XUXIUFHCSA-N	1	0	288.322	1.576	50	0		CDAARO
C[NH+]1CCN(c2nc(-c3ccccc3)cc(=O)[nH]2)CC1	ZINC000008844073	377396974	/nfs/dbraw/zinc/39/69/74/377396974.db2.gz	WWQJFONSHVJSCJ-UHFFFAOYSA-N	1	0	270.336	1.189	50	0		CDAARO
CC(=O)c1ccc(OC[C@H](O)C[NH2+]C(C)C)cc1	ZINC000000195595	169570837	/nfs/dbraw/zinc/57/08/37/169570837.db2.gz	LXTVJPGACWPWOL-CYBMUJFWSA-N	1	0	251.326	1.627	50	0		CDAARO
CO[C@H]1CN(C(=O)c2ccn(C(C)(C)C)c2)CC[C@H]1[NH3+]	ZINC000071767949	184575226	/nfs/dbraw/zinc/57/52/26/184575226.db2.gz	HSQPGDXXTQOICU-OLZOCXBDSA-N	1	0	279.384	1.431	50	0		CDAARO
CCNC(=O)NC(=O)C[N@H+](Cc1ccc(C)cc1)C1CC1	ZINC000027593734	390252669	/nfs/dbraw/zinc/25/26/69/390252669.db2.gz	JNEXLLNVNIVREY-UHFFFAOYSA-N	1	0	289.379	1.805	50	0		CDAARO
CC[C@H]1CCCCN1C(=O)c1[nH]nc2c1C[NH2+]CC2	ZINC000042783808	390430159	/nfs/dbraw/zinc/43/01/59/390430159.db2.gz	UFHLKCVEWSZITR-JTQLQIEISA-N	1	0	262.357	1.460	50	0		CDAARO
CCS(=O)(=O)CC[NH2+][C@@](C)(CO)C1CCCCC1	ZINC000096420070	390513935	/nfs/dbraw/zinc/51/39/35/390513935.db2.gz	PEVPZLZDDOOVEW-ZDUSSCGKSA-N	1	0	277.430	1.342	50	0		CDAARO
CCC(CC)(CO)[NH2+]Cc1cccc(C(=O)NC)c1	ZINC000096424686	390516484	/nfs/dbraw/zinc/51/64/84/390516484.db2.gz	ACARNVCJKWPDAM-UHFFFAOYSA-N	1	0	264.369	1.687	50	0		CDAARO
CC(C)=CCC[N@H+]1CCN(C)[C@]2(C1)CCC(=O)N(C)CC2	ZINC000230095042	391158723	/nfs/dbraw/zinc/15/87/23/391158723.db2.gz	ATPKKUMHDHLRDZ-QGZVFWFLSA-N	1	0	293.455	1.971	50	0		CDAARO
CC[C@@H]1CCCCN1C(=O)[C@H](C)[N@@H+]1C[C@@H](C)[C@H](C(N)=O)C1	ZINC000408048181	391162413	/nfs/dbraw/zinc/16/24/13/391162413.db2.gz	LQVIFGSXPVRSBB-XJFOESAGSA-N	1	0	295.427	1.219	50	0		CDAARO
Cc1ccc(OC[C@H](O)C[NH2+][C@H]2CCO[C@H]2C)c(C)c1	ZINC000032523769	391461439	/nfs/dbraw/zinc/46/14/39/391461439.db2.gz	YEGOIUNTNBMTEZ-ZNMIVQPWSA-N	1	0	279.380	1.810	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@H]([N@@H+]2CC[C@H](CCO)C2)C1	ZINC000259868104	391510927	/nfs/dbraw/zinc/51/09/27/391510927.db2.gz	MYACVXPGFGZZNB-OLZOCXBDSA-N	1	0	284.400	1.700	50	0		CDAARO
CCOC(=O)[C@]12C[NH2+]C[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000040443105	391963831	/nfs/dbraw/zinc/96/38/31/391963831.db2.gz	LWIRXZLYPPQKOS-HZMBPMFUSA-N	1	0	284.356	1.006	50	0		CDAARO
CC(C)[NH2+]CCN1CCC[C@H](CNC(=O)C(C)(C)C)C1	ZINC000193443476	393341431	/nfs/dbraw/zinc/34/14/31/393341431.db2.gz	STKSFKJAMMUNRG-CQSZACIVSA-N	1	0	283.460	1.859	50	0		CDAARO
C[C@@H](NC(=O)[C@H]([NH3+])CC1CCCCC1)c1cnn(C)c1	ZINC000261827537	140396038	/nfs/dbraw/zinc/39/60/38/140396038.db2.gz	UKYIQNQIHNZSGT-BXUZGUMPSA-N	1	0	278.400	1.895	50	0		CDAARO
Cc1cc(C)cc(OCC(=O)NC[C@@H](C)C[NH+](C)C)c1	ZINC000004598835	169988297	/nfs/dbraw/zinc/98/82/97/169988297.db2.gz	NGGZDFBSOMJAHY-CQSZACIVSA-N	1	0	278.396	1.996	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@@H]2CO)cc1OC	ZINC000005527327	170108480	/nfs/dbraw/zinc/10/84/80/170108480.db2.gz	HXXMHGSSGPFTCS-GFCCVEGCSA-N	1	0	251.326	1.661	50	0		CDAARO
CC(C)Oc1ccc(C(=O)NCC[NH+](C)C)cc1	ZINC000006743683	170238468	/nfs/dbraw/zinc/23/84/68/170238468.db2.gz	LNXCFBRPLULUPC-UHFFFAOYSA-N	1	0	250.342	1.765	50	0		CDAARO
c1cnn(CCC[NH+]2CCC(Cn3cccn3)CC2)c1	ZINC000020784866	171272518	/nfs/dbraw/zinc/27/25/18/171272518.db2.gz	TYPZRGAKCWDUKV-UHFFFAOYSA-N	1	0	273.384	1.882	50	0		CDAARO
CC(C)[N@@H+]1CCN(Cc2ccncc2)C[C@@H]1CCO	ZINC000020910768	171279073	/nfs/dbraw/zinc/27/90/73/171279073.db2.gz	FJJIPBRCIWZZCZ-HNNXBMFYSA-N	1	0	263.385	1.359	50	0		CDAARO
Cn1nccc1CN1CC[N@H+](C)C[C@@H]1c1ccccc1	ZINC000020917550	171280015	/nfs/dbraw/zinc/28/00/15/171280015.db2.gz	SRJQUPRHDVRJHG-MRXNPFEDSA-N	1	0	270.380	1.909	50	0		CDAARO
NC(=O)COc1ccc(C[NH2+]Cc2ccco2)cc1	ZINC000022144701	171356256	/nfs/dbraw/zinc/35/62/56/171356256.db2.gz	CSENVNRJURAWQS-UHFFFAOYSA-N	1	0	260.293	1.434	50	0		CDAARO
CC(C)(C)C[N@@H+]1CCN(Cc2cccnc2)C[C@@H]1CCO	ZINC000022914354	171403175	/nfs/dbraw/zinc/40/31/75/171403175.db2.gz	FPHIEWMFPYDVJV-INIZCTEOSA-N	1	0	291.439	1.996	50	0		CDAARO
OCc1cc(N2CC[C@](O)(c3ccccc3)C2)cc[nH+]1	ZINC000032511783	171731085	/nfs/dbraw/zinc/73/10/85/171731085.db2.gz	GEYCIEPYVHSVGF-MRXNPFEDSA-N	1	0	270.332	1.672	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2ccc(=O)[nH]c2)CCCCCC1	ZINC000032719931	171745460	/nfs/dbraw/zinc/74/54/60/171745460.db2.gz	ZQWSDQBQZZMOHD-UHFFFAOYSA-N	1	0	291.395	1.759	50	0		CDAARO
CNC(=O)c1ccc(C[NH2+]Cc2c[nH]nc2C)cc1	ZINC000035273923	172094245	/nfs/dbraw/zinc/09/42/45/172094245.db2.gz	JKYIIAAROSAXGK-UHFFFAOYSA-N	1	0	258.325	1.368	50	0		CDAARO
CC[C@@H](CO)[NH2+]Cc1nn(CC)nc1-c1ccccc1	ZINC000035287321	172105353	/nfs/dbraw/zinc/10/53/53/172105353.db2.gz	UYMWWWYSACJNIM-ZDUSSCGKSA-N	1	0	274.368	1.826	50	0		CDAARO
Cc1cccc(S(=O)(=O)NC[C@@H]([NH3+])c2ccccc2)c1	ZINC000036297556	172590787	/nfs/dbraw/zinc/59/07/87/172590787.db2.gz	NIBUSPRFIPBQKU-OAHLLOKOSA-N	1	0	290.388	1.973	50	0		CDAARO
c1[nH]nc(-c2cccnc2)c1C[NH2+]C[C@H]1CCCOC1	ZINC000038045063	174053189	/nfs/dbraw/zinc/05/31/89/174053189.db2.gz	SUNMOVCPRCPIEM-GFCCVEGCSA-N	1	0	272.352	1.988	50	0		CDAARO
C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1cc(=O)n(C)c(=O)n1C	ZINC000040497572	174295442	/nfs/dbraw/zinc/29/54/42/174295442.db2.gz	SQEYXRNWVGQQNC-AAEUAGOBSA-N	1	0	279.384	1.095	50	0		CDAARO
Cc1nc(CC[NH3+])cc(NC[C@@H](O)Cc2ccccc2)n1	ZINC000067725170	175787200	/nfs/dbraw/zinc/78/72/00/175787200.db2.gz	ISJFIPVYEHCVNO-HNNXBMFYSA-N	1	0	286.379	1.302	50	0		CDAARO
CN(Cc1cc(C2CC2)on1)Cc1cc2n(n1)CC[NH2+]C2	ZINC000072173658	176333860	/nfs/dbraw/zinc/33/38/60/176333860.db2.gz	DSSLWUOQLOPQJM-UHFFFAOYSA-N	1	0	287.367	1.484	50	0		CDAARO
Cc1nc(CN2CCC([N@@H+]3CCC[C@H](O)C3)CC2)co1	ZINC000072475200	176407251	/nfs/dbraw/zinc/40/72/51/176407251.db2.gz	AJHBBYWHTMUWAV-HNNXBMFYSA-N	1	0	279.384	1.404	50	0		CDAARO
[NH3+]C[C@H]1O[C@H](Cc2cc(-c3ccccc3)on2)CC[C@@H]1O	ZINC000077262800	177246763	/nfs/dbraw/zinc/24/67/63/177246763.db2.gz	HXZCECCEJVDGJR-OFQRWUPVSA-N	1	0	288.347	1.751	50	0	biogenic,in-vitro	CDAARO
Cn1nc2c(c1C(=O)N1C[C@@H]3CC[N@H+](C)[C@@H]3C1)CCCC2	ZINC000077356917	177257154	/nfs/dbraw/zinc/25/71/54/177257154.db2.gz	GBXQTWYDVCFTSH-SMDDNHRTSA-N	1	0	288.395	1.075	50	0		CDAARO
O=C(c1ccccc1)C1CCN(C[C@@]2(O)CC[NH2+]C2)CC1	ZINC000077406565	177264043	/nfs/dbraw/zinc/26/40/43/177264043.db2.gz	COKAOFDPPCIBPK-QGZVFWFLSA-N	1	0	288.391	1.306	50	0		CDAARO
CN1CC[NH+](CCC(=O)N[C@H]2CC[C@@H]3CCC[C@@H]32)CC1	ZINC000077564735	177281341	/nfs/dbraw/zinc/28/13/41/177281341.db2.gz	IVMZQPIHRCLVCB-KKUMJFAQSA-N	1	0	279.428	1.319	50	0		CDAARO
CC(C)C[C@@](C)(C[NH3+])NS(=O)(=O)c1ccccc1	ZINC000095431221	275910368	/nfs/dbraw/zinc/91/03/68/275910368.db2.gz	UBZGWJWNQSFDAZ-ZDUSSCGKSA-N	1	0	270.398	1.728	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1n[nH]c2c1CCCC2	ZINC000095478540	276186882	/nfs/dbraw/zinc/18/68/82/276186882.db2.gz	LYZHYOWXVLZHPW-NSHDSACASA-N	1	0	276.384	1.503	50	0		CDAARO
C[NH+](C)CCCC(C)(C)NC(=O)[C@H]1CCCCC(=O)N1	ZINC000408520403	276759027	/nfs/dbraw/zinc/75/90/27/276759027.db2.gz	CFZKQZOXFLVYQA-GFCCVEGCSA-N	1	0	283.416	1.282	50	0		CDAARO
CC(C)(C)OC(=O)N1C[C@@H]2CCCCN2C[C@@H]1C[NH3+]	ZINC000238853200	277195147	/nfs/dbraw/zinc/19/51/47/277195147.db2.gz	IPIMDODCXFTYQT-RYUDHWBXSA-N	1	0	269.389	1.419	50	0		CDAARO
CC(C)(C)OC(=O)NC1CCN([C@H]2CC[NH2+]C2)CC1	ZINC000022014992	277197281	/nfs/dbraw/zinc/19/72/81/277197281.db2.gz	RYEDWVUQVIEGNA-LBPRGKRZSA-N	1	0	269.389	1.337	50	0		CDAARO
CN1C[C@]2(CCC[N@H+](Cc3cnc[nH]3)CC2)OC1=O	ZINC000072168093	277207629	/nfs/dbraw/zinc/20/76/29/277207629.db2.gz	YDSBGQHPLBSSRB-CYBMUJFWSA-N	1	0	264.329	1.216	50	0		CDAARO
COc1ccc(-c2cc3c(c(OC)c2)OCC[NH2+]C3)nn1	ZINC000067723239	277859661	/nfs/dbraw/zinc/85/96/61/277859661.db2.gz	TZGAIOZQFJQEHO-UHFFFAOYSA-N	1	0	287.319	1.643	50	0		CDAARO
CCC1(CC)[C@H]([NH2+][C@H]2CCC(=O)N(C)C2)C[C@H]1OC	ZINC000241368047	278636772	/nfs/dbraw/zinc/63/67/72/278636772.db2.gz	MJPZETJOKATEON-YNEHKIRRSA-N	1	0	268.401	1.791	50	0		CDAARO
Cc1cccc(C[NH2+]C2CCN(S(C)(=O)=O)CC2)c1	ZINC000030656262	279138273	/nfs/dbraw/zinc/13/82/73/279138273.db2.gz	PIOZCCFVZDVZFJ-UHFFFAOYSA-N	1	0	282.409	1.509	50	0		CDAARO
Cc1cc(C(=O)NC[C@H]2CC[N@@H+](C)C2)nn1-c1ccccc1	ZINC000109847818	279312819	/nfs/dbraw/zinc/31/28/19/279312819.db2.gz	ATJOXEFLDXQUAF-CQSZACIVSA-N	1	0	298.390	1.862	50	0		CDAARO
C[C@@H]1CN(CC[N@@H+]2CCCC[C@H]2c2ccnn2C)CCO1	ZINC000253398431	297001327	/nfs/dbraw/zinc/00/13/27/297001327.db2.gz	POSADKDFIMECRH-ZBFHGGJFSA-N	1	0	292.427	1.668	50	0		CDAARO
CC(C)[C@H](CNC(=O)CCc1ccno1)[NH+](C)C	ZINC000534591346	328318071	/nfs/dbraw/zinc/31/80/71/328318071.db2.gz	HOSOWOGAUXDNPW-LBPRGKRZSA-N	1	0	253.346	1.310	50	0		CDAARO
CC[N@H+](C)C1(CNC(=O)[C@H](O)CC(C)C)CCCC1	ZINC000534646430	328329526	/nfs/dbraw/zinc/32/95/26/328329526.db2.gz	LWYBPLXUMLDKOC-CYBMUJFWSA-N	1	0	270.417	1.774	50	0		CDAARO
Fc1ccc(N2CC[C@H]([NH2+]CCn3ccnn3)C2)cc1	ZINC000534648364	328343345	/nfs/dbraw/zinc/34/33/45/328343345.db2.gz	IZXCIDLCTAFFJE-ZDUSSCGKSA-N	1	0	275.331	1.286	50	0		CDAARO
Cc1nc(CCCNC(=O)[C@@H]2C=CC[NH2+]2)sc1C	ZINC000534654293	328338744	/nfs/dbraw/zinc/33/87/44/328338744.db2.gz	DPYLUJMUPKRZRR-NSHDSACASA-N	1	0	265.382	1.337	50	0		CDAARO
Cn1nc(CNC(=O)[C@H]2C=CC[NH2+]2)c2c1cccc2Cl	ZINC000534657498	328340911	/nfs/dbraw/zinc/34/09/11/328340911.db2.gz	NPKOAYQQSBKHJP-SNVBAGLBSA-N	1	0	290.754	1.371	50	0		CDAARO
O=C(NCCc1ccc(O)cc1)[C@@H]1CCC[NH2+]CC1	ZINC000534670064	328346893	/nfs/dbraw/zinc/34/68/93/328346893.db2.gz	YPSANDAUVVNXLS-CYBMUJFWSA-N	1	0	262.353	1.441	50	0		CDAARO
O=C(C[NH+]1CCCCCCC1)NCC[C@H]1CCOC1	ZINC000534671776	328348185	/nfs/dbraw/zinc/34/81/85/328348185.db2.gz	LIZYQILIEMOCKR-AWEZNQCLSA-N	1	0	268.401	1.795	50	0		CDAARO
CCn1nccc1C[NH+]1CCC(OC[C@H]2CCOC2)CC1	ZINC000097373047	323207944	/nfs/dbraw/zinc/20/79/44/323207944.db2.gz	DXIRBDRSSZJISH-AWEZNQCLSA-N	1	0	293.411	1.921	50	0		CDAARO
CCn1nccc1C[NH+]1CCC(OC[C@@H]2CCOC2)CC1	ZINC000097373044	323208002	/nfs/dbraw/zinc/20/80/02/323208002.db2.gz	DXIRBDRSSZJISH-CQSZACIVSA-N	1	0	293.411	1.921	50	0		CDAARO
CC(C)[C@@H]1C[N@H+](C)CCN1Cc1ccc(C(=O)N(C)C)[nH]1	ZINC000097376924	323208231	/nfs/dbraw/zinc/20/82/31/323208231.db2.gz	HTARYEVTPMOGGP-HNNXBMFYSA-N	1	0	292.427	1.489	50	0		CDAARO
Cc1cccc(OCCC(=O)N(C)[C@@H]2CC[NH2+]C2)c1C	ZINC000179121196	329205471	/nfs/dbraw/zinc/20/54/71/329205471.db2.gz	JNHCYIFNKVHZBH-CQSZACIVSA-N	1	0	276.380	1.893	50	0		CDAARO
Cc1ncc(Cl)c(NC[C@H]2C[N@@H+](C)CCN2C)n1	ZINC001772710360	1159444300	/nfs/dbraw/zinc/44/43/00/1159444300.db2.gz	QENMHLVGFMNHQV-JTQLQIEISA-N	1	0	269.780	1.096	50	0		CDAARO
c1cn2nc(N3CCC[C@@H]([NH+]4CCCC4)C3)ccc2n1	ZINC000091453496	482567289	/nfs/dbraw/zinc/56/72/89/482567289.db2.gz	ANYYLNHRQGOTFB-CYBMUJFWSA-N	1	0	271.368	1.794	50	0		CDAARO
COc1cc(F)cc(CNC(=O)NCC(C)(C)[NH+](C)C)c1	ZINC000091844078	482585932	/nfs/dbraw/zinc/58/59/32/482585932.db2.gz	PIGUAKLXEZVFIR-UHFFFAOYSA-N	1	0	297.374	1.974	50	0		CDAARO
COc1cccc(C[NH2+][C@@]2(CO)CCOC2)c1F	ZINC000192709072	482834628	/nfs/dbraw/zinc/83/46/28/482834628.db2.gz	JPYAPLYDPIORPN-CYBMUJFWSA-N	1	0	255.289	1.075	50	0		CDAARO
CCC[C@H](CNC(=O)Cc1ccc(CO)cc1)[NH+](C)C	ZINC000670448644	483004485	/nfs/dbraw/zinc/00/44/85/483004485.db2.gz	AISXDYBFZWYDBC-OAHLLOKOSA-N	1	0	278.396	1.568	50	0		CDAARO
COc1nc(N(C)C[C@@H]2CCC[N@@H+]2C)ncc1F	ZINC000670461003	483046169	/nfs/dbraw/zinc/04/61/69/483046169.db2.gz	UMTGAPPCJPYSQE-VIFPVBQESA-N	1	0	254.309	1.155	50	0		CDAARO
O=C(NC1CC[NH+](C2CCOCC2)CC1)C1CC=CC1	ZINC000670468147	483059586	/nfs/dbraw/zinc/05/95/86/483059586.db2.gz	KDBNNXATPXHJQQ-UHFFFAOYSA-N	1	0	278.396	1.712	50	0		CDAARO
CC[C@](C)(CC(=O)OC)[NH2+]Cc1cnc(C)cn1	ZINC000084721137	483317610	/nfs/dbraw/zinc/31/76/10/483317610.db2.gz	IRMCAXKXICJHST-CYBMUJFWSA-N	1	0	251.330	1.606	50	0		CDAARO
C[C@@H](CO)NC(=O)N[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C	ZINC000096503125	534132495	/nfs/dbraw/zinc/13/24/95/534132495.db2.gz	PMYTZFJRKYSLSV-YDHLFZDLSA-N	1	0	291.395	1.187	50	0		CDAARO
CCc1noc(CC)c1CC(=O)N1CCC[NH2+]CC1	ZINC000178357658	522881206	/nfs/dbraw/zinc/88/12/06/522881206.db2.gz	BNNWOQCQASYBFE-UHFFFAOYSA-N	1	0	265.357	1.164	50	0		CDAARO
CCCNC(=O)NC(=O)C[N@H+](C)C1CCCCC1	ZINC000007786425	528410848	/nfs/dbraw/zinc/41/08/48/528410848.db2.gz	DWZOSCTZQQHFMM-UHFFFAOYSA-N	1	0	255.362	1.487	50	0		CDAARO
C[C@H](c1ccsc1)N1CC[NH+](CCCO)CC1	ZINC000097142294	567905184	/nfs/dbraw/zinc/90/51/84/567905184.db2.gz	NRDSRPGKUXRJKN-GFCCVEGCSA-N	1	0	254.399	1.809	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](CN(C)Cc2cncnc2)C1	ZINC000952972981	614112305	/nfs/dbraw/zinc/11/23/05/614112305.db2.gz	QWBBMUNAEJBJOW-CQSZACIVSA-N	1	0	262.401	1.886	50	0		CDAARO
CCn1ccc(CNC[C@H]2CCC[N@H+](CCOC)C2)n1	ZINC000952968723	616031838	/nfs/dbraw/zinc/03/18/38/616031838.db2.gz	FOIYWFBMNLMQGP-CQSZACIVSA-N	1	0	280.416	1.351	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](CNCc2nc(C)c(C)n2C)C1	ZINC000952968970	616341281	/nfs/dbraw/zinc/34/12/81/616341281.db2.gz	QEZHXLDQSAXUGA-HNNXBMFYSA-N	1	0	294.443	1.485	50	0		CDAARO
CC(=O)N1CC([NH2+][C@H](C)c2ccc(C(F)F)nc2)C1	ZINC000888101185	617764284	/nfs/dbraw/zinc/76/42/84/617764284.db2.gz	NWRZSVSIDFKPSO-MRVPVSSYSA-N	1	0	269.295	1.901	50	0		CDAARO
NC(=O)c1nc(-c2cccc(C[NH+]3CCCCC3)c2)no1	ZINC000874435569	632388891	/nfs/dbraw/zinc/38/88/91/632388891.db2.gz	XZHFDDSXHHGDKU-UHFFFAOYSA-N	1	0	286.335	1.821	50	0		CDAARO
OC[C@]12C[NH2+]C[C@@H]1CN(CCCOc1ccc(F)cc1)C2	ZINC001772710807	1159445151	/nfs/dbraw/zinc/44/51/51/1159445151.db2.gz	WRMMOBREASERSA-CZUORRHYSA-N	1	0	294.370	1.108	50	0		CDAARO
Cc1ccc(O)cc1C(=O)N1C[C@H](C)[N@@H+](C)C[C@@H]1C	ZINC000585135288	1164216276	/nfs/dbraw/zinc/21/62/76/1164216276.db2.gz	AGBYZSGOMGHARG-RYUDHWBXSA-N	1	0	262.353	1.865	50	0		CDAARO
O=c1cc([C@@H]2CCC[NH2+]C2)nc(Cc2cccs2)[nH]1	ZINC000023338235	728853150	/nfs/dbraw/zinc/85/31/50/728853150.db2.gz	AIQDTWAKQZHYPK-SNVBAGLBSA-N	1	0	275.377	1.889	50	0		CDAARO
CC1(C)C(=O)NCCN1Cc1cc2ccccc2[nH]c1=O	ZINC000111218968	728913489	/nfs/dbraw/zinc/91/34/89/728913489.db2.gz	MYDJVBVBTJESON-UHFFFAOYSA-N	1	0	285.347	1.239	50	0		CDAARO
COCCn1cncc1CN1CCC[C@H]([NH+](C)C)C1	ZINC000252488634	728435217	/nfs/dbraw/zinc/43/52/17/728435217.db2.gz	IVXXQQDYKRWNFW-ZDUSSCGKSA-N	1	0	266.389	1.056	50	0		CDAARO
Cc1nc(C2CC[NH+]([C@@H]3CCSC3)CC2)cc(=O)[nH]1	ZINC000023543092	728531798	/nfs/dbraw/zinc/53/17/98/728531798.db2.gz	WEJSECZUIVCAEM-GFCCVEGCSA-N	1	0	279.409	1.763	50	0		CDAARO
NC(=O)c1cc2c(nc1-c1cccc3c1CC[NH2+]C3)CCC2	ZINC000071721425	728976397	/nfs/dbraw/zinc/97/63/97/728976397.db2.gz	GUTAEZJXIDGLFE-UHFFFAOYSA-N	1	0	293.370	1.982	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](n2cnc3ncccc3c2=O)C1	ZINC000032587024	729205749	/nfs/dbraw/zinc/20/57/49/729205749.db2.gz	BWLVXZGBRFQZRA-GFCCVEGCSA-N	1	0	272.352	1.838	50	0		CDAARO
C[N@@H+]1CCC[C@H](c2cc(=O)[nH]c(-c3ccccn3)n2)C1	ZINC000023213952	729233422	/nfs/dbraw/zinc/23/34/22/729233422.db2.gz	RPZCSHUQQYBUDC-NSHDSACASA-N	1	0	270.336	1.641	50	0		CDAARO
[NH3+]CCSCC(=O)NC1C2CC3CC(C2)CC1C3	ZINC000003683347	729323908	/nfs/dbraw/zinc/32/39/08/729323908.db2.gz	OAMLULZJPRNEHZ-UHFFFAOYSA-N	1	0	268.426	1.619	50	0		CDAARO
COc1cnc(N2CCC([C@H](C)[NH+](C)C)CC2)nc1	ZINC000077356337	729933987	/nfs/dbraw/zinc/93/39/87/729933987.db2.gz	SHDDPCCXVYAZTH-NSHDSACASA-N	1	0	264.373	1.652	50	0		CDAARO
CC(C)Oc1ccccc1OCCN1CC[NH2+]CC1	ZINC000019973761	729959622	/nfs/dbraw/zinc/95/96/22/729959622.db2.gz	FXLYLSRLSIJBKI-UHFFFAOYSA-N	1	0	264.369	1.758	50	0		CDAARO
CC(C)(CN1CCOCC1)CN1C[C@@H]2CC[C@H]1C[NH2+]C2	ZINC000426486445	729966151	/nfs/dbraw/zinc/96/61/51/729966151.db2.gz	SITKGDCRAWAJJV-CABCVRRESA-N	1	0	281.444	1.029	50	0		CDAARO
CO[C@H]1CN(c2cc(C(F)(F)F)cc(C)n2)CC[C@H]1[NH3+]	ZINC000071613750	730029872	/nfs/dbraw/zinc/02/98/72/730029872.db2.gz	NSQSWZCWTOIQTB-MNOVXSKESA-N	1	0	289.301	1.961	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)CC/C=C\c1ccccc1	ZINC000885978715	730041931	/nfs/dbraw/zinc/04/19/31/730041931.db2.gz	JHBRNYDEDNAXRU-KDQWWBNRSA-N	1	0	274.364	1.583	50	0		CDAARO
Cc1nonc1[C@H](C)[NH2+]CCCNC(=O)c1cccs1	ZINC000863984646	730399596	/nfs/dbraw/zinc/39/95/96/730399596.db2.gz	XPEYSMGFBGBJOV-VIFPVBQESA-N	1	0	294.380	1.910	50	0		CDAARO
c1cnc(N2CC[NH+](C3CSCCSC3)CC2)nc1	ZINC000952870043	910421078	/nfs/dbraw/zinc/42/10/78/910421078.db2.gz	QPHUPWIXUWVJCF-UHFFFAOYSA-N	1	0	296.465	1.447	50	0		CDAARO
C[C@H](O)C(C)(C)[NH2+]CC(=O)Nc1ccc(F)cc1F	ZINC000952878201	910434642	/nfs/dbraw/zinc/43/46/42/910434642.db2.gz	ZRLAMRQVOVAQLY-QMMMGPOBSA-N	1	0	272.295	1.652	50	0		CDAARO
CCCNc1nc(SCC)nc2c1cnn2CC[NH3+]	ZINC000669550899	911726585	/nfs/dbraw/zinc/72/65/85/911726585.db2.gz	OLANVEYFIMLFCV-UHFFFAOYSA-N	1	0	280.401	1.719	50	0		CDAARO
CC[C@H](C)NC(=O)NCCNc1cc[nH+]cc1C	ZINC000822635465	925643568	/nfs/dbraw/zinc/64/35/68/925643568.db2.gz	NMLIXYLNULKAKB-NSHDSACASA-N	1	0	250.346	1.322	50	0		CDAARO
C[NH2+]Cc1nnc(Sc2nc(C)cnc2C)n1C	ZINC000824052463	925798259	/nfs/dbraw/zinc/79/82/59/925798259.db2.gz	RUZBKRGZPNFAEC-UHFFFAOYSA-N	1	0	264.358	1.093	50	0		CDAARO
CN1CC[N@H+](CC2CCCCCC2)C[C@H]1CCO	ZINC000828747295	926174674	/nfs/dbraw/zinc/17/46/74/926174674.db2.gz	WAPTZUSWVNLKKP-OAHLLOKOSA-N	1	0	254.418	1.955	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1CCNC(=O)c1nccn1C	ZINC000581813008	927203101	/nfs/dbraw/zinc/20/31/01/927203101.db2.gz	HVYMOXBXSJLSIH-UHFFFAOYSA-N	1	0	273.340	1.232	50	0		CDAARO
Cc1nn(C)cc1-c1ccnc(NCC[NH+](C)C)n1	ZINC000048179443	937312112	/nfs/dbraw/zinc/31/21/12/937312112.db2.gz	OQLAOXMUXDGMEJ-UHFFFAOYSA-N	1	0	260.345	1.159	50	0		CDAARO
CN(C)c1nnc(SCC[NH+]2CCCC2)s1	ZINC000584906781	930650440	/nfs/dbraw/zinc/65/04/40/930650440.db2.gz	IKMRVHQQWAFFEE-UHFFFAOYSA-N	1	0	258.416	1.792	50	0		CDAARO
O=[S@@](CC[NH2+]Cc1cccc2c1OCO2)C(F)(F)F	ZINC000585116751	930969126	/nfs/dbraw/zinc/96/91/26/930969126.db2.gz	HHVKLJHUEUAEQT-IBGZPJMESA-N	1	0	295.282	1.773	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](CN(C)Cc2cnc(C)cn2)C1	ZINC001506400248	975148998	/nfs/dbraw/zinc/14/89/98/975148998.db2.gz	BEMINPXVVWCXQO-OAHLLOKOSA-N	1	0	292.427	1.575	50	0		CDAARO
Cc1sc2c(c1C)C(=O)N(CC[NH+](C)C)CC(=O)N2	ZINC000584904186	341994148	/nfs/dbraw/zinc/99/41/48/341994148.db2.gz	ZGLKIGZFVCNMEI-UHFFFAOYSA-N	1	0	281.381	1.321	50	0		CDAARO
CN(C)C(=O)OCC[NH+]1CCC(c2cnn(C)c2)CC1	ZINC000097373620	342002610	/nfs/dbraw/zinc/00/26/10/342002610.db2.gz	IXQWRXFXCKVIEX-UHFFFAOYSA-N	1	0	280.372	1.298	50	0		CDAARO
Cc1cc(C[NH+]2CCC3(CC2)OCCC[C@@H]3O)on1	ZINC000215796636	398205105	/nfs/dbraw/zinc/20/51/05/398205105.db2.gz	GRAZMFGCCOIQOZ-ZDUSSCGKSA-N	1	0	266.341	1.489	50	0		CDAARO
COC(=O)CCCC(=O)N1CCC[C@@H]([NH+]2CCCCC2)C1	ZINC000095943087	185037541	/nfs/dbraw/zinc/03/75/41/185037541.db2.gz	WYUNXFMVUDLKFE-CQSZACIVSA-N	1	0	296.411	1.807	50	0		CDAARO
CCC[N@@H+]1CC[C@@H](CNC(=O)NCc2c(C)noc2C)C1	ZINC000095955125	185042198	/nfs/dbraw/zinc/04/21/98/185042198.db2.gz	ICNKYLUZRSBEMG-ZDUSSCGKSA-N	1	0	294.399	1.823	50	0		CDAARO
CC(C)CSCC[N@@H+]1CCCN(S(C)(=O)=O)CC1	ZINC000095976119	185050880	/nfs/dbraw/zinc/05/08/80/185050880.db2.gz	BAFFXCJIBORPDC-UHFFFAOYSA-N	1	0	294.486	1.343	50	0		CDAARO
CC(C)=CC[NH2+][C@@H](C(=O)N1CCOCC1)C(C)C	ZINC000095985502	185054825	/nfs/dbraw/zinc/05/48/25/185054825.db2.gz	GYBKKTNVZWKKOO-CYBMUJFWSA-N	1	0	254.374	1.426	50	0		CDAARO
C[C@@H]([NH2+]CCCNS(C)(=O)=O)c1cccc(F)c1F	ZINC000095986049	185056271	/nfs/dbraw/zinc/05/62/71/185056271.db2.gz	CCJKEXVYKUAIGD-SECBINFHSA-N	1	0	292.351	1.555	50	0		CDAARO
CC(C)C(=O)NCCC[NH2+][C@H](C)CCn1cccn1	ZINC000095996917	185060954	/nfs/dbraw/zinc/06/09/54/185060954.db2.gz	JBRVIISOQSLLCY-CYBMUJFWSA-N	1	0	266.389	1.414	50	0		CDAARO
CCOc1ccccc1OCCOCCN1CC[NH2+]CC1	ZINC000019944975	365613420	/nfs/dbraw/zinc/61/34/20/365613420.db2.gz	NOHAZJXTVSPMNF-UHFFFAOYSA-N	1	0	294.395	1.386	50	0		CDAARO
CC[C@@H](C(=O)N[C@H]1C[NH2+]C[C@@H]1OC)c1ccc(OC)cc1	ZINC000195554049	342625749	/nfs/dbraw/zinc/62/57/49/342625749.db2.gz	SCBATRITYQFNPX-ILXRZTDVSA-N	1	0	292.379	1.292	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)C1CCC(C)(C)CC1	ZINC000195554057	342625811	/nfs/dbraw/zinc/62/58/11/342625811.db2.gz	PSOYFMXWNFSRPQ-RYUDHWBXSA-N	1	0	254.374	1.306	50	0		CDAARO
O=C(NCCCc1cc(F)cc(F)c1)[C@@H]1CCC[NH2+]1	ZINC000195554996	342626107	/nfs/dbraw/zinc/62/61/07/342626107.db2.gz	GZOSHXDJQBNCKA-ZDUSSCGKSA-N	1	0	268.307	1.766	50	0		CDAARO
C(Cc1nc([C@@H]2CCOC2)no1)C[NH+]1CCCCC1	ZINC000096147971	185106794	/nfs/dbraw/zinc/10/67/94/185106794.db2.gz	VNSAPAKCOOGNMT-GFCCVEGCSA-N	1	0	265.357	1.992	50	0		CDAARO
CCn1nccc1C[N@@H+]1C[C@@H]2CCC[C@@]2(C(=O)OC)C1	ZINC000195559165	342628568	/nfs/dbraw/zinc/62/85/68/342628568.db2.gz	FQDGPIADCAUKGN-SWLSCSKDSA-N	1	0	277.368	1.678	50	0		CDAARO
Cc1ccc(NC(=O)N2C[C@@H](O)[C@H]([NH+]3CCCC3)C2)s1	ZINC000095407149	539088002	/nfs/dbraw/zinc/08/80/02/539088002.db2.gz	VWXIDEQMGIQRPP-VXGBXAGGSA-N	1	0	295.408	1.729	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN1C(=O)C1CCCCC1	ZINC000085469756	282141481	/nfs/dbraw/zinc/14/14/81/282141481.db2.gz	ZTNICKVCRDNOTF-ZDUSSCGKSA-N	1	0	254.374	1.356	50	0		CDAARO
CC[C@H](C(=O)NCc1[nH]cc(C)c(=O)c1C)[N@H+](C)CC	ZINC000244734845	361859629	/nfs/dbraw/zinc/85/96/29/361859629.db2.gz	NMUVZRZAMLKRLG-CYBMUJFWSA-N	1	0	279.384	1.751	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@H]2CCC[C@@H]2CO)cc1	ZINC000097034943	185157327	/nfs/dbraw/zinc/15/73/27/185157327.db2.gz	PYKUSLZVULZWMW-KGLIPLIRSA-N	1	0	263.337	1.724	50	0		CDAARO
CN(C)c1ncc(C[NH+](CCO)CCO)c2ccccc21	ZINC000585136617	342215966	/nfs/dbraw/zinc/21/59/66/342215966.db2.gz	NCFUABXKLYILJU-UHFFFAOYSA-N	1	0	289.379	1.087	50	0		CDAARO
Cc1ncc2c(c1CNC(=O)c1ccco1)CC[NH2+]C2	ZINC000299773828	282168554	/nfs/dbraw/zinc/16/85/54/282168554.db2.gz	GAGAKDQZESBCEN-UHFFFAOYSA-N	1	0	271.320	1.559	50	0		CDAARO
C[C@H]1Cc2ccccc2N1C(=O)CSC1=[NH+]CCN1	ZINC000012752670	539100110	/nfs/dbraw/zinc/10/01/10/539100110.db2.gz	IPRLYFWYSJJJQS-JTQLQIEISA-N	1	0	275.377	1.657	50	0		CDAARO
COc1cccc(CN2C[C@H](C)[NH2+]C[C@H]2[C@H](C)O)c1	ZINC000072233533	342273299	/nfs/dbraw/zinc/27/32/99/342273299.db2.gz	SBXUEXTUQONRQQ-HUBLWGQQSA-N	1	0	264.369	1.238	50	0		CDAARO
CCn1ccnc1CN1CCC[C@H]([NH+](C)C)CC1	ZINC000097743656	529567875	/nfs/dbraw/zinc/56/78/75/529567875.db2.gz	XLOFURRFVXYWOS-ZDUSSCGKSA-N	1	0	250.390	1.819	50	0		CDAARO
CCOc1cc(C(=O)N2CC[NH2+]C[C@@H]2C)ccc1C	ZINC000126278758	187229526	/nfs/dbraw/zinc/22/95/26/187229526.db2.gz	FKZMBZBCJKJDGB-LBPRGKRZSA-N	1	0	262.353	1.828	50	0		CDAARO
CCCC[C@H](NC1CC[NH+]([C@H]2CCOC2)CC1)C(=O)OC	ZINC000585091309	362019499	/nfs/dbraw/zinc/01/94/99/362019499.db2.gz	CGCCLUWTGJLQQF-GJZGRUSLSA-N	1	0	298.427	1.561	50	0		CDAARO
C[C@H](C(=O)N(C)C1CCCCC1)[N@@H+]1CC[C@H](O)C1	ZINC000095435357	342431643	/nfs/dbraw/zinc/43/16/43/342431643.db2.gz	IXTMVQZSFCICEK-YPMHNXCESA-N	1	0	254.374	1.233	50	0		CDAARO
C[C@H]1CN(C)CC[N@@H+]1CCc1ccc2c(c1)CCO2	ZINC000095404866	342431715	/nfs/dbraw/zinc/43/17/15/342431715.db2.gz	AAGZJTPYPSUACJ-ZDUSSCGKSA-N	1	0	260.381	1.800	50	0		CDAARO
COC(=O)[C@H]1CN(C/C=C/c2ccccc2)C[C@@H](C)O1	ZINC000083996145	362256403	/nfs/dbraw/zinc/25/64/03/362256403.db2.gz	YGYVIJNTBTZXCT-LBMWNBJUSA-N	1	0	275.348	1.962	50	0		CDAARO
COc1ccnc(C[N@H+](C)[C@@H](C)Cc2cnccn2)c1	ZINC000252482006	362385567	/nfs/dbraw/zinc/38/55/67/362385567.db2.gz	CWQOOUPTQOKBLE-LBPRGKRZSA-N	1	0	272.352	1.943	50	0		CDAARO
CC[N@H+](CCn1cc[nH]c1=O)C[C@H]1CCCCO1	ZINC000252505779	362390569	/nfs/dbraw/zinc/39/05/69/362390569.db2.gz	VTRSUKGIKFJZCT-GFCCVEGCSA-N	1	0	253.346	1.067	50	0		CDAARO
CC[C@](C)([NH2+]Cc1ccc(-n2ccnc2)cc1C)C(N)=O	ZINC000192114245	362611137	/nfs/dbraw/zinc/61/11/37/362611137.db2.gz	GWFFIKBNYJORRC-INIZCTEOSA-N	1	0	286.379	1.924	50	0		CDAARO
CN1C[C@@H]([NH3+])C[C@H]1C(=O)NCc1ccc2c(c1)CCCC2	ZINC000097468671	185611687	/nfs/dbraw/zinc/61/16/87/185611687.db2.gz	IJYXWDMZLYQVQZ-HOTGVXAUSA-N	1	0	287.407	1.213	50	0		CDAARO
O[C@H](C[NH+]1CCN(Cc2cc(F)cc(F)c2)CC1)C1CC1	ZINC000085436876	179062627	/nfs/dbraw/zinc/06/26/27/179062627.db2.gz	FXJXOKFQRFQLJA-MRXNPFEDSA-N	1	0	296.361	1.853	50	0		CDAARO
Cc1cccc(C)c1C[N@H+](C)CC(=O)N1CCC(O)CC1	ZINC000085949119	179203473	/nfs/dbraw/zinc/20/34/73/179203473.db2.gz	KWQXSHCFNNXKKV-UHFFFAOYSA-N	1	0	290.407	1.719	50	0		CDAARO
Cn1cc([C@H]2OCC[C@@H]2C[NH2+]Cc2cccn2C)cn1	ZINC000089756756	347612397	/nfs/dbraw/zinc/61/23/97/347612397.db2.gz	INMQVYMPKMLXQP-DOMZBBRYSA-N	1	0	274.368	1.626	50	0		CDAARO
[NH3+]CC[C@H]1CCCCN1C(=O)c1ccncc1F	ZINC000086316839	179269945	/nfs/dbraw/zinc/26/99/45/179269945.db2.gz	CRULGVWFEUIRGC-SNVBAGLBSA-N	1	0	251.305	1.564	50	0		CDAARO
CCc1cc(N2CC[NH+]([C@H]3CCSC3)CC2)ncn1	ZINC000584884923	349343403	/nfs/dbraw/zinc/34/34/03/349343403.db2.gz	BBLGQKNPUKFFPN-ZDUSSCGKSA-N	1	0	278.425	1.667	50	0		CDAARO
CC[N@@H+]1CCCN(C(=O)[C@H]2CC(C(C)C)=NO2)CC1	ZINC000584897650	349359254	/nfs/dbraw/zinc/35/92/54/349359254.db2.gz	LKFZFFICOFQCGL-CYBMUJFWSA-N	1	0	267.373	1.342	50	0		CDAARO
COCc1cc(C(=O)N2CCCC[C@H]2CC[NH3+])no1	ZINC000090254332	179940462	/nfs/dbraw/zinc/94/04/62/179940462.db2.gz	WWURLJDIAQWTEG-JTQLQIEISA-N	1	0	267.329	1.165	50	0		CDAARO
C[C@@H]([NH2+]C[C@@H]1CN2CCN1CC2)c1ccc2c(c1)OCO2	ZINC000090649274	180017978	/nfs/dbraw/zinc/01/79/78/180017978.db2.gz	LIRPGXFIBQLNJG-TZMCWYRMSA-N	1	0	289.379	1.066	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@H]1CCCC[NH2+]1	ZINC000104448263	186005991	/nfs/dbraw/zinc/00/59/91/186005991.db2.gz	AKEJDCMWDNCELD-SNVBAGLBSA-N	1	0	253.371	1.552	50	0		CDAARO
CC(C)CC[N@@H+]1CCN(Cc2cnn(C)c2)C[C@H]1CCO	ZINC000104476800	186007771	/nfs/dbraw/zinc/00/77/71/186007771.db2.gz	QAWZNOZXRDDSAH-MRXNPFEDSA-N	1	0	294.443	1.335	50	0		CDAARO
O=C(c1ccccc1)N1C[C@H](CO)[C@H](C[NH+]2CCCC2)C1	ZINC000091663246	180220434	/nfs/dbraw/zinc/22/04/34/180220434.db2.gz	AWCKSQFXMHEMJP-HZPDHXFCSA-N	1	0	288.391	1.463	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2cc(=O)c3cc(F)ccc3[nH]2)C1	ZINC000091726135	180242777	/nfs/dbraw/zinc/24/27/77/180242777.db2.gz	WLDMWGNSALAHMJ-SNVBAGLBSA-N	1	0	261.300	1.200	50	0		CDAARO
CC[N@H+](CCO)Cc1cc(=O)c2cc(C)ccc2[nH]1	ZINC000092064972	180316678	/nfs/dbraw/zinc/31/66/78/180316678.db2.gz	OPUNXQNPQWOPSX-UHFFFAOYSA-N	1	0	260.337	1.651	50	0		CDAARO
OC[C@@H]1CCC[N@@H+]1C[C@@H]1CCCN1c1ncc(Cl)cn1	ZINC000107513746	186177793	/nfs/dbraw/zinc/17/77/93/186177793.db2.gz	CWOLRFWBQSVZCT-STQMWFEESA-N	1	0	296.802	1.556	50	0		CDAARO
CN(C[C@@H]1CCCCO1)C(=O)[C@H]1CCCCC[C@H]1[NH3+]	ZINC000108485427	186219957	/nfs/dbraw/zinc/21/99/57/186219957.db2.gz	BEENGRHAQNSIEJ-MELADBBJSA-N	1	0	268.401	1.922	50	0		CDAARO
COc1ccc(C[NH2+][C@H]2CCC[C@@H]2O)c(OC)c1	ZINC000109554303	186262856	/nfs/dbraw/zinc/26/28/56/186262856.db2.gz	FRYKMYDSYUUBRI-STQMWFEESA-N	1	0	251.326	1.707	50	0		CDAARO
CO[C@@H](C)C(=O)NCCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000110674585	186311754	/nfs/dbraw/zinc/31/17/54/186311754.db2.gz	CUBSDDODTHRBQN-XQQFMLRXSA-N	1	0	272.389	1.027	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@@H]1CCC[C@H]([NH3+])C1	ZINC000111668876	186439099	/nfs/dbraw/zinc/43/90/99/186439099.db2.gz	COFVBRSMGXOXRA-MNOVXSKESA-N	1	0	267.398	1.927	50	0		CDAARO
Cc1nn(C)c(C)c1C[NH2+]Cc1nc(C)ccc1O	ZINC000112716934	366126246	/nfs/dbraw/zinc/12/62/46/366126246.db2.gz	HRYDIQYUWWKMLB-UHFFFAOYSA-N	1	0	260.341	1.736	50	0		CDAARO
C[C@H]1CN(CCOc2ccc(CC[NH3+])cc2)C[C@H](C)O1	ZINC000037049819	363330895	/nfs/dbraw/zinc/33/08/95/363330895.db2.gz	QLIRRHFEZCKROH-KBPBESRZSA-N	1	0	278.396	1.676	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@H](O)C2)cc2c1OCO2	ZINC000000210517	355896679	/nfs/dbraw/zinc/89/66/79/355896679.db2.gz	ZLADRTNSAUIYGW-NSHDSACASA-N	1	0	265.309	1.381	50	0		CDAARO
COc1ccc(CC[NH2+]C2CCN(C)CC2)cc1OC	ZINC000002575371	355975992	/nfs/dbraw/zinc/97/59/92/355975992.db2.gz	CWENNUNXHJSJRK-UHFFFAOYSA-N	1	0	278.396	1.930	50	0		CDAARO
Cc1cc(C)c(C)c(OCC(=O)NCC[NH+](C)C)c1	ZINC000002825079	355983190	/nfs/dbraw/zinc/98/31/90/355983190.db2.gz	QPDZOBBSJNYIBW-UHFFFAOYSA-N	1	0	264.369	1.668	50	0		CDAARO
Cn1nnnc1SCC[NH2+]Cc1cccs1	ZINC000002181799	355963742	/nfs/dbraw/zinc/96/37/42/355963742.db2.gz	QKLPZFUPXMTOLH-UHFFFAOYSA-N	1	0	255.372	1.154	50	0		CDAARO
COc1ccccc1/C(C)=C\C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000255276318	356032392	/nfs/dbraw/zinc/03/23/92/356032392.db2.gz	MCPLYNCXVBIVTG-UKVQZPPCSA-N	1	0	274.364	1.919	50	0		CDAARO
C[NH+](C)CCCNS(=O)(=O)c1ccc(Cl)cc1	ZINC000004322809	356027032	/nfs/dbraw/zinc/02/70/32/356027032.db2.gz	YPTSRXOIXHOFTC-UHFFFAOYSA-N	1	0	276.789	1.570	50	0		CDAARO
NC(=O)c1ccc[n+](Cc2cccc(Br)c2)c1	ZINC000013135259	356339494	/nfs/dbraw/zinc/33/94/94/356339494.db2.gz	NSDNLXXVRLWGIN-UHFFFAOYSA-O	1	0	292.156	1.884	50	0		CDAARO
CCOc1ccc(S(=O)(=O)NC2CC[NH+](C)CC2)cc1	ZINC000014252174	356382184	/nfs/dbraw/zinc/38/21/84/356382184.db2.gz	SLPVEEYAKYPXPM-UHFFFAOYSA-N	1	0	298.408	1.458	50	0		CDAARO
CC[C@H](C)[NH+]1CCC2(CC1)C(=O)N(C(C)C)C(=O)N2C	ZINC000014751238	356397061	/nfs/dbraw/zinc/39/70/61/356397061.db2.gz	CLVWFUGBJSTTIN-LBPRGKRZSA-N	1	0	281.400	1.922	50	0		CDAARO
COc1ccccc1N1CCN([C@@H]2CCC[NH2+]C2)CC1	ZINC000037246742	356461013	/nfs/dbraw/zinc/46/10/13/356461013.db2.gz	BXHPSALNYNHLJP-CQSZACIVSA-N	1	0	275.396	1.569	50	0		CDAARO
CC[NH+]1CCC(NC(=O)c2cc(OC)cc(OC)c2)CC1	ZINC000016603209	356443042	/nfs/dbraw/zinc/44/30/42/356443042.db2.gz	RPRSANVZBPZOSX-UHFFFAOYSA-N	1	0	292.379	1.918	50	0		CDAARO
CCc1noc(C)c1C(=O)NC1CC[NH+](CC)CC1	ZINC000016603927	356443069	/nfs/dbraw/zinc/44/30/69/356443069.db2.gz	JPLKFIWFVOSKIW-UHFFFAOYSA-N	1	0	265.357	1.760	50	0		CDAARO
COc1cc(CN2CCC[N@H+](C)CC2)cc(OC)c1	ZINC000019607078	356493254	/nfs/dbraw/zinc/49/32/54/356493254.db2.gz	APBWWTMQMDPJNL-UHFFFAOYSA-N	1	0	264.369	1.841	50	0		CDAARO
CCC[NH+]1CCC([N@@H+]2CCC[C@@H](C(=O)[O-])C2)CC1	ZINC000019735612	356498429	/nfs/dbraw/zinc/49/84/29/356498429.db2.gz	DZRSRWZRQUUFNV-GFCCVEGCSA-N	1	0	254.374	1.657	50	0		CDAARO
CC[NH+]1CCN([C@@H](C)C(=O)Nc2ccc(OC)cc2)CC1	ZINC000022812960	356621042	/nfs/dbraw/zinc/62/10/42/356621042.db2.gz	SGDRJOJZILGOIN-ZDUSSCGKSA-N	1	0	291.395	1.660	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)c1ccc[nH]c1=O)c1ccsc1	ZINC000023133318	356629598	/nfs/dbraw/zinc/62/95/98/356629598.db2.gz	HKAYNAJLAUPLAN-LBPRGKRZSA-N	1	0	291.376	1.469	50	0		CDAARO
CNC(=O)N1c2ccc(C)cc2[C@@H]2C[N@@H+](C)CC[C@H]21	ZINC000005969562	356640511	/nfs/dbraw/zinc/64/05/11/356640511.db2.gz	ZLLYQMRMDBRZGG-GXTWGEPZSA-N	1	0	259.353	1.942	50	0		CDAARO
O=C(NC1CC1)[C@H]([NH2+]C[C@@H]1CCCO1)c1ccccc1	ZINC000024515305	356657009	/nfs/dbraw/zinc/65/70/09/356657009.db2.gz	CYUJPCVMCZCWRV-LSDHHAIUSA-N	1	0	274.364	1.775	50	0		CDAARO
CC(C)[NH+]1CCN(c2cc(Cl)nc(N)n2)CC1	ZINC000026712566	356698529	/nfs/dbraw/zinc/69/85/29/356698529.db2.gz	REWRTCVELPVHII-UHFFFAOYSA-N	1	0	255.753	1.243	50	0		CDAARO
CC(=O)N1CCC([NH2+]CCc2ccc(F)cc2)CC1	ZINC000000214057	356734593	/nfs/dbraw/zinc/73/45/93/356734593.db2.gz	QZTFWXJNAQEAIL-UHFFFAOYSA-N	1	0	264.344	1.969	50	0		CDAARO
CC[NH+](CC)CCN/C=C1/c2ccccc2NC1=O	ZINC000100694805	356806749	/nfs/dbraw/zinc/80/67/49/356806749.db2.gz	VPMCHFPBJIURSH-QBFSEMIESA-N	1	0	259.353	1.911	50	0		CDAARO
CCc1c(C(=O)N2CC[C@H](C[NH3+])C2)cnn1C(C)(C)C	ZINC000269176699	356819312	/nfs/dbraw/zinc/81/93/12/356819312.db2.gz	YOPWOKGOCYSRCH-LLVKDONJSA-N	1	0	278.400	1.621	50	0		CDAARO
Cc1cc(CC(=O)NCC2([NH+](C)C)CCCCC2)on1	ZINC000573329132	356830690	/nfs/dbraw/zinc/83/06/90/356830690.db2.gz	HOJJPNJRXBENHC-UHFFFAOYSA-N	1	0	279.384	1.906	50	0		CDAARO
[NH3+]CCNc1cc(C(F)(F)F)cc(N2CCOCC2)n1	ZINC000043179051	357087576	/nfs/dbraw/zinc/08/75/76/357087576.db2.gz	FAJLXRNSBSTXCI-UHFFFAOYSA-N	1	0	290.289	1.308	50	0		CDAARO
COCCN(Cc1cccs1)C(=O)[C@@H]1CC[NH2+]C1	ZINC000055384336	357333351	/nfs/dbraw/zinc/33/33/51/357333351.db2.gz	CMVKVZRHOCKVLC-LLVKDONJSA-N	1	0	268.382	1.333	50	0		CDAARO
Cc1nnc(CN2CCC[C@@H](c3nnc[nH]3)C2)s1	ZINC000408097552	357431781	/nfs/dbraw/zinc/43/17/81/357431781.db2.gz	NZMPYFWQKZYVCL-SECBINFHSA-N	1	0	264.358	1.344	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)CCc3cscn3)C[C@@H]12	ZINC000185125816	357511340	/nfs/dbraw/zinc/51/13/40/357511340.db2.gz	BLVIOZXPUQQPNT-YUSALJHKSA-N	1	0	265.382	1.271	50	0		CDAARO
CCn1nc(C)c(C[NH2+][C@@H](C)Cn2cncn2)c1C	ZINC000065394547	357535760	/nfs/dbraw/zinc/53/57/60/357535760.db2.gz	JFKULWLHRMOCSP-JTQLQIEISA-N	1	0	262.361	1.290	50	0		CDAARO
C[NH2+]Cc1n[nH]c(=O)n1-c1cccc(Cl)c1Cl	ZINC000065406966	357539335	/nfs/dbraw/zinc/53/93/35/357539335.db2.gz	ATTTZHBLAUPCJW-UHFFFAOYSA-N	1	0	273.123	1.587	50	0		CDAARO
CCCOCCn1cnc2sc3c(c2c1=O)CC[NH2+]C3	ZINC000065465559	357543785	/nfs/dbraw/zinc/54/37/85/357543785.db2.gz	ARVVWIIQFMVCOO-UHFFFAOYSA-N	1	0	293.392	1.530	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](c2nc(C)nn2-c2ccccn2)C1	ZINC000065489544	357544839	/nfs/dbraw/zinc/54/48/39/357544839.db2.gz	SJFVEGXSCCUNQG-CYBMUJFWSA-N	1	0	287.367	1.406	50	0		CDAARO
COCc1nc(CNC2CSCCSC2)no1	ZINC000067727491	357621749	/nfs/dbraw/zinc/62/17/49/357621749.db2.gz	FVINQNWCSOUFBN-UHFFFAOYSA-N	1	0	275.399	1.154	50	0		CDAARO
C[C@H]1Cc2cc(S(=O)(=O)N[C@H](C[NH3+])C3CC3)ccc2O1	ZINC000097229372	358043753	/nfs/dbraw/zinc/04/37/53/358043753.db2.gz	RIVZJDXJLOHCKN-TVQRCGJNSA-N	1	0	296.392	1.026	50	0		CDAARO
C[C@H]([NH2+]CCNC(=O)c1ccn[nH]1)c1cccs1	ZINC000097236294	358048553	/nfs/dbraw/zinc/04/85/53/358048553.db2.gz	KEDHLAOOGZCRRY-VIFPVBQESA-N	1	0	264.354	1.552	50	0		CDAARO
CSCCC[N@@H+]1CCn2nc(CNC(C)=O)cc2C1	ZINC000082137237	358148890	/nfs/dbraw/zinc/14/88/90/358148890.db2.gz	REEQEQGDZFFVJP-UHFFFAOYSA-N	1	0	282.413	1.088	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCC(=O)NCCNc2cccnc2)C1	ZINC000091503647	358515577	/nfs/dbraw/zinc/51/55/77/358515577.db2.gz	VXEBXCWOTRYIAK-AWEZNQCLSA-N	1	0	290.411	1.732	50	0		CDAARO
CCS(=O)(=O)N1CC(C[NH2+]C[C@@H](C)c2ccccc2)C1	ZINC000194826675	358542218	/nfs/dbraw/zinc/54/22/18/358542218.db2.gz	OVHWUIVMLUEAOJ-CYBMUJFWSA-N	1	0	296.436	1.661	50	0		CDAARO
Cc1cnc(NCC[C@@H]2CCC(=O)N2CC[NH+](C)C)nc1	ZINC000095365595	358686934	/nfs/dbraw/zinc/68/69/34/358686934.db2.gz	JQZGNMPPGJXFEW-ZDUSSCGKSA-N	1	0	291.399	1.140	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCC(=O)NCCn2cc(Cl)cn2)C1	ZINC000095373842	358688668	/nfs/dbraw/zinc/68/86/68/358688668.db2.gz	ZLZURVRMVLFXEI-LBPRGKRZSA-N	1	0	298.818	1.775	50	0		CDAARO
Cc1cc(C)c2[nH]c(CN[C@H]3CCC[NH2+]C3)cc(=O)c2c1	ZINC000095388500	358692305	/nfs/dbraw/zinc/69/23/05/358692305.db2.gz	URXKMELMACPOCG-ZDUSSCGKSA-N	1	0	285.391	1.987	50	0		CDAARO
c1cc(C[N@@H+]2CCCO[C@H](CN3CCOCC3)C2)ccn1	ZINC000097179333	358756106	/nfs/dbraw/zinc/75/61/06/358756106.db2.gz	SPHONTKMMHNFTB-MRXNPFEDSA-N	1	0	291.395	1.005	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)N(CCO)Cc1ccco1	ZINC000097307545	358766181	/nfs/dbraw/zinc/76/61/81/358766181.db2.gz	KLSLLGQVYRXURF-CQSZACIVSA-N	1	0	280.368	1.475	50	0		CDAARO
CCN(Cc1ccncc1)C(=O)[C@@H]1CCC[NH2+]CC1	ZINC000096137806	358709056	/nfs/dbraw/zinc/70/90/56/358709056.db2.gz	PGAJWXYFBSLDKQ-CQSZACIVSA-N	1	0	261.369	1.820	50	0		CDAARO
O=C(C[C@H]1COCC[NH2+]1)NCCCc1ccccc1F	ZINC000097463548	358778294	/nfs/dbraw/zinc/77/82/94/358778294.db2.gz	FYSQBHVETDZPMT-ZDUSSCGKSA-N	1	0	280.343	1.253	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)CCc2cn3ccccc3n2)CC1	ZINC000097514201	358781640	/nfs/dbraw/zinc/78/16/40/358781640.db2.gz	LVTRMNNTQYOWII-UHFFFAOYSA-N	1	0	286.379	1.431	50	0		CDAARO
CC(C)c1nc(CN2C[C@H](O)[C@@H]([NH+]3CCCCC3)C2)co1	ZINC000216027620	358918994	/nfs/dbraw/zinc/91/89/94/358918994.db2.gz	PBPFOMBVPVDKIP-GJZGRUSLSA-N	1	0	293.411	1.829	50	0		CDAARO
C[N@@H+]1CCC[C@@H](C(=O)NCc2nnc(-c3ccccc3)[nH]2)C1	ZINC000215431426	358889429	/nfs/dbraw/zinc/88/94/29/358889429.db2.gz	MGBCUHGBNCDBFB-CYBMUJFWSA-N	1	0	299.378	1.430	50	0		CDAARO
CN(C)c1ccc(C[N@H+](C)CCn2ccnc2)cn1	ZINC000215476313	358891000	/nfs/dbraw/zinc/89/10/00/358891000.db2.gz	STECOWMXUOCVBB-UHFFFAOYSA-N	1	0	259.357	1.476	50	0		CDAARO
CC(=O)c1cc(CN2CCC[C@@](O)(C[NH+](C)C)C2)cs1	ZINC000215553318	358894363	/nfs/dbraw/zinc/89/43/63/358894363.db2.gz	WJZXJJDAHMRPEJ-OAHLLOKOSA-N	1	0	296.436	1.839	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)N1CCCCCC1	ZINC000130032706	370665058	/nfs/dbraw/zinc/66/50/58/370665058.db2.gz	VKEZMEUULCCRAW-UHFFFAOYSA-N	1	0	277.434	1.214	50	0		CDAARO
CCc1ncc(C[N@H+](C)CCCn2cccn2)cn1	ZINC000216227291	358932816	/nfs/dbraw/zinc/93/28/16/358932816.db2.gz	WMJDHNMWDJBLDH-UHFFFAOYSA-N	1	0	259.357	1.758	50	0		CDAARO
CN(Cc1ccc2c(c1)C[N@@H+](C)C2)C(=O)c1c[nH]cn1	ZINC000219131939	359079615	/nfs/dbraw/zinc/07/96/15/359079615.db2.gz	FVEOMHQECHKQSG-UHFFFAOYSA-N	1	0	270.336	1.627	50	0		CDAARO
COCC(=O)N1C[C@@H](CF)C2(C1)CC[NH+](C(C)C)CC2	ZINC000257177651	359131515	/nfs/dbraw/zinc/13/15/15/359131515.db2.gz	XNYGUQBKHLTVJY-CYBMUJFWSA-N	1	0	286.391	1.551	50	0		CDAARO
CCOC(=O)[C@@]12CC[NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C2	ZINC000261250132	359276234	/nfs/dbraw/zinc/27/62/34/359276234.db2.gz	ZMLGCFGHQXSXAH-XHDPSFHLSA-N	1	0	298.383	1.539	50	0		CDAARO
COCC[NH+]1CCC(CNc2ncnc3[nH]ccc32)CC1	ZINC000089414502	359284018	/nfs/dbraw/zinc/28/40/18/359284018.db2.gz	ZHZDATDDJYWAPC-UHFFFAOYSA-N	1	0	289.383	1.728	50	0		CDAARO
Cn1cc(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cn1	ZINC000027937789	359348557	/nfs/dbraw/zinc/34/85/57/359348557.db2.gz	UWASXQLFLUFTGH-UHFFFAOYSA-N	1	0	264.373	1.459	50	0		CDAARO
Cc1n[nH]c(C)c1CNc1cc(C2CC([NH3+])C2)ncn1	ZINC000222494063	359349767	/nfs/dbraw/zinc/34/97/67/359349767.db2.gz	VSSRRQYMYODGJO-UHFFFAOYSA-N	1	0	272.356	1.633	50	0		CDAARO
Cc1ccsc1C(=O)N1CCOC[C@H](C[NH+](C)C)C1	ZINC000223583705	359436321	/nfs/dbraw/zinc/43/63/21/359436321.db2.gz	NGAZJZCXIKGJDP-GFCCVEGCSA-N	1	0	282.409	1.707	50	0		CDAARO
COCc1cc(CN(C)[C@@H]2CC[N@H+](C)C2)ccc1OC	ZINC000223791491	359457172	/nfs/dbraw/zinc/45/71/72/359457172.db2.gz	YTLVWSPVMXRUPJ-OAHLLOKOSA-N	1	0	278.396	1.978	50	0		CDAARO
Cc1c(Cl)cccc1S(=O)(=O)NCCn1ccnc1	ZINC000032405886	359663935	/nfs/dbraw/zinc/66/39/35/359663935.db2.gz	BYPHLNKVOZCLGV-UHFFFAOYSA-N	1	0	299.783	1.823	50	0		CDAARO
COc1cccc(CC(=O)N2CCC[C@@H]([NH3+])[C@H]2C)c1	ZINC000297415951	200182414	/nfs/dbraw/zinc/18/24/14/200182414.db2.gz	RHBDQQFTQCYRMS-BXUZGUMPSA-N	1	0	262.353	1.576	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1C[C@@H]1CCCN(S(C)(=O)=O)C1	ZINC000409420895	360224276	/nfs/dbraw/zinc/22/42/76/360224276.db2.gz	ANSWCVZZYZCDCF-GFCCVEGCSA-N	1	0	297.424	1.741	50	0		CDAARO
c1cc(COC[C@H]2C[NH2+]CC23CCOCC3)ccn1	ZINC000409421630	360231972	/nfs/dbraw/zinc/23/19/72/360231972.db2.gz	RJFAIEXJSRJYFR-CQSZACIVSA-N	1	0	262.353	1.614	50	0		CDAARO
O=C(NCCC[NH+]1CCN(c2ccccc2)CC1)C1CC1	ZINC000011853305	360358328	/nfs/dbraw/zinc/35/83/28/360358328.db2.gz	SMJJBSMBNBGMEB-UHFFFAOYSA-N	1	0	287.407	1.725	50	0		CDAARO
O=C(NCCn1cccn1)N1CC[C@H]([NH+]2CCCCC2)C1	ZINC000426359358	360658655	/nfs/dbraw/zinc/65/86/55/360658655.db2.gz	BGLYAUKSAPGFEN-AWEZNQCLSA-N	1	0	291.399	1.153	50	0		CDAARO
CCc1noc2ncc(C(=O)N3CC[C@@H](C[NH3+])C3)cc12	ZINC000178519331	189123146	/nfs/dbraw/zinc/12/31/46/189123146.db2.gz	KYWZUGLUWSIPNP-VIFPVBQESA-N	1	0	274.324	1.206	50	0		CDAARO
CN(Cc1cnccn1)C(=O)NC[C@H]1CCCC[N@@H+]1C	ZINC000426428433	360668984	/nfs/dbraw/zinc/66/89/84/360668984.db2.gz	XBCMQVDFZKPGOO-CYBMUJFWSA-N	1	0	277.372	1.102	50	0		CDAARO
CO[C@@H]1CCCN(C(=O)Cc2ccc(OCC[NH3+])cc2)C1	ZINC000426728192	360699531	/nfs/dbraw/zinc/69/95/31/360699531.db2.gz	FKAKEQUROCLNMY-OAHLLOKOSA-N	1	0	292.379	1.204	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)/C=C/c2cccc(F)c2)C1	ZINC000179011527	189161929	/nfs/dbraw/zinc/16/19/29/189161929.db2.gz	TVRAPDFLXCCHHK-GFUIURDCSA-N	1	0	262.328	1.907	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCN(C(=O)c2ccnc(-n3ccnc3)c2)C1	ZINC000179220561	189179108	/nfs/dbraw/zinc/17/91/08/189179108.db2.gz	RMRZSEOCIVCHFB-GXTWGEPZSA-N	1	0	299.378	1.467	50	0		CDAARO
CCCC[C@H]([NH3+])C(=O)NCCn1cc(Cl)cn1	ZINC000299773115	200867667	/nfs/dbraw/zinc/86/76/67/200867667.db2.gz	AOUSOTYZQPDWND-JTQLQIEISA-N	1	0	258.753	1.170	50	0		CDAARO
Cc1cccnc1C[C@@H](C)[N@H+](C)CCC(=O)NC1CC1	ZINC000299787382	200873154	/nfs/dbraw/zinc/87/31/54/200873154.db2.gz	WHCABHJMAALQHO-CYBMUJFWSA-N	1	0	275.396	1.922	50	0		CDAARO
C[C@H]([NH3+])c1ccc(Br)cc1OCCO	ZINC000132039154	361181994	/nfs/dbraw/zinc/18/19/94/361181994.db2.gz	NVWXKUUAGIRMSO-ZETCQYMHSA-N	1	0	260.131	1.840	50	0		CDAARO
Cc1ccc(S(=O)(=O)N(C)C2CC[NH2+]CC2)c(C)c1	ZINC000036300023	361489680	/nfs/dbraw/zinc/48/96/80/361489680.db2.gz	GKJSLWUUZIDUBY-UHFFFAOYSA-N	1	0	282.409	1.676	50	0		CDAARO
C[N@H+](CCCC(=O)NC(N)=O)Cc1cc2ccccc2o1	ZINC000175187750	364635419	/nfs/dbraw/zinc/63/54/19/364635419.db2.gz	CHYQEWYQNHMCOR-UHFFFAOYSA-N	1	0	289.335	1.840	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)c1ccn[nH]1	ZINC000249697920	365196728	/nfs/dbraw/zinc/19/67/28/365196728.db2.gz	VIRCNEDZRMUJOA-QWHCGFSZSA-N	1	0	262.357	1.499	50	0		CDAARO
CS[C@@H]1CN(c2nc(C)cc(C)n2)C[C@@H]1[NH+](C)C	ZINC000271098645	366968155	/nfs/dbraw/zinc/96/81/55/366968155.db2.gz	MJAXLAINCZCQHO-NWDGAFQWSA-N	1	0	266.414	1.575	50	0		CDAARO
O=C(NC1(c2ccc(Cl)cc2)CC1)[C@H]1C[NH2+]CCO1	ZINC000157805170	283911664	/nfs/dbraw/zinc/91/16/64/283911664.db2.gz	QDFOIXVRFLDLMD-GFCCVEGCSA-N	1	0	280.755	1.434	50	0		CDAARO
COCc1cc(C(=O)N2CCCC[C@@H]2CC[NH3+])no1	ZINC000090254331	367027562	/nfs/dbraw/zinc/02/75/62/367027562.db2.gz	WWURLJDIAQWTEG-SNVBAGLBSA-N	1	0	267.329	1.165	50	0		CDAARO
CCc1nn(C)cc1CNC(=O)N1CC[C@@H](C[NH+](C)C)C1	ZINC000130517623	367246740	/nfs/dbraw/zinc/24/67/40/367246740.db2.gz	YKDYIENQOFGUGO-LBPRGKRZSA-N	1	0	293.415	1.076	50	0		CDAARO
COCC(=O)N[C@@H](C[NH+](C)C)c1ccc(Cl)cc1	ZINC000252507551	367652103	/nfs/dbraw/zinc/65/21/03/367652103.db2.gz	WOIGVGVYUTXLQO-LBPRGKRZSA-N	1	0	270.760	1.705	50	0		CDAARO
FC(F)(F)CN1CC[C@H]([NH2+][C@H]2CCN3CCCC[C@@H]23)C1	ZINC000252517729	367741681	/nfs/dbraw/zinc/74/16/81/367741681.db2.gz	PYYKMKAJZAWCMR-AVGNSLFASA-N	1	0	291.361	1.839	50	0		CDAARO
CC[C@@H]1C[N@@H+](C2C[C@H](C)O[C@@H](C)C2)CCN1C[C@@H](C)O	ZINC000252517742	367741943	/nfs/dbraw/zinc/74/19/43/367741943.db2.gz	QGMZKBYZLRBSRP-CBBWQLFWSA-N	1	0	284.444	1.719	50	0		CDAARO
[NH3+]CCN(Cc1ccccc1)C(=O)[C@@H]1C[C@H]1c1c[nH]cn1	ZINC000638168073	368612980	/nfs/dbraw/zinc/61/29/80/368612980.db2.gz	BXNQUMZDXMVFDI-ZIAGYGMSSA-N	1	0	284.363	1.501	50	0		CDAARO
C[C@@H](NC(=O)N1CC[NH+]2CCC1CC2)c1cccnc1	ZINC000376803812	371343343	/nfs/dbraw/zinc/34/33/43/371343343.db2.gz	ZKSKGXWUUQOAIG-GFCCVEGCSA-N	1	0	274.368	1.632	50	0		CDAARO
O=C(NCC1CC[NH+]([C@H]2CCOC2)CC1)c1ccoc1	ZINC000575616298	371720465	/nfs/dbraw/zinc/72/04/65/371720465.db2.gz	MXHXYYRWWITDFN-AWEZNQCLSA-N	1	0	278.352	1.510	50	0		CDAARO
CN(C(=O)c1ccn(-c2ccccc2F)n1)[C@H]1CC[NH2+]C1	ZINC000179049846	372239870	/nfs/dbraw/zinc/23/98/70/372239870.db2.gz	YIBQWDIVVDUTCX-NSHDSACASA-N	1	0	288.326	1.445	50	0		CDAARO
COc1ccc(-c2noc(C[NH2+][C@@H](CO)C(C)C)n2)cc1	ZINC000071774455	541870748	/nfs/dbraw/zinc/87/07/48/541870748.db2.gz	SSPFUUQHLGAKJV-ZDUSSCGKSA-N	1	0	291.351	1.852	50	0		CDAARO
O=C(N[C@H]1COC[C@@H]1[NH+]1CCCC1)c1ccncc1Cl	ZINC000299755739	372744929	/nfs/dbraw/zinc/74/49/29/372744929.db2.gz	CTFYHXXFNROXAF-STQMWFEESA-N	1	0	295.770	1.328	50	0		CDAARO
CNc1ncnc2c1cnn2CC1(O)CCC(C)CC1	ZINC000193758838	372747893	/nfs/dbraw/zinc/74/78/93/372747893.db2.gz	JBWDWCJKJXYCGR-UHFFFAOYSA-N	1	0	275.356	1.809	50	0		CDAARO
Cc1nc(CN(C)C[C@H]2CCCC[N@@H+]2C)[nH]c1C	ZINC000299781868	372759665	/nfs/dbraw/zinc/75/96/65/372759665.db2.gz	LXAHWUZOCXJEIZ-CYBMUJFWSA-N	1	0	250.390	1.943	50	0		CDAARO
CCOC(=O)[C@@H](C)N1CCC2(CCC[N@@H+]2C)CC1	ZINC000253392554	373681521	/nfs/dbraw/zinc/68/15/21/373681521.db2.gz	GERAJLFMMCNBSM-GFCCVEGCSA-N	1	0	254.374	1.498	50	0		CDAARO
C[NH2+]CC(=O)N1CCCc2c(NC(=O)C(C)C)cccc21	ZINC000253430512	373736274	/nfs/dbraw/zinc/73/62/74/373736274.db2.gz	FHIYJLVULNTQNP-UHFFFAOYSA-N	1	0	289.379	1.780	50	0		CDAARO
C[C@H](C(=O)Nc1ccc(C(N)=O)cc1)[N@@H+]1CCC[C@@H](C)C1	ZINC000103309177	373949329	/nfs/dbraw/zinc/94/93/29/373949329.db2.gz	VFWKLJMZWUBNTP-VXGBXAGGSA-N	1	0	289.379	1.844	50	0		CDAARO
Cn1cncc1C[NH2+]C[C@H]1CCN(CC(F)(F)F)C1	ZINC000112341442	374221757	/nfs/dbraw/zinc/22/17/57/374221757.db2.gz	RZNZANXJDSJDJA-SNVBAGLBSA-N	1	0	276.306	1.394	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CN(C)CCn1nc(C)cc1C	ZINC000252486474	189976559	/nfs/dbraw/zinc/97/65/59/189976559.db2.gz	HLPULYVMDMKBMK-HNNXBMFYSA-N	1	0	264.417	1.916	50	0		CDAARO
CC[N@@H+]1CC[C@@H](N(C)CC(=O)NCc2cccc(C)c2)C1	ZINC000095395073	374902148	/nfs/dbraw/zinc/90/21/48/374902148.db2.gz	NDCFNWMCWSOXBI-MRXNPFEDSA-N	1	0	289.423	1.637	50	0		CDAARO
Cc1ccc(CNC(=O)CCOC2CC[NH2+]CC2)s1	ZINC000095394284	374899508	/nfs/dbraw/zinc/89/95/08/374899508.db2.gz	NJBCGUZLQHPRJJ-UHFFFAOYSA-N	1	0	282.409	1.831	50	0		CDAARO
COCCOc1ccc(C[NH2+][C@@H]2C[C@@H](C)N(C)C2)cn1	ZINC000095420409	374924252	/nfs/dbraw/zinc/92/42/52/374924252.db2.gz	MEFLVUJUMLGTMG-TZMCWYRMSA-N	1	0	279.384	1.289	50	0		CDAARO
CCc1ccccc1NC(=O)C[NH2+][C@@](C)(CO)C1CC1	ZINC000095469395	374963128	/nfs/dbraw/zinc/96/31/28/374963128.db2.gz	ZCKQREYCWNTSCL-INIZCTEOSA-N	1	0	276.380	1.938	50	0		CDAARO
CNc1snc(C)c1C(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000095405237	374909395	/nfs/dbraw/zinc/90/93/95/374909395.db2.gz	YFCIISGHOYZSOH-MNOVXSKESA-N	1	0	294.424	1.802	50	0		CDAARO
Cn1cc(CCC(=O)N[C@H]2CCC[C@H]([NH+](C)C)C2)cn1	ZINC000095408062	374910785	/nfs/dbraw/zinc/91/07/85/374910785.db2.gz	RKRZSQPCVFPRGG-KBPBESRZSA-N	1	0	278.400	1.342	50	0		CDAARO
CCO[C@@H]1CCCN(C(=O)[C@H](C2CC2)[NH+]2CCCC2)C1	ZINC000095939781	375037571	/nfs/dbraw/zinc/03/75/71/375037571.db2.gz	ANZCHLXPDCBAHP-CABCVRRESA-N	1	0	280.412	1.888	50	0		CDAARO
Cc1ccnc(N2CC[C@@H](OCC[NH+]3CCCCC3)C2)n1	ZINC000095974196	375047379	/nfs/dbraw/zinc/04/73/79/375047379.db2.gz	RJWGNEQKQUYMPT-OAHLLOKOSA-N	1	0	290.411	1.866	50	0		CDAARO
COc1ccc(C[NH2+]Cc2c(C)nn(CCO)c2C)cn1	ZINC000097159819	375150442	/nfs/dbraw/zinc/15/04/42/375150442.db2.gz	QOJFSIXQRPSNCT-UHFFFAOYSA-N	1	0	290.367	1.186	50	0		CDAARO
CCCCCS(=O)(=O)N(C)[C@H]1CC[N@H+](C)[C@H](C)C1	ZINC000097115499	375151542	/nfs/dbraw/zinc/15/15/42/375151542.db2.gz	GTWPBCMDLOQUKW-OLZOCXBDSA-N	1	0	276.446	1.921	50	0		CDAARO
Cc1cc(C)nc(NC[C@H](C)N2CCOCC2)n1	ZINC000097220649	375157185	/nfs/dbraw/zinc/15/71/85/375157185.db2.gz	UDDDDYXNRLMVSZ-LBPRGKRZSA-N	1	0	250.346	1.226	50	0		CDAARO
C[NH+](C)CCNC(=S)NCCc1ccccc1	ZINC000002776627	375323487	/nfs/dbraw/zinc/32/34/87/375323487.db2.gz	NLNKYEZDHDHQPQ-UHFFFAOYSA-N	1	0	251.399	1.255	50	0		CDAARO
C[C@@H]([NH3+])C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000261891970	190045808	/nfs/dbraw/zinc/04/58/08/190045808.db2.gz	WQYINDSPEMMTEK-MRVWCRGKSA-N	1	0	262.353	1.448	50	0		CDAARO
CN(CC1([NH+](C)C)CCC1)C(=O)NCc1cc[nH]n1	ZINC000189960288	377488135	/nfs/dbraw/zinc/48/81/35/377488135.db2.gz	CUHWHJTUKAZDQR-UHFFFAOYSA-N	1	0	265.361	1.035	50	0		CDAARO
CNS(=O)(=O)CC[NH2+]C[C@@H]1C(C)=CCC[C@H]1C	ZINC000190301553	377598356	/nfs/dbraw/zinc/59/83/56/377598356.db2.gz	RRRROPMCVRZLQF-VXGBXAGGSA-N	1	0	260.403	1.118	50	0		CDAARO
CC(C)C[C@H](CO)NC(=O)[C@H](C)[N@H+]1[C@H](C)CC[C@@H]1C	ZINC000245338934	378072055	/nfs/dbraw/zinc/07/20/55/378072055.db2.gz	PKKPOEDIGMNOJP-RFQIPJPRSA-N	1	0	270.417	1.771	50	0		CDAARO
C[C@@H]1COCC[C@@H]1[NH2+]Cc1cccc(-n2cncn2)c1	ZINC000281020313	195072412	/nfs/dbraw/zinc/07/24/12/195072412.db2.gz	XNPWEXXQUFAHCZ-DOMZBBRYSA-N	1	0	272.352	1.782	50	0		CDAARO
Cc1cc(F)cc(S(=O)(=O)N[C@H]2CCC[C@@H]2C[NH3+])c1	ZINC000195544570	291915941	/nfs/dbraw/zinc/91/59/41/291915941.db2.gz	BNIYWYFVJDFDOE-MFKMUULPSA-N	1	0	286.372	1.540	50	0		CDAARO
OCC1(C[NH2+][C@H]2CCc3cc4c(cc32)OCCO4)CC1	ZINC000089764977	285248332	/nfs/dbraw/zinc/24/83/32/285248332.db2.gz	KASZPASBNPNFIW-ZDUSSCGKSA-N	1	0	275.348	1.807	50	0		CDAARO
Cc1cccnc1[C@H]([NH2+]CCN1C(=O)CNC1=O)C(C)C	ZINC000096424397	256759987	/nfs/dbraw/zinc/75/99/87/256759987.db2.gz	WSARPIMTUZKPOG-CYBMUJFWSA-N	1	0	290.367	1.229	50	0		CDAARO
CN(CC[C@@H](O)c1ccccc1)C(=O)NCCC[NH+](C)C	ZINC000426529306	256860301	/nfs/dbraw/zinc/86/03/01/256860301.db2.gz	MUEYCKXZVKQLGU-OAHLLOKOSA-N	1	0	293.411	1.703	50	0		CDAARO
CCc1ccc(OC[C@@H](O)CN2CC[NH+](CC)CC2)cc1	ZINC000019790344	390229194	/nfs/dbraw/zinc/22/91/94/390229194.db2.gz	SSGZTFFYHNEZRO-INIZCTEOSA-N	1	0	292.423	1.626	50	0		CDAARO
Cc1nsc(NC(=O)N2CCC[C@@H](C[NH3+])C2)n1	ZINC000055119699	390488188	/nfs/dbraw/zinc/48/81/88/390488188.db2.gz	YZJDZCUUZDUXTK-QMMMGPOBSA-N	1	0	255.347	1.049	50	0		CDAARO
Cc1ccsc1CNC(=O)C[N@@H+]1CCC[C@@H]1CCCO	ZINC000096424255	390515822	/nfs/dbraw/zinc/51/58/22/390515822.db2.gz	ODYGTSNNIUTIEA-CYBMUJFWSA-N	1	0	296.436	1.910	50	0		CDAARO
[NH3+]CCn1ccn2nc(-c3ccc(F)cc3)cc2c1=O	ZINC000096517332	390533421	/nfs/dbraw/zinc/53/34/21/390533421.db2.gz	GBWHARGFALERRP-UHFFFAOYSA-N	1	0	272.283	1.261	50	0		CDAARO
C[C@@H]([NH2+]Cc1nncn1C)[C@@H]1COc2ccccc21	ZINC000097112619	390796201	/nfs/dbraw/zinc/79/62/01/390796201.db2.gz	RFXIUKTYHAAVOH-PWSUYJOCSA-N	1	0	258.325	1.469	50	0		CDAARO
CC[N@@H+]1CCC[C@H](Nc2nc3ccccc3c(=O)[nH]2)C1	ZINC000097995091	390814886	/nfs/dbraw/zinc/81/48/86/390814886.db2.gz	VFUSZHQFIJZNCK-NSHDSACASA-N	1	0	272.352	1.819	50	0		CDAARO
C[C@@H](C[N@@H+]1C[C@@H](O)C[C@H]1CO)c1cccc(Cl)c1	ZINC000188568866	390967818	/nfs/dbraw/zinc/96/78/18/390967818.db2.gz	FVIJBWIQYISCDT-BPNCWPANSA-N	1	0	269.772	1.871	50	0		CDAARO
CO[C@@H]1CCN(C(=O)c2ccc(C)cc2OCCC[NH3+])C1	ZINC000426668413	533409209	/nfs/dbraw/zinc/40/92/09/533409209.db2.gz	QNUYPMDNUAVQGP-CYBMUJFWSA-N	1	0	292.379	1.584	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)NCCCOC2CCCC2)C1	ZINC000237994611	391365680	/nfs/dbraw/zinc/36/56/80/391365680.db2.gz	WOXKJKFJGIDGJN-NWDGAFQWSA-N	1	0	254.374	1.579	50	0		CDAARO
CC(C)(CC(=O)NC[C@@]1(O)CC[NH2+]C1)c1ccccc1	ZINC000299766154	391721387	/nfs/dbraw/zinc/72/13/87/391721387.db2.gz	BTESXVCAQSRNPR-MRXNPFEDSA-N	1	0	276.380	1.195	50	0		CDAARO
c1cc(N2CCCO[C@H](C[NH+]3CCCCC3)C2)ncn1	ZINC000091594399	285443207	/nfs/dbraw/zinc/44/32/07/285443207.db2.gz	ZYVDRRAFUZVCMY-CQSZACIVSA-N	1	0	276.384	1.558	50	0		CDAARO
CCC[NH+]1CCC(NS(=O)(=O)Cc2ccccc2)CC1	ZINC000014252408	392551214	/nfs/dbraw/zinc/55/12/14/392551214.db2.gz	JMHSRJCOHJBXAW-UHFFFAOYSA-N	1	0	296.436	1.980	50	0		CDAARO
C[C@@H]1OCC[C@H]1[N@H+](CCO)Cc1cnn(C(C)(C)C)c1	ZINC000449675539	392854395	/nfs/dbraw/zinc/85/43/95/392854395.db2.gz	AKTLJBAADQPGJA-GXTWGEPZSA-N	1	0	281.400	1.610	50	0		CDAARO
C[NH+]1CCN(CCNC(=O)/C=C\c2cccc(F)c2)CC1	ZINC000096248620	393171764	/nfs/dbraw/zinc/17/17/64/393171764.db2.gz	LZCLVUOPQIFBKE-WAYWQWQTSA-N	1	0	291.370	1.203	50	0		CDAARO
CCOCC[N@H+](C)CCN1CCN(c2ccccc2)CC1	ZINC000089986958	135061686	/nfs/dbraw/zinc/06/16/86/135061686.db2.gz	AAURRWSDFWYOCX-UHFFFAOYSA-N	1	0	291.439	1.777	50	0		CDAARO
COC(C)(C)C[C@H](C)[NH2+]C1CCS(=O)(=O)CC1	ZINC000036330913	292075827	/nfs/dbraw/zinc/07/58/27/292075827.db2.gz	IANXFWLFJNYMTL-JTQLQIEISA-N	1	0	263.403	1.357	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N1CCC([NH3+])CC1	ZINC000037116367	292123056	/nfs/dbraw/zinc/12/30/56/292123056.db2.gz	QMURDGQZNBFNJJ-UHFFFAOYSA-N	1	0	272.345	1.246	50	0		CDAARO
COc1ccc2c(c1)CC[N@@H+](CCn1cnnc1)CC2	ZINC000095388446	397827101	/nfs/dbraw/zinc/82/71/01/397827101.db2.gz	CZMZLTCFGGWHJC-UHFFFAOYSA-N	1	0	272.352	1.388	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)c2cnc(-c3ccncc3)s2)C1	ZINC000269120119	397818493	/nfs/dbraw/zinc/81/84/93/397818493.db2.gz	JKQQRFLLXPUKPO-SNVBAGLBSA-N	1	0	274.349	1.378	50	0		CDAARO
C[C@H](NC(=O)N1CC[C@H](C[NH+](C)C)C1)c1ccco1	ZINC000097101591	397966900	/nfs/dbraw/zinc/96/69/00/397966900.db2.gz	CBYLHNZOQCEATP-NWDGAFQWSA-N	1	0	265.357	1.934	50	0		CDAARO
O=C(N[C@@H]1CCSc2c(F)cccc21)[C@@H]1C[C@@H](O)C[NH2+]1	ZINC000299750347	397897957	/nfs/dbraw/zinc/89/79/57/397897957.db2.gz	NECWZFMNDSWACM-FXAINCCUSA-N	1	0	296.367	1.202	50	0		CDAARO
C[C@H]1COCCN1C(=O)N[C@H]1CC[N@@H+](C2CCCC2)C1	ZINC000098012581	398004496	/nfs/dbraw/zinc/00/44/96/398004496.db2.gz	GYLVUZDOUYTMPK-STQMWFEESA-N	1	0	281.400	1.434	50	0		CDAARO
Cc1cc(C)n(CCC[NH2+][C@@H](C)Cn2cccn2)n1	ZINC000121821548	147384017	/nfs/dbraw/zinc/38/40/17/147384017.db2.gz	AFEFZDDVOMLLOI-ZDUSSCGKSA-N	1	0	261.373	1.765	50	0		CDAARO
Cc1cc(CNC(=O)N2CC[C@@H]([NH3+])C2)ccc1F	ZINC000335616691	150853346	/nfs/dbraw/zinc/85/33/46/150853346.db2.gz	IPTZWGWBBOFBJH-LLVKDONJSA-N	1	0	251.305	1.377	50	0		CDAARO
COc1ccc([C@]2(C(=O)NCC[NH3+])CC2(C)C)cc1	ZINC000096142239	286380982	/nfs/dbraw/zinc/38/09/82/286380982.db2.gz	XHHBWYYOIYYCIO-HNNXBMFYSA-N	1	0	262.353	1.438	50	0		CDAARO
CCc1cccc(NC(=O)CN2CC[C@H](n3cncn3)C2)c1	ZINC000375319693	160367194	/nfs/dbraw/zinc/36/71/94/160367194.db2.gz	OWYRIPAKSZCTOJ-HNNXBMFYSA-N	1	0	299.378	1.726	50	0		CDAARO
C[NH+](C)Cc1cccc(C(=O)N[C@@H]2CCc3c[nH]nc3C2)c1	ZINC000371959920	160064365	/nfs/dbraw/zinc/06/43/65/160064365.db2.gz	OUSKEVBATRHJQS-OAHLLOKOSA-N	1	0	298.390	1.759	50	0		CDAARO
C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[NH+]1CCCCC1	ZINC000008119000	170319838	/nfs/dbraw/zinc/31/98/38/170319838.db2.gz	QZJJQHDMXCRBDS-SNVBAGLBSA-N	1	0	288.351	1.669	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1nc(-c2cccnc2)no1	ZINC000009405759	170376006	/nfs/dbraw/zinc/37/60/06/170376006.db2.gz	OYPPUGXZYCTHAV-UHFFFAOYSA-N	1	0	289.339	1.203	50	0		CDAARO
C[C@H](Oc1ccccc1)C(=O)NC1CC[NH+](C)CC1	ZINC000012380621	170482072	/nfs/dbraw/zinc/48/20/72/170482072.db2.gz	FAVDGRBVFPVLKR-LBPRGKRZSA-N	1	0	262.353	1.664	50	0		CDAARO
O[C@@H](COc1ccccc1-c1cc[nH]n1)C[NH+]1CCCC1	ZINC000019741571	170851403	/nfs/dbraw/zinc/85/14/03/170851403.db2.gz	CSNNGJMIZDYYEP-CYBMUJFWSA-N	1	0	287.363	1.912	50	0		CDAARO
C[C@H]([NH2+]Cc1ccc(OCC(N)=O)cc1)c1ccccn1	ZINC000020123279	171004378	/nfs/dbraw/zinc/00/43/78/171004378.db2.gz	RFDREZCRYRSQCY-LBPRGKRZSA-N	1	0	285.347	1.797	50	0		CDAARO
[NH3+][C@@H](CC(=O)N1CCSCC1)c1ccccc1	ZINC000020257285	171112029	/nfs/dbraw/zinc/11/20/29/171112029.db2.gz	SLKVVWNOATXNGX-LBPRGKRZSA-N	1	0	250.367	1.652	50	0		CDAARO
Cc1cccc(OCC(=O)NC2CC[NH+](C)CC2)c1C	ZINC000020417947	171183396	/nfs/dbraw/zinc/18/33/96/171183396.db2.gz	ZVYLEQUYKNBHQX-UHFFFAOYSA-N	1	0	276.380	1.893	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)Nc2ccccc2C)CC1	ZINC000020595181	171264186	/nfs/dbraw/zinc/26/41/86/171264186.db2.gz	YPLOLIBZVYYSRY-UHFFFAOYSA-N	1	0	275.396	1.961	50	0		CDAARO
CCOCCc1nc(-c2c(C)ncc3c2CC[NH2+]C3)no1	ZINC000020601857	171266614	/nfs/dbraw/zinc/26/66/14/171266614.db2.gz	HPVUBPZHCHVWHA-UHFFFAOYSA-N	1	0	288.351	1.665	50	0		CDAARO
CSc1ccccc1C(=O)NCCN1CC[NH+](C)CC1	ZINC000020820008	171273713	/nfs/dbraw/zinc/27/37/13/171273713.db2.gz	KXFULEUEJBUGMJ-UHFFFAOYSA-N	1	0	293.436	1.386	50	0		CDAARO
CC[NH2+]C[C@@H](O)COc1ccc(CCOC)cc1	ZINC000022056324	171351239	/nfs/dbraw/zinc/35/12/39/171351239.db2.gz	HYRRKPFGZHWUPQ-CYBMUJFWSA-N	1	0	253.342	1.225	50	0	in-vitro	CDAARO
Cc1cc(C)c(S(=O)(=O)NCCC[NH+](C)C)cc1C	ZINC000035670772	172343541	/nfs/dbraw/zinc/34/35/41/172343541.db2.gz	YRPDZYGYRBHNQJ-UHFFFAOYSA-N	1	0	284.425	1.842	50	0		CDAARO
CCCN([C@H]1CC[NH2+]C1)S(=O)(=O)c1ccccc1F	ZINC000037539500	173261047	/nfs/dbraw/zinc/26/10/47/173261047.db2.gz	YDLZRKWILPYNFG-NSHDSACASA-N	1	0	286.372	1.588	50	0		CDAARO
c1ccc(C2=NN=C(N3CC[NH2+]CC3)SC2)cc1	ZINC000038478393	174141867	/nfs/dbraw/zinc/14/18/67/174141867.db2.gz	SIJRFUNQWYFTHO-UHFFFAOYSA-N	1	0	260.366	1.399	50	0		CDAARO
[NH3+]CCOc1ccc2nnc(-c3ccccc3)n2n1	ZINC000038478036	174142222	/nfs/dbraw/zinc/14/22/22/174142222.db2.gz	MRIDPVDWCQPMJE-UHFFFAOYSA-N	1	0	255.281	1.129	50	0		CDAARO
C[C@H]1CCCC[C@H]1[N@H+](C)Cc1cc(=O)n(C)c(=O)n1C	ZINC000040497574	174295694	/nfs/dbraw/zinc/29/56/94/174295694.db2.gz	SQEYXRNWVGQQNC-WCQYABFASA-N	1	0	279.384	1.095	50	0		CDAARO
[NH3+]CCCN(CCN1CCOCC1)Cc1cccs1	ZINC000045796282	175383895	/nfs/dbraw/zinc/38/38/95/175383895.db2.gz	VRRNYYRTPULFLD-UHFFFAOYSA-N	1	0	283.441	1.231	50	0		CDAARO
O=C1N(Cc2cccc(F)c2)CCN1C1CC[NH2+]CC1	ZINC000045796140	175384006	/nfs/dbraw/zinc/38/40/06/175384006.db2.gz	VWERWUASJRYPHU-UHFFFAOYSA-N	1	0	277.343	1.815	50	0		CDAARO
C[C@@H](C1CCN(C(=O)c2nc[nH]n2)CC1)[NH+]1CCCC1	ZINC000067674130	175782874	/nfs/dbraw/zinc/78/28/74/175782874.db2.gz	AICDGTYSTZZOCF-NSHDSACASA-N	1	0	277.372	1.141	50	0		CDAARO
O=C(C[C@H]1COCC[NH2+]1)Nc1cccc2cccnc21	ZINC000072164156	176330627	/nfs/dbraw/zinc/33/06/27/176330627.db2.gz	ZNFLSARIGLYDTD-LBPRGKRZSA-N	1	0	271.320	1.552	50	0		CDAARO
CCCc1nc(C)c(CNC(=O)C[C@H]2COCC[NH2+]2)s1	ZINC000072167127	176331922	/nfs/dbraw/zinc/33/19/22/176331922.db2.gz	YCVSBTIEBULDNM-NSHDSACASA-N	1	0	297.424	1.399	50	0		CDAARO
CCOC(=O)c1coc(N2CC([N@@H+]3CCCC[C@H]3C)C2)n1	ZINC000077353580	177255842	/nfs/dbraw/zinc/25/58/42/177255842.db2.gz	FMCZUGAKCWJJGV-LLVKDONJSA-N	1	0	293.367	1.914	50	0		CDAARO
COc1ccccc1OC1CN(C[C@H]2CC[NH2+]C2)C1	ZINC000077471921	177272613	/nfs/dbraw/zinc/27/26/13/177272613.db2.gz	WNGMDULOYUQCPZ-LBPRGKRZSA-N	1	0	262.353	1.368	50	0		CDAARO
COC(=O)c1ccc(NC(=O)N2CC[C@@H]([NH3+])C2)cc1Cl	ZINC000096150675	260563173	/nfs/dbraw/zinc/56/31/73/260563173.db2.gz	RMXCOPVDZJVBQQ-MRVPVSSYSA-N	1	0	297.742	1.692	50	0		CDAARO
CC(C)c1nnsc1CN1C[C@H]([NH3+])[C@@H](C2CC2)C1	ZINC000091915327	275777624	/nfs/dbraw/zinc/77/76/24/275777624.db2.gz	CHRUTBSAPPYRBC-MNOVXSKESA-N	1	0	266.414	1.831	50	0		CDAARO
CCN1C(=O)/C(=C\C=C2\CCC[N@@H+]2C)OC1=S	ZINC000095932221	276145464	/nfs/dbraw/zinc/14/54/64/276145464.db2.gz	YADMFLGOGVPZGG-PCCLLEMOSA-N	1	0	252.339	1.643	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)c2cccnc2Cl)CC1	ZINC000003235392	277050892	/nfs/dbraw/zinc/05/08/92/277050892.db2.gz	FBDCRVUARSZBNE-UHFFFAOYSA-N	1	0	253.733	1.513	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(N2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1	ZINC000096663777	277180969	/nfs/dbraw/zinc/18/09/69/277180969.db2.gz	HAFAKJJVJJJEOM-BETUJISGSA-N	1	0	295.427	1.822	50	0		CDAARO
CO[C@@H]1CCCC[C@H]1NC(=O)NCC[N@H+](C)C(C)C	ZINC000107063661	277284099	/nfs/dbraw/zinc/28/40/99/277284099.db2.gz	UEBLWCGQUNQWFI-CHWSQXEVSA-N	1	0	271.405	1.583	50	0		CDAARO
Cc1c(Cl)cccc1S(=O)(=O)N1CCC([NH3+])CC1	ZINC000036753748	278599020	/nfs/dbraw/zinc/59/90/20/278599020.db2.gz	RVQKXQLQMTUPCG-UHFFFAOYSA-N	1	0	288.800	1.760	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)[C@H]1CSc2ccccc21	ZINC000092239301	278837129	/nfs/dbraw/zinc/83/71/29/278837129.db2.gz	GFHPBBMTFUUNDQ-PWSUYJOCSA-N	1	0	262.378	1.696	50	0		CDAARO
Cc1nc2ccc(N[C@H]3CCC[C@@H]([NH+](C)C)C3)nn2n1	ZINC000253415435	279127535	/nfs/dbraw/zinc/12/75/35/279127535.db2.gz	CPSQSWZENXNGCP-NWDGAFQWSA-N	1	0	274.372	1.717	50	0		CDAARO
C[C@H](C(=O)N(C)C1CCCCC1)[N@@H+]1CC[C@@H](O)C1	ZINC000175307490	279183354	/nfs/dbraw/zinc/18/33/54/279183354.db2.gz	IXTMVQZSFCICEK-DGCLKSJQSA-N	1	0	254.374	1.233	50	0		CDAARO
Cn1cc([C@@H]2OCC[C@H]2C[NH2+]Cc2cccn2C)cn1	ZINC000089756757	279266540	/nfs/dbraw/zinc/26/65/40/279266540.db2.gz	INMQVYMPKMLXQP-SWLSCSKDSA-N	1	0	274.368	1.626	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H](c2ccccc2)N(C)C)C[C@H](C)[NH2+]1	ZINC000246668675	280297683	/nfs/dbraw/zinc/29/76/83/280297683.db2.gz	FFVDZFSBPSKDOB-GUTXKFCHSA-N	1	0	275.396	1.498	50	0		CDAARO
C[C@@H]1COCCN1CCN(C)CC[C@H]1CCCC[N@@H+]1C	ZINC000242197044	288342007	/nfs/dbraw/zinc/34/20/07/288342007.db2.gz	XHHTUCHDLQGMMP-HZPDHXFCSA-N	1	0	283.460	1.513	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)/C=C\c2cncc(F)c2)C1	ZINC000255328216	289366251	/nfs/dbraw/zinc/36/62/51/289366251.db2.gz	DLTKTBQPEBUIHO-ZZKXABKFSA-N	1	0	263.316	1.302	50	0		CDAARO
C[C@H]([NH2+]CCn1cccn1)C(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000106787691	289962470	/nfs/dbraw/zinc/96/24/70/289962470.db2.gz	HENGVQGUGQAPNI-MJBXVCDLSA-N	1	0	278.400	1.366	50	0		CDAARO
C[C@H]([NH2+]CCN1CCC(O)CC1)c1cn2ccccc2n1	ZINC000568411008	294033099	/nfs/dbraw/zinc/03/30/99/294033099.db2.gz	DXYANAFFVRJWAG-ZDUSSCGKSA-N	1	0	288.395	1.442	50	0		CDAARO
NC(=O)C1([NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1	ZINC000191488179	295034457	/nfs/dbraw/zinc/03/44/57/295034457.db2.gz	OUWFZWYPIFMUAG-HTQZYQBOSA-N	1	0	250.264	1.715	50	0		CDAARO
NC(=O)c1ccccc1-c1cccc2c1O[C@@H](C[NH3+])C2	ZINC000067712953	295276496	/nfs/dbraw/zinc/27/64/96/295276496.db2.gz	WEJQBZTUZREQEI-LLVKDONJSA-N	1	0	268.316	1.715	50	0		CDAARO
Cn1c(CN2CCCCC2)nnc1C1CC[NH+](C)CC1	ZINC000077341298	302895357	/nfs/dbraw/zinc/89/53/57/302895357.db2.gz	STZSCNDWSZLMME-UHFFFAOYSA-N	1	0	277.416	1.610	50	0		CDAARO
O=C(NC1(c2ccc(Cl)cc2)CC1)[C@@H]1C[NH2+]CCO1	ZINC000157805011	303717555	/nfs/dbraw/zinc/71/75/55/303717555.db2.gz	QDFOIXVRFLDLMD-LBPRGKRZSA-N	1	0	280.755	1.434	50	0		CDAARO
COc1ccc(CC[C@H](C)[NH2+]Cc2nc(N)n[nH]2)cc1	ZINC000534574429	328309600	/nfs/dbraw/zinc/30/96/00/328309600.db2.gz	LLZQDJLOMCIKSP-JTQLQIEISA-N	1	0	275.356	1.337	50	0		CDAARO
COCC1(C(=O)N2CCCC3(CC[NH2+]CC3)CC2)CC1	ZINC000534643441	328329366	/nfs/dbraw/zinc/32/93/66/328329366.db2.gz	NKTRTVGONMZVTP-UHFFFAOYSA-N	1	0	280.412	1.795	50	0		CDAARO
O=C(c1cc(C2CC[NH2+]CC2)ccn1)N1CCSCC1	ZINC000534665511	328345115	/nfs/dbraw/zinc/34/51/15/328345115.db2.gz	KWTKFFMXGOTQOL-UHFFFAOYSA-N	1	0	291.420	1.738	50	0		CDAARO
CC[N@H+](C)C1(CNc2cc(OC)nc(N)n2)CCCC1	ZINC000534664013	328351469	/nfs/dbraw/zinc/35/14/69/328351469.db2.gz	XRDVKDUZGABVNU-UHFFFAOYSA-N	1	0	279.388	1.574	50	0		CDAARO
COC[C@@H](CO)NC(=O)CC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000534676111	328356286	/nfs/dbraw/zinc/35/62/86/328356286.db2.gz	SBHSXGFIZINYFB-GFCCVEGCSA-N	1	0	286.416	1.057	50	0		CDAARO
Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2[NH2+]CCO)cc1	ZINC000184890029	323377233	/nfs/dbraw/zinc/37/72/33/323377233.db2.gz	ZCOCACMOFVUOKA-HUUCEWRRSA-N	1	0	297.420	1.662	50	0		CDAARO
Cc1c(C[NH2+][C@@H](C)CC(=O)N2CCCCCC2)cnn1C	ZINC000090887669	482517252	/nfs/dbraw/zinc/51/72/52/482517252.db2.gz	UBANCXQIKUMZHM-ZDUSSCGKSA-N	1	0	292.427	1.999	50	0		CDAARO
CCn1cnnc1CC[NH2+]Cc1cccc(F)c1F	ZINC000085325866	482576132	/nfs/dbraw/zinc/57/61/32/482576132.db2.gz	UHKNHNZPNDYOII-UHFFFAOYSA-N	1	0	266.295	1.909	50	0		CDAARO
OC[C@@H]1CCC[N@H+](CCCNc2ncnc3[nH]ccc32)C1	ZINC000670461565	483045123	/nfs/dbraw/zinc/04/51/23/483045123.db2.gz	MUNKBOWPMYYTNF-GFCCVEGCSA-N	1	0	289.383	1.416	50	0		CDAARO
Cc1ncn(C)c1C(=O)N1CC[C@@H]([NH+]2CCCCC2)C1	ZINC000670461975	483050934	/nfs/dbraw/zinc/05/09/34/483050934.db2.gz	VZWSTMGGNCNDBF-CYBMUJFWSA-N	1	0	276.384	1.429	50	0		CDAARO
O=C(NC1(C[NH+]2CCCC2)CCCCC1)[C@H]1CCOC1	ZINC000670465056	483055352	/nfs/dbraw/zinc/05/53/52/483055352.db2.gz	SIZPMUAMHHOJGJ-AWEZNQCLSA-N	1	0	280.412	1.938	50	0		CDAARO
Cc1ncccc1C[N@@H+]1C[C@H](O)[C@@H](OC(C)C)C1	ZINC000670465586	483056057	/nfs/dbraw/zinc/05/60/57/483056057.db2.gz	RNOCISGLOQNQEN-KBPBESRZSA-N	1	0	250.342	1.360	50	0		CDAARO
OC1(c2ccccn2)CCN([C@@H]2C[NH+]3CCC2CC3)CC1	ZINC000670468985	483061132	/nfs/dbraw/zinc/06/11/32/483061132.db2.gz	XMPXUFCMKOHELR-OAHLLOKOSA-N	1	0	287.407	1.459	50	0		CDAARO
Cc1[nH]nc(C2CC2)c1C(=O)NC[C@@]1(C)CC[N@@H+](C)C1	ZINC000670472563	483081125	/nfs/dbraw/zinc/08/11/25/483081125.db2.gz	NMYGQOPQBQAQSY-OAHLLOKOSA-N	1	0	276.384	1.667	50	0		CDAARO
CCCC[C@H](C(N)=O)[N@@H+]1CC[C@H](Oc2ccccn2)C1	ZINC000084742897	483322286	/nfs/dbraw/zinc/32/22/86/483322286.db2.gz	HWAUFOAKFAUXJD-QWHCGFSZSA-N	1	0	277.368	1.579	50	0		CDAARO
O=C([C@H](O)c1ccc(F)cc1)N1CC([NH+]2CCCCC2)C1	ZINC000223063553	534622760	/nfs/dbraw/zinc/62/27/60/534622760.db2.gz	HPIVWLPUEVHKRR-OAHLLOKOSA-N	1	0	292.354	1.556	50	0		CDAARO
Cn1c(CC[NH3+])nnc1SCCOCc1ccccc1	ZINC000426359445	534683439	/nfs/dbraw/zinc/68/34/39/534683439.db2.gz	DYKVPMHHKNLVGX-UHFFFAOYSA-N	1	0	292.408	1.625	50	0		CDAARO
COC[C@@H]([NH3+])C(=O)NCc1nc2ccccc2n1C(C)C	ZINC000262248855	536664466	/nfs/dbraw/zinc/66/44/66/536664466.db2.gz	ILIFNYNOVLPANC-LLVKDONJSA-N	1	0	290.367	1.207	50	0		CDAARO
Cc1ccc(C)c(OCCOCC[N@H+](C)CCO)c1C	ZINC000002974990	538148974	/nfs/dbraw/zinc/14/89/74/538148974.db2.gz	KKGZUAOSVLQWOO-UHFFFAOYSA-N	1	0	281.396	1.931	50	0		CDAARO
Cc1nnc([C@@H]2CCC[N@H+](Cc3cnc(C)cn3)C2)[nH]1	ZINC000328650991	538244684	/nfs/dbraw/zinc/24/46/84/538244684.db2.gz	JMHQVUOCIYXYQW-GFCCVEGCSA-N	1	0	272.356	1.591	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C[C@H](O)COc1ccccc1	ZINC000097159272	567905037	/nfs/dbraw/zinc/90/50/37/567905037.db2.gz	QQFJHTKDCFPCJO-ZDUSSCGKSA-N	1	0	275.352	1.556	50	0		CDAARO
C[C@@H]1CC[C@H]([NH3+])[C@H]([C@@H]2CC[C@@H](C(F)(F)F)NC2)N1	ZINC000757216098	577036446	/nfs/dbraw/zinc/03/64/46/577036446.db2.gz	XPGJYWYAEPVISB-UVOCVTCTSA-N	1	0	265.323	1.385	50	0		CDAARO
CCCOC(=O)CC[NH2+][C@H](C)CCn1cccn1	ZINC000952964886	614925990	/nfs/dbraw/zinc/92/59/90/614925990.db2.gz	XWTHIPWYQHTRRM-GFCCVEGCSA-N	1	0	253.346	1.595	50	0		CDAARO
CCCOC(=O)CC[NH2+][C@@H](C)CCn1cccn1	ZINC000952964900	614926039	/nfs/dbraw/zinc/92/60/39/614926039.db2.gz	XWTHIPWYQHTRRM-LBPRGKRZSA-N	1	0	253.346	1.595	50	0		CDAARO
CN(C)c1c[nH+]ccc1NC([O-])=[NH+]c1cnn(CCF)c1	ZINC000888100279	617762872	/nfs/dbraw/zinc/76/28/72/617762872.db2.gz	GQADGNWVDZGEPY-UHFFFAOYSA-N	1	0	292.318	1.380	50	0		CDAARO
CC(C)[C@H](O)C[N@@H+]1CC[C@](CO)(c2cccc(F)c2)C1	ZINC000888101426	617766193	/nfs/dbraw/zinc/76/61/93/617766193.db2.gz	VJJSBVPODGPLCP-CVEARBPZSA-N	1	0	281.371	1.778	50	0		CDAARO
[NH3+]C1(C(=O)N2CCC[C@]3(CCC[C@H]3O)C2)CCCC1	ZINC001704332063	1177690465	/nfs/dbraw/zinc/69/04/65/1177690465.db2.gz	WJMLPPBIZXYVRE-TZMCWYRMSA-N	1	0	266.385	1.412	50	0		CDAARO
[NH3+]C1(C(=O)N[C@@H]2COC[C@H]2Cc2ccncc2)CCCC1	ZINC001704352361	1177699167	/nfs/dbraw/zinc/69/91/67/1177699167.db2.gz	DWHSGJGNMJQYGO-ZIAGYGMSSA-N	1	0	289.379	1.027	50	0		CDAARO
COc1cccc2c1OC[C@H]([NH2+][C@H]1CC[C@H](O)CC1)C2	ZINC000299872926	730421904	/nfs/dbraw/zinc/42/19/04/730421904.db2.gz	JOOGRKGECGZQSS-MGPQQGTHSA-N	1	0	277.364	1.892	50	0		CDAARO
C[NH+](C)CCc1noc(Cn2ncc3ccccc32)n1	ZINC000020536451	730742709	/nfs/dbraw/zinc/74/27/09/730742709.db2.gz	GZHYKXQADLBSHT-UHFFFAOYSA-N	1	0	271.324	1.572	50	0		CDAARO
Cc1ccc(C[N@H+]2CCc3nncn3CC2)c(C)c1	ZINC000020598606	731101397	/nfs/dbraw/zinc/10/13/97/731101397.db2.gz	MEQLAWQDXNHLTM-UHFFFAOYSA-N	1	0	256.353	1.953	50	0		CDAARO
CNC(=O)CC1CC[NH+](C2CSCCSC2)CC1	ZINC000065381889	731224517	/nfs/dbraw/zinc/22/45/17/731224517.db2.gz	AZKXZOVAKWEDFU-UHFFFAOYSA-N	1	0	288.482	1.683	50	0		CDAARO
C[C@H](O)c1ncc(CNc2cnn(CC[NH+](C)C)c2)s1	ZINC000809613939	731315406	/nfs/dbraw/zinc/31/54/06/731315406.db2.gz	DDNNMWZYPNFKLD-JTQLQIEISA-N	1	0	295.412	1.567	50	0		CDAARO
Cc1cc(N[C@@H](CO)c2ccccc2)nc(N(C)C)[nH+]1	ZINC000032573355	731872451	/nfs/dbraw/zinc/87/24/51/731872451.db2.gz	FAWOUYPNHDBCEX-ZDUSSCGKSA-N	1	0	272.352	1.997	50	0		CDAARO
Cc1nnc(CSc2nnc(C3CC[NH2+]CC3)n2C)[nH]1	ZINC000426443073	732069278	/nfs/dbraw/zinc/06/92/78/732069278.db2.gz	CLILBUZCWSCYJZ-UHFFFAOYSA-N	1	0	293.400	1.001	50	0		CDAARO
Cc1nn(C)c(C)c1/C=C/C(=O)N1CC[N@@H+](C)C[C@@H]1C	ZINC000089505600	732121238	/nfs/dbraw/zinc/12/12/38/732121238.db2.gz	OULHUDVALSPHSW-MLRMMBSGSA-N	1	0	276.384	1.213	50	0		CDAARO
CC[C@H](Nc1nc(N)nc2c1CC[NH2+]CC2)c1ccncc1	ZINC000072426363	732169179	/nfs/dbraw/zinc/16/91/79/732169179.db2.gz	KCFCWKZTCFTETF-ZDUSSCGKSA-N	1	0	298.394	1.705	50	0		CDAARO
CCCO[C@H]1CCC[N@@H+](C2CCN(C(C)=O)CC2)C1	ZINC000032540637	732177664	/nfs/dbraw/zinc/17/76/64/732177664.db2.gz	GJHPDGHSLDFOFQ-HNNXBMFYSA-N	1	0	268.401	1.888	50	0		CDAARO
C[NH2+]C1(C(=O)NC[C@H](O)c2ccc(F)cc2)CCC1	ZINC000864092664	732279772	/nfs/dbraw/zinc/27/97/72/732279772.db2.gz	SEPMHTHSCATZBM-LBPRGKRZSA-N	1	0	266.316	1.117	50	0		CDAARO
Cc1cc(N(C)CCc2cn[nH]c2)nc(N(C)C)[nH+]1	ZINC000032541166	732308828	/nfs/dbraw/zinc/30/88/28/732308828.db2.gz	MVIWJDHNTJMMCB-UHFFFAOYSA-N	1	0	260.345	1.253	50	0		CDAARO
CN(CC[NH+](C)C)C(=O)NCCCc1cccnc1	ZINC000426360080	732942267	/nfs/dbraw/zinc/94/22/67/732942267.db2.gz	FWLQYVNXRYQHMA-UHFFFAOYSA-N	1	0	264.373	1.217	50	0		CDAARO
[NH3+][C@H](c1nccs1)C1(O)CCC2(CC1)OCCO2	ZINC000958527607	732992778	/nfs/dbraw/zinc/99/27/78/732992778.db2.gz	BBJPGQXSTSKLKA-SECBINFHSA-N	1	0	270.354	1.191	50	0		CDAARO
O=C1CC[C@]2(CC[N@H+](Cc3ccc4c(c3)OCCO4)C2)N1	ZINC000675018043	899870775	/nfs/dbraw/zinc/87/07/75/899870775.db2.gz	SGVIAYYUQACEEV-MRXNPFEDSA-N	1	0	288.347	1.312	50	0		CDAARO
CCC[NH2+]C[C@]1(O)CCCN(Cc2cccc(C)c2)C1=O	ZINC000011953980	921298905	/nfs/dbraw/zinc/29/89/05/921298905.db2.gz	PJPLZUMXNKIDAF-QGZVFWFLSA-N	1	0	290.407	1.848	50	0		CDAARO
C[N@@H+]1C[C@H](C(=O)Nc2c[nH]ccc2=O)[C@H](C(F)(F)F)C1	ZINC000952880128	910441818	/nfs/dbraw/zinc/44/18/18/910441818.db2.gz	BRSNONYTFKMKPW-JGVFFNPUSA-N	1	0	289.257	1.054	50	0		CDAARO
C[N@@H+]1C[C@@H](C(=O)Nc2c[nH]ccc2=O)[C@H](C(F)(F)F)C1	ZINC000952880121	910441913	/nfs/dbraw/zinc/44/19/13/910441913.db2.gz	BRSNONYTFKMKPW-HTQZYQBOSA-N	1	0	289.257	1.054	50	0		CDAARO
OC[C@H]1CCCCN1CC[NH2+]Cc1ccc(F)cc1F	ZINC000952964837	910481787	/nfs/dbraw/zinc/48/17/87/910481787.db2.gz	QPPGXEXWHAFUJV-CQSZACIVSA-N	1	0	284.350	1.901	50	0		CDAARO
C[C@@H](CNS(=O)(=O)C1CC1)[NH2+]C1(C2CCCC2)CC1	ZINC000821826842	925599178	/nfs/dbraw/zinc/59/91/78/925599178.db2.gz	RMYCJILKUBLAFS-NSHDSACASA-N	1	0	286.441	1.769	50	0		CDAARO
CC[C@H](C(=O)N(C)Cc1cc(C)no1)[N@H+](C)CC	ZINC000822541616	925633372	/nfs/dbraw/zinc/63/33/72/925633372.db2.gz	LTLORLRSJXGAOK-GFCCVEGCSA-N	1	0	253.346	1.672	50	0		CDAARO
CCCc1nc(N[C@H]2COC[C@@H]2[NH+]2CCCC2)no1	ZINC000823023313	925666759	/nfs/dbraw/zinc/66/67/59/925666759.db2.gz	DXCMOGLYPOHHDP-QWRGUYRKSA-N	1	0	266.345	1.297	50	0		CDAARO
COCC1(CNC(=O)[C@@]2(C)CC[N@H+](C)C2)CCC1	ZINC000824346702	925817406	/nfs/dbraw/zinc/81/74/06/925817406.db2.gz	BWQXQUOOWZMYJP-ZDUSSCGKSA-N	1	0	254.374	1.261	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)NCC1(O)CCCCC1	ZINC000827832297	925972791	/nfs/dbraw/zinc/97/27/91/925972791.db2.gz	VRHDGHQMCLJUGJ-UHFFFAOYSA-N	1	0	268.401	1.674	50	0		CDAARO
Cn1cc(CC[NH2+]Cc2ccc(Cl)s2)nn1	ZINC000585089172	930912841	/nfs/dbraw/zinc/91/28/41/930912841.db2.gz	YGAQEQHZAHJVFZ-UHFFFAOYSA-N	1	0	256.762	1.862	50	0		CDAARO
O=c1c2ccsc2ncn1CC[N@H+]1CCCC[C@@H]1CO	ZINC000043144635	932221412	/nfs/dbraw/zinc/22/14/12/932221412.db2.gz	FDXZFQVQXGKFHF-LLVKDONJSA-N	1	0	293.392	1.305	50	0		CDAARO
Cc1cccc(C[N@H+]2C[C@@H](Cc3cnccn3)[C@H](O)C2)c1	ZINC001529101066	968981727	/nfs/dbraw/zinc/98/17/27/968981727.db2.gz	ABFBFMYYEWKNIQ-NVXWUHKLSA-N	1	0	283.375	1.820	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3ccccn3)C[C@H]2O)[nH]n1	ZINC001529172419	969001737	/nfs/dbraw/zinc/00/17/37/969001737.db2.gz	HFUOUKCMISVJGK-IUODEOHRSA-N	1	0	272.352	1.149	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](C(=O)Nc2cnn(C(C)C)c2)C1	ZINC001529172860	969003070	/nfs/dbraw/zinc/00/30/70/969003070.db2.gz	QQKJJIKYSMVELP-CYBMUJFWSA-N	1	0	294.399	1.761	50	0		CDAARO
C[C@H](C[N@H+](C)CCCn1cccc1)N1CCOCC1	ZINC001529196097	969011477	/nfs/dbraw/zinc/01/14/77/969011477.db2.gz	UXKWLVBFWXDXGN-OAHLLOKOSA-N	1	0	265.401	1.531	50	0		CDAARO
C[C@H](NCC(C)(C)C[NH+]1CCCC1)c1nncn1C	ZINC001506400437	975149275	/nfs/dbraw/zinc/14/92/75/975149275.db2.gz	JOJHMIIDTSAGHL-LBPRGKRZSA-N	1	0	265.405	1.588	50	0		CDAARO
Cc1nc[nH]c1C[N@@H+](C[C@@H]1CCC(=O)N1)C(C)C	ZINC001506406000	975151610	/nfs/dbraw/zinc/15/16/10/975151610.db2.gz	PEUKVEPCKJCFSD-NSHDSACASA-N	1	0	250.346	1.207	50	0		CDAARO
CC1=C(C(=O)N(C)CC[NH+]2CCCCCC2)OCCO1	ZINC001506405830	975151962	/nfs/dbraw/zinc/15/19/62/975151962.db2.gz	XBTSUXROCVWWGI-UHFFFAOYSA-N	1	0	282.384	1.599	50	0		CDAARO
C[NH+](C)C[C@H]1CCN(c2cc(NC3CC3)nc(N)n2)C1	ZINC001506419139	975156770	/nfs/dbraw/zinc/15/67/70/975156770.db2.gz	YFRISXXBPHRVMX-SNVBAGLBSA-N	1	0	276.388	1.021	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1CCNc1ncccc1Cl	ZINC001506427121	975160468	/nfs/dbraw/zinc/16/04/68/975160468.db2.gz	XANOXQWPAKCNGI-LLVKDONJSA-N	1	0	269.776	1.994	50	0		CDAARO
Cc1nc(N2C[C@H](O)[C@@H]([NH+]3CCCC3)C2)ccc1Cl	ZINC001506426650	975160745	/nfs/dbraw/zinc/16/07/45/975160745.db2.gz	UBTUVVWDPHWMIC-STQMWFEESA-N	1	0	281.787	1.689	50	0		CDAARO
Cc1nc(N)nc(N2CCC3(C2)CC[NH+](C)CC3)c1Cl	ZINC001506431460	975161779	/nfs/dbraw/zinc/16/17/79/975161779.db2.gz	LCDZPFHJZBGYLL-UHFFFAOYSA-N	1	0	295.818	1.943	50	0		CDAARO
CCn1cnc2c1ncnc2N1CCC[N@H+](CC)C[C@H]1C	ZINC000408523514	230405592	/nfs/dbraw/zinc/40/55/92/230405592.db2.gz	KSBQYSMPGKNDKJ-GFCCVEGCSA-N	1	0	288.399	1.767	50	0		CDAARO
CCS(=O)(=O)NC[C@H](C)[NH2+]C1(c2ccccc2C)CC1	ZINC000584902141	341986796	/nfs/dbraw/zinc/98/67/96/341986796.db2.gz	SLVJGHIBPFUECX-ZDUSSCGKSA-N	1	0	296.436	1.902	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN(C(=O)c2cc(Cl)c[nH]2)C1	ZINC000426711116	230427498	/nfs/dbraw/zinc/42/74/98/230427498.db2.gz	BDVCZBUNGPHRSV-SNVBAGLBSA-N	1	0	285.775	1.318	50	0		CDAARO
Cc1nc(C)c(C[C@@H](O)C[NH2+]C(C)(C)C)nc1C	ZINC000095918123	185030956	/nfs/dbraw/zinc/03/09/56/185030956.db2.gz	JGVUWDNANGTVQW-GFCCVEGCSA-N	1	0	251.374	1.693	50	0		CDAARO
OCCOCC[N@@H+]1CCC[C@H]1CN1CCc2ccccc21	ZINC000095960787	185043708	/nfs/dbraw/zinc/04/37/08/185043708.db2.gz	GEMMUGMNTXQWAZ-INIZCTEOSA-N	1	0	290.407	1.522	50	0		CDAARO
COCCN1CCC[C@@H]1C[NH2+][C@@H](C)c1cncc(F)c1	ZINC000095967646	185046600	/nfs/dbraw/zinc/04/66/00/185046600.db2.gz	UREMEBPFEBQKGD-SWLSCSKDSA-N	1	0	281.375	1.982	50	0		CDAARO
CC(C)([NH3+])CNS(=O)(=O)Cc1cccc2cccnc21	ZINC000095972651	185049194	/nfs/dbraw/zinc/04/91/94/185049194.db2.gz	MWUJISLOGCBBBP-UHFFFAOYSA-N	1	0	293.392	1.392	50	0		CDAARO
O=C(C[NH2+][C@@H]1CCSC1)NCCc1ccccc1	ZINC000095991225	185058331	/nfs/dbraw/zinc/05/83/31/185058331.db2.gz	XWRRDMSMPNJXSQ-CYBMUJFWSA-N	1	0	264.394	1.440	50	0		CDAARO
O=C(NC1CC1)[C@@H](Cc1ccccc1)[NH2+]C1CCOCC1	ZINC000095991231	185058812	/nfs/dbraw/zinc/05/88/12/185058812.db2.gz	RORJVCFNTRXNFW-MRXNPFEDSA-N	1	0	288.391	1.645	50	0		CDAARO
CC[C@H](CO)[NH2+]Cc1cn(-c2ccc(F)c(Cl)c2)nn1	ZINC000096008567	185064022	/nfs/dbraw/zinc/06/40/22/185064022.db2.gz	NVFYXRBCUJIDTQ-SECBINFHSA-N	1	0	298.749	1.920	50	0		CDAARO
C[NH+](C)Cc1cccc(CNC(=O)c2cncnc2)c1	ZINC000273829702	192324434	/nfs/dbraw/zinc/32/44/34/192324434.db2.gz	PQPIQMYAHBAUBC-UHFFFAOYSA-N	1	0	270.336	1.468	50	0		CDAARO
C[C@H](CNC(=O)NCCC1(O)CCC1)[NH+]1CCC(C)CC1	ZINC000241926470	361754213	/nfs/dbraw/zinc/75/42/13/361754213.db2.gz	UGKXNQOPZKTUHB-CQSZACIVSA-N	1	0	297.443	1.711	50	0		CDAARO
CO[C@@H]1CCN(C(=O)CC[C@@H]2CC[C@@H](C)O2)[C@H](C[NH3+])C1	ZINC000242292507	361756116	/nfs/dbraw/zinc/75/61/16/361756116.db2.gz	YMWFGDNPQADZJC-ZOBORPQBSA-N	1	0	284.400	1.299	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1cccc(-n2ccnc2)c1	ZINC000125010833	187165429	/nfs/dbraw/zinc/16/54/29/187165429.db2.gz	RBXUDEZZDNLDDJ-GFCCVEGCSA-N	1	0	270.336	1.306	50	0		CDAARO
CC(C)(C[NH+]1CCCCC1)NC(=O)c1csc(N)n1	ZINC000308664063	342089697	/nfs/dbraw/zinc/08/96/97/342089697.db2.gz	CUEQUQWJYGQFOL-UHFFFAOYSA-N	1	0	282.413	1.720	50	0		CDAARO
CC1(C)C[C@H](O)CCN(C(=O)CC2CC[NH2+]CC2)C1	ZINC000395358083	342089950	/nfs/dbraw/zinc/08/99/50/342089950.db2.gz	VSPFHSRIZKWPDY-CYBMUJFWSA-N	1	0	268.401	1.386	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@H](O)C2)c(OC)c1C	ZINC000004977595	342089017	/nfs/dbraw/zinc/08/90/17/342089017.db2.gz	WGPVDNSATDVAPK-ZDUSSCGKSA-N	1	0	265.353	1.969	50	0		CDAARO
CNC(=O)Cn1cc(-c2cccc([C@@H](C)[NH+](C)C)c2)cn1	ZINC000096140973	185106378	/nfs/dbraw/zinc/10/63/78/185106378.db2.gz	DAFZWIPJODIEIF-GFCCVEGCSA-N	1	0	286.379	1.919	50	0		CDAARO
COC(=O)c1nccnc1N1CC[C@H](C[NH+]2CCCC2)C1	ZINC000591915305	342656904	/nfs/dbraw/zinc/65/69/04/342656904.db2.gz	LUHLIWFZMRGYQL-GFCCVEGCSA-N	1	0	290.367	1.185	50	0		CDAARO
CCc1ccc(C[N@H+](C)CCC(=O)NC2CC2)nc1	ZINC000244633139	361855762	/nfs/dbraw/zinc/85/57/62/361855762.db2.gz	FXJJPECVKDOAOZ-UHFFFAOYSA-N	1	0	261.369	1.745	50	0		CDAARO
COc1cccc(OCC[N@H+](C)CCn2cc[nH]c2=O)c1	ZINC000244894024	361869327	/nfs/dbraw/zinc/86/93/27/361869327.db2.gz	YYRMXALVWYKHDU-UHFFFAOYSA-N	1	0	291.351	1.196	50	0		CDAARO
CS[C@H](C)CNC(=O)C[C@@H](C)C1CC[NH2+]CC1	ZINC000125432181	187184446	/nfs/dbraw/zinc/18/44/46/187184446.db2.gz	ZPGCZKZWHYQHIT-GHMZBOCLSA-N	1	0	258.431	1.880	50	0		CDAARO
[NH3+]CCN1CCC[C@@H](c2cc(C(F)(F)F)n[nH]2)C1	ZINC000263011066	361904307	/nfs/dbraw/zinc/90/43/07/361904307.db2.gz	PTKUGAPBOQLJGB-MRVPVSSYSA-N	1	0	262.279	1.567	50	0		CDAARO
NC(=O)[C@@H]1CCC[N@H+](Cc2cccc3cc[nH]c32)C1	ZINC000097020238	185152896	/nfs/dbraw/zinc/15/28/96/185152896.db2.gz	ZDPIMJYFRXWCKT-CYBMUJFWSA-N	1	0	257.337	1.865	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@@H](C)c1ccc(F)cc1F	ZINC000097032981	185155875	/nfs/dbraw/zinc/15/58/75/185155875.db2.gz	KXPRBJXQTPHGMA-VIFPVBQESA-N	1	0	292.351	1.555	50	0		CDAARO
Cc1nc(Cl)cc(N2CC[NH+](CCCCCO)CC2)n1	ZINC000585136378	342215983	/nfs/dbraw/zinc/21/59/83/342215983.db2.gz	CXCOPJUQBQQIPM-UHFFFAOYSA-N	1	0	298.818	1.723	50	0		CDAARO
CC(C)c1nc(C2(NC(=O)[C@@H](C)C[NH3+])CCCC2)no1	ZINC000585136422	342216014	/nfs/dbraw/zinc/21/60/14/342216014.db2.gz	FMQPPIUQJDHEDA-JTQLQIEISA-N	1	0	280.372	1.673	50	0		CDAARO
Cc1cccc(NC(=O)NC[C@H](C)C[NH+](C)C)n1	ZINC000585140006	342218893	/nfs/dbraw/zinc/21/88/93/342218893.db2.gz	UZJCWENAMACNJU-JTQLQIEISA-N	1	0	250.346	1.709	50	0		CDAARO
C[NH+](C)CCn1cc(NC(=O)CCc2ccncc2)cn1	ZINC000061635093	342236654	/nfs/dbraw/zinc/23/66/54/342236654.db2.gz	HXWNRCYGDNIKQX-UHFFFAOYSA-N	1	0	287.367	1.411	50	0		CDAARO
CCCS(=O)(=O)N1C[C@@H]2C[N@@H+]3CCCC[C@@H]3[C@@H]2C1	ZINC000098013115	539095086	/nfs/dbraw/zinc/09/50/86/539095086.db2.gz	RFNYQIDRRWCEMC-YNEHKIRRSA-N	1	0	272.414	1.142	50	0		CDAARO
O=C(C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1)N1CCNC1=O	ZINC000015516920	539113884	/nfs/dbraw/zinc/11/38/84/539113884.db2.gz	BYPICHFBSHCXNV-VXGBXAGGSA-N	1	0	265.357	1.050	50	0		CDAARO
C[C@@H]([NH2+][C@@H](C)c1nnnn1-c1ccccc1)[C@H]1CCCO1	ZINC000248505615	342270822	/nfs/dbraw/zinc/27/08/22/342270822.db2.gz	WFTZHWHSWLCKDZ-MBNYWOFBSA-N	1	0	287.367	1.880	50	0		CDAARO
C[C@H]1CN(C(=O)CN2CCc3ccccc3C2)CCO1	ZINC000032863644	539135498	/nfs/dbraw/zinc/13/54/98/539135498.db2.gz	NDCHFHMBNZBACI-ZDUSSCGKSA-N	1	0	274.364	1.292	50	0		CDAARO
CCCCNC(=O)[C@@H](C)N1CCC([NH+]2CCOCC2)CC1	ZINC000585116303	362043376	/nfs/dbraw/zinc/04/33/76/362043376.db2.gz	PFNXRRKUJXPUSS-CQSZACIVSA-N	1	0	297.443	1.088	50	0		CDAARO
O=C(NCCn1cccc1)N1CC[C@H]([NH+]2CCCCC2)C1	ZINC000084457994	343629027	/nfs/dbraw/zinc/62/90/27/343629027.db2.gz	WKCWNUHEWFYCTG-HNNXBMFYSA-N	1	0	290.411	1.758	50	0		CDAARO
CN(C)S(=O)(=O)CCC[NH+]1CCc2ccccc2CC1	ZINC000083851253	362255218	/nfs/dbraw/zinc/25/52/18/362255218.db2.gz	KBECAUXOCWDOKV-UHFFFAOYSA-N	1	0	296.436	1.369	50	0		CDAARO
CC1=CCC[C@H](C)[C@@H]1C[N@H+](C)C[C@@H](O)CN1CCOCC1	ZINC000249116944	362280663	/nfs/dbraw/zinc/28/06/63/362280663.db2.gz	SLFDQKPTHQTVGG-GVDBMIGSSA-N	1	0	296.455	1.604	50	0		CDAARO
COc1ccc(C(=O)NCC[NH2+][C@@H]2CCCSC2)cc1	ZINC000097084592	185526560	/nfs/dbraw/zinc/52/65/60/185526560.db2.gz	SDHRYAUGGTXLFL-CYBMUJFWSA-N	1	0	294.420	1.910	50	0		CDAARO
O[C@@H](C[NH+]1CCN(Cc2cc(F)cc(F)c2)CC1)C1CC1	ZINC000085436875	179063044	/nfs/dbraw/zinc/06/30/44/179063044.db2.gz	FXJXOKFQRFQLJA-INIZCTEOSA-N	1	0	296.361	1.853	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N(C)[C@@H](C)C[NH3+]	ZINC000193280263	362887596	/nfs/dbraw/zinc/88/75/96/362887596.db2.gz	IWSTZMKVZDANLI-JTQLQIEISA-N	1	0	256.371	1.217	50	0		CDAARO
O=C(C1CCC1)N1CCC[N@@H+]([C@@H]2CCSC2)CC1	ZINC000584885305	349343246	/nfs/dbraw/zinc/34/32/46/349343246.db2.gz	IDBNLVVYBJFEBY-CYBMUJFWSA-N	1	0	268.426	1.826	50	0		CDAARO
CO[C@@H](C)C(=O)N1CCC[N@@H+](C2CCCCC2)CC1	ZINC000584887571	349345913	/nfs/dbraw/zinc/34/59/13/349345913.db2.gz	SERNEQXSTYCCHN-ZDUSSCGKSA-N	1	0	268.401	1.888	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@H]2CO[C@H](C[NH3+])[C@H]2C1	ZINC000091304010	180130946	/nfs/dbraw/zinc/13/09/46/180130946.db2.gz	HLBMPIBPEUZPJQ-GARJFASQSA-N	1	0	256.346	1.217	50	0		CDAARO
Cc1cc(NCCc2noc(C(C)C)n2)nc(N)[nH+]1	ZINC000091526365	180179024	/nfs/dbraw/zinc/17/90/24/180179024.db2.gz	UVEVCOMNNQZEKU-UHFFFAOYSA-N	1	0	262.317	1.528	50	0		CDAARO
CC(C)[C@H]1CN(C(=O)c2scc3c2OCCO3)C[C@@H]1[NH3+]	ZINC000091616759	180208935	/nfs/dbraw/zinc/20/89/35/180208935.db2.gz	RXMIYIQHYLSRIH-ZJUUUORDSA-N	1	0	296.392	1.575	50	0		CDAARO
CC(=O)N1CC[N@H+](CCSc2ccccc2)C[C@H](O)C1	ZINC000091665366	180221177	/nfs/dbraw/zinc/22/11/77/180221177.db2.gz	HSSNEPLIBQAZGY-AWEZNQCLSA-N	1	0	294.420	1.304	50	0		CDAARO
CCOc1cc(C[NH2+]C[C@H]2CN(C)CCO2)ccc1OC	ZINC000105472498	186059018	/nfs/dbraw/zinc/05/90/18/186059018.db2.gz	XKMYGHPFQFFLRX-AWEZNQCLSA-N	1	0	294.395	1.514	50	0		CDAARO
CC(C)N1CCCC[C@H]1C[NH2+][C@H](C)CS(C)(=O)=O	ZINC000110706547	350284389	/nfs/dbraw/zinc/28/43/89/350284389.db2.gz	DBEFSNPSGLKEPA-OLZOCXBDSA-N	1	0	276.446	1.272	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2ccnc(NC)c2)C[C@@H]1[NH3+]	ZINC000091808123	180260878	/nfs/dbraw/zinc/26/08/78/180260878.db2.gz	YTQDNNNZHOYVNR-RYUDHWBXSA-N	1	0	262.357	1.323	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)[C@H](C)OCC(F)(F)F	ZINC000106068084	186100172	/nfs/dbraw/zinc/10/01/72/186100172.db2.gz	BKVUZJAFJHLQCK-VHSXEESVSA-N	1	0	282.306	1.554	50	0		CDAARO
CC(=O)Nc1ccc(OC[C@H](O)C[NH2+]C(C)C)cc1	ZINC000000000652	355879912	/nfs/dbraw/zinc/87/99/12/355879912.db2.gz	DURULFYMVIFBIR-CYBMUJFWSA-N	1	0	266.341	1.383	50	0	world	CDAARO
OCC[NH+](CCO)C1CCC(c2ccccc2)CC1	ZINC000000221002	355897608	/nfs/dbraw/zinc/89/76/08/355897608.db2.gz	OQNRWILIOOJETL-UHFFFAOYSA-N	1	0	263.381	1.999	50	0		CDAARO
Cc1ccccc1NC(=O)C(=O)NCCC[NH+](C)C	ZINC000002853222	355984684	/nfs/dbraw/zinc/98/46/84/355984684.db2.gz	PYWDLUPBRZBQOQ-UHFFFAOYSA-N	1	0	263.341	1.001	50	0		CDAARO
Cc1ccc(C[NH2+]CCSc2nnnn2C)s1	ZINC000002181783	355962078	/nfs/dbraw/zinc/96/20/78/355962078.db2.gz	HAEDRSSMQQQNRP-UHFFFAOYSA-N	1	0	269.399	1.462	50	0		CDAARO
CCOc1ccc(N2C(=O)C[C@H](SCC[NH3+])C2=O)cc1	ZINC000002233383	355964596	/nfs/dbraw/zinc/96/45/96/355964596.db2.gz	JYVSRDOMPMYDMZ-LBPRGKRZSA-N	1	0	294.376	1.409	50	0		CDAARO
C[NH+]1CCC(OC(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000004476141	356031573	/nfs/dbraw/zinc/03/15/73/356031573.db2.gz	WXQZMGSIPQGQPH-UHFFFAOYSA-N	1	0	277.320	1.709	50	0		CDAARO
[NH3+]CCS[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1=O	ZINC000004476085	356032145	/nfs/dbraw/zinc/03/21/45/356032145.db2.gz	UFQLMUNSFFZSNH-SNVBAGLBSA-N	1	0	284.768	1.664	50	0		CDAARO
O=S(=O)(CC[C@@H]1CCCC[NH2+]1)c1ccccc1	ZINC000003882656	356011711	/nfs/dbraw/zinc/01/17/11/356011711.db2.gz	ACPAJXSEQAMCLG-LBPRGKRZSA-N	1	0	253.367	1.993	50	0		CDAARO
OC[C@H](Cc1ccccc1)[NH2+]C[C@H](O)C(F)(F)F	ZINC000004092328	356018127	/nfs/dbraw/zinc/01/81/27/356018127.db2.gz	SJSOKMKUAWKDDB-QWRGUYRKSA-N	1	0	263.259	1.103	50	0		CDAARO
C[C@H](O)C1CCN(C(=O)[C@@H]2[NH2+]CCc3ccccc32)CC1	ZINC000195543391	363458829	/nfs/dbraw/zinc/45/88/29/363458829.db2.gz	LNVOSNSYMLUQSS-BLLLJJGKSA-N	1	0	288.391	1.493	50	0		CDAARO
COc1cccc2c1OC[C@@H]([NH2+]CCn1cccn1)C2	ZINC000012301373	356292897	/nfs/dbraw/zinc/29/28/97/356292897.db2.gz	WJWBCLNDCKDYQJ-ZDUSSCGKSA-N	1	0	273.336	1.485	50	0		CDAARO
O[C@H](COCc1ccc2c(c1)OCO2)C[NH+]1CCCC1	ZINC000014238198	356381305	/nfs/dbraw/zinc/38/13/05/356381305.db2.gz	SETSJNISPQKTMF-ZDUSSCGKSA-N	1	0	279.336	1.389	50	0		CDAARO
CCN1C(=O)N(C)C(=O)C12CC[NH+](CC(C)C)CC2	ZINC000014537093	356390321	/nfs/dbraw/zinc/39/03/21/356390321.db2.gz	WQCWIAHUCRKRQN-UHFFFAOYSA-N	1	0	267.373	1.391	50	0		CDAARO
COc1ccc(-c2noc(CN(C)[C@H]3CCOC3)n2)cc1	ZINC000015063865	356404924	/nfs/dbraw/zinc/40/49/24/356404924.db2.gz	APELBHHSYZIPIT-LBPRGKRZSA-N	1	0	289.335	1.966	50	0		CDAARO
Cc1ccccc1C[NH+]1CCN(CCOCCO)CC1	ZINC000019369565	356482458	/nfs/dbraw/zinc/48/24/58/356482458.db2.gz	WAWOVPOJCXGIPA-UHFFFAOYSA-N	1	0	278.396	1.122	50	0		CDAARO
Cc1ccc(C(=O)N2CC[C@H]([NH+]3CC=CC3)C2)c(O)c1	ZINC000104220044	538452885	/nfs/dbraw/zinc/45/28/85/538452885.db2.gz	JVDORYSSHYOBNS-ZDUSSCGKSA-N	1	0	272.348	1.787	50	0		CDAARO
COc1cccc(NC(=O)CN2CC[N@@H+]3CCC[C@@H]3C2)c1	ZINC000023095837	356627641	/nfs/dbraw/zinc/62/76/41/356627641.db2.gz	BCYPZJVAKVYPNN-CQSZACIVSA-N	1	0	289.379	1.414	50	0		CDAARO
CSCCC(=O)N[C@@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000023338551	356640966	/nfs/dbraw/zinc/64/09/66/356640966.db2.gz	XPXSHTPTLDJHCE-CYBMUJFWSA-N	1	0	299.484	1.414	50	0		CDAARO
Cc1ccc(Cl)cc1N1CC[NH+](C[C@@H](O)CO)CC1	ZINC000025436910	356675477	/nfs/dbraw/zinc/67/54/77/356675477.db2.gz	GXFBASRMMOWXEG-CYBMUJFWSA-N	1	0	284.787	1.124	50	0		CDAARO
C[C@@H]([N@H+](C)CC(=O)NC(=O)NC(C)(C)C)C(C)(C)C	ZINC000027133387	356703993	/nfs/dbraw/zinc/70/39/93/356703993.db2.gz	FQWXZEGDVRQMLU-SNVBAGLBSA-N	1	0	271.405	1.977	50	0		CDAARO
NC(=O)[C@H]([NH2+]CCOc1ccccc1)c1ccccc1	ZINC000028375363	356720164	/nfs/dbraw/zinc/72/01/64/356720164.db2.gz	JGTSFNUKUBJPCO-OAHLLOKOSA-N	1	0	270.332	1.882	50	0		CDAARO
CCOc1cc(CN2CC[NH+](CC)CC2)ccc1O	ZINC000019536114	356736710	/nfs/dbraw/zinc/73/67/10/356736710.db2.gz	HLPQNZPNVABEOT-UHFFFAOYSA-N	1	0	264.369	1.928	50	0		CDAARO
CC[C@H](C)c1ccc(S(=O)(=O)N2CCNCC2)cc1	ZINC000034781409	356820108	/nfs/dbraw/zinc/82/01/08/356820108.db2.gz	GWJIWGHMZOHUCS-LBPRGKRZSA-N	1	0	282.409	1.794	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN(C(=O)[C@H]2CCC[NH2+]C2)CC1	ZINC000036379802	356873281	/nfs/dbraw/zinc/87/32/81/356873281.db2.gz	CGBRVCPIVDANCZ-LBPRGKRZSA-N	1	0	297.399	1.065	50	0		CDAARO
COc1cc(COC2CC[NH2+]CC2)cc(OC)c1	ZINC000042783001	357080343	/nfs/dbraw/zinc/08/03/43/357080343.db2.gz	POULXYCVBGIBHF-UHFFFAOYSA-N	1	0	251.326	1.972	50	0		CDAARO
[NH3+]CCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000054957118	357327588	/nfs/dbraw/zinc/32/75/88/357327588.db2.gz	ZPNZUPSDZRZGKY-UHFFFAOYSA-N	1	0	253.777	1.811	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1cccc(F)c1F	ZINC000095432144	357516717	/nfs/dbraw/zinc/51/67/17/357516717.db2.gz	BVJQIQWPZZQGKN-MRVPVSSYSA-N	1	0	278.324	1.371	50	0		CDAARO
CCOc1ccnc(N2CC[C@H]([NH+](CC)CC)C2)n1	ZINC000065406596	357539071	/nfs/dbraw/zinc/53/90/71/357539071.db2.gz	OUQWQNFWRIOZON-LBPRGKRZSA-N	1	0	264.373	1.796	50	0		CDAARO
COc1cc(N(C)CCCc2nccn2C)ncn1	ZINC000065459398	357542379	/nfs/dbraw/zinc/54/23/79/357542379.db2.gz	TZEYXISYXZDJKP-UHFFFAOYSA-N	1	0	261.329	1.288	50	0		CDAARO
C[C@@H]1CCCN(C(=O)CC[NH2+]CCSc2c[nH]nn2)C1	ZINC000065452847	357542537	/nfs/dbraw/zinc/54/25/37/357542537.db2.gz	UOQRBCBZNVJGKJ-LLVKDONJSA-N	1	0	297.428	1.135	50	0		CDAARO
C[C@@H](CO)[NH2+]C1CCN(C(=O)NC2CCCCC2)CC1	ZINC000065488171	357544047	/nfs/dbraw/zinc/54/40/47/357544047.db2.gz	JRHNJHULBRTRDV-LBPRGKRZSA-N	1	0	283.416	1.464	50	0		CDAARO
COc1cc(NC[C@@]2([NH+](C)C)CCSC2)ncn1	ZINC000065498267	357545821	/nfs/dbraw/zinc/54/58/21/357545821.db2.gz	ISFSUCZAOUVIKS-LBPRGKRZSA-N	1	0	268.386	1.334	50	0		CDAARO
O=C(c1ccc2cc(O)ccc2c1)N1CC[NH2+]CC1	ZINC000067802536	357629166	/nfs/dbraw/zinc/62/91/66/357629166.db2.gz	KGCDLBUEOHPPJI-UHFFFAOYSA-N	1	0	256.305	1.591	50	0		CDAARO
CCN(CC)S(=O)(=O)NCC[C@@H]1CCC[N@H+](CC)C1	ZINC000067821741	357629971	/nfs/dbraw/zinc/62/99/71/357629971.db2.gz	HWSXUVWNUBTNJX-ZDUSSCGKSA-N	1	0	291.461	1.285	50	0		CDAARO
COCc1ncc(C[N@@H+]2CC[C@@]3(O)CCCC[C@H]3C2)cn1	ZINC000067676271	357617526	/nfs/dbraw/zinc/61/75/26/357617526.db2.gz	KTOUCSWZXXDDDE-HOCLYGCPSA-N	1	0	291.395	1.750	50	0		CDAARO
Cc1nc(CC[NH3+])cc(NC[C@H](O)Cc2ccccc2)n1	ZINC000067725164	357621334	/nfs/dbraw/zinc/62/13/34/357621334.db2.gz	ISJFIPVYEHCVNO-OAHLLOKOSA-N	1	0	286.379	1.302	50	0		CDAARO
[NH3+]CC(=O)NCc1cccnc1Oc1ccc(F)c(F)c1	ZINC000067893992	357634754	/nfs/dbraw/zinc/63/47/54/357634754.db2.gz	AAHBNLNAKJDUTM-UHFFFAOYSA-N	1	0	293.273	1.727	50	0		CDAARO
CCOc1ccc(/C=C/C(=O)N2CC[NH2+][C@H](C)C2)cc1	ZINC000188437393	357680604	/nfs/dbraw/zinc/68/06/04/357680604.db2.gz	VOUOWMNEBQRSOA-YSKGHYERSA-N	1	0	274.364	1.919	50	0		CDAARO
Nc1nc2c(s1)[C@H](c1ccc3nsnc3c1)[NH2+]CC2	ZINC000071753674	357777440	/nfs/dbraw/zinc/77/74/40/357777440.db2.gz	OUELQUDZHKFICP-JTQLQIEISA-N	1	0	289.389	1.965	50	0		CDAARO
C[NH+](C)[C@@H]1CC[C@H](NC(=O)N[C@H](CO)c2ccccc2)C1	ZINC000097048340	358112432	/nfs/dbraw/zinc/11/24/32/358112432.db2.gz	WQJPIECQLNSZCE-RRFJBIMHSA-N	1	0	291.395	1.502	50	0		CDAARO
CC(C)[N@@H+]1CCO[C@@H](Cn2cc(Br)cn2)C1	ZINC000080747778	358104819	/nfs/dbraw/zinc/10/48/19/358104819.db2.gz	FXCVWEOHVAKVCG-LLVKDONJSA-N	1	0	288.189	1.755	50	0		CDAARO
Cc1nc(=O)[nH]c(C)c1CCC(=O)N1CCCC[C@H]([NH3+])C1	ZINC000082106064	358146935	/nfs/dbraw/zinc/14/69/35/358146935.db2.gz	SZDIIQFUDGKSGQ-LBPRGKRZSA-N	1	0	292.383	1.071	50	0		CDAARO
[NH3+]CCCNS(=O)(=O)/C=C/c1ccccc1Cl	ZINC000195544501	358559866	/nfs/dbraw/zinc/55/98/66/358559866.db2.gz	XNINXAMWLKDUHV-RMKNXTFCSA-N	1	0	274.773	1.579	50	0		CDAARO
C[C@@H](Cc1ccccc1)C[N@@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000195569300	358566595	/nfs/dbraw/zinc/56/65/95/358566595.db2.gz	UZYGOQULALXDEG-DZGCQCFKSA-N	1	0	296.436	1.489	50	0		CDAARO
C[C@@H](O)C[NH2+]CCNCc1cccc2ccccc21	ZINC000095098706	358678374	/nfs/dbraw/zinc/67/83/74/358678374.db2.gz	ARHZSUTUKFGWGB-CYBMUJFWSA-N	1	0	258.365	1.900	50	0		CDAARO
CN(CC[NH+](C)C)C(=O)c1ccc(-c2cc[nH]n2)cc1	ZINC000095355728	358683433	/nfs/dbraw/zinc/68/34/33/358683433.db2.gz	WYTNLGVCCDECRT-UHFFFAOYSA-N	1	0	272.352	1.710	50	0		CDAARO
CN(Cc1nc([C@H]2CCOC2)no1)C1CC[NH+](C)CC1	ZINC000096161393	358711471	/nfs/dbraw/zinc/71/14/71/358711471.db2.gz	ZJQDHFHXMQGOBB-NSHDSACASA-N	1	0	280.372	1.100	50	0		CDAARO
COCc1cccc(C(=O)NCC[C@@H]2CCC[NH2+]2)c1	ZINC000097514249	358781277	/nfs/dbraw/zinc/78/12/77/358781277.db2.gz	IGHHNGJJAUXOQG-AWEZNQCLSA-N	1	0	262.353	1.705	50	0		CDAARO
CC(=O)c1cc(C(=O)NCC[C@@H]2CCC[NH2+]2)cs1	ZINC000097675566	358793124	/nfs/dbraw/zinc/79/31/24/358793124.db2.gz	ABWBNBQTZLHJOT-NSHDSACASA-N	1	0	266.366	1.823	50	0		CDAARO
CC(C)[C@H]1C=CCN1Cc1cc2n(n1)CCC[NH2+]C2	ZINC000215306220	358883328	/nfs/dbraw/zinc/88/33/28/358883328.db2.gz	HZXJBHKVVUVUJI-OAHLLOKOSA-N	1	0	260.385	1.773	50	0		CDAARO
C[NH+]1CCC(N2CCN(Cc3nccs3)CC2)CC1	ZINC000216313531	358935915	/nfs/dbraw/zinc/93/59/15/358935915.db2.gz	XDVOHIURNWJPAV-UHFFFAOYSA-N	1	0	280.441	1.355	50	0		CDAARO
[NH3+]C1(Cc2ccccc2F)CCS(=O)(=O)CC1	ZINC000098213636	359100163	/nfs/dbraw/zinc/10/01/63/359100163.db2.gz	IGPPLJOGNYFPLU-UHFFFAOYSA-N	1	0	257.330	1.274	50	0		CDAARO
CC(C)[C@@H](CO)Nc1cc(N2CCCC2)ncn1	ZINC000287644152	359100279	/nfs/dbraw/zinc/10/02/79/359100279.db2.gz	AQGBTZPFWZRWTB-LLVKDONJSA-N	1	0	250.346	1.506	50	0		CDAARO
CN1CCC[C@H]1c1nc(C2CN(C(=O)C3CCC3)C2)no1	ZINC000257178188	359142750	/nfs/dbraw/zinc/14/27/50/359142750.db2.gz	FXMQCOXUVQADAY-LBPRGKRZSA-N	1	0	290.367	1.562	50	0		CDAARO
c1[nH]nc(-c2cccnc2)c1C[NH2+]C[C@H]1CCOC1	ZINC000037738935	359456226	/nfs/dbraw/zinc/45/62/26/359456226.db2.gz	GNEAYIYXALPDLY-LLVKDONJSA-N	1	0	258.325	1.598	50	0		CDAARO
Cc1c2ccccc2[nH]c1CN1CCN2CC[N@@H+](C)C[C@H]2C1	ZINC000225316717	359576017	/nfs/dbraw/zinc/57/60/17/359576017.db2.gz	WGDLXMRJUIWEJG-HNNXBMFYSA-N	1	0	298.434	1.908	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)COCC1CC1	ZINC000257365718	359946786	/nfs/dbraw/zinc/94/67/86/359946786.db2.gz	IDJGFAUGPQHLFI-HUUCEWRRSA-N	1	0	280.412	1.888	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1Cc1cccc(C(=O)N(C)C)c1	ZINC000089939291	360198821	/nfs/dbraw/zinc/19/88/21/360198821.db2.gz	CIGHVXSKRNMBPQ-ZDUSSCGKSA-N	1	0	275.396	1.524	50	0		CDAARO
Cc1cccc(OCCNC(=O)[C@@H]2CCC[NH2+][C@@H]2C)c1	ZINC000094647852	360278490	/nfs/dbraw/zinc/27/84/90/360278490.db2.gz	CLFIGCIKDCSZNW-UKRRQHHQSA-N	1	0	276.380	1.878	50	0		CDAARO
[NH3+]CC[C@H]1CN(Cc2ccc3nsnc3c2)CCO1	ZINC000426498634	360678028	/nfs/dbraw/zinc/67/80/28/360678028.db2.gz	PSPFBEXEDDJJOD-NSHDSACASA-N	1	0	278.381	1.241	50	0		CDAARO
CN(C(=O)c1ccc(-c2ncccn2)cc1)[C@@H]1CC[N@H+](C)C1	ZINC000426544532	360681996	/nfs/dbraw/zinc/68/19/96/360681996.db2.gz	WEVXXTUTYDGIPL-OAHLLOKOSA-N	1	0	296.374	1.920	50	0		CDAARO
COCCN(Cc1sccc1C)C(=O)[C@H](C)[NH+](C)C	ZINC000426358227	360658329	/nfs/dbraw/zinc/65/83/29/360658329.db2.gz	GFZMZPUWOBCNBS-LBPRGKRZSA-N	1	0	284.425	1.982	50	0		CDAARO
O=C(Cc1ccc2c(c1)CCC2)NC[C@@H]1CCC[NH2+]C1	ZINC000178484422	189119965	/nfs/dbraw/zinc/11/99/65/189119965.db2.gz	OWEJXJKJCMFMBO-CQSZACIVSA-N	1	0	272.392	1.834	50	0		CDAARO
Cc1ncn(CCNC(=O)C[C@@H]2CCCC[N@H+]2C)c1C	ZINC000426388109	360662533	/nfs/dbraw/zinc/66/25/33/360662533.db2.gz	DJIBSRQVDVSMCS-AWEZNQCLSA-N	1	0	278.400	1.491	50	0		CDAARO
COc1cc(F)ccc1CNC(=O)[C@H](C)[NH+](C)C	ZINC000426425234	360669105	/nfs/dbraw/zinc/66/91/05/360669105.db2.gz	LKABUNOBCDMSQD-VIFPVBQESA-N	1	0	254.305	1.401	50	0		CDAARO
COc1cc(/C=C/C(=O)N2CC[C@@H](C[NH3+])C2)cc(OC)c1	ZINC000178566570	189127559	/nfs/dbraw/zinc/12/75/59/189127559.db2.gz	DYCQKMJYVXRNEM-OOPCZODUSA-N	1	0	290.363	1.524	50	0		CDAARO
COc1cc(F)c(C(=O)N2CC[C@H](C[NH3+])C2)cc1OC	ZINC000178522718	189124017	/nfs/dbraw/zinc/12/40/17/189124017.db2.gz	WXLVUMWNQLILFB-SECBINFHSA-N	1	0	282.315	1.264	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)Cc2cc(Cl)ccc2OC)C1	ZINC000178962244	189157896	/nfs/dbraw/zinc/15/78/96/189157896.db2.gz	FQBMYRLNCYAIRJ-NSHDSACASA-N	1	0	296.798	1.959	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cnn(C(C)(C)C)c2C)C1	ZINC000178964538	189158083	/nfs/dbraw/zinc/15/80/83/189158083.db2.gz	JLYISJSWGMYGKT-GFCCVEGCSA-N	1	0	278.400	1.628	50	0		CDAARO
COc1ccc(CC(=O)N(C)[C@H]2CC[NH2+]C2)cc1F	ZINC000179047251	189164775	/nfs/dbraw/zinc/16/47/75/189164775.db2.gz	YJUFZMFCIGIOCC-NSHDSACASA-N	1	0	266.316	1.197	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCN(C(=O)c2cnc3ccccc3n2)C1	ZINC000179213795	189178073	/nfs/dbraw/zinc/17/80/73/189178073.db2.gz	BDNGGPIKORYWLT-RYUDHWBXSA-N	1	0	284.363	1.829	50	0		CDAARO
C[C@H]1CN(C(=O)c2cccc3ncccc32)CC[NH2+]1	ZINC000088058883	364051239	/nfs/dbraw/zinc/05/12/39/364051239.db2.gz	ULJBJOYTZBAPBO-NSHDSACASA-N	1	0	255.321	1.669	50	0		CDAARO
Cc1ccccc1-n1cc(CN2CC[C@@H]([NH3+])C2)cn1	ZINC000216088658	189700254	/nfs/dbraw/zinc/70/02/54/189700254.db2.gz	JBVLHEHZDVQRRI-CQSZACIVSA-N	1	0	256.353	1.714	50	0		CDAARO
CC(C)c1noc(N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)n1	ZINC000089893650	366956835	/nfs/dbraw/zinc/95/68/35/366956835.db2.gz	ZOBJOVJNDVMPJH-MNOVXSKESA-N	1	0	250.346	1.866	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1CC(=O)NCCc1ccc(F)cc1	ZINC000089939046	366973367	/nfs/dbraw/zinc/97/33/67/366973367.db2.gz	SSELNAYRTBOBLY-ZDUSSCGKSA-N	1	0	293.386	1.120	50	0		CDAARO
CN(C)S(=O)(=O)c1ccccc1C[NH2+]CC1(C)COC1	ZINC000279568859	367046770	/nfs/dbraw/zinc/04/67/70/367046770.db2.gz	YLEGKCZEVCJPQQ-UHFFFAOYSA-N	1	0	298.408	1.063	50	0		CDAARO
COC(=O)CC(C)(C)C(=O)N[C@H]1C[C@@H](C)[N@@H+](C2CC2)C1	ZINC000252508581	367656848	/nfs/dbraw/zinc/65/68/48/367656848.db2.gz	XPIYNGPWQAOGKE-MNOVXSKESA-N	1	0	282.384	1.317	50	0		CDAARO
O=C(C[C@@H]1C=CCC1)N1CC[NH+]([C@@H]2CCC[C@H]2O)CC1	ZINC000252507106	367652209	/nfs/dbraw/zinc/65/22/09/367652209.db2.gz	YJBVQZBEMNUPMY-RBSFLKMASA-N	1	0	278.396	1.400	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CCOc1ccc(S(N)(=O)=O)cc1	ZINC000027344186	368153981	/nfs/dbraw/zinc/15/39/81/368153981.db2.gz	MVEQZYMYFUKVBD-GFCCVEGCSA-N	1	0	298.408	1.587	50	0		CDAARO
NC(=O)C[C@H](c1ccc2c(c1)OCCCO2)n1ccnc1	ZINC000012540576	368626314	/nfs/dbraw/zinc/62/63/14/368626314.db2.gz	PWVQWQSUSJWSJC-GFCCVEGCSA-N	1	0	287.319	1.509	50	0		CDAARO
COC(=O)NCC1CCN(c2cc[nH+]c(C)c2)CC1	ZINC000239593077	369717205	/nfs/dbraw/zinc/71/72/05/369717205.db2.gz	DNXQHAZJMKSEBE-UHFFFAOYSA-N	1	0	263.341	1.962	50	0		CDAARO
Cc1nc(CCN2CC[N@@H+]3CCC[C@@H]3C2)cs1	ZINC000020537857	370011911	/nfs/dbraw/zinc/01/19/11/370011911.db2.gz	FKVGWKXQVYMWGF-CYBMUJFWSA-N	1	0	251.399	1.774	50	0		CDAARO
COC(=O)c1cc(C[NH2+][C@H](C(N)=O)C(C)(C)C)c(C)s1	ZINC000089135242	370071332	/nfs/dbraw/zinc/07/13/32/370071332.db2.gz	XMJXJLRPIYNOQY-LLVKDONJSA-N	1	0	298.408	1.833	50	0		CDAARO
CC(C)(C)NC(=O)NCC1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000575606430	370614971	/nfs/dbraw/zinc/61/49/71/370614971.db2.gz	JMCWALOXAPRXRU-CYBMUJFWSA-N	1	0	283.416	1.585	50	0		CDAARO
CCn1ncc(C[N@H+](C)CCn2cnnc2C)c1C	ZINC000670443483	482988045	/nfs/dbraw/zinc/98/80/45/482988045.db2.gz	WKPTVYZMAJCBNE-UHFFFAOYSA-N	1	0	262.361	1.243	50	0		CDAARO
O=C(NCC1CC[NH+]([C@@H]2CCOC2)CC1)C1CC1	ZINC000575616575	371708212	/nfs/dbraw/zinc/70/82/12/371708212.db2.gz	QMJQWALRNNNIFG-CYBMUJFWSA-N	1	0	252.358	1.014	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(S(=O)(=O)CC2CCCC2)C1	ZINC000177748595	372118318	/nfs/dbraw/zinc/11/83/18/372118318.db2.gz	JYPWORPOMPSMHV-CYBMUJFWSA-N	1	0	274.430	1.532	50	0		CDAARO
O=C(CCc1cnn(-c2ccccc2)c1)NC[C@H]1CCC[NH2+]1	ZINC000178725480	372203633	/nfs/dbraw/zinc/20/36/33/372203633.db2.gz	LQCSQFOBWPDXGM-OAHLLOKOSA-N	1	0	298.390	1.673	50	0		CDAARO
Cc1n[nH]nc1C(=O)N1CCC(CC[NH+]2CCCC2)CC1	ZINC000299755304	372745472	/nfs/dbraw/zinc/74/54/72/372745472.db2.gz	GLQYXUCBNONXNU-UHFFFAOYSA-N	1	0	291.399	1.451	50	0		CDAARO
Cc1ncc2c(c1CNC(=O)C1CCOCC1)CC[NH2+]C2	ZINC000299771523	372750703	/nfs/dbraw/zinc/75/07/03/372750703.db2.gz	QEWQKHSOGZGERE-UHFFFAOYSA-N	1	0	289.379	1.079	50	0		CDAARO
O=C([C@@H]1C=CC[NH2+]1)N1CCC2(CC1)C(=O)Nc1ccccc12	ZINC000299768133	372750998	/nfs/dbraw/zinc/75/09/98/372750998.db2.gz	JJDKUVZBDJVWPI-AWEZNQCLSA-N	1	0	297.358	1.027	50	0		CDAARO
Cc1ccc2c(c1)c(C(=O)NCC[NH+]1CCCC1)nn2C	ZINC000299789999	372764476	/nfs/dbraw/zinc/76/44/76/372764476.db2.gz	AMFZTVFGHHEWDN-UHFFFAOYSA-N	1	0	286.379	1.707	50	0		CDAARO
C[NH+](C)CC[C@H](NC(=O)c1cn[nH]n1)c1ccccc1	ZINC000299794783	372766934	/nfs/dbraw/zinc/76/69/34/372766934.db2.gz	KKMZYHHTRKTJHE-LBPRGKRZSA-N	1	0	273.340	1.228	50	0		CDAARO
O=c1cc(C[N@H+]2CC[C@@H](O)C2)[nH]c2ccc(F)cc12	ZINC000299794545	372767139	/nfs/dbraw/zinc/76/71/39/372767139.db2.gz	JUFINOXADGMCHM-LLVKDONJSA-N	1	0	262.284	1.646	50	0		CDAARO
CC(C)(C)c1ccccc1NC(=O)N[C@@H]1C[NH2+]CC[C@H]1O	ZINC000299801806	372773199	/nfs/dbraw/zinc/77/31/99/372773199.db2.gz	YDZAOZXLQJRQKZ-ZIAGYGMSSA-N	1	0	291.395	1.828	50	0		CDAARO
CC[N@@H+]1CC[C@H]2[C@H](C1)OCCN2C(=O)CC(F)(F)F	ZINC000253416356	373726636	/nfs/dbraw/zinc/72/66/36/373726636.db2.gz	IIEQZEFGDMADIB-UWVGGRQHSA-N	1	0	280.290	1.260	50	0		CDAARO
OCC[NH2+]CCOc1ccccc1Br	ZINC000005023472	170057221	/nfs/dbraw/zinc/05/72/21/170057221.db2.gz	HKGMTVJPCCTQGI-UHFFFAOYSA-N	1	0	260.131	1.410	50	0		CDAARO
C[C@@H](C(N)=O)N1CC[NH+](Cc2cccc3[nH]ccc32)CC1	ZINC000093440430	374754903	/nfs/dbraw/zinc/75/49/03/374754903.db2.gz	GUYVBITURLWSQK-LBPRGKRZSA-N	1	0	286.379	1.159	50	0		CDAARO
C[C@H](CNC(=O)c1ccc(O)cc1)C[NH+]1CCN(C)CC1	ZINC000095451534	374952024	/nfs/dbraw/zinc/95/20/24/374952024.db2.gz	GXIPOPSHVMBGKX-CYBMUJFWSA-N	1	0	291.395	1.006	50	0		CDAARO
CCOC(=O)[C@H]1CCC[N@H+](CCC(=O)C2CC2)C1	ZINC000095453382	374952037	/nfs/dbraw/zinc/95/20/37/374952037.db2.gz	AIZAKOCTQPFBGE-LBPRGKRZSA-N	1	0	253.342	1.631	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NCCc1nccn1C	ZINC000095401004	374906301	/nfs/dbraw/zinc/90/63/01/374906301.db2.gz	QQYAUVXPQMZOJD-CYBMUJFWSA-N	1	0	278.400	1.342	50	0		CDAARO
COC[C@H](C)n1cc(C(=O)N2CC[NH2+]C(C)(C)C2)c(C)n1	ZINC000097059642	375142932	/nfs/dbraw/zinc/14/29/32/375142932.db2.gz	POIHXXVXBBCIFM-NSHDSACASA-N	1	0	294.399	1.223	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCCC[NH+](C)C)cc1	ZINC000002478042	375164255	/nfs/dbraw/zinc/16/42/55/375164255.db2.gz	MFLRGXNDNKRSKU-UHFFFAOYSA-N	1	0	256.371	1.225	50	0		CDAARO
[NH3+][C@@H]1CCC[C@H]1C(=O)N1CCO[C@H](c2nccs2)C1	ZINC000299739483	375199408	/nfs/dbraw/zinc/19/94/08/375199408.db2.gz	OXRXGJYDBGWIHJ-MXWKQRLJSA-N	1	0	281.381	1.170	50	0		CDAARO
[NH3+][C@@H]1CCC[C@H](C(=O)N2CCC[C@H](Cn3cncn3)C2)C1	ZINC000299738835	375199529	/nfs/dbraw/zinc/19/95/29/375199529.db2.gz	HBKFEHZCYSWXLP-MELADBBJSA-N	1	0	291.399	1.034	50	0		CDAARO
COc1ccc(Cl)cc1CN(C)C(=O)[C@@H]1C[C@@H](O)C[NH2+]1	ZINC000299748962	375206518	/nfs/dbraw/zinc/20/65/18/375206518.db2.gz	IRYDWOKEBBARMR-NEPJUHHUSA-N	1	0	298.770	1.030	50	0		CDAARO
C[NH+](C)CCCNC(=O)CSc1ccccc1	ZINC000003392228	375680223	/nfs/dbraw/zinc/68/02/23/375680223.db2.gz	CJPTWXBRYPQHRX-UHFFFAOYSA-N	1	0	252.383	1.847	50	0		CDAARO
CN(C)c1ncc(C[N@@H+]2C[C@H](O)C3(CC3)C2)s1	ZINC000428378215	247289521	/nfs/dbraw/zinc/28/95/21/247289521.db2.gz	UEDVLJDIBAPKQN-JTQLQIEISA-N	1	0	253.371	1.166	50	0		CDAARO
CC(C)C[C@@H]1NC(=O)N(CCCn2ccnc2)C1=O	ZINC000003985045	375829662	/nfs/dbraw/zinc/82/96/62/375829662.db2.gz	JYEBAOFOKIQBJQ-NSHDSACASA-N	1	0	264.329	1.240	50	0	biogenic	CDAARO
COC(=O)[C@H](CC(C)C)NC(=O)C[NH2+]Cc1ccccc1	ZINC000071782576	376777233	/nfs/dbraw/zinc/77/72/33/376777233.db2.gz	MUUIBHPGLLKBLJ-AWEZNQCLSA-N	1	0	292.379	1.480	50	0		CDAARO
O=C(Cc1cccc(O)c1)N1CCC[C@]2(CC[NH2+]C2)C1	ZINC000067688543	377209539	/nfs/dbraw/zinc/20/95/39/377209539.db2.gz	MMFGKLINSGMCJX-MRXNPFEDSA-N	1	0	274.364	1.537	50	0		CDAARO
C[C@@H]1C[N@H+](CCCCO)CCN1C(=O)OC(C)(C)C	ZINC000189333562	377240071	/nfs/dbraw/zinc/24/00/71/377240071.db2.gz	CONVGRJCDKGUBD-GFCCVEGCSA-N	1	0	272.389	1.700	50	0		CDAARO
CCS[C@@H]1CCCC[C@@H]1[NH2+]CCN1C(=O)CCC1=O	ZINC000190021959	377521738	/nfs/dbraw/zinc/52/17/38/377521738.db2.gz	QJOHJAORROEHAC-NWDGAFQWSA-N	1	0	284.425	1.789	50	0		CDAARO
Cn1c[n+](C[C@@H](O)COc2ccccc2)c2ccccc21	ZINC000000273019	169594315	/nfs/dbraw/zinc/59/43/15/169594315.db2.gz	FYOHUQBEVOXBNL-CQSZACIVSA-N	1	0	283.351	1.906	50	0		CDAARO
C[NH2+]CCCCNC(=O)c1cnc(C(C)C)nc1	ZINC000096160756	256884689	/nfs/dbraw/zinc/88/46/89/256884689.db2.gz	ZXBSKRLFDATYFF-UHFFFAOYSA-N	1	0	250.346	1.329	50	0		CDAARO
Cc1ccc(C)c(CC(=O)N[C@@H]2CC[NH2+]C[C@H]2C)c1	ZINC000094345413	184786359	/nfs/dbraw/zinc/78/63/59/184786359.db2.gz	IOJPQDWJWCMNEZ-UKRRQHHQSA-N	1	0	260.381	1.960	50	0		CDAARO
CCOC(=O)N1CCN(C2CC[NH+](CC)CC2)CC1	ZINC000000280529	390135682	/nfs/dbraw/zinc/13/56/82/390135682.db2.gz	DNGMWYIPKVXQNS-UHFFFAOYSA-N	1	0	269.389	1.245	50	0		CDAARO
C[C@@H](Cc1cnccn1)NC(=O)CCC[NH+]1CCCCC1	ZINC000095377983	184958210	/nfs/dbraw/zinc/95/82/10/184958210.db2.gz	WDGVMPYQAVELKV-AWEZNQCLSA-N	1	0	290.411	1.790	50	0		CDAARO
Cc1cccnc1[C@@H]([NH2+]C[C@H](O)Cn1cccn1)C(C)C	ZINC000096424382	390515940	/nfs/dbraw/zinc/51/59/40/390515940.db2.gz	PGUJKMLEIZPVBJ-GJZGRUSLSA-N	1	0	288.395	1.934	50	0		CDAARO
Cc1ccc(N2CC[C@@H]([N@@H+]3CC[C@H](CCO)C3)C2=O)cc1	ZINC000096424551	390516299	/nfs/dbraw/zinc/51/62/99/390516299.db2.gz	HIDISNYLAILDFY-GDBMZVCRSA-N	1	0	288.391	1.805	50	0		CDAARO
Cc1cc2c(c(-c3cnc(N)cn3)c1)O[C@@H](C[NH3+])C2	ZINC000067756098	390575909	/nfs/dbraw/zinc/57/59/09/390575909.db2.gz	MNFZTJQAEKUSIP-SNVBAGLBSA-N	1	0	256.309	1.296	50	0		CDAARO
Cc1cc(C)n(-c2ccc(C(=O)N(C)[C@@H]3CC[NH2+]C3)cc2)n1	ZINC000179120642	390943104	/nfs/dbraw/zinc/94/31/04/390943104.db2.gz	LLSBRGCXRYMALW-MRXNPFEDSA-N	1	0	298.390	1.923	50	0		CDAARO
CS(=O)(=O)CC1(C[NH2+]Cc2cccs2)CC1	ZINC000096449363	533330296	/nfs/dbraw/zinc/33/02/96/533330296.db2.gz	UHJDYKKEXUBDNF-UHFFFAOYSA-N	1	0	259.396	1.663	50	0		CDAARO
CC(C)NC(=O)[C@@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000012205930	391412336	/nfs/dbraw/zinc/41/23/36/391412336.db2.gz	PEXVNUNEIOBZQA-CYBMUJFWSA-N	1	0	267.417	1.317	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[N@H+](C)Cc1ccccc1C	ZINC000007844899	391951342	/nfs/dbraw/zinc/95/13/42/391951342.db2.gz	LQFGHWKYOLTRTA-NSHDSACASA-N	1	0	263.341	1.271	50	0		CDAARO
Cc1ccc(CC(=O)N2CCCC[C@H]2[C@H](C)[NH3+])cn1	ZINC000262749578	131258608	/nfs/dbraw/zinc/25/86/08/131258608.db2.gz	MCZSCKWEJQOHIS-JSGCOSHPSA-N	1	0	261.369	1.661	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N[C@H]1CC[NH2+]C[C@H]1C	ZINC000262811709	131263448	/nfs/dbraw/zinc/26/34/48/131263448.db2.gz	YFUYOUUCPCWPGO-YPMHNXCESA-N	1	0	282.409	1.525	50	0		CDAARO
C[C@@H]1CCCC[C@@H]1C[NH2+]C1CCN(CC(N)=O)CC1	ZINC000096502301	393188492	/nfs/dbraw/zinc/18/84/92/393188492.db2.gz	DABRLKDINQQCDA-CHWSQXEVSA-N	1	0	267.417	1.352	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)/C=C\C1CCOCC1	ZINC000493619410	393439914	/nfs/dbraw/zinc/43/99/14/393439914.db2.gz	CKCIKWXBDOFRJB-DSYXLKISSA-N	1	0	252.358	1.180	50	0		CDAARO
C[C@@H]([NH3+])C(=O)N1CCC[C@H]1Cc1cccc(F)c1	ZINC000095426454	147114326	/nfs/dbraw/zinc/11/43/26/147114326.db2.gz	MUUCVAJBYVIOTC-MFKMUULPSA-N	1	0	250.317	1.706	50	0		CDAARO
C[C@H]([NH2+]C[C@H]1CC[C@@H](C(=O)N(C)C)O1)C(C)(C)C(F)F	ZINC000657939240	413099090	/nfs/dbraw/zinc/09/90/90/413099090.db2.gz	WGPMUWNCNGBYGI-AXFHLTTASA-N	1	0	292.370	1.892	50	0		CDAARO
COC[C@H]([NH3+])C(=O)NCc1nc2ccccc2n1C(C)C	ZINC000262248866	149040202	/nfs/dbraw/zinc/04/02/02/149040202.db2.gz	ILIFNYNOVLPANC-NSHDSACASA-N	1	0	290.367	1.207	50	0		CDAARO
COc1ccc(C2=NC3(CC[NH2+]CC3)NC2=S)cc1	ZINC000006817114	286297568	/nfs/dbraw/zinc/29/75/68/286297568.db2.gz	YZCZLUCSFDRSQV-UHFFFAOYSA-N	1	0	275.377	1.495	50	0		CDAARO
CCO[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCC[NH2+]C2)C1(C)C	ZINC000246853307	286328684	/nfs/dbraw/zinc/32/86/84/286328684.db2.gz	UASFHPXVZIJZAP-RWMBFGLXSA-N	1	0	268.401	1.648	50	0		CDAARO
c1cc(C[N@@H+]2CCN3CCOC[C@@H]3C2)cc2c1OCC2	ZINC000375238884	160356070	/nfs/dbraw/zinc/35/60/70/160356070.db2.gz	SEKXHZWBSALOKL-HNNXBMFYSA-N	1	0	274.364	1.138	50	0		CDAARO
C[C@@H]([NH2+][C@@H](C)C(=O)NC[C@@H]1CCCO1)C1CCOCC1	ZINC000096492047	287046596	/nfs/dbraw/zinc/04/65/96/287046596.db2.gz	HDPGLGYLVYQNEE-DYEKYZERSA-N	1	0	284.400	1.075	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@H]1[NH2+][C@@H](C)C(=O)N(CC)CC	ZINC000089948623	287179573	/nfs/dbraw/zinc/17/95/73/287179573.db2.gz	DCMODUOHPKERKF-NWANDNLSSA-N	1	0	297.443	1.480	50	0		CDAARO
O=C1CCCN1CCC[NH2+]C[C@H](O)COc1ccccc1	ZINC000003324741	169878985	/nfs/dbraw/zinc/87/89/85/169878985.db2.gz	JLLCQLYAQVGORT-AWEZNQCLSA-N	1	0	292.379	1.028	50	0		CDAARO
COc1cc(C(=O)N[C@H]2CCC[NH2+]C2)cc(OC)c1OC	ZINC000003812903	169913597	/nfs/dbraw/zinc/91/35/97/169913597.db2.gz	YSIITVVESCNIPR-NSHDSACASA-N	1	0	294.351	1.194	50	0	investigational	CDAARO
Cc1cc(C)cc(OCC(=O)NCCC[NH+](C)C)c1	ZINC000004698838	170000946	/nfs/dbraw/zinc/00/09/46/170000946.db2.gz	ADKXWYOSNXWDCZ-UHFFFAOYSA-N	1	0	264.369	1.750	50	0		CDAARO
COc1cccc2cc(C(=O)NCC[NH+](C)C)c(=O)oc21	ZINC000004805216	170020185	/nfs/dbraw/zinc/02/01/85/170020185.db2.gz	RUILTXSESDILPX-UHFFFAOYSA-N	1	0	290.319	1.093	50	0		CDAARO
Cc1cccc(O[C@@H](C)C(=O)NCC[NH+](C)C)c1	ZINC000004832728	170026147	/nfs/dbraw/zinc/02/61/47/170026147.db2.gz	PSDSWADHTOYFLP-LBPRGKRZSA-N	1	0	250.342	1.440	50	0		CDAARO
CC(C)(C)[NH2+]C[C@H](O)Cn1cc(CO)c2ccccc21	ZINC000005521111	170107499	/nfs/dbraw/zinc/10/74/99/170107499.db2.gz	SAELQCWWYUKSFI-ZDUSSCGKSA-N	1	0	276.380	1.883	50	0		CDAARO
[NH3+]C[C@H](c1ccco1)S(=O)(=O)c1ccccc1	ZINC000007997082	170312993	/nfs/dbraw/zinc/31/29/93/170312993.db2.gz	HZWJQBNSBQWWQO-GFCCVEGCSA-N	1	0	251.307	1.753	50	0		CDAARO
CCC(C)(C)[NH2+]CC(=O)Nc1cccc(C(=O)NC)c1	ZINC000009495713	170378840	/nfs/dbraw/zinc/37/88/40/170378840.db2.gz	AQYQUDFROMHVPI-UHFFFAOYSA-N	1	0	277.368	1.763	50	0		CDAARO
CSc1nc(C(=O)NC2CC[NH2+]CC2)cs1	ZINC000020560910	171251947	/nfs/dbraw/zinc/25/19/47/171251947.db2.gz	WUHALCGNYNHATH-UHFFFAOYSA-N	1	0	257.384	1.347	50	0		CDAARO
CCCc1cn(CC2CC[NH+](C[C@@H]3CCOC3)CC2)nn1	ZINC000020598711	171266395	/nfs/dbraw/zinc/26/63/95/171266395.db2.gz	PEMRHHBLFURUPX-HNNXBMFYSA-N	1	0	292.427	1.979	50	0		CDAARO
Cc1ccc(NC(=O)[C@@H]([NH3+])COC(C)C)c(C)n1	ZINC000659251429	413642135	/nfs/dbraw/zinc/64/21/35/413642135.db2.gz	FWOHRULILOINAS-NSHDSACASA-N	1	0	251.330	1.389	50	0		CDAARO
C[C@@](CO)(c1ccc(Br)cc1)N1CC[NH2+]CC1	ZINC000038120673	174128421	/nfs/dbraw/zinc/12/84/21/174128421.db2.gz	WDUJJOYVCFRGBR-CYBMUJFWSA-N	1	0	299.212	1.562	50	0		CDAARO
CCOC(=O)CCC(=O)NCC1CC[NH+](C(C)C)CC1	ZINC000038573052	174147457	/nfs/dbraw/zinc/14/74/57/174147457.db2.gz	ZGSQIZKWWBAROL-UHFFFAOYSA-N	1	0	284.400	1.566	50	0		CDAARO
CC(C)n1c(=O)c2ccccc2n(CC[NH+](C)C)c1=O	ZINC000071279680	176108237	/nfs/dbraw/zinc/10/82/37/176108237.db2.gz	OQOWNCJZBNZFLM-UHFFFAOYSA-N	1	0	275.352	1.306	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCN(C(=O)c2cc3sccc3[nH]2)C1	ZINC000072137168	176322990	/nfs/dbraw/zinc/32/29/90/176322990.db2.gz	CJCXPLBGJMFWJZ-AWEZNQCLSA-N	1	0	293.392	1.368	50	0		CDAARO
NC(=O)CC[C@@H]1CCC[N@H+](Cc2cccnc2N)C1	ZINC000072148479	176325577	/nfs/dbraw/zinc/32/55/77/176325577.db2.gz	OYKMTQKMYVHMTB-NSHDSACASA-N	1	0	262.357	1.141	50	0		CDAARO
COc1ccc(NC(=O)C[C@@H]2COCC[NH2+]2)c(C)c1	ZINC000072162275	176330094	/nfs/dbraw/zinc/33/00/94/176330094.db2.gz	SHKCZMXIIAPJIK-LLVKDONJSA-N	1	0	264.325	1.321	50	0		CDAARO
O=C(CC[NH+]1CCCC1)Nc1ccc(Cn2cncn2)cc1	ZINC000072405917	176397686	/nfs/dbraw/zinc/39/76/86/176397686.db2.gz	GUMLTMHNWLEQRC-UHFFFAOYSA-N	1	0	299.378	1.751	50	0		CDAARO
CCOCCC(=O)N(C)C[C@@H]1Cc2ccccc2C[N@@H+]1C	ZINC000077452917	177270546	/nfs/dbraw/zinc/27/05/46/177270546.db2.gz	WALOJDACKMPKHI-INIZCTEOSA-N	1	0	290.407	1.928	50	0		CDAARO
C[NH+]1CCC(CNC(=O)c2ccccc2F)CC1	ZINC000023013544	260125171	/nfs/dbraw/zinc/12/51/71/260125171.db2.gz	FNYPCCNCJVGJPU-UHFFFAOYSA-N	1	0	250.317	1.897	50	0		CDAARO
CC(C)[C@H](NC(=O)Cn1ccnc1)c1cccnc1	ZINC000218963132	262347920	/nfs/dbraw/zinc/34/79/20/262347920.db2.gz	SLKRDJIGHDERRC-AWEZNQCLSA-N	1	0	258.325	1.792	50	0		CDAARO
COc1ccccc1C[N@H+](C)CCCN1CCOCC1	ZINC000089340340	424502518	/nfs/dbraw/zinc/50/25/18/424502518.db2.gz	CMPVIPXMFJFWJV-UHFFFAOYSA-N	1	0	278.396	1.849	50	0		CDAARO
CC1(C)CC(NC(=O)c2ccn[nH]2)CC(C)(C)[NH2+]1	ZINC000000092959	275808930	/nfs/dbraw/zinc/80/89/30/275808930.db2.gz	KRCPLLRGUAVQQY-UHFFFAOYSA-N	1	0	250.346	1.449	50	0		CDAARO
COC(=O)N1CCC[C@@H]([NH2+][C@H]2CCCSC2)C1	ZINC000097084523	277071594	/nfs/dbraw/zinc/07/15/94/277071594.db2.gz	IFAHXWCEDTWEFE-MNOVXSKESA-N	1	0	258.387	1.702	50	0		CDAARO
CC(C)(C)c1ncsc1C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178544217	277277285	/nfs/dbraw/zinc/27/72/85/277277285.db2.gz	JPIHMOOSGGCUBS-SECBINFHSA-N	1	0	267.398	1.861	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@@H]2Cc3ccccc3C[NH2+]2)C[C@@H](C)O1	ZINC000019474675	277844353	/nfs/dbraw/zinc/84/43/53/277844353.db2.gz	OJBMKRPUCMZCIY-JMSVASOKSA-N	1	0	274.364	1.337	50	0		CDAARO
CC(C)(C)CC(=O)N1CCC(OCCC[NH3+])CC1	ZINC000094071237	278304065	/nfs/dbraw/zinc/30/40/65/278304065.db2.gz	VPPPDUZLFRTUNB-UHFFFAOYSA-N	1	0	256.390	1.779	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2CCOc3ccccc32)CC[NH2+]1	ZINC000088059130	278676761	/nfs/dbraw/zinc/67/67/61/278676761.db2.gz	FKNNEELFNGPQKF-YPMHNXCESA-N	1	0	260.337	1.373	50	0		CDAARO
C[C@@H](Cn1c(=O)[nH]c2ccccc2c1=O)[NH+]1CCCC1	ZINC000036398039	279140758	/nfs/dbraw/zinc/14/07/58/279140758.db2.gz	YLWIPZFYMNNVCC-NSHDSACASA-N	1	0	273.336	1.174	50	0		CDAARO
CC(C)[N@H+](C)C[C@]1(O)CCCN(CC(C)(C)C)C1=O	ZINC000011878443	279384424	/nfs/dbraw/zinc/38/44/24/279384424.db2.gz	BVTWXEJOSXLOHX-OAHLLOKOSA-N	1	0	270.417	1.726	50	0		CDAARO
CC[C@]1(C)CN(C(=O)N[C@@H]2CC[C@@H]([NH+](C)C)C2)CCO1	ZINC000252551811	281319279	/nfs/dbraw/zinc/31/92/79/281319279.db2.gz	UHLHHHMWKJLOOF-UMVBOHGHSA-N	1	0	283.416	1.680	50	0		CDAARO
C[C@H]1CCCN(S(=O)(=O)c2cccs2)[C@H]1C[NH3+]	ZINC000252192228	290452607	/nfs/dbraw/zinc/45/26/07/290452607.db2.gz	RTSAILULKVQTTI-UWVGGRQHSA-N	1	0	274.411	1.496	50	0		CDAARO
CCCc1cc(CN(C)C(=O)[C@@H]2CC23CC[NH2+]CC3)[nH]n1	ZINC000534575295	328309734	/nfs/dbraw/zinc/30/97/34/328309734.db2.gz	VTDJYHKRHNVGIY-AWEZNQCLSA-N	1	0	290.411	1.710	50	0		CDAARO
C[NH+](C)C[C@@H](O)CNc1ccc2cc(Cl)ccc2n1	ZINC000534580336	328311556	/nfs/dbraw/zinc/31/15/56/328311556.db2.gz	AAWSOJWYBMPHMM-LBPRGKRZSA-N	1	0	279.771	1.645	50	0		CDAARO
C[NH+](C)CC(C)(C)NC(=O)COC[C@H]1CCCCO1	ZINC000534639232	328334978	/nfs/dbraw/zinc/33/49/78/328334978.db2.gz	RCDYUCMLEYDAJN-GFCCVEGCSA-N	1	0	272.389	1.029	50	0		CDAARO
Cc1nn(C[C@@H](C)[NH2+]CCn2ccnn2)c(C)c1Cl	ZINC000534655269	328339759	/nfs/dbraw/zinc/33/97/59/328339759.db2.gz	RCEFVHSCCQFSNI-SECBINFHSA-N	1	0	282.779	1.423	50	0		CDAARO
COc1nc(NCC[C@H]2CCC[N@H+](C)C2)ncc1F	ZINC000534673156	328348888	/nfs/dbraw/zinc/34/88/88/328348888.db2.gz	NDDPKARAEZXSAG-SNVBAGLBSA-N	1	0	268.336	1.190	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]CCc2ncc[nH]2)CC1	ZINC000139132288	328449059	/nfs/dbraw/zinc/44/90/59/328449059.db2.gz	OMYOKOUIXGRKRO-UHFFFAOYSA-N	1	0	266.345	1.163	50	0		CDAARO
CN(C)c1ccnc(OC2C[C@H]3CC[C@@H](C2)[N@H+]3C)n1	ZINC000585652012	1159305684	/nfs/dbraw/zinc/30/56/84/1159305684.db2.gz	UNFKTYMCOVKCPZ-FOSCPWQOSA-N	1	0	262.357	1.547	50	0		CDAARO
CCc1[nH+]c(N)nc(NCCNC(=O)C(C)C)c1C	ZINC001772705259	1159440609	/nfs/dbraw/zinc/44/06/09/1159440609.db2.gz	XVRHRQFRHCZKEQ-UHFFFAOYSA-N	1	0	265.361	1.114	50	0		CDAARO
NCc1nnc(NC[C@H]2CC[N@@H+](C3CCCCC3)C2)o1	ZINC001772708183	1159442402	/nfs/dbraw/zinc/44/24/02/1159442402.db2.gz	FACGUEIEIYNNIL-LLVKDONJSA-N	1	0	279.388	1.595	50	0		CDAARO
OCc1ccc2c(c1)C[N@@H+](CC[C@@H]1CCOC1)CCO2	ZINC000670450044	483011963	/nfs/dbraw/zinc/01/19/63/483011963.db2.gz	FWOQKXBZLPYFSQ-CYBMUJFWSA-N	1	0	277.364	1.800	50	0		CDAARO
Cc1nc2c(c(=O)[nH]1)C[N@@H+](C1CSCCSC1)C2	ZINC000670469113	483062314	/nfs/dbraw/zinc/06/23/14/483062314.db2.gz	NDCLTDBROQRPAO-UHFFFAOYSA-N	1	0	283.422	1.655	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CN(C)Cc2ccc(OC)nc2)C1	ZINC000670473515	483083434	/nfs/dbraw/zinc/08/34/34/483083434.db2.gz	MIDMJMILMDAHFZ-HNNXBMFYSA-N	1	0	293.411	1.490	50	0		CDAARO
C[C@H]([NH2+]Cc1cnn(C)c1)[C@H](O)c1ccc(F)c(F)c1	ZINC000096452786	533940314	/nfs/dbraw/zinc/94/03/14/533940314.db2.gz	UGYCVKWRRINOCN-XPTSAGLGSA-N	1	0	281.306	1.910	50	0		CDAARO
C[NH2+][C@H](C)CNC(=O)c1ccc(-c2n[nH]c(C)n2)cc1	ZINC000261661689	536400336	/nfs/dbraw/zinc/40/03/36/536400336.db2.gz	GAFLSTRYXKSNLT-SECBINFHSA-N	1	0	273.340	1.118	50	0		CDAARO
C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1ccon1	ZINC000097142610	538437599	/nfs/dbraw/zinc/43/75/99/538437599.db2.gz	NGNRMYJVDBGUHJ-WFASDCNBSA-N	1	0	285.347	1.925	50	0		CDAARO
CCCN(CCc1ccccc1)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000952979271	614583545	/nfs/dbraw/zinc/58/35/45/614583545.db2.gz	IEOLHNWTGCRZCM-HNNXBMFYSA-N	1	0	258.365	1.996	50	0		CDAARO
CCCCCc1nc([C@@H]([NH3+])Cc2c[nH]cn2)n(CC)n1	ZINC000952973672	614945979	/nfs/dbraw/zinc/94/59/79/614945979.db2.gz	YEMOEITUQBTEJE-LBPRGKRZSA-N	1	0	276.388	1.996	50	0		CDAARO
CN(C)c1ccc(C[NH2+]CCN2CCCC[C@@H]2CO)cn1	ZINC000952990745	616015580	/nfs/dbraw/zinc/01/55/80/616015580.db2.gz	SVULJBRTAAHXJN-OAHLLOKOSA-N	1	0	292.427	1.084	50	0		CDAARO
C[NH+](C)CCn1nccc1C(=O)NCc1cccs1	ZINC000585135739	1164218001	/nfs/dbraw/zinc/21/80/01/1164218001.db2.gz	ZDZNZHBBVSBIQJ-UHFFFAOYSA-N	1	0	278.381	1.436	50	0		CDAARO
Cn1cncc1CN(CCO)CCOCc1ccccc1	ZINC001704303599	1177680422	/nfs/dbraw/zinc/68/04/22/1177680422.db2.gz	LFBLEWJGSFORCJ-UHFFFAOYSA-N	1	0	289.379	1.431	50	0		CDAARO
CCCC[NH+]1CCN(c2ncc(F)c(OC)n2)CC1	ZINC001704309225	1177683500	/nfs/dbraw/zinc/68/35/00/1177683500.db2.gz	LDPKFMAKLGCHIQ-UHFFFAOYSA-N	1	0	268.336	1.546	50	0		CDAARO
CC[N@H+](CCC(=O)NC1CCCCCC1)[C@H](C)C(N)=O	ZINC001704314651	1177685719	/nfs/dbraw/zinc/68/57/19/1177685719.db2.gz	VXMGQWYSEVPJEE-GFCCVEGCSA-N	1	0	283.416	1.411	50	0		CDAARO
CCc1cnc(N)nc1NC[C@@H]1CCC[N@H+](CCOC)C1	ZINC001704336239	1177693792	/nfs/dbraw/zinc/69/37/92/1177693792.db2.gz	WPXCZRMOAAGKJC-LBPRGKRZSA-N	1	0	293.415	1.392	50	0		CDAARO
CCN(C)c1cc(N[C@@H]2CCC[C@H]2[NH+](C)C)ncn1	ZINC001704355485	1177699702	/nfs/dbraw/zinc/69/97/02/1177699702.db2.gz	OKSJMRMFLLZRDO-VXGBXAGGSA-N	1	0	263.389	1.827	50	0		CDAARO
COCCN(Cc1ccccn1)C(=O)[C@@H](C)n1ccnc1	ZINC000056984905	735391015	/nfs/dbraw/zinc/39/10/15/735391015.db2.gz	PBQUDJNPUDIWHY-CYBMUJFWSA-N	1	0	288.351	1.514	50	0		CDAARO
O=C(Nc1ccc(F)cc1F)[C@H]1C[N@@H+]2CC3CC2(C3)CO1	ZINC000952994586	735493195	/nfs/dbraw/zinc/49/31/95/735493195.db2.gz	YWSRSNXGWXDIBR-KWCGZIOASA-N	1	0	294.301	1.767	50	0		CDAARO
C[C@@H](C(=O)N1CCC(Oc2ccncc2)CC1)[NH+](C)C	ZINC000426689969	734200088	/nfs/dbraw/zinc/20/00/88/734200088.db2.gz	VFTMCOAAPPZASI-LBPRGKRZSA-N	1	0	277.368	1.402	50	0		CDAARO
Cc1nc(C)c(C[N@@H+](C)CC2(O)CCOCC2)s1	ZINC000187112618	734312118	/nfs/dbraw/zinc/31/21/18/734312118.db2.gz	DSRKOFYTPTUZTH-UHFFFAOYSA-N	1	0	270.398	1.733	50	0		CDAARO
CC[N@H+](C)C[C@@]1(O)CCCN(Cc2ccc(F)cc2)C1=O	ZINC000012711215	734723150	/nfs/dbraw/zinc/72/31/50/734723150.db2.gz	YCENJGRHKRBQRT-INIZCTEOSA-N	1	0	294.370	1.631	50	0		CDAARO
Cc1nc(-c2cccc(NC(=O)[C@@H]3C=CC[NH2+]3)c2)n[nH]1	ZINC000952973150	734854536	/nfs/dbraw/zinc/85/45/36/734854536.db2.gz	RGXMJRKXOYUGPT-LBPRGKRZSA-N	1	0	269.308	1.247	50	0		CDAARO
[NH3+]CCCNS(=O)(=O)/C=C\c1ccccc1Cl	ZINC000821764471	735083403	/nfs/dbraw/zinc/08/34/03/735083403.db2.gz	XNINXAMWLKDUHV-TWGQIWQCSA-N	1	0	274.773	1.579	50	0		CDAARO
Nc1nc2c(c(NCCCc3ccncc3)n1)CC[NH2+]CC2	ZINC000072468237	735139829	/nfs/dbraw/zinc/13/98/29/735139829.db2.gz	VEOBVURQHGKCAS-UHFFFAOYSA-N	1	0	298.394	1.187	50	0		CDAARO
O=C(NC[C@@H]1CCCN(c2cc[nH+]cc2)C1)c1cnccn1	ZINC000952976435	735189574	/nfs/dbraw/zinc/18/95/74/735189574.db2.gz	RPBHXQDXODRBJF-ZDUSSCGKSA-N	1	0	297.362	1.518	50	0		CDAARO
O=C(N[C@H]1CC[NH2+]C1)c1ncccc1OCc1ccncc1	ZINC000178459477	735195571	/nfs/dbraw/zinc/19/55/71/735195571.db2.gz	RLCJEUKXCQSLEM-ZDUSSCGKSA-N	1	0	298.346	1.147	50	0		CDAARO
c1cc(C2CCN(c3ncnc4c3CC[NH2+]C4)CC2)ccn1	ZINC000067691634	736018863	/nfs/dbraw/zinc/01/88/63/736018863.db2.gz	KLGBAQFFAUPATQ-UHFFFAOYSA-N	1	0	295.390	1.901	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@@H]1NC(=O)Cc1ccc(O)cc1	ZINC000389081082	736082047	/nfs/dbraw/zinc/08/20/47/736082047.db2.gz	BAIPSSMXSHXLCA-UEKVPHQBSA-N	1	0	262.353	1.437	50	0		CDAARO
[NH3+]C[C@@H]1CN(C[C@H](O)C(F)(F)F)C[C@H]1c1ccccc1	ZINC000381295098	736340737	/nfs/dbraw/zinc/34/07/37/736340737.db2.gz	KZHBSTWDZQNFBX-AGIUHOORSA-N	1	0	288.313	1.584	50	0		CDAARO
CCCNC(=O)N(CC[NH+](C)C)C1CCOCC1	ZINC000675019286	899873344	/nfs/dbraw/zinc/87/33/44/899873344.db2.gz	LTRFYYOBIKALMB-UHFFFAOYSA-N	1	0	257.378	1.149	50	0		CDAARO
CC(C)n1ccnc1C[NH2+][C@@H]1CCNC(=O)CC1	ZINC000692907875	901377968	/nfs/dbraw/zinc/37/79/68/901377968.db2.gz	XILIKKWPVZMGOM-NSHDSACASA-N	1	0	250.346	1.222	50	0		CDAARO
CCN(Cc1nc(C(C)C)no1)C(=O)[C@H]1C=CC[NH2+]1	ZINC001506411765	908955540	/nfs/dbraw/zinc/95/55/40/908955540.db2.gz	UPKITMKJZINQOR-SNVBAGLBSA-N	1	0	264.329	1.070	50	0		CDAARO
CCC1CCC(CNC(=O)[C@@]2([NH3+])CC[C@@H](O)C2)CC1	ZINC000952884282	910459145	/nfs/dbraw/zinc/45/91/45/910459145.db2.gz	XTXQQAOIFVBRIA-UJFKTDLFSA-N	1	0	268.401	1.561	50	0		CDAARO
CCCC[C@@H]1C=CCN1C(=O)[C@H]1CCC[N@H+](CC(N)=O)C1	ZINC000952867556	910461881	/nfs/dbraw/zinc/46/18/81/910461881.db2.gz	OYMAASWJWSBAPR-UONOGXRCSA-N	1	0	293.411	1.141	50	0		CDAARO
CC(C)[C@@H](CNC(=O)c1cncnc1)[NH+]1CCCC1	ZINC000820696457	925544386	/nfs/dbraw/zinc/54/43/86/925544386.db2.gz	XIXGMETVKHSPLD-CYBMUJFWSA-N	1	0	262.357	1.327	50	0		CDAARO
C[N@@H+]1CCC[C@H]1C(=O)NCCCn1ncc2ccccc21	ZINC000823783378	925733159	/nfs/dbraw/zinc/73/31/59/925733159.db2.gz	FLARFOJIGBODGQ-HNNXBMFYSA-N	1	0	286.379	1.637	50	0		CDAARO
COCC1(C[NH2+][C@@H](C)Cn2ccnc2C)CCC1	ZINC000824346796	925816548	/nfs/dbraw/zinc/81/65/48/925816548.db2.gz	FFJFGGIWPWRFHE-LBPRGKRZSA-N	1	0	251.374	1.986	50	0		CDAARO
COc1cc(C(=O)NCCNc2cc[nH+]cc2C)ccn1	ZINC000824852006	925840581	/nfs/dbraw/zinc/84/05/81/925840581.db2.gz	NAZATAIVFKVOGN-UHFFFAOYSA-N	1	0	286.335	1.057	50	0		CDAARO
Cc1ccc(C)c(OCCNC(=O)N2CC[C@@H]([NH3+])C2)c1	ZINC000826951604	925925789	/nfs/dbraw/zinc/92/57/89/925925789.db2.gz	GYUSMKVLMAHXJB-CYBMUJFWSA-N	1	0	277.368	1.425	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1C(=O)NCc1ccc(CO)cc1	ZINC000827268003	925936977	/nfs/dbraw/zinc/93/69/77/925936977.db2.gz	LGZSGMLBXSJJDZ-CQSZACIVSA-N	1	0	277.368	1.202	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)[C@@H]1CC(C(C)C)=NO1	ZINC000827791997	925966656	/nfs/dbraw/zinc/96/66/56/925966656.db2.gz	SOWCCEXGPXACRD-AWEZNQCLSA-N	1	0	290.367	1.141	50	0		CDAARO
O=C(NC[C@H]1CCC[NH2+]C1)c1cccc2c1CCC2=O	ZINC000828177559	926059675	/nfs/dbraw/zinc/05/96/75/926059675.db2.gz	ULYALVPRUHIQJB-NSHDSACASA-N	1	0	272.348	1.545	50	0		CDAARO
CC[N@H+](C[C@H](O)[C@@H](C)O)[C@@H](C)c1cccc(OC)c1	ZINC000585117093	930977489	/nfs/dbraw/zinc/97/74/89/930977489.db2.gz	QODUOPBZWMCNTC-ZOWXZIJZSA-N	1	0	267.369	1.820	50	0		CDAARO
CN(C(=O)c1cn(C)cn1)[C@@H]1C[C@@H]2C[C@H]([NH+](C)C)C[C@@H]2C1	ZINC001529120075	968985384	/nfs/dbraw/zinc/98/53/84/968985384.db2.gz	SHLAQHVATMECRP-KPWCQOOUSA-N	1	0	290.411	1.611	50	0		CDAARO
Nc1ncccc1C[N@H+]1C[C@@H](Cc2ccncc2)[C@H](O)C1	ZINC001529173526	969004742	/nfs/dbraw/zinc/00/47/42/969004742.db2.gz	XVSZOBSTHRODHX-HUUCEWRRSA-N	1	0	284.363	1.094	50	0		CDAARO
Cc1cc(N[C@@H]2CCOC2)nc(N2CCCCC2)[nH+]1	ZINC001529186569	969007479	/nfs/dbraw/zinc/00/74/79/969007479.db2.gz	IEEWDXIQIVLKID-GFCCVEGCSA-N	1	0	262.357	1.976	50	0		CDAARO
Cc1ccccc1[C@]1(O)CC[N@H+](CCn2ccnc2)C1	ZINC001506402822	975150028	/nfs/dbraw/zinc/15/00/28/975150028.db2.gz	PVBVCKLFTFSJNT-INIZCTEOSA-N	1	0	271.364	1.785	50	0		CDAARO
CSc1cccc(C[NH2+][C@@H](C)CN(C)CCO)c1	ZINC001506411712	975154132	/nfs/dbraw/zinc/15/41/32/975154132.db2.gz	KGMBAWPLNRNGAH-LBPRGKRZSA-N	1	0	268.426	1.811	50	0		CDAARO
Cc1nncn1CCN1CCC([NH+]2CCCC2)CC1	ZINC001506417290	975154400	/nfs/dbraw/zinc/15/44/00/975154400.db2.gz	IAKWOBFHGBZLMH-UHFFFAOYSA-N	1	0	263.389	1.147	50	0		CDAARO
Cc1nncn1CC[N@H+]1CCC[C@](CO)(CC(C)C)C1	ZINC001506418294	975157241	/nfs/dbraw/zinc/15/72/41/975157241.db2.gz	RWQZJUZWQAOTIM-HNNXBMFYSA-N	1	0	280.416	1.707	50	0		CDAARO
CC[N@@H+]1CCC[C@@]2(CCCN(CCS(C)(=O)=O)C2)C1	ZINC001506425608	975160476	/nfs/dbraw/zinc/16/04/76/975160476.db2.gz	DHRRMACLEYURSR-CQSZACIVSA-N	1	0	288.457	1.229	50	0		CDAARO
Cc1nncn1CC[NH+]1CCC(O)(c2ccccc2)CC1	ZINC001506427073	975161024	/nfs/dbraw/zinc/16/10/24/975161024.db2.gz	KFZDCNWOSUNPFL-UHFFFAOYSA-N	1	0	286.379	1.570	50	0		CDAARO
Cc1ccccc1[C@@H]1C[C@H]1C(=O)N1CC[NH2+]C[C@H]1C	ZINC000124346548	187133797	/nfs/dbraw/zinc/13/37/97/187133797.db2.gz	GDUAESQXMLIFOG-VHDGCEQUSA-N	1	0	258.365	1.919	50	0		CDAARO
Cc1cc(C(=O)NCC[N@@H+](C(C)C)C2CC2)cc(=O)[nH]1	ZINC000096495020	230383921	/nfs/dbraw/zinc/38/39/21/230383921.db2.gz	VULBRJPDTCSLSC-UHFFFAOYSA-N	1	0	277.368	1.286	50	0		CDAARO
C[C@H]1C[C@H](NC(=O)CCC(=O)OC(C)(C)C)C[N@@H+]1C1CC1	ZINC000192395508	342467855	/nfs/dbraw/zinc/46/78/55/342467855.db2.gz	AYDFKXVWFGFBHU-RYUDHWBXSA-N	1	0	296.411	1.850	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C(=O)c1cncnc1	ZINC000584903598	341987287	/nfs/dbraw/zinc/98/72/87/341987287.db2.gz	WZJCEONVWYPFLH-UHFFFAOYSA-N	1	0	262.357	1.423	50	0		CDAARO
Nc1nc(NCc2cccc(CO)c2)cc(C2CC([NH3+])C2)n1	ZINC000220633787	230397680	/nfs/dbraw/zinc/39/76/80/230397680.db2.gz	BOHPDIQBTMXXKI-UHFFFAOYSA-N	1	0	299.378	1.368	50	0		CDAARO
Cc1noc(C)c1CSC(=[NH2+])N1CCOCC1	ZINC000095947261	185038431	/nfs/dbraw/zinc/03/84/31/185038431.db2.gz	UNKGILCLXAIRQT-UHFFFAOYSA-N	1	0	255.343	1.792	50	0		CDAARO
Cc1ccc(N2CCC[N@H+](CC[C@@H]3CCCO3)CC2)nn1	ZINC000189134379	365569906	/nfs/dbraw/zinc/56/99/06/365569906.db2.gz	LCOLHPCLZAAKHF-HNNXBMFYSA-N	1	0	290.411	1.866	50	0		CDAARO
CC(C)CSCC[N@@H+]1CCC[C@H](N2CCNC2=O)C1	ZINC000095976149	185051093	/nfs/dbraw/zinc/05/10/93/185051093.db2.gz	UHGBMSZWWRWVDK-ZDUSSCGKSA-N	1	0	285.457	1.865	50	0		CDAARO
Cn1cc(C(=O)C[C@H]2CCC[N@@H+]2C[C@@H]2CCOC2)cn1	ZINC000095977655	185052432	/nfs/dbraw/zinc/05/24/32/185052432.db2.gz	ZMTYBABQLQKULY-GXTWGEPZSA-N	1	0	277.368	1.494	50	0		CDAARO
CN(Cc1ncnn1C)[C@@H]1CC[N@H+](CCc2ccccc2)C1	ZINC000095995528	185059993	/nfs/dbraw/zinc/05/99/93/185059993.db2.gz	KOEDYGWHCBLNDS-MRXNPFEDSA-N	1	0	299.422	1.564	50	0		CDAARO
c1ccn2c(c1)nnc2C[NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCC2	ZINC000096003519	185062334	/nfs/dbraw/zinc/06/23/34/185062334.db2.gz	HAJSXVJANHZYEY-DFBGVHRSSA-N	1	0	284.363	1.777	50	0		CDAARO
C[C@@H](C[NH+](C)C)NC(=O)c1ccnc(OCC(F)F)c1	ZINC000241776781	361753184	/nfs/dbraw/zinc/75/31/84/361753184.db2.gz	RSMSGRRVJPVMGM-VIFPVBQESA-N	1	0	287.310	1.405	50	0		CDAARO
CO[C@@H]1CCN(C(=O)CC[C@@H]2CC[C@H](C)O2)[C@@H](C[NH3+])C1	ZINC000242292504	361755942	/nfs/dbraw/zinc/75/59/42/361755942.db2.gz	YMWFGDNPQADZJC-RFQIPJPRSA-N	1	0	284.400	1.299	50	0		CDAARO
CC[NH+](CC)C[C@H](O)COc1cccc(OC)c1	ZINC000015799118	342088604	/nfs/dbraw/zinc/08/86/04/342088604.db2.gz	LFZQQYKLMPZFSH-LBPRGKRZSA-N	1	0	253.342	1.777	50	0		CDAARO
COC(=O)N1CCC[C@H]([NH2+]C2Cc3ccccc3C2)C1	ZINC000089401080	539087466	/nfs/dbraw/zinc/08/74/66/539087466.db2.gz	FUXSZZDRMOFFLO-AWEZNQCLSA-N	1	0	274.364	1.974	50	0		CDAARO
CC[C@@H]1CCC[N@@H+](C2CCN(S(C)(=O)=O)CC2)CC1	ZINC000095457115	539088035	/nfs/dbraw/zinc/08/80/35/539088035.db2.gz	JCWZYSNLRMYGGS-CYBMUJFWSA-N	1	0	288.457	1.923	50	0		CDAARO
COC(=O)[C@@H](N)Cc1ccc(C(=O)OC(C)(C)C)cc1	ZINC000514277675	342146171	/nfs/dbraw/zinc/14/61/71/342146171.db2.gz	IJXRCOXZKNNGBQ-LBPRGKRZSA-N	1	0	279.336	1.685	50	0		CDAARO
CN(Cc1nccs1)c1cc([C@H]2C[C@@H](O)C2)[nH+]c(N)n1	ZINC000244723981	361860557	/nfs/dbraw/zinc/86/05/57/361860557.db2.gz	MLGAYFPYEDLFFW-DTORHVGOSA-N	1	0	291.380	1.390	50	0		CDAARO
C[C@H]1SCC[N@H+](CCn2nc3ccccn3c2=O)[C@H]1C	ZINC000097002216	185150631	/nfs/dbraw/zinc/15/06/31/185150631.db2.gz	VLVVEDQLEMGFBA-NWDGAFQWSA-N	1	0	292.408	1.322	50	0		CDAARO
C[C@H]1CN(c2nc3ccccc3[nH]2)C[C@H]1[NH+]1CCOCC1	ZINC000270554382	361931021	/nfs/dbraw/zinc/93/10/21/361931021.db2.gz	HFBHTQJUZQVQGY-SWLSCSKDSA-N	1	0	286.379	1.720	50	0		CDAARO
NC(=O)[C@H]1CN(C(=O)c2ccc(C[NH3+])cc2)c2ccccc21	ZINC000097019139	185153138	/nfs/dbraw/zinc/15/31/38/185153138.db2.gz	PKUGSEVOZSWZEG-AWEZNQCLSA-N	1	0	295.342	1.375	50	0		CDAARO
CCc1nn(C)cc1C[N@@H+]1CCC[C@@H](N2CCCC2=O)C1	ZINC000097033938	185155739	/nfs/dbraw/zinc/15/57/39/185155739.db2.gz	IUZXHVJNMROAIB-CQSZACIVSA-N	1	0	290.411	1.569	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@](C)(C[NH2+]CCCO)C1	ZINC000585136792	342216034	/nfs/dbraw/zinc/21/60/34/342216034.db2.gz	SPLSBYVNGOSSFT-OAHLLOKOSA-N	1	0	286.416	1.996	50	0		CDAARO
CN1C[C@@]2(CC[N@H+](Cc3ccsc3)C2)OCC1=O	ZINC000670441525	539114223	/nfs/dbraw/zinc/11/42/23/539114223.db2.gz	OCXYODHPPRIKMR-CYBMUJFWSA-N	1	0	266.366	1.181	50	0		CDAARO
CCCC[C@@H](NC1CC[NH+]([C@H]2CCOC2)CC1)C(=O)OC	ZINC000585091311	362019984	/nfs/dbraw/zinc/01/99/84/362019984.db2.gz	CGCCLUWTGJLQQF-LSDHHAIUSA-N	1	0	298.427	1.561	50	0		CDAARO
CC[C@@H](C)C[N@H+](C)[C@H]1CCN(CCC(=O)OC)C1=O	ZINC000585094193	362021356	/nfs/dbraw/zinc/02/13/56/362021356.db2.gz	OEPYSUCRPIPTGG-NEPJUHHUSA-N	1	0	270.373	1.128	50	0		CDAARO
C[NH+](C)[C@H]1CCN(C(=O)c2nc3ccc(O)cc3s2)C1	ZINC000585118808	362037856	/nfs/dbraw/zinc/03/78/56/362037856.db2.gz	CMFFVBSMRPDNPI-VIFPVBQESA-N	1	0	291.376	1.778	50	0		CDAARO
C[NH+](C)CCc1ccc(NC(=O)[C@@]2(C)CCNC2=O)cc1	ZINC000585121006	362040475	/nfs/dbraw/zinc/04/04/75/362040475.db2.gz	BOYXLHZFUFCUEW-INIZCTEOSA-N	1	0	289.379	1.255	50	0		CDAARO
CCCCNC(=O)[C@H](C)N1CCC([NH+]2CCOCC2)CC1	ZINC000585116302	362044169	/nfs/dbraw/zinc/04/41/69/362044169.db2.gz	PFNXRRKUJXPUSS-AWEZNQCLSA-N	1	0	297.443	1.088	50	0		CDAARO
C[C@H]1C[NH+](CCCNC(=O)c2ccncc2)C[C@H](C)O1	ZINC000036391937	362048812	/nfs/dbraw/zinc/04/88/12/362048812.db2.gz	PGIRNMBDMYXKDG-STQMWFEESA-N	1	0	277.368	1.311	50	0		CDAARO
OCC[NH2+]C1CCN(c2ccc(C(F)(F)F)nn2)CC1	ZINC000092689468	342416839	/nfs/dbraw/zinc/41/68/39/342416839.db2.gz	QVKMLEIPRFZCBD-UHFFFAOYSA-N	1	0	290.289	1.046	50	0		CDAARO
COc1cccc(/C(C)=C/C(=O)N2CC[C@@H](C[NH3+])C2)c1	ZINC000178564370	362247063	/nfs/dbraw/zinc/24/70/63/362247063.db2.gz	HQMCXAKDXGOQTC-RPHSKFLZSA-N	1	0	274.364	1.906	50	0		CDAARO
Cc1nn(C)c2nc(N3CC[N@@H+]4CCC[C@@H]4C3)sc12	ZINC000095523206	282285209	/nfs/dbraw/zinc/28/52/09/282285209.db2.gz	FPONXCJKANDGKP-SNVBAGLBSA-N	1	0	277.397	1.623	50	0		CDAARO
Cc1cc(-c2cnc3ncnn3c2[C@@H]2CCC[NH2+]C2)on1	ZINC000095629434	343653823	/nfs/dbraw/zinc/65/38/23/343653823.db2.gz	WZRDXKDISPFCFD-SNVBAGLBSA-N	1	0	284.323	1.555	50	0		CDAARO
CN(CCn1cncn1)[C@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000096445750	529940955	/nfs/dbraw/zinc/94/09/55/529940955.db2.gz	VOCYRZSQJDMKQX-KRWDZBQOSA-N	1	0	299.422	1.875	50	0		CDAARO
CO[C@@H](C)c1nc(C)c(C(=O)N(C)[C@@H]2CC[NH2+]C2)s1	ZINC000179095182	362253495	/nfs/dbraw/zinc/25/34/95/362253495.db2.gz	DEXPCHCGWXVCFY-VHSXEESVSA-N	1	0	283.397	1.593	50	0		CDAARO
COc1ccccc1/C=C/C(=O)N1CC[N@H+](C)C[C@@H]1C	ZINC000089937763	362323608	/nfs/dbraw/zinc/32/36/08/362323608.db2.gz	VXWNCDJFTYBMHI-XEHSLEBBSA-N	1	0	274.364	1.871	50	0		CDAARO
COC(C)(C)CNC(=O)N(C)CC1([NH+](C)C)CCC1	ZINC000189926703	362341643	/nfs/dbraw/zinc/34/16/43/362341643.db2.gz	BKXRKZJGGGOYPR-UHFFFAOYSA-N	1	0	271.405	1.537	50	0		CDAARO
C[C@@H](NC(=O)C[NH+]1CCCC1)c1nc2ccccc2[nH]1	ZINC000252484420	362385666	/nfs/dbraw/zinc/38/56/66/362385666.db2.gz	FVTLOGJCFUUUBI-LLVKDONJSA-N	1	0	272.352	1.836	50	0		CDAARO
[NH3+]C1CC(c2cc(NC[C@H]3CC[C@H](CO)CC3)ncn2)C1	ZINC000252519067	362392150	/nfs/dbraw/zinc/39/21/50/362392150.db2.gz	AWBFFWTWNUALDF-HXZBBRIXSA-N	1	0	290.411	1.892	50	0		CDAARO
Nc1nc([C@H]2C[C@@H]([NH3+])C2)cc(N2CCCCCC2)n1	ZINC000252533054	362392190	/nfs/dbraw/zinc/39/21/90/362392190.db2.gz	FUDSXBMNBZWBKP-PHIMTYICSA-N	1	0	261.373	1.644	50	0		CDAARO
O[C@H]1C[C@@H]([C@@H](Cc2ccncc2)[NH2+]C2CCOCC2)C1	ZINC000252572399	362393250	/nfs/dbraw/zinc/39/32/50/362393250.db2.gz	ZFNUXKIDZWQVDP-VNQPRFMTSA-N	1	0	276.380	1.532	50	0		CDAARO
COc1ccc(OCCN(C)C(=O)[C@@H]2CCC[C@@H]2[NH3+])cc1	ZINC000085366938	179037163	/nfs/dbraw/zinc/03/71/63/179037163.db2.gz	GKEYHTJOSLAXDM-CABCVRRESA-N	1	0	292.379	1.660	50	0		CDAARO
Cc1ccccc1CN1CC[NH+](C[C@H](O)C2CC2)CC1	ZINC000085436861	179062611	/nfs/dbraw/zinc/06/26/11/179062611.db2.gz	YXXOFWYJRZTOQV-KRWDZBQOSA-N	1	0	274.408	1.884	50	0		CDAARO
Cn1ccc(CN2CCO[C@H](c3ccccc3)C2)cc1=O	ZINC000613407736	347716801	/nfs/dbraw/zinc/71/68/01/347716801.db2.gz	PJNYMCRHABBZND-INIZCTEOSA-N	1	0	284.359	1.959	50	0		CDAARO
CCS(=O)(=O)C1CCN(CC[NH+]2CCCCC2)CC1	ZINC000193232064	362901410	/nfs/dbraw/zinc/90/14/10/362901410.db2.gz	MTDZMKYPOHKYKC-UHFFFAOYSA-N	1	0	288.457	1.371	50	0		CDAARO
Cc1[nH]nc(C(=O)NC[C@H]2CCCC[N@H+]2C)c1Cl	ZINC000584885472	349343019	/nfs/dbraw/zinc/34/30/19/349343019.db2.gz	UJPKIUDJRPOMBZ-SECBINFHSA-N	1	0	270.764	1.586	50	0		CDAARO
CC(=O)NC(C)(C)C[C@@H](C)[NH2+]CC1(CO)CCOCC1	ZINC000584886746	349344646	/nfs/dbraw/zinc/34/46/46/349344646.db2.gz	LYQGEUWAWNVHJJ-GFCCVEGCSA-N	1	0	286.416	1.058	50	0		CDAARO
Cc1cncc(C(=O)NCCC[N@@H+]2CCCC[C@H]2CO)c1	ZINC000584888632	349347163	/nfs/dbraw/zinc/34/71/63/349347163.db2.gz	HEVRNJHQVQDCSX-HNNXBMFYSA-N	1	0	291.395	1.357	50	0		CDAARO
[NH3+]Cc1cccc(C(=O)N[C@H]2CCc3c[nH]nc3C2)c1	ZINC000584888539	349347303	/nfs/dbraw/zinc/34/73/03/349347303.db2.gz	XSDYABUCVHVGST-ZDUSSCGKSA-N	1	0	270.336	1.156	50	0		CDAARO
CN(CC1(CO)CCC1)C(=O)[C@@H]1CCCCC[N@@H+]1C	ZINC000584888737	349347312	/nfs/dbraw/zinc/34/73/12/349347312.db2.gz	QYEISNPOWBDAAU-ZDUSSCGKSA-N	1	0	268.401	1.482	50	0		CDAARO
CCCCOCC(=O)N1CCC(O)(C[NH+]2CCCC2)CC1	ZINC000584892990	349352839	/nfs/dbraw/zinc/35/28/39/349352839.db2.gz	PJTLEOWKPPFNGP-UHFFFAOYSA-N	1	0	298.427	1.252	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]CCc1cnn(C)c1	ZINC000584892857	349352967	/nfs/dbraw/zinc/35/29/67/349352967.db2.gz	ATELRMKCNHHZDE-LBPRGKRZSA-N	1	0	261.373	1.400	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1NC(=O)N(C)Cc1ccoc1	ZINC000584893907	349353442	/nfs/dbraw/zinc/35/34/42/349353442.db2.gz	VDWNQQOUOSMUAF-KBPBESRZSA-N	1	0	295.383	1.529	50	0		CDAARO
CO[C@H]1CCN(C(=O)C2([NH+]3CCCC3)CCCC2)C1	ZINC000584900853	349363161	/nfs/dbraw/zinc/36/31/61/349363161.db2.gz	VXXCOXNNGUZTJW-ZDUSSCGKSA-N	1	0	266.385	1.642	50	0		CDAARO
COCCCCN1CCN(C(=O)[C@@H](C)[NH+]2CCCC2)CC1	ZINC000584901060	349363308	/nfs/dbraw/zinc/36/33/08/349363308.db2.gz	SZENDMJJYAEVKT-OAHLLOKOSA-N	1	0	297.443	1.042	50	0		CDAARO
Cc1noc(C2CCN(C(=O)[C@@H]3CCC[N@@H+](C)C3)CC2)n1	ZINC000090608694	180012139	/nfs/dbraw/zinc/01/21/39/180012139.db2.gz	CXVWWVPKVMNMQR-CYBMUJFWSA-N	1	0	292.383	1.426	50	0		CDAARO
CC(C)Cc1cc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)n(C)n1	ZINC000091417062	180149539	/nfs/dbraw/zinc/14/95/39/180149539.db2.gz	BTJHSUNLSMHNLF-KGLIPLIRSA-N	1	0	290.411	1.428	50	0		CDAARO
Cc1cc(CC(=O)N2CC([N@H+]3CCCC[C@H]3C)C2)on1	ZINC000091596088	180202445	/nfs/dbraw/zinc/20/24/45/180202445.db2.gz	GTFZOYPWMSCNPT-GFCCVEGCSA-N	1	0	277.368	1.611	50	0		CDAARO
CC[C@H]1CN(C(=O)CCCn2ccnc2)CC[N@@H+]1C(C)C	ZINC000091536105	180182349	/nfs/dbraw/zinc/18/23/49/180182349.db2.gz	KSDWFVIKRKIUCC-HNNXBMFYSA-N	1	0	292.427	1.995	50	0		CDAARO
Nc1nc(CCNc2nc(N)[nH+]c3c2CCCC3)cs1	ZINC000091650528	180216380	/nfs/dbraw/zinc/21/63/80/180216380.db2.gz	IKTKMSDFYSZZIO-UHFFFAOYSA-N	1	0	290.396	1.631	50	0		CDAARO
CCOc1ccccc1C[NH2+]C[C@H]1CN(C)CCO1	ZINC000105472217	186058587	/nfs/dbraw/zinc/05/85/87/186058587.db2.gz	XWTGZPUGGFRHQT-AWEZNQCLSA-N	1	0	264.369	1.506	50	0		CDAARO
Cc1ccc([C@H]2CN(C(=O)c3cccc(O)c3)C[C@@H]2[NH3+])o1	ZINC000091997651	180302987	/nfs/dbraw/zinc/30/29/87/180302987.db2.gz	LYEBUOFAIRCGPD-KBPBESRZSA-N	1	0	286.331	1.861	50	0		CDAARO
CN(C)c1ccccc1C(=O)N1C[C@H]([NH3+])[C@@H](C2CC2)C1	ZINC000092078829	180318541	/nfs/dbraw/zinc/31/85/41/180318541.db2.gz	BHOIZHFCHHXPON-KGLIPLIRSA-N	1	0	273.380	1.562	50	0		CDAARO
C[C@H](CNC(=O)c1ccncc1)[N@@H+]1CCC[C@H](C)C1	ZINC000106078697	186101268	/nfs/dbraw/zinc/10/12/68/186101268.db2.gz	FQNWIOPQFJSMNW-QWHCGFSZSA-N	1	0	261.369	1.932	50	0		CDAARO
O=C(CCN1CCSC1=O)N[C@@H]1CC[N@@H+]2CCCC[C@H]12	ZINC000106079199	186102072	/nfs/dbraw/zinc/10/20/72/186102072.db2.gz	PJPHHROYLBXCJW-VXGBXAGGSA-N	1	0	297.424	1.288	50	0		CDAARO
c1nc2ccccn2c1C[NH2+]C[C@H]1CN(C2CC2)CCO1	ZINC000106379554	186111676	/nfs/dbraw/zinc/11/16/76/186111676.db2.gz	YFHPHDIFDKMFDB-HNNXBMFYSA-N	1	0	286.379	1.287	50	0		CDAARO
CC(C)CCN1C(=O)C[C@@H]([N@@H+]2CC[C@@]3(CCOC3)C2)C1=O	ZINC000110677813	186312444	/nfs/dbraw/zinc/31/24/44/186312444.db2.gz	LWTYVPAICCMJPD-CZUORRHYSA-N	1	0	294.395	1.272	50	0		CDAARO
C[C@@H](Cn1cnc2c(cnn2C)c1=O)[NH2+]Cc1ccccc1	ZINC000583652279	366019391	/nfs/dbraw/zinc/01/93/91/366019391.db2.gz	LAZYHORRHVWRIB-LBPRGKRZSA-N	1	0	297.362	1.308	50	0		CDAARO
C[C@H]([NH3+])C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000121581029	186982596	/nfs/dbraw/zinc/98/25/96/186982596.db2.gz	WQYINDSPEMMTEK-IACUBPJLSA-N	1	0	262.353	1.448	50	0		CDAARO
CN(CCOc1ccccc1)c1ncnc2c1cnn2C	ZINC000014213317	366133296	/nfs/dbraw/zinc/13/32/96/366133296.db2.gz	LGCCUMGHKXREAD-UHFFFAOYSA-N	1	0	283.335	1.879	50	0		CDAARO
CCN(CC(=O)NC(C)(C)C)c1ncnc2c1cnn2C	ZINC000014213245	366133312	/nfs/dbraw/zinc/13/33/12/366133312.db2.gz	RLGLWKUUADSZII-UHFFFAOYSA-N	1	0	290.371	1.104	50	0		CDAARO
O=C(N1CCc2[nH]cnc2C1)C1([NH+]2CCCC2)CCCC1	ZINC000065528418	363303537	/nfs/dbraw/zinc/30/35/37/363303537.db2.gz	YOILFXRKXLZOPC-UHFFFAOYSA-N	1	0	288.395	1.703	50	0		CDAARO
COC(=O)[C@H](CC(C)C)NC(=O)[C@@H]([NH3+])CC(C)C	ZINC000002530792	355973636	/nfs/dbraw/zinc/97/36/36/355973636.db2.gz	AJMOLNFDYWTVQW-QWRGUYRKSA-N	1	0	258.362	1.064	50	0	in-vitro	CDAARO
O=S(=O)(Cc1ccccc1)NCC[NH+]1CCCCC1	ZINC000004750029	356042279	/nfs/dbraw/zinc/04/22/79/356042279.db2.gz	HXIDUCICCQNALN-UHFFFAOYSA-N	1	0	282.409	1.592	50	0		CDAARO
COc1ccc(C[NH+]2CCC(O)CC2)cc1OC	ZINC000005361184	356052264	/nfs/dbraw/zinc/05/22/64/356052264.db2.gz	VDOQGKNUDAOWCK-UHFFFAOYSA-N	1	0	251.326	1.661	50	0		CDAARO
CC1=C[C@H](C)[C@H]2C(=O)N(CCC[NH+](C)C)C(=O)[C@@H]2C1	ZINC000004197740	356022260	/nfs/dbraw/zinc/02/22/60/356022260.db2.gz	OLVIZFKZLFJCGX-YNEHKIRRSA-N	1	0	264.369	1.525	50	0		CDAARO
CC[NH+]1CCN(c2nc(-c3ccc(C)cc3)cc(=O)[nH]2)CC1	ZINC000009698308	356244112	/nfs/dbraw/zinc/24/41/12/356244112.db2.gz	WHRVQMLWMHEAOT-UHFFFAOYSA-N	1	0	298.390	1.887	50	0		CDAARO
Cc1cnc(C(=O)NC[C@@H](C)N2C[C@@H](C)O[C@@H](C)C2)cn1	ZINC000032828443	356383060	/nfs/dbraw/zinc/38/30/60/356383060.db2.gz	ALAJWRUSURRLSN-UPJWGTAASA-N	1	0	292.383	1.013	50	0		CDAARO
Cc1ccc(C(=O)O[C@H](C)CN2CC[NH+](C)CC2)cc1	ZINC000019359361	356482667	/nfs/dbraw/zinc/48/26/67/356482667.db2.gz	BQUNOPATNHQYBA-CQSZACIVSA-N	1	0	276.380	1.788	50	0		CDAARO
CC(C)=CC[N@@H+]1CCC[C@@H](Cn2cc(CCCO)nn2)C1	ZINC000019145884	356475995	/nfs/dbraw/zinc/47/59/95/356475995.db2.gz	ZXPPVKFKJIVMHK-OAHLLOKOSA-N	1	0	292.427	1.881	50	0		CDAARO
CCc1ccccc1OCCOCCNCC[NH3+]	ZINC000019772613	356501933	/nfs/dbraw/zinc/50/19/33/356501933.db2.gz	GLJGVWIBJFALNK-UHFFFAOYSA-N	1	0	252.358	1.193	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2ccc(F)cc2F)CC1	ZINC000020027046	356521700	/nfs/dbraw/zinc/52/17/00/356521700.db2.gz	IDIILTJFSQFNDR-UHFFFAOYSA-N	1	0	283.322	1.541	50	0		CDAARO
COc1cc(C)c(CN2CC[N@H+](C)[C@@H](CCO)C2)cc1C	ZINC000023374762	356641785	/nfs/dbraw/zinc/64/17/85/356641785.db2.gz	DJLXKNRCDIQDCZ-INIZCTEOSA-N	1	0	292.423	1.810	50	0		CDAARO
CNC(=O)c1ccc(C[N@H+](CCOC)C2CC2)cc1	ZINC000025198030	356669917	/nfs/dbraw/zinc/66/99/17/356669917.db2.gz	NPTNGYBSOAAATP-UHFFFAOYSA-N	1	0	262.353	1.657	50	0		CDAARO
COCC(=O)NC[C@H](C)[N@@H+]1CCc2ccccc2C1	ZINC000025939163	356685773	/nfs/dbraw/zinc/68/57/73/356685773.db2.gz	ABILSTNWWBGOOK-LBPRGKRZSA-N	1	0	262.353	1.196	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)c1cnccn1)c1cccs1	ZINC000027676255	356712396	/nfs/dbraw/zinc/71/23/96/356712396.db2.gz	WXTJOXZIVPBIKO-NSHDSACASA-N	1	0	276.365	1.571	50	0		CDAARO
CN(C(=O)Cc1ccc2c(c1)CCO2)C1CC[NH+](C)CC1	ZINC000032888160	356788526	/nfs/dbraw/zinc/78/85/26/356788526.db2.gz	UCCGBKAHPANPHD-UHFFFAOYSA-N	1	0	288.391	1.717	50	0		CDAARO
COc1ccc(S(=O)(=O)C2CC[NH2+]CC2)cc1	ZINC000034103802	356809675	/nfs/dbraw/zinc/80/96/75/356809675.db2.gz	JMPBLOVCCHRJPM-UHFFFAOYSA-N	1	0	255.339	1.221	50	0		CDAARO
Cc1nn[nH]c1C(=O)NCc1ccc(C[NH+]2CCCC2)cc1	ZINC000189856570	356819989	/nfs/dbraw/zinc/81/99/89/356819989.db2.gz	PBEKTKVPULKESH-UHFFFAOYSA-N	1	0	299.378	1.639	50	0		CDAARO
C[NH2+][C@@H](C)c1cccc(N2CCCS2(=O)=O)c1	ZINC000036880980	356888982	/nfs/dbraw/zinc/88/89/82/356888982.db2.gz	AGCBTVPOGKFJMO-JTQLQIEISA-N	1	0	254.355	1.507	50	0		CDAARO
C[C@@H](C1CCN(c2nccnc2N(C)C)CC1)[NH+](C)C	ZINC000096140841	357172129	/nfs/dbraw/zinc/17/21/29/357172129.db2.gz	ATVGLRMCINFPLR-LBPRGKRZSA-N	1	0	277.416	1.709	50	0		CDAARO
COC(=O)CC(=O)[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000048623183	357193064	/nfs/dbraw/zinc/19/30/64/357193064.db2.gz	SXQVHCRWMOYTMU-ZDUSSCGKSA-N	1	0	261.321	1.641	50	0		CDAARO
CSCCC[N@@H+]1CCC[C@@H](c2cc(C(N)=O)[nH]n2)C1	ZINC000095402722	357195390	/nfs/dbraw/zinc/19/53/90/357195390.db2.gz	VZQOPGOZSDYXGO-SNVBAGLBSA-N	1	0	282.413	1.441	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)COc1ccc(F)cc1	ZINC000054460359	357320800	/nfs/dbraw/zinc/32/08/00/357320800.db2.gz	SKLJONDQPWPTBT-ZDUSSCGKSA-N	1	0	280.343	1.805	50	0		CDAARO
CCOc1cc(C[NH2+][C@H]2CCN(C3CC3)C2)ccn1	ZINC000095420331	357337983	/nfs/dbraw/zinc/33/79/83/357337983.db2.gz	VRAOTXYZFHBTLF-ZDUSSCGKSA-N	1	0	261.369	1.807	50	0		CDAARO
COC[C@@H](C)[NH2+]CCc1nc(C)c2c(n1)CCCC2	ZINC000065385047	357534576	/nfs/dbraw/zinc/53/45/76/357534576.db2.gz	IANBDYAHPWRTQY-LLVKDONJSA-N	1	0	263.385	1.831	50	0		CDAARO
Cc1cc2nc(C[NH2+][C@H](C)Cn3cncn3)[nH]c2cc1C	ZINC000067785659	357627019	/nfs/dbraw/zinc/62/70/19/357627019.db2.gz	VLQXAMOEFNUJPI-GFCCVEGCSA-N	1	0	284.367	1.950	50	0		CDAARO
CN(CC[NH+]1CCCCCC1)C(=O)[C@@H]1CCCCO1	ZINC000067895967	357636522	/nfs/dbraw/zinc/63/65/22/357636522.db2.gz	UCFRWPGFQFZDKC-AWEZNQCLSA-N	1	0	268.401	1.890	50	0		CDAARO
CCn1nc(C)c(C(=O)N2CC[NH2+][C@H](C)C2)c1Cl	ZINC000188456752	357689312	/nfs/dbraw/zinc/68/93/12/357689312.db2.gz	NPXPMVBFYVECNK-MRVPVSSYSA-N	1	0	270.764	1.299	50	0		CDAARO
CC(C)(O)CCc1ccc(C[N@@H+]2CC[C@](O)(CO)C2)cc1	ZINC000072423380	357834103	/nfs/dbraw/zinc/83/41/03/357834103.db2.gz	AKUMMXQJPZNHNE-QGZVFWFLSA-N	1	0	293.407	1.319	50	0		CDAARO
C[N@H+](CCc1ccncc1)Cc1cnc2cnccn12	ZINC000097113791	357983154	/nfs/dbraw/zinc/98/31/54/357983154.db2.gz	UCZFIWXWGNGTFM-UHFFFAOYSA-N	1	0	267.336	1.799	50	0		CDAARO
C[C@H]([NH2+]CCS(=O)(=O)c1ccccc1)[C@@H]1CCCO1	ZINC000097108724	357983701	/nfs/dbraw/zinc/98/37/01/357983701.db2.gz	URJHRYJJCKRWBM-JSGCOSHPSA-N	1	0	283.393	1.617	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)NCc1ccccc1F)[C@H]1CCCO1	ZINC000097111737	357986855	/nfs/dbraw/zinc/98/68/55/357986855.db2.gz	INUITPNANDIHEM-BXUZGUMPSA-N	1	0	280.343	1.599	50	0		CDAARO
Cc1nc(CN[C@@H](CC(N)=O)C2CCCCC2)no1	ZINC000097111043	357987015	/nfs/dbraw/zinc/98/70/15/357987015.db2.gz	RRJOEJBQOOGHGI-NSHDSACASA-N	1	0	266.345	1.292	50	0		CDAARO
C[NH2+]CC(=O)N1CCC(Oc2ccc(Cl)cc2)CC1	ZINC000082092633	358146883	/nfs/dbraw/zinc/14/68/83/358146883.db2.gz	OOTRLFJMQFVPRM-UHFFFAOYSA-N	1	0	282.771	1.929	50	0		CDAARO
C[NH2+]CC(=O)N1CCC(Oc2ccc(C)cc2)CC1	ZINC000082134770	358148978	/nfs/dbraw/zinc/14/89/78/358148978.db2.gz	UAIZXRHCMHKXLZ-UHFFFAOYSA-N	1	0	262.353	1.584	50	0		CDAARO
C[C@@H](CCc1cccc(F)c1)[N@@H+]1C[C@@H](C)O[C@@H](C(N)=O)C1	ZINC000097084478	358184245	/nfs/dbraw/zinc/18/42/45/358184245.db2.gz	HXTRVNDAGZZWNV-YWPYICTPSA-N	1	0	294.370	1.721	50	0		CDAARO
C[N@@H+]1CC[C@H](CNC(=O)CCOc2ccccc2)C1	ZINC000067679327	358330195	/nfs/dbraw/zinc/33/01/95/358330195.db2.gz	QFPOATFZKJGJND-CYBMUJFWSA-N	1	0	262.353	1.523	50	0		CDAARO
CCOC[C@H](O)C[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1	ZINC000195547762	358560939	/nfs/dbraw/zinc/56/09/39/358560939.db2.gz	DIIJGYMCKOAPRN-MCIONIFRSA-N	1	0	267.373	1.163	50	0		CDAARO
[NH3+]CC(=O)N[C@H]1CCCc2nc(-c3ccccc3)ncc21	ZINC000092062462	358536909	/nfs/dbraw/zinc/53/69/09/358536909.db2.gz	YCJHVTIUJLKUSI-ZDUSSCGKSA-N	1	0	282.347	1.596	50	0		CDAARO
COC(=O)c1cc(F)c(N2CC[NH2+]CC2)nc1Cl	ZINC000095836293	358703708	/nfs/dbraw/zinc/70/37/08/358703708.db2.gz	XSWRNBAWWFPKPS-UHFFFAOYSA-N	1	0	273.695	1.070	50	0		CDAARO
COC(=O)c1cc(Cl)nc(N2CCC[NH2+]CC2)c1	ZINC000095215881	358679989	/nfs/dbraw/zinc/67/99/89/358679989.db2.gz	PNBUKXIDAMKBCZ-UHFFFAOYSA-N	1	0	269.732	1.321	50	0		CDAARO
CC(C)n1cc(C(=O)N2C[C@H]3CC[C@@H]2C[N@H+](C)C3)cn1	ZINC000097272422	358764329	/nfs/dbraw/zinc/76/43/29/358764329.db2.gz	NUCFMJSLQPFAHR-GXTWGEPZSA-N	1	0	276.384	1.630	50	0		CDAARO
Cc1cc(C(N)=O)ccc1NC(=O)N(C)[C@H]1CC[N@H+](C)C1	ZINC000096165014	358711814	/nfs/dbraw/zinc/71/18/14/358711814.db2.gz	JOQZLLRTFZBAJS-LBPRGKRZSA-N	1	0	290.367	1.262	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@H](OC2CC[NH2+]CC2)C1	ZINC000098089957	358812906	/nfs/dbraw/zinc/81/29/06/358812906.db2.gz	JVTZDQRIYKNYSF-LBPRGKRZSA-N	1	0	270.373	1.764	50	0		CDAARO
CCOC(=O)CC[NH2+]C[C@@H]1COc2ccccc2O1	ZINC000002483474	358785354	/nfs/dbraw/zinc/78/53/54/358785354.db2.gz	HNXGXYPCJMVNQV-LLVKDONJSA-N	1	0	265.309	1.369	50	0		CDAARO
Cc1[nH]nc(C2CC2)c1C(=O)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000097572338	358785803	/nfs/dbraw/zinc/78/58/03/358785803.db2.gz	NDGGMPKDAMCNFC-NEPJUHHUSA-N	1	0	274.368	1.562	50	0		CDAARO
c1cc2nonc2c(CN2C[C@H]3CC[C@@H](C2)[NH2+]C3)c1	ZINC000097732811	358795960	/nfs/dbraw/zinc/79/59/60/358795960.db2.gz	HKEKLXNLJGUEOT-JQWIXIFHSA-N	1	0	258.325	1.407	50	0		CDAARO
CCOc1ccc(CN(C)CC[NH2+]C)cc1CO	ZINC000097773239	358797777	/nfs/dbraw/zinc/79/77/77/358797777.db2.gz	PXRJQAXIHGBMMM-UHFFFAOYSA-N	1	0	252.358	1.229	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1C(=O)NCCc1ccco1	ZINC000097766677	358797968	/nfs/dbraw/zinc/79/79/68/358797968.db2.gz	WUJYVXNXPCXHNO-CYBMUJFWSA-N	1	0	250.342	1.813	50	0		CDAARO
COC(=O)N1C[C@H]2[C@H](C[N@H+](C)Cc3ccno3)[C@H]2C1	ZINC000101771184	358861730	/nfs/dbraw/zinc/86/17/30/358861730.db2.gz	NAUZDXZQBQSHDN-CNDDSTCGSA-N	1	0	265.313	1.051	50	0		CDAARO
[NH3+][C@@H]1CCCCN(C(=O)CC2=CSC3=NCCCN23)C1	ZINC000102476169	358879919	/nfs/dbraw/zinc/87/99/19/358879919.db2.gz	LVLANBREJUCKLV-LLVKDONJSA-N	1	0	294.424	1.366	50	0		CDAARO
O=C(C(=O)N1CC[C@@H]([NH+]2CCCCC2)C1)c1ccccc1	ZINC000215329356	358884566	/nfs/dbraw/zinc/88/45/66/358884566.db2.gz	CSLDARHFLTXCQD-OAHLLOKOSA-N	1	0	286.375	1.956	50	0		CDAARO
CSc1ccccc1C[N@@H+]1CCC[C@@](O)(CO)C1	ZINC000215497689	358892158	/nfs/dbraw/zinc/89/21/58/358892158.db2.gz	GELYLWPBBWRDAL-AWEZNQCLSA-N	1	0	267.394	1.728	50	0		CDAARO
CN(Cc1ncc[nH]1)Cc1ccc(OCC[NH+](C)C)cc1	ZINC000215626444	358895801	/nfs/dbraw/zinc/89/58/01/358895801.db2.gz	VWJZLZLBRHOZBD-UHFFFAOYSA-N	1	0	288.395	1.982	50	0		CDAARO
Cc1cc(CN2CCCO[C@@H](Cn3cccn3)C2)on1	ZINC000215684038	358899313	/nfs/dbraw/zinc/89/93/13/358899313.db2.gz	GDUFXOWFIPJANU-CQSZACIVSA-N	1	0	276.340	1.471	50	0		CDAARO
O=C(CC[NH+]1Cc2ccccc2C1)N[C@H]1C[C@@H]2OCC[C@H]12	ZINC000219556491	359104733	/nfs/dbraw/zinc/10/47/33/359104733.db2.gz	BXKZAJTYKHKJDY-PMPSAXMXSA-N	1	0	286.375	1.686	50	0		CDAARO
CO[C@@H]1COCC[C@H]1Nc1cc(OC(C)C)nc(N)n1	ZINC000222973330	359388948	/nfs/dbraw/zinc/38/89/48/359388948.db2.gz	WYUAVGDTHSZHEQ-NXEZZACHSA-N	1	0	282.344	1.062	50	0		CDAARO
Cc1nc(N)nc(N[C@H]2[C@H]3CCO[C@H]3[C@@H]2[NH+](C)C)c1Cl	ZINC000223198407	359407808	/nfs/dbraw/zinc/40/78/08/359407808.db2.gz	PZOHCIJEFRTQOD-APHKKCJPSA-N	1	0	297.790	1.150	50	0		CDAARO
Cc1cc(C)n(CCC[N@@H+]2CCn3nc(CO)cc3C2)n1	ZINC000223939520	359476859	/nfs/dbraw/zinc/47/68/59/359476859.db2.gz	MKTMSRVVSVQRAF-UHFFFAOYSA-N	1	0	289.383	1.095	50	0		CDAARO
CC[NH+]1CCC(CC(=O)N2CCC3(CC[C@@H]3O)CC2)CC1	ZINC000257186170	359522287	/nfs/dbraw/zinc/52/22/87/359522287.db2.gz	KDSZEHPOXLKJLT-HNNXBMFYSA-N	1	0	294.439	1.872	50	0		CDAARO
C[C@H](C(=O)NC1CCCC1)[NH+]1CCC2(CC1)OCCO2	ZINC000028077394	359523263	/nfs/dbraw/zinc/52/32/63/359523263.db2.gz	NVDHCANFLHOPED-GFCCVEGCSA-N	1	0	282.384	1.273	50	0		CDAARO
CN(CC[N@H+](C)C1CC1)C(=O)c1cc2nc[nH]c2cc1F	ZINC000408517170	359900525	/nfs/dbraw/zinc/90/05/25/359900525.db2.gz	ARTAKLWURCQLNW-UHFFFAOYSA-N	1	0	290.342	1.868	50	0		CDAARO
COC(=O)[C@@H]1CN(CCN(C)c2ccccc2)C[C@@H](C)O1	ZINC000089496902	359941023	/nfs/dbraw/zinc/94/10/23/359941023.db2.gz	MFKXNTWVFWBQSH-HIFRSBDPSA-N	1	0	292.379	1.385	50	0		CDAARO
Fc1cnc(N2CCC[N@H+](CC3CCC3)CC2)nc1	ZINC000521395258	359966857	/nfs/dbraw/zinc/96/68/57/359966857.db2.gz	LDCJEKHGODDCPD-UHFFFAOYSA-N	1	0	264.348	1.928	50	0		CDAARO
C[C@](O)(CCNC1=[NH+]CCCCN1)c1ccccc1	ZINC000521396921	359970366	/nfs/dbraw/zinc/97/03/66/359970366.db2.gz	GMVUSKSURKITHS-HNNXBMFYSA-N	1	0	261.369	1.613	50	0		CDAARO
Cc1nc([C@H]2CCOC2)cc(N(C)CC[NH+](C)C)n1	ZINC000426489414	360570487	/nfs/dbraw/zinc/57/04/87/360570487.db2.gz	VBABLXWKZZNNRO-LBPRGKRZSA-N	1	0	264.373	1.287	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](C(=O)NCc2cnc3c(c2)CCC3)C1	ZINC000426656961	360693312	/nfs/dbraw/zinc/69/33/12/360693312.db2.gz	NYJNWQJOEVYAMQ-OAHLLOKOSA-N	1	0	287.407	1.918	50	0		CDAARO
CCN(CC[NH+](C)C)C(=O)NCCSc1nccn1C	ZINC000426382691	360661406	/nfs/dbraw/zinc/66/14/06/360661406.db2.gz	LQXJPGDHWCLQQE-UHFFFAOYSA-N	1	0	299.444	1.105	50	0		CDAARO
Cc1ccc(OCCC(=O)N2CC[C@H](C[NH3+])C2)cc1C	ZINC000178586372	189128455	/nfs/dbraw/zinc/12/84/55/189128455.db2.gz	QIQUDMURCHVSCC-CQSZACIVSA-N	1	0	276.380	1.880	50	0		CDAARO
COC[C@@H]1CCCN1C(=O)Cc1ccc(OCC[NH3+])cc1	ZINC000426734586	360700971	/nfs/dbraw/zinc/70/09/71/360700971.db2.gz	XNVSKTDBGLPBNO-AWEZNQCLSA-N	1	0	292.379	1.204	50	0		CDAARO
CC(C)Nc1ncccc1C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178531762	189124630	/nfs/dbraw/zinc/12/46/30/189124630.db2.gz	ANTDQFRNYKKBEN-NSHDSACASA-N	1	0	262.357	1.323	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1cncc(C(=O)N(C)C)n1	ZINC000429198049	360777784	/nfs/dbraw/zinc/77/77/84/360777784.db2.gz	MDBLHIQLARHGIC-LBPRGKRZSA-N	1	0	291.399	1.465	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)/C=C/c2c(C)nn(C)c2Cl)C1	ZINC000179015399	189161975	/nfs/dbraw/zinc/16/19/75/189161975.db2.gz	OIDHXNNPLYTURJ-ZWNMCFTASA-N	1	0	296.802	1.463	50	0		CDAARO
COc1ccc(Cl)cc1CC(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179045606	189164858	/nfs/dbraw/zinc/16/48/58/189164858.db2.gz	FAPLTHNSCXFGEI-GFCCVEGCSA-N	1	0	282.771	1.711	50	0		CDAARO
Cn1c(SCCCCCCO)nnc1[C@@H]1CCC[NH2+]C1	ZINC000426535912	361005793	/nfs/dbraw/zinc/00/57/93/361005793.db2.gz	QJBXIFJMVXBKOJ-GFCCVEGCSA-N	1	0	298.456	1.927	50	0		CDAARO
CC(C)[C@@H](Oc1ccc(F)cc1F)C(=O)N1CC[C@H]([NH3+])C1	ZINC000299738957	200850029	/nfs/dbraw/zinc/85/00/29/200850029.db2.gz	ITXMYRGMCPTXMT-SMDDNHRTSA-N	1	0	298.333	1.928	50	0		CDAARO
Cc1nn(C)cc1NC(=O)NCCNc1cc[nH+]cc1C	ZINC000299777776	200869629	/nfs/dbraw/zinc/86/96/29/200869629.db2.gz	FDHWXGQNGOOEET-UHFFFAOYSA-N	1	0	288.355	1.666	50	0		CDAARO
O=C(CC1CCCCC1)NCCN1CCOCC1	ZINC000019972671	361583091	/nfs/dbraw/zinc/58/30/91/361583091.db2.gz	FMHVRHSXEOMYHU-UHFFFAOYSA-N	1	0	254.374	1.405	50	0		CDAARO
C[C@H]([NH2+]C[C@@]1(O)CCOC1)c1ccc(Br)o1	ZINC000193050145	364168418	/nfs/dbraw/zinc/16/84/18/364168418.db2.gz	HWZLLKWHWZIIAF-KWQFWETISA-N	1	0	290.157	1.844	50	0		CDAARO
C[C@H](C1CC1)[N@H+](CC(=O)NC(=O)NC1CC1)C1CC1	ZINC000031654652	365242743	/nfs/dbraw/zinc/24/27/43/365242743.db2.gz	SGVOLZCBOLAOAX-SECBINFHSA-N	1	0	265.357	1.238	50	0		CDAARO
CC[N@@H+]1CCCN(c2nc(C3CC3)ns2)CC1	ZINC000089977271	366992884	/nfs/dbraw/zinc/99/28/84/366992884.db2.gz	UFAWIEBHXMVDJH-UHFFFAOYSA-N	1	0	252.387	1.948	50	0		CDAARO
Cn1c(CO)cnc1SCC[C@@H]1CCCC[N@@H+]1C	ZINC000090243489	367026868	/nfs/dbraw/zinc/02/68/68/367026868.db2.gz	SFHBSSJGVJAFAO-NSHDSACASA-N	1	0	269.414	1.879	50	0		CDAARO
O=C(Cc1ccccc1Br)N1CCC[NH2+]CC1	ZINC000084719042	367349212	/nfs/dbraw/zinc/34/92/12/367349212.db2.gz	LHRJAVBPKGALIR-UHFFFAOYSA-N	1	0	297.196	1.814	50	0		CDAARO
Cc1cc(C(=O)N[C@@H]2CC[NH2+]C[C@H]2C)ccc1F	ZINC000094345013	367408291	/nfs/dbraw/zinc/40/82/91/367408291.db2.gz	VRECQTRJNSHGGO-ZWNOBZJWSA-N	1	0	250.317	1.862	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@H]1NC(=O)c1ccc(F)cc1F	ZINC000094345161	367418622	/nfs/dbraw/zinc/41/86/22/367418622.db2.gz	MDYHBLIXGBISPW-PRHODGIISA-N	1	0	254.280	1.693	50	0		CDAARO
CC1([NH3+])CCN(S(=O)(=O)CCCC(F)(F)F)CC1	ZINC000252485086	367569140	/nfs/dbraw/zinc/56/91/40/367569140.db2.gz	GNJFXIIYHRLMHV-UHFFFAOYSA-N	1	0	288.335	1.472	50	0		CDAARO
C[C@@H]1CCC[N@H+](Cc2cc(=O)n3ccsc3n2)C1	ZINC000003564870	370225055	/nfs/dbraw/zinc/22/50/55/370225055.db2.gz	CCDJRWIOKZIJLB-SNVBAGLBSA-N	1	0	263.366	1.988	50	0		CDAARO
Cc1c[nH+]ccc1N1CCN(c2cnccn2)CC1	ZINC000191978437	371541862	/nfs/dbraw/zinc/54/18/62/371541862.db2.gz	CNHSCOAYBNCWHG-UHFFFAOYSA-N	1	0	255.325	1.507	50	0		CDAARO
Cn1ccnc1NC(=O)CC[C@H]1CCCC[N@@H+]1C	ZINC000578484771	372477849	/nfs/dbraw/zinc/47/78/49/372477849.db2.gz	NBCVMBXYCGKOKQ-LLVKDONJSA-N	1	0	250.346	1.623	50	0		CDAARO
CCOCCC(=O)N[C@@H](C)C[N@@H+]1CCc2ccccc2C1	ZINC000299768508	372751097	/nfs/dbraw/zinc/75/10/97/372751097.db2.gz	JWLMAYXXKPSLQI-AWEZNQCLSA-N	1	0	290.407	1.976	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@H]([NH3+])CN1Cc1ccc2ccccc2c1	ZINC000299795565	372769051	/nfs/dbraw/zinc/76/90/51/372769051.db2.gz	KPXKCNPVFUZPOA-IRXDYDNUSA-N	1	0	297.402	1.878	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1NC(=O)c1ccc(C)c(F)c1	ZINC000299801394	372771010	/nfs/dbraw/zinc/77/10/10/372771010.db2.gz	XVIMOQHXMFQMLK-GJZGRUSLSA-N	1	0	294.370	1.972	50	0		CDAARO
[NH3+]C[C@H]1CCC2(CC[NH+](Cc3cccnc3)CC2)O1	ZINC000299799999	372771561	/nfs/dbraw/zinc/77/15/61/372771561.db2.gz	YMNXKPZHXHPYLF-CQSZACIVSA-N	1	0	261.369	1.554	50	0		CDAARO
O=S(=O)(c1ccccc1)N1CC[N@@H+]2CCC[C@@H]2C1	ZINC000055051850	373778896	/nfs/dbraw/zinc/77/88/96/373778896.db2.gz	CCFPTESXTWVKDO-GFCCVEGCSA-N	1	0	266.366	1.155	50	0		CDAARO
Cc1nn(C)c(Cl)c1C[NH2+]CC1(O)CCCC1	ZINC000111385508	374184857	/nfs/dbraw/zinc/18/48/57/374184857.db2.gz	CGWNREXKQJUEAU-UHFFFAOYSA-N	1	0	257.765	1.777	50	0		CDAARO
CC(C)[NH+]1CCN(C[C@H]2COc3ccccc3O2)CC1	ZINC000019703111	374776651	/nfs/dbraw/zinc/77/66/51/374776651.db2.gz	VJEXBVRKTISHJF-AWEZNQCLSA-N	1	0	276.380	1.852	50	0	biogenic	CDAARO
Cc1ccc2nc(Cn3cc([C@H]4CCC[NH2+]C4)nn3)cn2c1	ZINC000095387136	374896573	/nfs/dbraw/zinc/89/65/73/374896573.db2.gz	SFSXMACYCYNECO-ZDUSSCGKSA-N	1	0	296.378	1.750	50	0		CDAARO
[NH3+][C@@H](CNC(=O)c1cccc2ncccc21)C1CC1	ZINC000095394020	374899243	/nfs/dbraw/zinc/89/92/43/374899243.db2.gz	CTVMLUOMQVZOLL-ZDUSSCGKSA-N	1	0	255.321	1.702	50	0		CDAARO
O[C@@H](C[NH2+]C1CCOCC1)c1c(F)cccc1F	ZINC000037893131	374990880	/nfs/dbraw/zinc/99/08/80/374990880.db2.gz	PZPVTISAWAXZAU-LBPRGKRZSA-N	1	0	257.280	1.767	50	0		CDAARO
COc1ccc(NC(=O)N2CC([NH+](C)C)C2)cc1C	ZINC000097049400	375141390	/nfs/dbraw/zinc/14/13/90/375141390.db2.gz	IFLFPYPHXFEOIE-UHFFFAOYSA-N	1	0	263.341	1.781	50	0		CDAARO
C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)N1C(=O)[C@@H]1CC[NH2+]C1	ZINC000299739577	375200375	/nfs/dbraw/zinc/20/03/75/375200375.db2.gz	QHYBCUIODLFKTP-CLWVCHIJSA-N	1	0	288.391	1.973	50	0		CDAARO
CCOC(=O)NCCC[NH+]1CCN(c2ccccc2)CC1	ZINC000038592728	376874652	/nfs/dbraw/zinc/87/46/52/376874652.db2.gz	KVDVHQHZORNDIF-UHFFFAOYSA-N	1	0	291.395	1.945	50	0		CDAARO
CC(C)CCc1noc(CN2CC[N@@H+]3CCC[C@H]3C2)n1	ZINC000247253877	377075760	/nfs/dbraw/zinc/07/57/60/377075760.db2.gz	UEIFNKNYWXDPOE-ZDUSSCGKSA-N	1	0	278.400	1.938	50	0		CDAARO
Cc1nc(C[NH3+])cc(N(C)CC[C@@H](O)c2ccccc2)n1	ZINC000067850291	377260721	/nfs/dbraw/zinc/26/07/21/377260721.db2.gz	SEUSWUMNYQFWAE-OAHLLOKOSA-N	1	0	286.379	1.804	50	0		CDAARO
Cn1ccc(C[NH+]2CCC(c3cc[nH]n3)CC2)cc1=O	ZINC000069350984	378025110	/nfs/dbraw/zinc/02/51/10/378025110.db2.gz	WDVIHPOQZFATGG-UHFFFAOYSA-N	1	0	272.352	1.488	50	0		CDAARO
CCc1nnc(C2CC[NH+](C[C@@H](O)C(F)(F)F)CC2)[nH]1	ZINC000190712535	378318219	/nfs/dbraw/zinc/31/82/19/378318219.db2.gz	MUPSIBRIVYTESR-SECBINFHSA-N	1	0	292.305	1.470	50	0		CDAARO
[NH3+]C1(C(=O)NCCCn2ncc3ccccc32)CC1	ZINC000071775833	379635914	/nfs/dbraw/zinc/63/59/14/379635914.db2.gz	BLUNJKSOHSMHHV-UHFFFAOYSA-N	1	0	258.325	1.034	50	0		CDAARO
COc1ccc(C)cc1/C=C\C(=O)N1CCC[C@H]1C[NH3+]	ZINC000493012266	253346316	/nfs/dbraw/zinc/34/63/16/253346316.db2.gz	CZTMAHDVRNWQAJ-QPBFKRLHSA-N	1	0	274.364	1.967	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@H]1CCNC(=O)Cn1ccnn1	ZINC000426526004	256860800	/nfs/dbraw/zinc/86/08/00/256860800.db2.gz	HHNGHLBHUCTKPG-ZDUSSCGKSA-N	1	0	279.388	1.047	50	0		CDAARO
CCCCNC(=O)[C@@H](C)[NH+]1CCC(C2N=NC(=O)O2)CC1	ZINC000450916621	390577144	/nfs/dbraw/zinc/57/71/44/390577144.db2.gz	VZTLHPOQUQKASF-SNVBAGLBSA-N	1	0	296.371	1.259	50	0		CDAARO
COc1ccc([C@H](O)C[NH2+]Cc2c[nH]nc2C)cc1	ZINC000097159546	390801097	/nfs/dbraw/zinc/80/10/97/390801097.db2.gz	HJSWSFAECULWKY-CQSZACIVSA-N	1	0	261.325	1.550	50	0		CDAARO
C[N@H+](Cc1ccccc1C(F)(F)F)[C@H]1COC[C@@H]1O	ZINC000215512886	390994686	/nfs/dbraw/zinc/99/46/86/390994686.db2.gz	AIRTUTBRVTZRCT-RYUDHWBXSA-N	1	0	275.270	1.897	50	0		CDAARO
COc1ccc(CC(=O)OCCC[NH+](C)C)cc1	ZINC000001786556	533452373	/nfs/dbraw/zinc/45/23/73/533452373.db2.gz	TVAKXFGCRXPXNB-UHFFFAOYSA-N	1	0	251.326	1.733	50	0		CDAARO
C[N@H+](CC(=O)N1CCNC1=O)[C@H]1CCCc2ccccc21	ZINC000008126396	391947396	/nfs/dbraw/zinc/94/73/96/391947396.db2.gz	DTHDEJRARNBHNX-AWEZNQCLSA-N	1	0	287.363	1.548	50	0		CDAARO
Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)[C@@H](C)[NH3+]	ZINC000237322448	131024093	/nfs/dbraw/zinc/02/40/93/131024093.db2.gz	DVZBWGXYXULSEX-LLVKDONJSA-N	1	0	275.352	1.517	50	0		CDAARO
[NH3+]Cc1ccc(C(=O)N[C@@H]2CCC[C@@H]3OCC[C@H]32)cc1	ZINC000262353991	131214756	/nfs/dbraw/zinc/21/47/56/131214756.db2.gz	ZHUZKEZCFHWMKK-ZNMIVQPWSA-N	1	0	274.364	1.833	50	0		CDAARO
COCCCNC(=O)C(C)(C)[N@H+](C)C1CCCC1	ZINC000089620984	392429575	/nfs/dbraw/zinc/42/95/75/392429575.db2.gz	GSTBERJQUKRELC-UHFFFAOYSA-N	1	0	256.390	1.792	50	0		CDAARO
CC(C)[N@H+](CCNC(=O)N1CCOC[C@H]1C1CC1)C1CC1	ZINC000089896270	392516903	/nfs/dbraw/zinc/51/69/03/392516903.db2.gz	ZMKLEXXVVRQEMN-HNNXBMFYSA-N	1	0	295.427	1.680	50	0		CDAARO
CCC[C@]1(COC)CCC[N@@H+]1Cc1nc(N(C)C)no1	ZINC000192824928	393169010	/nfs/dbraw/zinc/16/90/10/393169010.db2.gz	MECNINORBDYHDC-CQSZACIVSA-N	1	0	282.388	1.917	50	0		CDAARO
C[C@@]1([NH3+])CCCC[C@@H]1C(=O)NCc1ccc(F)cn1	ZINC000263222617	149124233	/nfs/dbraw/zinc/12/42/33/149124233.db2.gz	MERXFJOGQNIJHV-TZMCWYRMSA-N	1	0	265.332	1.745	50	0		CDAARO
CC[NH2+]C[C@H](O)COCc1ccc(OC)c(OC)c1	ZINC000002641502	169817600	/nfs/dbraw/zinc/81/76/00/169817600.db2.gz	AVORDRCSIJEREN-LBPRGKRZSA-N	1	0	269.341	1.191	50	0		CDAARO
Cn1nnnc1SCC[NH2+]Cc1cccc(Cl)c1	ZINC000004998032	170052369	/nfs/dbraw/zinc/05/23/69/170052369.db2.gz	QQERCPNONLKOBU-UHFFFAOYSA-N	1	0	283.788	1.745	50	0		CDAARO
COc1cccc(C[N@@H+]2CCC[C@H]2CO)c1OC	ZINC000005527520	170108969	/nfs/dbraw/zinc/10/89/69/170108969.db2.gz	FYEZUCBZHCOSIX-LBPRGKRZSA-N	1	0	251.326	1.661	50	0		CDAARO
COC(=O)[C@@H]1C[NH2+]C[C@H]1c1ccc(Br)cc1	ZINC000008699276	170346178	/nfs/dbraw/zinc/34/61/78/170346178.db2.gz	OHYNFAGOLZTLOM-WDEREUQCSA-N	1	0	284.153	1.925	50	0		CDAARO
Cc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(C(N)=O)CC2)cc1	ZINC000009908731	170389329	/nfs/dbraw/zinc/38/93/29/170389329.db2.gz	QDHVDXMVFFKVSV-GFCCVEGCSA-N	1	0	289.379	1.519	50	0		CDAARO
COc1ccc(C[NH2+]CCCCCO)cc1OC	ZINC000013717828	170581235	/nfs/dbraw/zinc/58/12/35/170581235.db2.gz	SSKNWXFAEVHOSD-UHFFFAOYSA-N	1	0	253.342	1.956	50	0		CDAARO
CCN1CCC(CNc2nccc(NC)n2)([NH+](C)C)CC1	ZINC000534578952	411827586	/nfs/dbraw/zinc/82/75/86/411827586.db2.gz	OAUKOUADVHSNNT-UHFFFAOYSA-N	1	0	292.431	1.346	50	0		CDAARO
CCC[NH+]1CCC(NC(=O)c2cnc(OC)nc2)CC1	ZINC000019953010	170940005	/nfs/dbraw/zinc/94/00/05/170940005.db2.gz	GZQSINVODRPWRH-UHFFFAOYSA-N	1	0	278.356	1.089	50	0		CDAARO
CN(C)c1ncc(CN2CCO[C@H](CC[NH+](C)C)C2)s1	ZINC000020200923	171064459	/nfs/dbraw/zinc/06/44/59/171064459.db2.gz	ITZFVCIKJZWISL-GFCCVEGCSA-N	1	0	298.456	1.362	50	0		CDAARO
O=C(NCC[N@H+]1CCC[C@@H](O)C1)c1ccc2occc2c1	ZINC000020601135	171266839	/nfs/dbraw/zinc/26/68/39/171266839.db2.gz	XOEXGSTZZHHOLG-CQSZACIVSA-N	1	0	288.347	1.619	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2cccc(Cl)c2)CC1	ZINC000020608840	171267420	/nfs/dbraw/zinc/26/74/20/171267420.db2.gz	QJHHVYPVRHGPOY-UHFFFAOYSA-N	1	0	281.787	1.916	50	0		CDAARO
C[NH+]1CCN(CCCNC(=O)c2cccs2)CC1	ZINC000020819072	171273059	/nfs/dbraw/zinc/27/30/59/171273059.db2.gz	ZCQSXKDHENSBSY-UHFFFAOYSA-N	1	0	267.398	1.115	50	0		CDAARO
COc1ccc([C@H](CNC(=O)CSC)[NH+](C)C)cc1	ZINC000022621382	171394897	/nfs/dbraw/zinc/39/48/97/171394897.db2.gz	FZKWWZTWGIPAGA-ZDUSSCGKSA-N	1	0	282.409	1.777	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)c1nccnc1N)c1cccs1	ZINC000022687875	171395813	/nfs/dbraw/zinc/39/58/13/171395813.db2.gz	CCLCGOXMXPCVME-SECBINFHSA-N	1	0	291.380	1.153	50	0		CDAARO
CCOc1cccc(OCCCC[NH2+]CCN)c1	ZINC000039960850	174179865	/nfs/dbraw/zinc/17/98/65/174179865.db2.gz	JZOZJKPAPHHFJU-UHFFFAOYSA-N	1	0	252.358	1.793	50	0		CDAARO
CS(=O)(=O)c1ccc(O[C@@H]2CCC[NH2+]C2)cc1	ZINC000043501529	175058720	/nfs/dbraw/zinc/05/87/20/175058720.db2.gz	XBWVNYQDOCXFRG-LLVKDONJSA-N	1	0	255.339	1.221	50	0		CDAARO
CC[NH2+][C@H](C)CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1	ZINC000058040603	175606264	/nfs/dbraw/zinc/60/62/64/175606264.db2.gz	BSHSKNSMRZLQBW-GFCCVEGCSA-N	1	0	299.415	1.454	50	0		CDAARO
O[C@H](COc1ccccc1-n1cccn1)C[NH+]1CCCC1	ZINC000065405636	175731153	/nfs/dbraw/zinc/73/11/53/175731153.db2.gz	ALTHMEAMQVOEJM-AWEZNQCLSA-N	1	0	287.363	1.708	50	0		CDAARO
O=c1[nH]c2cc3c(cc2cc1C[N@H+]1CC[C@H](O)C1)CCC3	ZINC000067974398	175805391	/nfs/dbraw/zinc/80/53/91/175805391.db2.gz	ZZAPUQILWFTJEK-HNNXBMFYSA-N	1	0	284.359	1.583	50	0		CDAARO
CC[C@H]1C[N@H+](CCO)CCC(=O)N1Cc1ccccc1	ZINC000071752641	176260155	/nfs/dbraw/zinc/26/01/55/176260155.db2.gz	JPQILORLYIZRTE-HNNXBMFYSA-N	1	0	276.380	1.492	50	0		CDAARO
NC(=[NH2+])c1nn(Cc2ccccc2F)c2ncccc12	ZINC000072194098	176336893	/nfs/dbraw/zinc/33/68/93/176336893.db2.gz	LQCFFAGUCURQEC-UHFFFAOYSA-N	1	0	269.283	1.903	50	0		CDAARO
CC(C)(C)OC(=O)NCCCOC1CC[NH2+]CC1	ZINC000072312131	176367566	/nfs/dbraw/zinc/36/75/66/176367566.db2.gz	DZQUGCQCUZQUBW-UHFFFAOYSA-N	1	0	258.362	1.670	50	0		CDAARO
Cc1ccc2[nH]c(SC[C@@H](O)C[NH+](C)C)nc2c1	ZINC000076556457	177037550	/nfs/dbraw/zinc/03/75/50/177037550.db2.gz	DLQIXZCOFLFBME-JTQLQIEISA-N	1	0	265.382	1.886	50	0		CDAARO
CC(=O)N(Cc1ncc(C(C)C)o1)[C@H]1CC[NH2+]C1	ZINC000078878693	177399511	/nfs/dbraw/zinc/39/95/11/177399511.db2.gz	BBPCZOMOPFDMKH-NSHDSACASA-N	1	0	251.330	1.508	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](NC(=O)c2ccc(SCCO)cc2)C1	ZINC000215879651	424584303	/nfs/dbraw/zinc/58/43/03/424584303.db2.gz	OAXPWFANDTXHHT-VXGBXAGGSA-N	1	0	280.393	1.381	50	0		CDAARO
CCn1nc(C(=O)NC)c2c1CC[C@@H]([NH2+]C1CCCC1)C2	ZINC000014540031	273781965	/nfs/dbraw/zinc/78/19/65/273781965.db2.gz	BNEFRDUSZPPLFQ-GFCCVEGCSA-N	1	0	290.411	1.652	50	0		CDAARO
C[C@@H]1CC[C@@H]([NH2+]C[C@@H]2COC3(CCOCC3)O2)C1	ZINC000095991135	287707363	/nfs/dbraw/zinc/70/73/63/287707363.db2.gz	NZKLOQYHBFZNMP-JHJVBQTASA-N	1	0	255.358	1.687	50	0		CDAARO
O=C(N[C@@H]1CCSc2c(F)cccc21)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000299750346	274986833	/nfs/dbraw/zinc/98/68/33/274986833.db2.gz	NECWZFMNDSWACM-AXTRIDKLSA-N	1	0	296.367	1.202	50	0		CDAARO
CC[N@H+](C)C[C@H](C)c1nc2c([nH]1)C(=O)NCCC2	ZINC000095529478	276073952	/nfs/dbraw/zinc/07/39/52/276073952.db2.gz	SUYJWSIJKOTNEF-VIFPVBQESA-N	1	0	250.346	1.141	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)Nc2cccc3c[nH]nc32)CC1	ZINC000299797351	277048407	/nfs/dbraw/zinc/04/84/07/277048407.db2.gz	NNUBVFALSISKDQ-UHFFFAOYSA-N	1	0	273.340	1.732	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)[C@@H]2Cc3ccccc3S2)CC1	ZINC000032878799	277048917	/nfs/dbraw/zinc/04/89/17/277048917.db2.gz	JIFCOXRHTKJVJI-AWEZNQCLSA-N	1	0	276.405	1.868	50	0		CDAARO
C[N@@H+]1CC[C@H]2CCN(C(=O)Nc3nccs3)[C@H]2C1	ZINC000272510262	277175155	/nfs/dbraw/zinc/17/51/55/277175155.db2.gz	YIIYOZHSONORBC-UWVGGRQHSA-N	1	0	266.370	1.701	50	0		CDAARO
CNC(=O)c1c(N)sc2c1CC[N@@H+](C(C)C)C2	ZINC000036985046	277255412	/nfs/dbraw/zinc/25/54/12/277255412.db2.gz	GWVUDZFZLUMWCS-UHFFFAOYSA-N	1	0	253.371	1.456	50	0		CDAARO
CC(C)C[N@@H+]1CCCN(C(=O)[C@@H]2CCOC2)CC1	ZINC000368820881	277389469	/nfs/dbraw/zinc/38/94/69/277389469.db2.gz	DTRGMZFADGNWBQ-CYBMUJFWSA-N	1	0	254.374	1.213	50	0		CDAARO
C[C@@H]1CCNC(=O)[C@@H]1[NH2+]Cc1ccc(Cl)cc1	ZINC000193592599	277762136	/nfs/dbraw/zinc/76/21/36/277762136.db2.gz	BHFNTYUJMQZJJC-BXKDBHETSA-N	1	0	252.745	1.954	50	0		CDAARO
COc1ccnc(N2CCC[C@@H]3C[N@H+](C)CC[C@H]32)n1	ZINC000095971015	278065813	/nfs/dbraw/zinc/06/58/13/278065813.db2.gz	YBGRACOVWSIJLV-VXGBXAGGSA-N	1	0	262.357	1.406	50	0		CDAARO
C[C@@H](C(=O)N1C[C@@H](C)OC[C@H]1C)[C@H]([NH3+])c1ccccc1	ZINC000251669624	278198318	/nfs/dbraw/zinc/19/83/18/278198318.db2.gz	LLEMMCFEIVBBHL-BHPKHCPMSA-N	1	0	276.380	1.958	50	0		CDAARO
CC(C)(C)CN1CCC[C@](O)(C[NH+]2CCCCC2)C1=O	ZINC000012302527	278325117	/nfs/dbraw/zinc/32/51/17/278325117.db2.gz	JCRYOGPGGVULMQ-INIZCTEOSA-N	1	0	282.428	1.872	50	0		CDAARO
CCOC(=O)N(C)C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1	ZINC000095976556	279568913	/nfs/dbraw/zinc/56/89/13/279568913.db2.gz	UQUUYHUOTSPQLV-ZIAGYGMSSA-N	1	0	284.400	1.843	50	0		CDAARO
C[NH+](C)C(C)(C)CNC(=O)N[C@@H]1CCC[C@H]2OCC[C@@H]21	ZINC000089761761	282015425	/nfs/dbraw/zinc/01/54/25/282015425.db2.gz	MJZJAAIRQXMNAI-JHJVBQTASA-N	1	0	283.416	1.583	50	0		CDAARO
Cc1[nH+]c2ccccc2c(N2CCO[C@@H](C(N)=O)C2)c1C	ZINC000097085939	293474257	/nfs/dbraw/zinc/47/42/57/293474257.db2.gz	VVSLGZRDYCUMQZ-CQSZACIVSA-N	1	0	285.347	1.542	50	0		CDAARO
C[C@@H]1c2ccccc2O[C@H]1C(=O)N1CC[NH2+]C[C@@H]1C	ZINC000126023846	297829017	/nfs/dbraw/zinc/82/90/17/297829017.db2.gz	ICOMDHXXJVIDRB-MISXGVKJSA-N	1	0	260.337	1.371	50	0		CDAARO
CC(C)[C@@H](CNC(=O)[C@H]1CC[C@@H](O)CC1)[NH+](C)C	ZINC000534646048	328332854	/nfs/dbraw/zinc/33/28/54/328332854.db2.gz	KCEOUEMSAAXUOD-FRRDWIJNSA-N	1	0	256.390	1.240	50	0		CDAARO
CC(C)c1nc(CN(C)C(=O)C[C@H]2C[NH2+]CCO2)cs1	ZINC000534647916	328342932	/nfs/dbraw/zinc/34/29/32/328342932.db2.gz	LVGUVVACHWUSKX-LBPRGKRZSA-N	1	0	297.424	1.603	50	0		CDAARO
C[C@H](C(=O)NCCc1ncc[nH]1)[N@H+](C)C1CCCCC1	ZINC000534674667	328349698	/nfs/dbraw/zinc/34/96/98/328349698.db2.gz	RZYCXLQAHZFLMC-GFCCVEGCSA-N	1	0	278.400	1.721	50	0		CDAARO
CCc1cc(N[C@@H](C)C2CC[NH+](C)CC2)nc(C)n1	ZINC000396454997	328450666	/nfs/dbraw/zinc/45/06/66/328450666.db2.gz	MDGMKKUGDPFSAG-NSHDSACASA-N	1	0	262.401	1.912	50	0		CDAARO
O=C(c1cc(=O)c2ccccc2[nH]1)N1CC[C@H]2C[NH2+]C[C@H]21	ZINC000077436850	327132532	/nfs/dbraw/zinc/13/25/32/327132532.db2.gz	KZCQWHFIYJPKLB-IINYFYTJSA-N	1	0	283.331	1.374	50	0		CDAARO
CN(Cc1ccccc1F)C(=O)C[C@@H]1CC[NH2+]C1	ZINC000089741513	330387538	/nfs/dbraw/zinc/38/75/38/330387538.db2.gz	RMCTYTDYDQXXIY-NSHDSACASA-N	1	0	250.317	1.784	50	0		CDAARO
Brc1ccc(C2=NOC3(CC[NH2+]CC3)N2)cc1	ZINC000409422459	333239828	/nfs/dbraw/zinc/23/98/28/333239828.db2.gz	GCTFIBFEGXGXKD-UHFFFAOYSA-N	1	0	296.168	1.810	50	0		CDAARO
FC(F)(F)c1ccnc(O[C@H]2C[NH+]3CCC2CC3)n1	ZINC000585651062	1159306111	/nfs/dbraw/zinc/30/61/11/1159306111.db2.gz	JQDPPWQHTMZQKD-VIFPVBQESA-N	1	0	273.258	1.968	50	0		CDAARO
CC(=O)c1cnc(N2CCOC[C@@H](C[NH+](C)C)C2)nc1C	ZINC001772701299	1159437063	/nfs/dbraw/zinc/43/70/63/1159437063.db2.gz	NIMGRKKLFCKQOK-ZDUSSCGKSA-N	1	0	292.383	1.002	50	0		CDAARO
COc1nc(N2CC([N@@H+]3CCCC[C@@H]3C)C2)ncc1F	ZINC001772703412	1159437308	/nfs/dbraw/zinc/43/73/08/1159437308.db2.gz	MZSHECGKJLCJAQ-JTQLQIEISA-N	1	0	280.347	1.687	50	0		CDAARO
Cc1ccc(-c2noc([C@H](C)[NH+]3CCCC3)n2)nn1	ZINC000092028094	482598207	/nfs/dbraw/zinc/59/82/07/482598207.db2.gz	CZHUXECJRPFBKX-JTQLQIEISA-N	1	0	259.313	1.992	50	0		CDAARO
CC(C)c1nsc(N2CC(CN3CC[NH+](C)CC3)C2)n1	ZINC000585092031	482664594	/nfs/dbraw/zinc/66/45/94/482664594.db2.gz	BLSFMFPOSGDVCT-UHFFFAOYSA-N	1	0	295.456	1.345	50	0		CDAARO
Clc1cnn(CC[N@@H+]2CCC[C@H](c3nnc[nH]3)C2)c1	ZINC000459394362	482792309	/nfs/dbraw/zinc/79/23/09/482792309.db2.gz	SVFYHWGDCKYPOU-JTQLQIEISA-N	1	0	280.763	1.534	50	0		CDAARO
Cc1cccc(N2CCC(NC(=O)[C@H]3CC[NH2+]3)CC2)c1	ZINC000670451867	483014713	/nfs/dbraw/zinc/01/47/13/483014713.db2.gz	VKVSUTUJZKDCMD-OAHLLOKOSA-N	1	0	273.380	1.442	50	0		CDAARO
NC(=O)C1(NC(=O)[C@@H]2CC23CC[NH2+]CC3)CCCCCC1	ZINC000670450972	483016210	/nfs/dbraw/zinc/01/62/10/483016210.db2.gz	LANQUQNBSKITTC-LBPRGKRZSA-N	1	0	293.411	1.071	50	0		CDAARO
Cc1cc(C(N)=O)c(N2CC[N@@H+](C(C)C)[C@@H](C)C2)nc1C	ZINC000670456150	483034853	/nfs/dbraw/zinc/03/48/53/483034853.db2.gz	INXQZLFGRITBQQ-LBPRGKRZSA-N	1	0	290.411	1.716	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN(C(=O)c2cncc(Cl)c2)C1	ZINC000670456721	483035862	/nfs/dbraw/zinc/03/58/62/483035862.db2.gz	JRYVSXIDENKJOJ-NSHDSACASA-N	1	0	297.786	1.385	50	0		CDAARO
CCCC[C@@H]1C[C@@H]1C(=O)N1CCC(CO)(C[NH+](C)C)CC1	ZINC000670468139	483059770	/nfs/dbraw/zinc/05/97/70/483059770.db2.gz	WVGPOMWTLLHFJM-CABCVRRESA-N	1	0	296.455	1.975	50	0		CDAARO
C[NH+]1CCC(NC(=S)N2CCO[C@@H]3CCCC[C@H]32)CC1	ZINC000083877631	483216382	/nfs/dbraw/zinc/21/63/82/483216382.db2.gz	HIKKYDUIKONYIQ-ZIAGYGMSSA-N	1	0	297.468	1.599	50	0		CDAARO
O[C@H](COC[C@@H]1CCCO1)C[N@@H+]1CCO[C@@H]2CCCC[C@@H]21	ZINC000084544027	483286583	/nfs/dbraw/zinc/28/65/83/483286583.db2.gz	JOZHAXHLVOTTSN-YHUYYLMFSA-N	1	0	299.411	1.186	50	0		CDAARO
CCC(=O)N1CC[C@@H]([NH2+]Cc2c[nH]nc2C)[C@H](CC)C1	ZINC000084736282	483320662	/nfs/dbraw/zinc/32/06/62/483320662.db2.gz	ZGNYSJSCJZNGMM-TZMCWYRMSA-N	1	0	278.400	1.845	50	0		CDAARO
c1coc(-c2ncc(CN3C[C@@H]4CC[NH2+][C@@H]4C3)cn2)c1	ZINC000426487495	534513955	/nfs/dbraw/zinc/51/39/55/534513955.db2.gz	QOHLQGQJXOOHRN-QWHCGFSZSA-N	1	0	270.336	1.530	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2ccc(-n3cc(C)cn3)cc2)C1	ZINC000178982048	522090675	/nfs/dbraw/zinc/09/06/75/522090675.db2.gz	DJCXWAORGDAWSU-CQSZACIVSA-N	1	0	298.390	1.862	50	0		CDAARO
CC(C)[C@@H](C(=O)N1CC[C@@H](O)C1)[NH+]1CCCCC1	ZINC000098016202	528356295	/nfs/dbraw/zinc/35/62/95/528356295.db2.gz	CFXCZBKRZHQYDN-OLZOCXBDSA-N	1	0	254.374	1.090	50	0		CDAARO
Cc1ccc([C@H](O)CN2CC[N@@H+](C)C[C@H]2C)cc1C	ZINC000300403799	538230946	/nfs/dbraw/zinc/23/09/46/538230946.db2.gz	DIPUAHUTSUGSST-GDBMZVCRSA-N	1	0	262.397	1.973	50	0		CDAARO
CCOc1cc(N2CC[C@@H](Oc3ccncc3)C2)ncn1	ZINC000097095461	567904209	/nfs/dbraw/zinc/90/42/09/567904209.db2.gz	YSSNQMUWYXYJBK-CYBMUJFWSA-N	1	0	286.335	1.928	50	0		CDAARO
C[C@@H]1CC[NH2+]C[C@@H]1c1ccc(NS(C)(=O)=O)cc1	ZINC000757213914	574906937	/nfs/dbraw/zinc/90/69/37/574906937.db2.gz	RZIZQCUAZLZPGL-MFKMUULPSA-N	1	0	268.382	1.771	50	0		CDAARO
C[C@@H]1CCN[C@H]([C@@H]2CC[C@@H](C(F)(F)F)NC2)[C@H]1[NH3+]	ZINC000757216305	574908066	/nfs/dbraw/zinc/90/80/66/574908066.db2.gz	ZLMYRHUJGGZDCW-SAVGLBRCSA-N	1	0	265.323	1.242	50	0		CDAARO
C[C@@H]1CCN[C@H]([C@@H]2CC[C@H](C(F)(F)F)NC2)[C@@H]1[NH3+]	ZINC000757216244	574908383	/nfs/dbraw/zinc/90/83/83/574908383.db2.gz	ZLMYRHUJGGZDCW-ISUQUUIWSA-N	1	0	265.323	1.242	50	0		CDAARO
C[C@H]1C[C@H](c2ccc(NS(C)(=O)=O)cc2)CC[NH2+]1	ZINC000757211103	577036134	/nfs/dbraw/zinc/03/61/34/577036134.db2.gz	JFOKFYSYWJAASD-CMPLNLGQSA-N	1	0	268.382	1.914	50	0		CDAARO
C[C@@H]1C[C@H]([C@@H]2CC[C@@H](C(F)(F)F)NC2)NC[C@@H]1[NH3+]	ZINC000757210043	577036438	/nfs/dbraw/zinc/03/64/38/577036438.db2.gz	HQFSEQAUFRVGQX-NZFPMDFQSA-N	1	0	265.323	1.242	50	0		CDAARO
CC(C)(O)CC[N@@H+]1CCC[C@@H](CNC(=O)c2ccoc2)C1	ZINC000952974399	614184656	/nfs/dbraw/zinc/18/46/56/614184656.db2.gz	MGCCXFBRBDGXBK-ZDUSSCGKSA-N	1	0	294.395	1.882	50	0		CDAARO
[NH3+][C@H]1CCCCCC[C@H]1C(=O)N1CCC(O)CC1	ZINC000888096022	617757450	/nfs/dbraw/zinc/75/74/50/617757450.db2.gz	HPJWYAXGCHUHCP-OLZOCXBDSA-N	1	0	254.374	1.267	50	0		CDAARO
Cc1ccc(C)c(-c2cc3c(=O)n(CC[NH3+])ccn3n2)c1	ZINC000888088182	618077171	/nfs/dbraw/zinc/07/71/71/618077171.db2.gz	ROGVMQHGRYMABV-UHFFFAOYSA-N	1	0	282.347	1.739	50	0		CDAARO
CCc1cnc(C)nc1N[C@H]1C[NH2+]CC[C@H]1OC	ZINC001704312359	1177684465	/nfs/dbraw/zinc/68/44/65/1177684465.db2.gz	QDRKMDAHDRMLRZ-NWDGAFQWSA-N	1	0	250.346	1.136	50	0		CDAARO
CCCSCC(=O)N(CC[NH+](C)C)Cc1c[nH]cn1	ZINC001704337518	1177692440	/nfs/dbraw/zinc/69/24/40/1177692440.db2.gz	VFIJKHMAVBLODL-UHFFFAOYSA-N	1	0	284.429	1.443	50	0		CDAARO
Cn1cc(CC[N@H+](C)CCn2cc(Cl)cn2)cn1	ZINC001704356787	1177700420	/nfs/dbraw/zinc/70/04/20/1177700420.db2.gz	KPFPYTSNYRGWNQ-UHFFFAOYSA-N	1	0	267.764	1.445	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)c2nccn2C)CC1	ZINC000952972832	737710628	/nfs/dbraw/zinc/71/06/28/737710628.db2.gz	GVQCADKMUALONI-UHFFFAOYSA-N	1	0	250.346	1.024	50	0		CDAARO
OC[C@@H]1CCCCN1CC[NH2+]Cc1cccc(O)c1	ZINC000952971847	738243060	/nfs/dbraw/zinc/24/30/60/738243060.db2.gz	GMRNYCABTXYOEJ-AWEZNQCLSA-N	1	0	264.369	1.329	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc3ccccc3n2)C[C@H]1CCO	ZINC000257371990	737744447	/nfs/dbraw/zinc/74/44/47/737744447.db2.gz	PJGBYORCFDGMPZ-MRXNPFEDSA-N	1	0	285.391	1.733	50	0		CDAARO
CC(C)C[N@@H+]1CCC[C@@H]1C(=O)N1CCO[C@@H]2CCC[C@@H]21	ZINC000952848917	910405557	/nfs/dbraw/zinc/40/55/57/910405557.db2.gz	LDXIIKWEEDYBOK-RRFJBIMHSA-N	1	0	280.412	1.887	50	0		CDAARO
CCC1=NO[C@@H](C(=O)N(CC)CC[NH+]2CCCC2)C1	ZINC000952862293	910416176	/nfs/dbraw/zinc/41/61/76/910416176.db2.gz	OHWFRHXKOZTPTC-CYBMUJFWSA-N	1	0	267.373	1.486	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1CCCNc1nnc2ccccn21	ZINC000952872567	910429544	/nfs/dbraw/zinc/42/95/44/910429544.db2.gz	RIBNWNDKGSPYPH-CYBMUJFWSA-N	1	0	289.383	1.378	50	0		CDAARO
CNC(=O)CC[N@H+](C)CC1([C@@H]2CCCCO2)CCC1	ZINC000952882144	910449144	/nfs/dbraw/zinc/44/91/44/910449144.db2.gz	IVAJBQTTYOOCHG-ZDUSSCGKSA-N	1	0	268.401	1.794	50	0		CDAARO
[NH3+][C@@H](Cc1c[nH]cn1)c1ncnn1C1Cc2ccccc2C1	ZINC000827540272	925943587	/nfs/dbraw/zinc/94/35/87/925943587.db2.gz	PUPBKGGMNGBTIT-HNNXBMFYSA-N	1	0	294.362	1.584	50	0		CDAARO
O=C(NCCc1c[nH]cn1)C1([NH+]2CCCC2)CCCCC1	ZINC000827661454	925954647	/nfs/dbraw/zinc/95/46/47/925954647.db2.gz	XYZNBJFTBFTQKL-UHFFFAOYSA-N	1	0	290.411	1.867	50	0		CDAARO
CC(C)(C)n1nc(-c2ccco2)nc1[C@@H]([NH3+])CO	ZINC000828784096	926182763	/nfs/dbraw/zinc/18/27/63/926182763.db2.gz	KNEUYSPNYYTBQO-QMMMGPOBSA-N	1	0	250.302	1.285	50	0		CDAARO
C[C@H](C[NH+]1CCCC1)C(=O)NCc1cccc(CO)c1	ZINC000828827561	926194560	/nfs/dbraw/zinc/19/45/60/926194560.db2.gz	DGVPQZSJRFFOLE-CYBMUJFWSA-N	1	0	276.380	1.527	50	0		CDAARO
CC1(C[N@@H+]2C[C@H](O)[C@@H](N3CCCCC3)C2)CCOCC1	ZINC000828896622	926211245	/nfs/dbraw/zinc/21/12/45/926211245.db2.gz	BAVBMKFIRXHSOR-GJZGRUSLSA-N	1	0	282.428	1.334	50	0		CDAARO
CCCS(=O)(=O)N1CCC(CCOC)([NH+](C)C)CC1	ZINC000581804988	927203169	/nfs/dbraw/zinc/20/31/69/927203169.db2.gz	PMRUMLVQINSXCU-UHFFFAOYSA-N	1	0	292.445	1.159	50	0		CDAARO
C=CC(=O)N1CC[C@@H](C[N@@H+](C)Cc2scnc2C)C1	ZINC000585086852	930890551	/nfs/dbraw/zinc/89/05/51/930890551.db2.gz	DQZIHGVCQNLTGA-LBPRGKRZSA-N	1	0	279.409	1.918	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3cc(C)no3)C[C@H]2O)[nH]n1	ZINC001529110794	968984303	/nfs/dbraw/zinc/98/43/03/968984303.db2.gz	PBLOXMJILIGWCS-BXUZGUMPSA-N	1	0	276.340	1.050	50	0		CDAARO
CCN(CC[NH+]1CCCC1)c1nccnc1OC	ZINC001529194812	969009671	/nfs/dbraw/zinc/00/96/71/969009671.db2.gz	DBDGEYDCUSTXSW-UHFFFAOYSA-N	1	0	250.346	1.407	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1Nc1ccncc1F	ZINC001506400547	975149345	/nfs/dbraw/zinc/14/93/45/975149345.db2.gz	FVYHZGAEVUBBGQ-STQMWFEESA-N	1	0	253.321	1.162	50	0		CDAARO
COc1cc(OC)nc(N[C@H]2C[N@H+](C(C)C)C[C@@H]2OC)n1	ZINC001506402112	975150518	/nfs/dbraw/zinc/15/05/18/975150518.db2.gz	MNGZLSORAKJLIV-QWRGUYRKSA-N	1	0	296.371	1.013	50	0		CDAARO
c1cn(CC[NH+]2CCC(OCc3cccnc3)CC2)cn1	ZINC001506426205	975160860	/nfs/dbraw/zinc/16/08/60/975160860.db2.gz	DSNSFNQVDCRXQS-UHFFFAOYSA-N	1	0	286.379	1.959	50	0		CDAARO
O=C(NCC1CC[NH+](CCO)CC1)[C@H]1CC12CCCCC2	ZINC001506428798	975161999	/nfs/dbraw/zinc/16/19/99/975161999.db2.gz	ZBMUDIJYCSWRGB-OAHLLOKOSA-N	1	0	294.439	1.777	50	0		CDAARO
C[C@@H]1C[C@@H](NC(=O)CCC(=O)OC(C)(C)C)C[N@@H+]1C1CC1	ZINC000192395511	342467867	/nfs/dbraw/zinc/46/78/67/342467867.db2.gz	AYDFKXVWFGFBHU-VXGBXAGGSA-N	1	0	296.411	1.850	50	0		CDAARO
O=C(C1CCC1)N1CCC[N@@H+]([C@@H]2CCCOC2)CC1	ZINC000584903153	341986547	/nfs/dbraw/zinc/98/65/47/341986547.db2.gz	YNWDSZMKHKGNOH-CQSZACIVSA-N	1	0	266.385	1.500	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@@H](C(=O)NCCCc2cnn(C)c2)C1	ZINC000095524930	185003345	/nfs/dbraw/zinc/00/33/45/185003345.db2.gz	LADPOYKDNPPWRU-OAHLLOKOSA-N	1	0	292.427	1.589	50	0		CDAARO
C[C@H](NC(=O)C[NH+]1CCCC1)c1cn2ncsc2n1	ZINC000220531701	230397497	/nfs/dbraw/zinc/39/74/97/230397497.db2.gz	JTSOQPRZLSHKEG-VIFPVBQESA-N	1	0	279.369	1.064	50	0		CDAARO
Cc1cccc(CCNC(=O)[C@H](C)[NH+]2CCCC2)n1	ZINC000223890378	230399265	/nfs/dbraw/zinc/39/92/65/230399265.db2.gz	VDIARWKACCJSTJ-ZDUSSCGKSA-N	1	0	261.369	1.533	50	0		CDAARO
CN(C)C(=O)Cc1ccc(-c2ccc(C[NH3+])nc2)cc1	ZINC000096132816	185104670	/nfs/dbraw/zinc/10/46/70/185104670.db2.gz	SIODKSNNPPITEA-UHFFFAOYSA-N	1	0	269.348	1.838	50	0		CDAARO
CO[C@H]1CCN(C(=O)COC2CCCCC2)[C@H](C[NH3+])C1	ZINC000195557590	342626848	/nfs/dbraw/zinc/62/68/48/342626848.db2.gz	PWGRXQNIWJDVPK-JSGCOSHPSA-N	1	0	284.400	1.300	50	0		CDAARO
CC(=O)c1ccc(N2C(=O)C[C@@H]([NH2+]CC3CC3)C2=O)cc1	ZINC000083251952	178370048	/nfs/dbraw/zinc/37/00/48/178370048.db2.gz	KIWCQZOUIROYBM-CQSZACIVSA-N	1	0	286.331	1.521	50	0		CDAARO
Cc1ccc(NC(=O)N2C[C@@H](O)[C@@H]([NH+]3CCCC3)C2)s1	ZINC000095407148	539088032	/nfs/dbraw/zinc/08/80/32/539088032.db2.gz	VWXIDEQMGIQRPP-NWDGAFQWSA-N	1	0	295.408	1.729	50	0		CDAARO
CCc1ccc(C[N@H+](C)C[C@H](C)n2cncn2)nc1	ZINC000244659546	361854950	/nfs/dbraw/zinc/85/49/50/361854950.db2.gz	HEOJGAVMHSPJGU-LBPRGKRZSA-N	1	0	259.357	1.929	50	0		CDAARO
CCc1nccn1CC[NH+]1CCN(c2ccccn2)CC1	ZINC000244633365	361855191	/nfs/dbraw/zinc/85/51/91/361855191.db2.gz	GBRKKJABOOPQCQ-UHFFFAOYSA-N	1	0	285.395	1.663	50	0		CDAARO
Cc1nc2cc(CNC(=O)[C@H]([NH3+])C(C)C)ccc2[nH]1	ZINC000244707823	361856408	/nfs/dbraw/zinc/85/64/08/361856408.db2.gz	KIHMRAOZIHJIEC-CYBMUJFWSA-N	1	0	260.341	1.471	50	0		CDAARO
C[C@H]1SCC[N@H+](CCn2nc3ccccn3c2=O)[C@@H]1C	ZINC000097002215	185150531	/nfs/dbraw/zinc/15/05/31/185150531.db2.gz	VLVVEDQLEMGFBA-VXGBXAGGSA-N	1	0	292.408	1.322	50	0		CDAARO
COCC[N@H+](C)CCNC(=O)N1CCC[C@@H](C)[C@@H]1C	ZINC000097010471	185151630	/nfs/dbraw/zinc/15/16/30/185151630.db2.gz	FZZCPJYZNVCULW-OLZOCXBDSA-N	1	0	271.405	1.395	50	0		CDAARO
CCc1nc2ccccc2n1CC(=O)N1CC[C@H]([NH3+])C1	ZINC000097019594	185153182	/nfs/dbraw/zinc/15/31/82/185153182.db2.gz	UAEOLGVUDHYLTM-NSHDSACASA-N	1	0	272.352	1.158	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@H]1NC(=O)CCc1ccon1	ZINC000585136699	342216044	/nfs/dbraw/zinc/21/60/44/342216044.db2.gz	PXCILHJJNGFJOY-BREBYQMCSA-N	1	0	251.330	1.110	50	0		CDAARO
C[C@H]([NH2+]C[C@@H](c1ccco1)N1CCCC1)c1cnnn1C	ZINC000585134843	342215544	/nfs/dbraw/zinc/21/55/44/342215544.db2.gz	LVTGDIZJMGHJQX-JSGCOSHPSA-N	1	0	289.383	1.896	50	0		CDAARO
Cc1ccc([C@@H](CNC(=O)c2cncnc2)[NH+](C)C)cc1	ZINC000273882004	192346109	/nfs/dbraw/zinc/34/61/09/192346109.db2.gz	XPQQYZZKDIMBKA-OAHLLOKOSA-N	1	0	284.363	1.818	50	0		CDAARO
CSC[C@H](C)C(=O)N[C@H]1C[C@H]([NH+](C)C)C1(C)C	ZINC000600841142	342252474	/nfs/dbraw/zinc/25/24/74/342252474.db2.gz	AHQZSXZSJBIOTG-DCAQKATOSA-N	1	0	258.431	1.830	50	0		CDAARO
COc1ccc(CN2C[C@@]3(C)CCC[N@@H+]3C[C@@H]2CO)cc1	ZINC000072233628	342273195	/nfs/dbraw/zinc/27/31/95/342273195.db2.gz	ZUGGYBZWAOHVJU-NVXWUHKLSA-N	1	0	290.407	1.726	50	0		CDAARO
Cc1nccc(N2CCC[C@@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)n1	ZINC000195570829	282186044	/nfs/dbraw/zinc/18/60/44/282186044.db2.gz	ZRASOMLHLUMZES-VNHYZAJKSA-N	1	0	290.411	1.863	50	0		CDAARO
CC[C@H](C)C[N@H+](C)[C@H]1CCN(CCC(=O)OC)C1=O	ZINC000585094195	362021462	/nfs/dbraw/zinc/02/14/62/362021462.db2.gz	OEPYSUCRPIPTGG-RYUDHWBXSA-N	1	0	270.373	1.128	50	0		CDAARO
CC(C)(C)OC(=O)[C@@H]1CCCC[N@@H+]1C[C@H]1CNC(=O)C1	ZINC000585094290	362021618	/nfs/dbraw/zinc/02/16/18/362021618.db2.gz	DPERJHVZHOMMST-NEPJUHHUSA-N	1	0	282.384	1.319	50	0		CDAARO
C[NH+](C)[C@H]1C[C@H](NC(=O)CCc2ccncc2)C1(C)C	ZINC000585130210	362063314	/nfs/dbraw/zinc/06/33/14/362063314.db2.gz	KMZVAQPUIPNDNE-KBPBESRZSA-N	1	0	275.396	1.859	50	0		CDAARO
CCOc1c(F)cccc1C(=O)N1CC[C@@H](C[NH2+]C)C1	ZINC000178968564	362250853	/nfs/dbraw/zinc/25/08/53/362250853.db2.gz	HVQOMXFLSOYUIE-NSHDSACASA-N	1	0	280.343	1.906	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)COc2cccc(C)c2)C1	ZINC000179003274	362250910	/nfs/dbraw/zinc/25/09/10/362250910.db2.gz	GIHDTOBKYNFEGT-ZDUSSCGKSA-N	1	0	262.353	1.442	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cccc3c2OCO3)C1	ZINC000179007408	362250979	/nfs/dbraw/zinc/25/09/79/362250979.db2.gz	XODJQHZDVJQRCC-SNVBAGLBSA-N	1	0	262.309	1.097	50	0		CDAARO
Cc1cc(-n2cncn2)ccc1C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179125871	362252141	/nfs/dbraw/zinc/25/21/41/362252141.db2.gz	DJUHXEOEMPLWFC-ZDUSSCGKSA-N	1	0	285.351	1.010	50	0		CDAARO
C[C@@H]1CN(C(=O)COc2cccc(F)c2)C[C@@H](C)[NH2+]1	ZINC000179163501	362253262	/nfs/dbraw/zinc/25/32/62/362253262.db2.gz	AXWHKRUYDLJJCE-GHMZBOCLSA-N	1	0	266.316	1.413	50	0		CDAARO
COc1ccc(CC2([NH3+])CCS(=O)(=O)CC2)cc1	ZINC000255189239	362492712	/nfs/dbraw/zinc/49/27/12/362492712.db2.gz	OPSGYCVGNTUWPX-UHFFFAOYSA-N	1	0	269.366	1.144	50	0		CDAARO
CCC[N@H+](CCN1C(=O)CCC1=O)C[C@@H]1CCCCO1	ZINC000095431925	362545455	/nfs/dbraw/zinc/54/54/55/362545455.db2.gz	ZXGSCOQXOHUWHP-ZDUSSCGKSA-N	1	0	282.384	1.417	50	0		CDAARO
CC(=O)N1CCN([C@@H]2C[N@H+]([C@H]3C=CCCC3)C[C@H]2C)CC1	ZINC000607974383	345491643	/nfs/dbraw/zinc/49/16/43/345491643.db2.gz	CTFCRIMRPWSGPK-HYVNUMGLSA-N	1	0	291.439	1.580	50	0		CDAARO
Cc1ccc(-c2n[nH]cc2C[NH2+]CCNc2ncccn2)o1	ZINC000097160025	185551846	/nfs/dbraw/zinc/55/18/46/185551846.db2.gz	IATYGDQBOHNTRP-UHFFFAOYSA-N	1	0	298.350	1.970	50	0		CDAARO
C[C@H]1CCC[NH2+][C@@H]1CNC(=O)CCC(F)(F)F	ZINC000088833032	346100048	/nfs/dbraw/zinc/10/00/48/346100048.db2.gz	VESGOPWVXBZQEY-DTWKUNHWSA-N	1	0	252.280	1.833	50	0		CDAARO
CC(C)COC(=O)N1CCC([NH2+]C[C@H]2CCC[C@H]2O)CC1	ZINC000089157739	346155139	/nfs/dbraw/zinc/15/51/39/346155139.db2.gz	IHEXHGMUIZGZMD-UKRRQHHQSA-N	1	0	298.427	1.994	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN1C(=O)CC1CCCC1	ZINC000085469775	179075501	/nfs/dbraw/zinc/07/55/01/179075501.db2.gz	ODPYGNQUAYVIAM-CYBMUJFWSA-N	1	0	254.374	1.356	50	0		CDAARO
CN(CC[NH2+][C@@H]1CCCC(C)(C)C1)S(C)(=O)=O	ZINC000067739590	282477044	/nfs/dbraw/zinc/47/70/44/282477044.db2.gz	HIJBVWJQEDNTPA-LLVKDONJSA-N	1	0	262.419	1.436	50	0		CDAARO
Cc1cnc(CN2CC[NH2+]C[C@H]2c2ccccc2)cn1	ZINC000086177744	179246262	/nfs/dbraw/zinc/24/62/62/179246262.db2.gz	SCJHXVQPKRXPJR-INIZCTEOSA-N	1	0	268.364	1.932	50	0		CDAARO
CC(=O)N1CC[C@H]([NH2+]Cc2occc2C)[C@@H](C)C1	ZINC000089701977	347608005	/nfs/dbraw/zinc/60/80/05/347608005.db2.gz	LFMUYMSYTNLEJY-AAEUAGOBSA-N	1	0	250.342	1.935	50	0		CDAARO
CC(C)[NH2+]CCN1CCC[C@H](Cc2nccn2C)C1	ZINC000193481581	362922399	/nfs/dbraw/zinc/92/23/99/362922399.db2.gz	OIGZBKKQNGCYEP-CQSZACIVSA-N	1	0	264.417	1.673	50	0		CDAARO
C[C@H](O)C(=O)NCC1([NH+]2CCCCC2)CCCC1	ZINC000584888974	349347234	/nfs/dbraw/zinc/34/72/34/349347234.db2.gz	VHQZGNQNANDQSP-LBPRGKRZSA-N	1	0	254.374	1.282	50	0		CDAARO
C[N@@H+]1CCOC[C@@H](CNC(=O)c2cccc3cc[nH]c32)C1	ZINC000584889664	349348656	/nfs/dbraw/zinc/34/86/56/349348656.db2.gz	UOTIDXFBTDRJNH-LBPRGKRZSA-N	1	0	287.363	1.476	50	0		CDAARO
CCc1nn(C)c2c1ncn(CC[C@@H]1CCC[N@@H+]1C)c2=O	ZINC000584895896	349356771	/nfs/dbraw/zinc/35/67/71/349356771.db2.gz	REILDIPNLXZEGL-NSHDSACASA-N	1	0	289.383	1.177	50	0		CDAARO
[NH3+][C@H]1CN(S(=O)(=O)Cc2ccccc2)C[C@@H]1C1CC1	ZINC000091382128	180143875	/nfs/dbraw/zinc/14/38/75/180143875.db2.gz	SGPKXBTTXOZPMH-KGLIPLIRSA-N	1	0	280.393	1.186	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)NCCc1cnccn1	ZINC000091416672	180149637	/nfs/dbraw/zinc/14/96/37/180149637.db2.gz	DBERROPOMWRLDO-CYBMUJFWSA-N	1	0	262.357	1.010	50	0		CDAARO
COc1ccc(OCCN(C)C(=O)[C@H]2CC[C@@H]([NH3+])C2)cc1	ZINC000091545884	180186275	/nfs/dbraw/zinc/18/62/75/180186275.db2.gz	IIEFUGGXFSGTAZ-QWHCGFSZSA-N	1	0	292.379	1.660	50	0		CDAARO
C[C@@H]1CN(C(=O)C[N@H+]2[C@H](C)CCC[C@@H]2C)C[C@]1(C)O	ZINC000091915428	180285898	/nfs/dbraw/zinc/28/58/98/180285898.db2.gz	WKJQJPAZXSWJIL-CXTNEJHOSA-N	1	0	268.401	1.479	50	0		CDAARO
C[C@H](CNc1ncnc2nc[nH]c21)[N@@H+]1CCC[C@@H](C)C1	ZINC000106826560	186137738	/nfs/dbraw/zinc/13/77/38/186137738.db2.gz	IHIQOJHAWULVSS-GHMZBOCLSA-N	1	0	274.372	1.885	50	0		CDAARO
C[C@@H](NC(=O)CCc1ccncc1)[C@H]1CCCC[NH2+]1	ZINC000583651210	366008843	/nfs/dbraw/zinc/00/88/43/366008843.db2.gz	GYXDMLQLCVANAD-TZMCWYRMSA-N	1	0	261.369	1.661	50	0		CDAARO
CC(=O)N1CCN([C@@H]2C[N@@H+](CC3CCCC3)C[C@H]2C)CC1	ZINC000257366216	350964553	/nfs/dbraw/zinc/96/45/53/350964553.db2.gz	ODMOHLZKSATKAX-RHSMWYFYSA-N	1	0	293.455	1.661	50	0		CDAARO
C[NH+](C)CCCN1C(=O)N[C@H](Cc2ccccc2)C1=O	ZINC000002115736	363050885	/nfs/dbraw/zinc/05/08/85/363050885.db2.gz	YDWXKRCTOVMVAJ-CYBMUJFWSA-N	1	0	275.352	1.101	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)[C@@H]1COc2ccccc2O1	ZINC000000620315	355920294	/nfs/dbraw/zinc/92/02/94/355920294.db2.gz	LRULXWAWWPSUQB-AWEZNQCLSA-N	1	0	276.336	1.038	50	0		CDAARO
COCCc1ccc(OC[C@H](O)C[NH2+]C(C)C)cc1	ZINC000001530718	355938772	/nfs/dbraw/zinc/93/87/72/355938772.db2.gz	IUBSYMUCCVWXPE-CQSZACIVSA-N	1	0	267.369	1.613	50	0	fda	CDAARO
COc1ccc(OC[C@@H](O)C[NH+]2CCCC2)cc1	ZINC000000127553	355889620	/nfs/dbraw/zinc/88/96/20/355889620.db2.gz	KSIRTXNTGFVNAU-LBPRGKRZSA-N	1	0	251.326	1.531	50	0		CDAARO
C[NH+]1CCN(c2ccc(Br)cc2N)CC1	ZINC000003888710	356013245	/nfs/dbraw/zinc/01/32/45/356013245.db2.gz	QRSKVMNMLVQJPL-UHFFFAOYSA-N	1	0	270.174	1.783	50	0		CDAARO
COc1cccc([C@H](O)C2CC[NH2+]CC2)c1OC	ZINC000004234521	356022543	/nfs/dbraw/zinc/02/25/43/356022543.db2.gz	LZRHDSQWBVFQMC-CYBMUJFWSA-N	1	0	251.326	1.737	50	0		CDAARO
Cc1ccc(C(=O)N[C@H](C[NH+](C)C)c2ccccc2)c(=O)[nH]1	ZINC000097465156	356160473	/nfs/dbraw/zinc/16/04/73/356160473.db2.gz	FQBDZZIKIGTYJQ-OAHLLOKOSA-N	1	0	299.374	1.716	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)c2coc(Br)c2)CC1	ZINC000032779865	356368319	/nfs/dbraw/zinc/36/83/19/356368319.db2.gz	BHLFMMSYLSSUKF-UHFFFAOYSA-N	1	0	287.157	1.820	50	0		CDAARO
C[NH+]1CCC2(CC1)OCCN2C(=O)COc1ccccc1	ZINC000013685786	356353375	/nfs/dbraw/zinc/35/33/75/356353375.db2.gz	RMZCQHVASDNSSG-UHFFFAOYSA-N	1	0	290.363	1.346	50	0		CDAARO
CCOc1ccc(CC(=O)NC2CC[NH+](C)CC2)cc1	ZINC000016604733	356442971	/nfs/dbraw/zinc/44/29/71/356442971.db2.gz	JMFTUUQLDOGYMD-UHFFFAOYSA-N	1	0	276.380	1.838	50	0		CDAARO
COc1ccc(CN2CC[NH2+]C[C@@H]2CCO)c(C)c1C	ZINC000019367996	356482659	/nfs/dbraw/zinc/48/26/59/356482659.db2.gz	SSWVGAQGUIIKGK-HNNXBMFYSA-N	1	0	278.396	1.468	50	0		CDAARO
COc1ccc(OC)c(NC(=O)[C@H]2CCC[NH2+]2)c1	ZINC000019413026	356484854	/nfs/dbraw/zinc/48/48/54/356484854.db2.gz	CRAOEJRGFZMOPP-SNVBAGLBSA-N	1	0	250.298	1.394	50	0		CDAARO
C1=C[C@H](N2CC[NH+](C[C@H]3CCOC3)CC2)CCC1	ZINC000084137116	356525933	/nfs/dbraw/zinc/52/59/33/356525933.db2.gz	HKJWBGPMOFRXDG-CABCVRRESA-N	1	0	250.386	1.749	50	0		CDAARO
NCC[NH2+]CCCOc1cccc(Br)c1	ZINC000020118395	356526254	/nfs/dbraw/zinc/52/62/54/356526254.db2.gz	LEKXQZORWSSDJT-UHFFFAOYSA-N	1	0	273.174	1.766	50	0		CDAARO
CN1C[C@@H]([NH2+][C@@H]2CCc3ccccc3C2)CCC1=O	ZINC000084060305	283203567	/nfs/dbraw/zinc/20/35/67/283203567.db2.gz	MSJNOVANOURGMA-CABCVRRESA-N	1	0	258.365	1.754	50	0		CDAARO
O=C(CCN1CCO[C@H](c2ccccc2)C1)NC1CC1	ZINC000026927858	356701142	/nfs/dbraw/zinc/70/11/42/356701142.db2.gz	KWLXTLBGNJOANF-HNNXBMFYSA-N	1	0	274.364	1.729	50	0		CDAARO
Cc1cc(NC(=O)NCC[NH+]2CCCCCC2)no1	ZINC000027348447	356706739	/nfs/dbraw/zinc/70/67/39/356706739.db2.gz	BAKLBLHYAMTAIS-UHFFFAOYSA-N	1	0	266.345	1.981	50	0		CDAARO
COc1ccccc1C[C@@H](C)[NH2+][C@H]1CCCCNC1=O	ZINC000004022936	356735680	/nfs/dbraw/zinc/73/56/80/356735680.db2.gz	PRMOMIGBCGVQBO-OCCSQVGLSA-N	1	0	276.380	1.885	50	0		CDAARO
OCC[N@@H+]1CCCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000033376424	356801307	/nfs/dbraw/zinc/80/13/07/356801307.db2.gz	YYTFBPWRLMWPMS-UHFFFAOYSA-N	1	0	289.301	1.605	50	0		CDAARO
CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1cn[nH]n1	ZINC000174919958	356818790	/nfs/dbraw/zinc/81/87/90/356818790.db2.gz	FSQDJJZXDFLNTN-CQSZACIVSA-N	1	0	299.378	1.399	50	0		CDAARO
Cn1nccc1CC[NH2+][C@@H]1CCOC2(CCOCC2)C1	ZINC000082161862	357066421	/nfs/dbraw/zinc/06/64/21/357066421.db2.gz	LZBVSZYPVKQYNU-CYBMUJFWSA-N	1	0	279.384	1.280	50	0		CDAARO
Cc1nccc(N2CCC(C[NH+]3CCN(C)CC3)CC2)n1	ZINC000266449627	363580078	/nfs/dbraw/zinc/58/00/78/363580078.db2.gz	XDMUPWJWYHTTBO-UHFFFAOYSA-N	1	0	289.427	1.249	50	0		CDAARO
CCOC(=O)CN(C)[C@H](C)Cc1cc(C)ccn1	ZINC000055309952	357332015	/nfs/dbraw/zinc/33/20/15/357332015.db2.gz	QDZWVXNIYCYMEI-GFCCVEGCSA-N	1	0	250.342	1.816	50	0		CDAARO
CNC(=O)C[C@H](C)[N@H+](C)Cc1nc2c(s1)CCCC2	ZINC000065380257	357533502	/nfs/dbraw/zinc/53/35/02/357533502.db2.gz	LYSWTOIKNDWKQH-JTQLQIEISA-N	1	0	281.425	1.978	50	0		CDAARO
C[N@@H+](Cc1ccccc1)C[C@@H]1CCCN(CCO)C1	ZINC000065460515	357543090	/nfs/dbraw/zinc/54/30/90/357543090.db2.gz	XOQZAUJMTLVLIL-INIZCTEOSA-N	1	0	262.397	1.823	50	0		CDAARO
[NH3+]Cc1n[nH]c(=O)n1-c1ccccc1-c1ccccc1	ZINC000065499708	357545886	/nfs/dbraw/zinc/54/58/86/357545886.db2.gz	DHYGQCDCALKLEU-UHFFFAOYSA-N	1	0	266.304	1.686	50	0		CDAARO
C[C@H](NC(=O)C[NH+]1CCCCCCC1)c1nncn1C	ZINC000067851496	357632797	/nfs/dbraw/zinc/63/27/97/357632797.db2.gz	ZQADJXCMIUKAPV-LBPRGKRZSA-N	1	0	279.388	1.258	50	0		CDAARO
CC(C)c1cc(N2CCC([NH3+])CC2)n2nccc2n1	ZINC000072476053	357838231	/nfs/dbraw/zinc/83/82/31/357838231.db2.gz	VWWUISCSCVKIGN-UHFFFAOYSA-N	1	0	259.357	1.780	50	0		CDAARO
O=C1C[C@]2(CC[N@@H+](C/C=C/c3ccc(F)cc3)C2)C(=O)N1	ZINC000082107355	358146825	/nfs/dbraw/zinc/14/68/25/358146825.db2.gz	SRBIRIKOXQRXRJ-PYKQWIPUSA-N	1	0	288.322	1.578	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1C1CN(C(=O)CCc2cnn(C)c2)C1	ZINC000082092247	358147039	/nfs/dbraw/zinc/14/70/39/358147039.db2.gz	LQEKMFMWOGEOBP-ZDUSSCGKSA-N	1	0	290.411	1.438	50	0		CDAARO
Cc1nc(C)c(C(=O)NC[C@@H]2C[C@H](F)C[NH2+]2)s1	ZINC000082108254	358147174	/nfs/dbraw/zinc/14/71/74/358147174.db2.gz	HIUVHDRLEQQASH-IUCAKERBSA-N	1	0	257.334	1.190	50	0		CDAARO
COC(=O)c1ccc(C(=O)N2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)cc1	ZINC000248652491	363615852	/nfs/dbraw/zinc/61/58/52/363615852.db2.gz	VJEAXYPEDANVGG-MELADBBJSA-N	1	0	288.347	1.283	50	0		CDAARO
Cc1ncc(C(=O)N[C@@H]2CC[NH2+]C2)c(-c2ccccc2)n1	ZINC000097468367	358779289	/nfs/dbraw/zinc/77/92/89/358779289.db2.gz	ZNEOGXCDJOZDEI-CYBMUJFWSA-N	1	0	282.347	1.544	50	0		CDAARO
CCc1cc(Cl)ccc1NC(=O)NC[C@@H](O)C[NH+](C)C	ZINC000097632167	358788213	/nfs/dbraw/zinc/78/82/13/358788213.db2.gz	CWJIFCRYMUVQBW-GFCCVEGCSA-N	1	0	299.802	1.946	50	0		CDAARO
CNC(=O)C[C@@H](C)N(C)C(=O)Nc1cccc(C[NH3+])c1	ZINC000097619609	358788662	/nfs/dbraw/zinc/78/86/62/358788662.db2.gz	ZJTQJVGNFOSTHZ-SNVBAGLBSA-N	1	0	278.356	1.134	50	0		CDAARO
Cc1n[nH]c(C)c1-c1ccc(N2CCN(C)CC2)nn1	ZINC000097766500	358797701	/nfs/dbraw/zinc/79/77/01/358797701.db2.gz	GGZGWIQDQDIYPK-UHFFFAOYSA-N	1	0	272.356	1.235	50	0		CDAARO
CCCc1ccc(C[N@@H+]2CC[C@H](NC(C)=O)C2)o1	ZINC000215751435	358900872	/nfs/dbraw/zinc/90/08/72/358900872.db2.gz	QWTINSPHBIFZAL-LBPRGKRZSA-N	1	0	250.342	1.943	50	0		CDAARO
O=C1N(CC2CCC2)CCC[C@]1(O)C[NH+]1CCSCC1	ZINC000012300237	358937672	/nfs/dbraw/zinc/93/76/72/358937672.db2.gz	VGDIVAQDUAYNMZ-HNNXBMFYSA-N	1	0	298.452	1.189	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@@H](O)C2)cc(OC)c1	ZINC000000209235	359301834	/nfs/dbraw/zinc/30/18/34/359301834.db2.gz	BCUULGGKAXRXTI-GFCCVEGCSA-N	1	0	251.326	1.661	50	0		CDAARO
O=C1c2ccccc2C(=O)N1CC[NH+]1CCCCC1	ZINC000000271606	359417740	/nfs/dbraw/zinc/41/77/40/359417740.db2.gz	XZVKPZWYCZCAGN-UHFFFAOYSA-N	1	0	258.321	1.769	50	0		CDAARO
NC(=O)CCC1CC[NH+](C[C@@H]2CCCOC2)CC1	ZINC000347938760	359708153	/nfs/dbraw/zinc/70/81/53/359708153.db2.gz	AEPFNQSRQSRTIP-ZDUSSCGKSA-N	1	0	254.374	1.391	50	0		CDAARO
C[C@H]1CC[N@H+](CC(=O)N[C@H]2CCOC(C)(C)C2)C1	ZINC000408517999	359903613	/nfs/dbraw/zinc/90/36/13/359903613.db2.gz	RJLUFBWQISIMIP-RYUDHWBXSA-N	1	0	254.374	1.402	50	0		CDAARO
C[NH+](C)CCCC(C)(C)NC(=O)c1ccc(C(N)=O)cc1	ZINC000408520763	359917044	/nfs/dbraw/zinc/91/70/44/359917044.db2.gz	WBGHPPKCDKCRLT-UHFFFAOYSA-N	1	0	291.395	1.636	50	0		CDAARO
COc1ccc(C(=O)OCCC[NH+](C)C)cc1OC	ZINC000004039160	359919963	/nfs/dbraw/zinc/91/99/63/359919963.db2.gz	SLAMQYPBRDESEQ-UHFFFAOYSA-N	1	0	267.325	1.812	50	0	biogenic	CDAARO
CC(C)(C)OC(=O)N[C@@H]1CCC[N@H+](C[C@H]2C[C@@H](O)C2)C1	ZINC000408521878	359920571	/nfs/dbraw/zinc/92/05/71/359920571.db2.gz	YARIWQCUOWBGGM-UPJWGTAASA-N	1	0	284.400	1.746	50	0		CDAARO
Cc1ccccc1[C@H](C)[NH2+]C[C@H](O)CN1CCCC1=O	ZINC000089515073	360095001	/nfs/dbraw/zinc/09/50/01/360095001.db2.gz	NVHDEYIQPJKXHY-KBPBESRZSA-N	1	0	276.380	1.629	50	0		CDAARO
[NH3+]Cc1ccc2c(I)n[nH]c2c1	ZINC000143968978	283529765	/nfs/dbraw/zinc/52/97/65/283529765.db2.gz	MGAMMFVSSNSLKV-UHFFFAOYSA-N	1	0	273.077	1.626	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1C[C@H]1CCCN(S(C)(=O)=O)C1	ZINC000409420896	360224364	/nfs/dbraw/zinc/22/43/64/360224364.db2.gz	ANSWCVZZYZCDCF-LBPRGKRZSA-N	1	0	297.424	1.741	50	0		CDAARO
CN1C(=O)N(C)[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1=O	ZINC000409420325	360224644	/nfs/dbraw/zinc/22/46/44/360224644.db2.gz	FUNVSFVCCDDCDE-OAHLLOKOSA-N	1	0	273.336	1.155	50	0		CDAARO
CCC[NH2+]C[C@]1(O)CCCN(Cc2ccc(F)cc2)C1=O	ZINC000011953074	360465438	/nfs/dbraw/zinc/46/54/38/360465438.db2.gz	DTRGLHZMHSGOIU-MRXNPFEDSA-N	1	0	294.370	1.679	50	0		CDAARO
[NH3+]CCCC(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1	ZINC000178085939	189090055	/nfs/dbraw/zinc/09/00/55/189090055.db2.gz	CHKCZTKGIWQVIF-HIFRSBDPSA-N	1	0	262.353	1.762	50	0		CDAARO
Cc1cc(C)c(CNC(=O)c2cccc(OCC[NH3+])c2)cn1	ZINC000426602342	360687444	/nfs/dbraw/zinc/68/74/44/360687444.db2.gz	DRJZAWHPSZZUOR-UHFFFAOYSA-N	1	0	299.374	1.966	50	0		CDAARO
CC(C)c1ncc(Cl)c(C(=O)N2CC[C@@H](C[NH3+])C2)n1	ZINC000178519294	189123021	/nfs/dbraw/zinc/12/30/21/189123021.db2.gz	BAOUVWAJRNTLJM-VIFPVBQESA-N	1	0	282.775	1.674	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)COc2ccc(F)c(Cl)c2)C1	ZINC000178550214	189126327	/nfs/dbraw/zinc/12/63/27/189126327.db2.gz	KGCKVNZHWHMTHE-SECBINFHSA-N	1	0	286.734	1.665	50	0		CDAARO
COc1ccc(C(=O)NC[C@@H](C)[NH+]2CCCC2)cc1	ZINC000036077000	360832057	/nfs/dbraw/zinc/83/20/57/360832057.db2.gz	YARDBZSQXLVOHE-GFCCVEGCSA-N	1	0	262.353	1.909	50	0		CDAARO
Cc1c[nH]c([C@H](C)NC(=O)CSCc2nc(C)no2)n1	ZINC000426523316	360981147	/nfs/dbraw/zinc/98/11/47/360981147.db2.gz	BKLFNQRXOXLFQV-QMMMGPOBSA-N	1	0	295.368	1.520	50	0		CDAARO
O[C@@H](Cn1ccc2ccccc21)CN1CCOCC1	ZINC000020060367	361582827	/nfs/dbraw/zinc/58/28/27/361582827.db2.gz	PFCCRVSTTSDWEQ-CQSZACIVSA-N	1	0	260.337	1.334	50	0		CDAARO
NC(=O)c1ccc(C[NH2+]Cc2ccc3c(c2)OCO3)cc1	ZINC000035046160	364813832	/nfs/dbraw/zinc/81/38/32/364813832.db2.gz	OLNZNMVHKWEMQU-UHFFFAOYSA-N	1	0	284.315	1.804	50	0		CDAARO
CCc1oc(C(=O)NC[C@H]2CCC[NH2+]C2)cc1C	ZINC000195542799	189677887	/nfs/dbraw/zinc/67/78/87/189677887.db2.gz	PPEWZIBSMJRXLJ-NSHDSACASA-N	1	0	250.342	1.880	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)c1ccn[nH]1	ZINC000249697918	365197680	/nfs/dbraw/zinc/19/76/80/365197680.db2.gz	VIRCNEDZRMUJOA-CHWSQXEVSA-N	1	0	262.357	1.499	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)c1cnccn1	ZINC000249698767	365200726	/nfs/dbraw/zinc/20/07/26/365200726.db2.gz	WJHGNWPKROQRQW-ZIAGYGMSSA-N	1	0	274.368	1.566	50	0		CDAARO
NC(=O)C1([NH2+]CCOc2ccc(F)cc2)CCCCC1	ZINC000088545505	365438991	/nfs/dbraw/zinc/43/89/91/365438991.db2.gz	DQHJQFHRQNTUCI-UHFFFAOYSA-N	1	0	280.343	1.982	50	0		CDAARO
O[C@@H](CNCc1cnc(C2CCC2)s1)C[NH+]1CCCC1	ZINC000089764823	366931055	/nfs/dbraw/zinc/93/10/55/366931055.db2.gz	MKTBMKZZBPPHPT-ZDUSSCGKSA-N	1	0	295.452	1.957	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1CC(=O)NCc1cccs1	ZINC000089939108	366972890	/nfs/dbraw/zinc/97/28/90/366972890.db2.gz	IIGAKQSBFCYMNX-LLVKDONJSA-N	1	0	267.398	1.000	50	0		CDAARO
CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1CC(=O)N(CC)CC	ZINC000089949302	366978268	/nfs/dbraw/zinc/97/82/68/366978268.db2.gz	CKENJVGWRLIJJW-ZIAGYGMSSA-N	1	0	267.417	1.413	50	0		CDAARO
Cn1ccnc1C[C@H]1CCC[N@H+](CC(=O)N2CCCC2)C1	ZINC000090004525	367006986	/nfs/dbraw/zinc/00/69/86/367006986.db2.gz	JUIJUXWVRMAINN-CQSZACIVSA-N	1	0	290.411	1.297	50	0		CDAARO
C[C@@H](COc1ccccc1)NC(=O)C[NH+]1CCCC1	ZINC000000394453	367501968	/nfs/dbraw/zinc/50/19/68/367501968.db2.gz	CFSHHPUWWPSARG-ZDUSSCGKSA-N	1	0	262.353	1.666	50	0		CDAARO
Cc1cc(OCC[NH+](C)C)ccc1NC(=O)C(C)(C)O	ZINC000252507444	367651653	/nfs/dbraw/zinc/65/16/53/367651653.db2.gz	WLXXQFDPUFOTAQ-UHFFFAOYSA-N	1	0	280.368	1.645	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]C[C@H](Cc2cnn(C)c2)C(N)=O)[C@@H](C)C1	ZINC000252512797	367712491	/nfs/dbraw/zinc/71/24/91/367712491.db2.gz	VTRNWUXGEIXWOT-DHMWGJHJSA-N	1	0	292.427	1.478	50	0		CDAARO
C[C@@H]([NH2+]CCO)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000003338947	369403316	/nfs/dbraw/zinc/40/33/16/369403316.db2.gz	BUSLATCLOVXRRL-SSDOTTSWSA-N	1	0	277.151	1.902	50	0		CDAARO
Cn1cncc1C[N@@H+]1CCC[C@H](c2ccncn2)C1	ZINC000370236512	369989269	/nfs/dbraw/zinc/98/92/69/369989269.db2.gz	PGMPDZQKBDLZSY-LBPRGKRZSA-N	1	0	257.341	1.590	50	0		CDAARO
C[C@]1(C2CC[NH2+]CC2)NC(=O)N(Cc2ccsc2)C1=O	ZINC000299801081	372771349	/nfs/dbraw/zinc/77/13/49/372771349.db2.gz	XQGGMTLSNNGEPK-CQSZACIVSA-N	1	0	293.392	1.558	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)N[C@@H](c1nccn1C)C1CC1	ZINC000299800088	372771444	/nfs/dbraw/zinc/77/14/44/372771444.db2.gz	VRYZLWMIJMPUAN-CQSZACIVSA-N	1	0	287.367	1.570	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@]1(C(F)F)CC[NH2+]C1	ZINC000299805316	372772391	/nfs/dbraw/zinc/77/23/91/372772391.db2.gz	IVORNZPANYCEIQ-NSHDSACASA-N	1	0	250.289	1.756	50	0		CDAARO
C[N@@H+]1CCN(Cc2[nH]c3ccccc3c2Cl)C[C@H]1CO	ZINC000225434279	373037281	/nfs/dbraw/zinc/03/72/81/373037281.db2.gz	VXQOBJBWAXXVEQ-NSHDSACASA-N	1	0	293.798	1.930	50	0		CDAARO
CC[NH+](CC)CCOC(=O)c1ccc(OC)cc1O	ZINC000002294846	373742474	/nfs/dbraw/zinc/74/24/74/373742474.db2.gz	PBBLVFQZTPDCJJ-UHFFFAOYSA-N	1	0	267.325	1.899	50	0		CDAARO
CC(C)C[C@H](CNc1ccc2nnnn2n1)[NH+]1CCCC1	ZINC000012985241	373914238	/nfs/dbraw/zinc/91/42/38/373914238.db2.gz	FOKBKUVVXKVWAG-GFCCVEGCSA-N	1	0	289.387	1.442	50	0		CDAARO
OC1(C[NH2+]Cc2ccc(Cl)cc2)CCOCC1	ZINC000112717005	374227260	/nfs/dbraw/zinc/22/72/60/374227260.db2.gz	MBPFQGHPXDYYTR-UHFFFAOYSA-N	1	0	255.745	1.971	50	0		CDAARO
C[C@@H]1CCC[C@H](C)[N@H+]1CCCNC(=O)CN1CCCC1=O	ZINC000027748944	374280675	/nfs/dbraw/zinc/28/06/75/374280675.db2.gz	SKQJXFIFVWTIIF-OKILXGFUSA-N	1	0	295.427	1.378	50	0		CDAARO
Cc1n[nH]cc1CCCNC(=O)N1CC[N@@H+](C)[C@@H](C)[C@H]1C	ZINC000108334610	412824136	/nfs/dbraw/zinc/82/41/36/412824136.db2.gz	MRWRIUNMJVPLOK-QWHCGFSZSA-N	1	0	293.415	1.385	50	0		CDAARO
CC(C)c1nc(CN2C[C@@H](C)O[C@@H](C)C2)cc(=O)[nH]1	ZINC000013146596	374656238	/nfs/dbraw/zinc/65/62/38/374656238.db2.gz	WXXVPPOBKXRDER-PHIMTYICSA-N	1	0	265.357	1.503	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1n[nH]c2c1CCCCC2	ZINC000096232206	375065103	/nfs/dbraw/zinc/06/51/03/375065103.db2.gz	CDMTZHAGOQVUDX-UHFFFAOYSA-N	1	0	264.373	1.360	50	0		CDAARO
C[C@H]1OCC[C@@H]1[NH2+]Cc1ccc(N2CCOC2=O)cc1	ZINC000097084777	375146978	/nfs/dbraw/zinc/14/69/78/375146978.db2.gz	MCZFZJMFPJPXLL-RISCZKNCSA-N	1	0	276.336	1.910	50	0		CDAARO
C[C@@H](CC(=O)N1C[C@@H](C)[NH2+][C@@H](C)C1)c1ccncc1	ZINC000299739470	375199491	/nfs/dbraw/zinc/19/94/91/375199491.db2.gz	OVJBBFJMLBVGIF-RWMBFGLXSA-N	1	0	261.369	1.784	50	0		CDAARO
CC[C@H](O)CN1C(=O)CC[C@H]1CC[NH2+]Cc1ccccc1	ZINC000299768947	375211446	/nfs/dbraw/zinc/21/14/46/375211446.db2.gz	HBXPXHXRUPXXLV-HOTGVXAUSA-N	1	0	290.407	1.928	50	0		CDAARO
CN(C)c1ncc(C[N@@H+]2CC[C@](O)(C3CC3)C2)s1	ZINC000426535867	247037884	/nfs/dbraw/zinc/03/78/84/247037884.db2.gz	DBLXTFQWLFAKTQ-CYBMUJFWSA-N	1	0	267.398	1.556	50	0		CDAARO
CC(C)C[NH2+]CC(=O)Nc1ccc2c(c1)OCO2	ZINC000003440618	375699458	/nfs/dbraw/zinc/69/94/58/375699458.db2.gz	ZDOPSSCOWHVEKQ-UHFFFAOYSA-N	1	0	250.298	1.599	50	0		CDAARO
CC(C)[N@H+](C)CCOC(=O)[C@H]1COc2ccccc2O1	ZINC000001831253	376104046	/nfs/dbraw/zinc/10/40/46/376104046.db2.gz	UZOJAUDXMLMQMM-CQSZACIVSA-N	1	0	279.336	1.710	50	0		CDAARO
Cc1ccc(CN2C[C@H]([C@H](C)O)[NH2+]C[C@@H]2[C@@H](C)O)cc1F	ZINC000585657555	376360773	/nfs/dbraw/zinc/36/07/73/376360773.db2.gz	LOAGMTIBSYNWDE-UAXWRAGISA-N	1	0	296.386	1.038	50	0		CDAARO
CCc1nnc(CNC(=O)[C@@H]([NH3+])Cc2ccccc2)s1	ZINC000244626520	377793508	/nfs/dbraw/zinc/79/35/08/377793508.db2.gz	FNHOOQYFOPGFFU-NSHDSACASA-N	1	0	290.392	1.287	50	0		CDAARO
COc1ccc(CN2C[C@]3(C)CCC[N@@H+]3C[C@H]2CO)cc1	ZINC000245224619	377939009	/nfs/dbraw/zinc/93/90/09/377939009.db2.gz	ZUGGYBZWAOHVJU-RDJZCZTQSA-N	1	0	290.407	1.726	50	0		CDAARO
CNC(=O)NC(=O)[C@@H](C)[NH2+]C1C2CC3CC(C2)CC1C3	ZINC000009483612	379373442	/nfs/dbraw/zinc/37/34/42/379373442.db2.gz	YYOONUBDHUDIFS-GLFGPFBSSA-N	1	0	279.384	1.245	50	0		CDAARO
O=C1[C@@H]2CC=C(Cl)C[C@@H]2C(=O)N1CC[n+]1ccccc1	ZINC000100648696	284983174	/nfs/dbraw/zinc/98/31/74/284983174.db2.gz	MKYMTEZDKHZESB-OLZOCXBDSA-N	1	0	291.758	1.492	50	0		CDAARO
CSc1ccccc1C(=O)N1C[C@H](O)[C@@H]([NH+](C)C)C1	ZINC000219880073	533031516	/nfs/dbraw/zinc/03/15/16/533031516.db2.gz	WZKVYFNWTNTPBV-RYUDHWBXSA-N	1	0	280.393	1.155	50	0		CDAARO
C[C@@H](CC(=O)N1CCCCCC1)[NH2+]CCc1cnn(C)c1	ZINC000095420639	184975657	/nfs/dbraw/zinc/97/56/57/184975657.db2.gz	LIRBXQMMQSFRAA-AWEZNQCLSA-N	1	0	292.427	1.733	50	0		CDAARO
Cc1cccc(S(=O)(=O)N[C@@H]2CC[NH2+]C2)c1Cl	ZINC000095467164	184995065	/nfs/dbraw/zinc/99/50/65/184995065.db2.gz	OATRODNOJKRHHO-SECBINFHSA-N	1	0	274.773	1.289	50	0		CDAARO
COc1c(CN2CCCC[C@H]2C2OCCO2)c(C)nn1C	ZINC000092937145	390509285	/nfs/dbraw/zinc/50/92/85/390509285.db2.gz	FAODYQCOJMXQTD-ZDUSSCGKSA-N	1	0	295.383	1.465	50	0		CDAARO
COCCCNC(=O)[C@@H](C)N1CCC[C@H]([NH+]2CCCC2)C1	ZINC000096419581	390513178	/nfs/dbraw/zinc/51/31/78/390513178.db2.gz	IKSFADJZHWLGNH-CABCVRRESA-N	1	0	297.443	1.088	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)[C@@H]1CCCO1)c1ccccc1	ZINC000033028896	390474407	/nfs/dbraw/zinc/47/44/07/390474407.db2.gz	KESNIGSTNSUANP-KGLIPLIRSA-N	1	0	262.353	1.585	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccc([S@](C)=O)cc2)C[C@@H](C)[NH2+]1	ZINC000179163379	390944090	/nfs/dbraw/zinc/94/40/90/390944090.db2.gz	BBWRLDBXECEFOA-BFKGZMGPSA-N	1	0	280.393	1.246	50	0		CDAARO
CS(=O)(=O)c1ccc(CN2CC[N@@H+]3CCC[C@H]3C2)cc1	ZINC000244700889	391042743	/nfs/dbraw/zinc/04/27/43/391042743.db2.gz	JVVILEJFWVNZFT-AWEZNQCLSA-N	1	0	294.420	1.370	50	0		CDAARO
CCOCCN1CC[N@H+](CC2(O)CCCCC2)C[C@H]1C	ZINC000241132809	391680750	/nfs/dbraw/zinc/68/07/50/391680750.db2.gz	JLVCLQWKFJXGOR-OAHLLOKOSA-N	1	0	284.444	1.724	50	0		CDAARO
Cc1ccccc1[C@@H](O)CNC(=O)C1CC[NH2+]CC1	ZINC000262705793	131253116	/nfs/dbraw/zinc/25/31/16/131253116.db2.gz	MCNMYXBWXHZHAV-AWEZNQCLSA-N	1	0	262.353	1.144	50	0		CDAARO
Cc1ccccc1[C@H](O)CNC(=O)C1CC[NH2+]CC1	ZINC000262705794	131253196	/nfs/dbraw/zinc/25/31/96/131253196.db2.gz	MCNMYXBWXHZHAV-CQSZACIVSA-N	1	0	262.353	1.144	50	0		CDAARO
Cc1cc(CC(=O)N2CCCC[C@@H]2[C@@H](C)[NH3+])no1	ZINC000262782991	131261616	/nfs/dbraw/zinc/26/16/16/131261616.db2.gz	YTKARWALZJBZIX-ZYHUDNBSSA-N	1	0	251.330	1.254	50	0		CDAARO
C[NH2+]CCN(C)C(=O)C1(c2ccccc2C)CCOCC1	ZINC000263266794	131287620	/nfs/dbraw/zinc/28/76/20/131287620.db2.gz	VMKXEHQDNCILCZ-UHFFFAOYSA-N	1	0	290.407	1.721	50	0		CDAARO
CNC(=O)CC1CC[NH+](CC[C@H]2CCOC2)CC1	ZINC000438125642	392536364	/nfs/dbraw/zinc/53/63/64/392536364.db2.gz	ITMPNHTYMZZOSM-ZDUSSCGKSA-N	1	0	254.374	1.261	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)[C@@H]2Cc3cc(Cl)ccc3O2)C1	ZINC000269153222	132122316	/nfs/dbraw/zinc/12/23/16/132122316.db2.gz	WNUSLJSORVGAAR-HZMBPMFUSA-N	1	0	294.782	1.711	50	0		CDAARO
CC[C@](C)(O)C[NH2+][C@@H]1CCN(c2ccccc2)C(=O)C1	ZINC000193093651	393220401	/nfs/dbraw/zinc/22/04/01/393220401.db2.gz	BVQQAERQFDZAPU-CJNGLKHVSA-N	1	0	276.380	1.933	50	0		CDAARO
c1ccc2c(c1)cnnc2N1CC[NH+](C[C@@H]2CCOC2)CC1	ZINC000095978860	285525592	/nfs/dbraw/zinc/52/55/92/285525592.db2.gz	VQVZTYPYJZKSKQ-AWEZNQCLSA-N	1	0	298.390	1.788	50	0		CDAARO
O=C([C@H]1CCC[NH2+]C1)N1CCN(c2ccccc2)CC1	ZINC000019413010	134700443	/nfs/dbraw/zinc/70/04/43/134700443.db2.gz	HXXQVBBUZYEVCH-AWEZNQCLSA-N	1	0	273.380	1.335	50	0		CDAARO
[NH3+]CCOc1cc(N2CCN(c3ccccc3)CC2)ncn1	ZINC000038478022	134854507	/nfs/dbraw/zinc/85/45/07/134854507.db2.gz	ZIVDNNFMEJKMGE-UHFFFAOYSA-N	1	0	299.378	1.141	50	0		CDAARO
Cc1n[nH]c([C@H]2CCCN(c3nc(N)[nH+]c(C)c3C)C2)n1	ZINC000091782497	135073744	/nfs/dbraw/zinc/07/37/44/135073744.db2.gz	SMWUECAYUABQLQ-NSHDSACASA-N	1	0	287.371	1.486	50	0		CDAARO
C[C@H](NC(=O)[C@@H]([NH3+])CC1CCCCC1)c1cnn(C)c1	ZINC000261827541	140395271	/nfs/dbraw/zinc/39/52/71/140395271.db2.gz	UKYIQNQIHNZSGT-FZMZJTMJSA-N	1	0	278.400	1.895	50	0		CDAARO
O=C(NC1CC[NH+](C2CCCC2)CC1)N[C@@H]1CCCOC1	ZINC000095407386	147113894	/nfs/dbraw/zinc/11/38/94/147113894.db2.gz	FTUMDZADHBWRHL-CQSZACIVSA-N	1	0	295.427	1.872	50	0		CDAARO
C[C@@H](C[NH3+])C(=O)N1CCc2c(cnn2-c2ccccc2)C1	ZINC000262349225	149050224	/nfs/dbraw/zinc/05/02/24/149050224.db2.gz	GEFVXFPKAKKPBX-LBPRGKRZSA-N	1	0	284.363	1.352	50	0		CDAARO
Cc1c(F)cccc1S(=O)(=O)N(C)[C@H](C[NH3+])C1CC1	ZINC000360000060	158437445	/nfs/dbraw/zinc/43/74/45/158437445.db2.gz	JZBPZYSJSZEABU-GFCCVEGCSA-N	1	0	286.372	1.492	50	0		CDAARO
COc1ccc(C(=O)NC[C@@H](C)C[NH+](C)C)cc1	ZINC000004740410	170009191	/nfs/dbraw/zinc/00/91/91/170009191.db2.gz	FULBVEAGOMQODT-LLVKDONJSA-N	1	0	250.342	1.623	50	0		CDAARO
CC[NH+](CC)CC(=O)Nc1ccc2c(c1)OCO2	ZINC000004828738	170025197	/nfs/dbraw/zinc/02/51/97/170025197.db2.gz	HSUYGINZMZMMRR-UHFFFAOYSA-N	1	0	250.298	1.696	50	0		CDAARO
Cc1ccc(N2C(=O)C[C@@H]([NH2+]C[C@H]3CCCO3)C2=O)cc1	ZINC000004996535	170051655	/nfs/dbraw/zinc/05/16/55/170051655.db2.gz	ATIPQIZIPFWXSA-ZIAGYGMSSA-N	1	0	288.347	1.396	50	0		CDAARO
C[NH+](C)CCNc1ncnc2c1cnn2Cc1ccccc1	ZINC000005509031	170105899	/nfs/dbraw/zinc/10/58/99/170105899.db2.gz	COGPUAMJPVEUHN-UHFFFAOYSA-N	1	0	296.378	1.848	50	0		CDAARO
CCOc1ccccc1C(=O)NCCC[NH+](C)C	ZINC000005593133	170117219	/nfs/dbraw/zinc/11/72/19/170117219.db2.gz	HDCYTNBZSAOIPQ-UHFFFAOYSA-N	1	0	250.342	1.767	50	0		CDAARO
[NH3+]C[C@@H](c1cccnc1)S(=O)(=O)c1cccs1	ZINC000008031078	170315363	/nfs/dbraw/zinc/31/53/63/170315363.db2.gz	COILNLCMPPWTPR-JTQLQIEISA-N	1	0	268.363	1.617	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1C[C@@H](O)COc1ccc(Cl)cc1	ZINC000008555648	170340273	/nfs/dbraw/zinc/34/02/73/170340273.db2.gz	WMTGSWKPLDSFKN-UONOGXRCSA-N	1	0	299.798	1.927	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC(C[NH3+])CC2)c(C)c1	ZINC000020182558	171046110	/nfs/dbraw/zinc/04/61/10/171046110.db2.gz	VOKDYBZXADOGCO-UHFFFAOYSA-N	1	0	282.409	1.663	50	0		CDAARO
COc1ccc(O[C@@H](C)C(=O)NC2CC[NH+](C)CC2)cc1	ZINC000020311997	171144670	/nfs/dbraw/zinc/14/46/70/171144670.db2.gz	NGAMTWVEMZJFET-LBPRGKRZSA-N	1	0	292.379	1.673	50	0		CDAARO
Cc1c(C)n(CCC[NH+]2CCOCC2)c2ncnc(N)c12	ZINC000020589215	171260287	/nfs/dbraw/zinc/26/02/87/171260287.db2.gz	CKWAEFXVIXUVMG-UHFFFAOYSA-N	1	0	289.383	1.353	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2ccc(OC)cc2)CC1	ZINC000020608833	171267380	/nfs/dbraw/zinc/26/73/80/171267380.db2.gz	QIPACLHITBTKQU-UHFFFAOYSA-N	1	0	277.368	1.271	50	0		CDAARO
CCN1CCC[C@H]1C[NH2+]C[C@H](O)COc1ccccc1	ZINC000022037795	171350326	/nfs/dbraw/zinc/35/03/26/171350326.db2.gz	MYZHMUCEOWWVOD-GJZGRUSLSA-N	1	0	278.396	1.500	50	0		CDAARO
O=S(=O)(c1cccc(Cl)c1F)N1CCC[NH2+]CC1	ZINC000037463950	173225621	/nfs/dbraw/zinc/22/56/21/173225621.db2.gz	WWZGAPVIDIOJBP-UHFFFAOYSA-N	1	0	292.763	1.463	50	0		CDAARO
O=C(c1ccc(=O)[nH]c1)N1CCC([NH+]2CCCCC2)CC1	ZINC000037842379	173800045	/nfs/dbraw/zinc/80/00/45/173800045.db2.gz	KXOIKSFGJDYKTQ-UHFFFAOYSA-N	1	0	289.379	1.465	50	0		CDAARO
Cc1cc(C)c(C)c(OCCN2CC[NH+](CCO)CC2)c1	ZINC000040456313	174267401	/nfs/dbraw/zinc/26/74/01/174267401.db2.gz	XHZUBJUBUOPGDV-UHFFFAOYSA-N	1	0	292.423	1.601	50	0		CDAARO
O=C(NC1CC1)[C@H]1CN(Cc2cc3ccccc3[nH]2)CC[NH2+]1	ZINC000072145699	176325197	/nfs/dbraw/zinc/32/51/97/176325197.db2.gz	ZYAWAMVCRRMESL-MRXNPFEDSA-N	1	0	298.390	1.220	50	0		CDAARO
COc1cc2c(cc1CNC(=O)[C@H]1CC[C@@H]([NH3+])C1)CCC2	ZINC000072410086	176398510	/nfs/dbraw/zinc/39/85/10/176398510.db2.gz	ILDAAWRFWHLADG-DZGCQCFKSA-N	1	0	288.391	1.928	50	0		CDAARO
c1nc2c(c(NCC[C@@H]3CCOC3)n1)CC[NH2+]CC2	ZINC000072429900	176402017	/nfs/dbraw/zinc/40/20/17/176402017.db2.gz	LQVFPJGAJBDNKH-LLVKDONJSA-N	1	0	262.357	1.003	50	0		CDAARO
Cc1c[nH]c(C[N@@H+](C)[C@H]2CCOC3(CCOCC3)C2)n1	ZINC000077504826	177276116	/nfs/dbraw/zinc/27/61/16/177276116.db2.gz	MSZORWYRKDLSRQ-ZDUSSCGKSA-N	1	0	279.384	1.878	50	0		CDAARO
COCC[NH+]1CCN(c2cc(C)nc3cc(C)nn32)CC1	ZINC000072473241	274030158	/nfs/dbraw/zinc/03/01/58/274030158.db2.gz	QQWVSBJDKGETOO-UHFFFAOYSA-N	1	0	289.383	1.115	50	0		CDAARO
CCC[C@@H](C)[N@@H+]1CCN(CCC(=O)OC)C[C@@H]1C	ZINC000192790716	276269814	/nfs/dbraw/zinc/26/98/14/276269814.db2.gz	DPBHWENEIQLIHP-OLZOCXBDSA-N	1	0	256.390	1.744	50	0		CDAARO
CCOCCN1CC[N@H+](C[C@H]2CCCCO2)C[C@H]1C	ZINC000247034483	276322869	/nfs/dbraw/zinc/32/28/69/276322869.db2.gz	DIMNYQCJPCYKAR-HUUCEWRRSA-N	1	0	270.417	1.598	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)[C@H]1COc2ccccc21	ZINC000122614406	277284684	/nfs/dbraw/zinc/28/46/84/277284684.db2.gz	VSQNQLAKQUGORK-YPMHNXCESA-N	1	0	260.337	1.373	50	0		CDAARO
Cc1cnc(NCCC[NH+]2CCCC2)nc1N(C)C	ZINC000065385589	279019963	/nfs/dbraw/zinc/01/99/63/279019963.db2.gz	FXMPACXEKKNKAM-UHFFFAOYSA-N	1	0	263.389	1.749	50	0		CDAARO
CC(C)Cn1cncc1CN1CCC[C@@](O)(C[NH+](C)C)C1	ZINC000072156525	279259834	/nfs/dbraw/zinc/25/98/34/279259834.db2.gz	XQFGVEHKSRKDIX-MRXNPFEDSA-N	1	0	294.443	1.428	50	0		CDAARO
CC[C@H](OC)C(=O)N1CC[C@H]([NH+]2CCCC2)[C@H]1C	ZINC000240244256	288127982	/nfs/dbraw/zinc/12/79/82/288127982.db2.gz	DLHPMUBYESNPAV-AGIUHOORSA-N	1	0	254.374	1.497	50	0		CDAARO
C[C@H]([NH2+]CC1(O)CCCCC1)C(=O)NC1CCCC1	ZINC000065396479	279463142	/nfs/dbraw/zinc/46/31/42/279463142.db2.gz	PDLKFNXGGAGPKL-LBPRGKRZSA-N	1	0	268.401	1.719	50	0		CDAARO
C[C@H]1[C@H]2CCC[N@@H+]2CCN1C(=O)c1ccc2c(c1)nnn2C	ZINC000020540864	280120545	/nfs/dbraw/zinc/12/05/45/280120545.db2.gz	HNLONUROJMOWNB-SMDDNHRTSA-N	1	0	299.378	1.277	50	0		CDAARO
Cc1c[nH]c(CC[NH2+][C@@H]2CCOC3(CCOCC3)C2)n1	ZINC000077321639	280279333	/nfs/dbraw/zinc/27/93/33/280279333.db2.gz	NSQJEPKZJOVUFU-CYBMUJFWSA-N	1	0	279.384	1.578	50	0		CDAARO
Cc1cnc(N2C[C@H]([NH3+])[C@@H](C3CC3)C2)nc1N(C)C	ZINC000091847520	281613901	/nfs/dbraw/zinc/61/39/01/281613901.db2.gz	JQDJKBXJFAMWJD-NEPJUHHUSA-N	1	0	261.373	1.025	50	0		CDAARO
CC1=C[C@@H](N2C(=O)NC3(CC[NH2+]CC3)C2=O)CC(C)(C)C1	ZINC000077564528	281690369	/nfs/dbraw/zinc/69/03/69/281690369.db2.gz	VAYFLSXOWXFMSQ-GFCCVEGCSA-N	1	0	291.395	1.795	50	0		CDAARO
CN(CC(F)(F)F)C(=O)[C@@H]1CC12CC[NH2+]CC2	ZINC000070253664	289537875	/nfs/dbraw/zinc/53/78/75/289537875.db2.gz	AMQGTBVXEXJLJQ-QMMMGPOBSA-N	1	0	250.264	1.397	50	0		CDAARO
[NH3+]CC[C@@H]1CN(Cc2cnc(-c3ccco3)nc2)CCO1	ZINC000426491571	295237997	/nfs/dbraw/zinc/23/79/97/295237997.db2.gz	RVEHQQRCCUWVIP-CYBMUJFWSA-N	1	0	288.351	1.286	50	0		CDAARO
[NH3+]C[C@H]1CC[C@@H](C(=O)NC2CCC3(CCOCC3)CC2)O1	ZINC000261849993	295274946	/nfs/dbraw/zinc/27/49/46/295274946.db2.gz	RJYVAQOXMTURDP-KGLIPLIRSA-N	1	0	296.411	1.348	50	0		CDAARO
O=C(CCC(F)(F)F)N[C@H]1COC[C@@H]1[NH+]1CCCC1	ZINC000534588965	328317107	/nfs/dbraw/zinc/31/71/07/328317107.db2.gz	ZQZNWKVJVQWCIZ-UWVGGRQHSA-N	1	0	280.290	1.308	50	0		CDAARO
C[C@@H](CCC(=O)NCc1cscn1)[NH+]1CCOCC1	ZINC000534673810	328349140	/nfs/dbraw/zinc/34/91/40/328349140.db2.gz	YBXUCJZFPACOFV-NSHDSACASA-N	1	0	283.397	1.260	50	0		CDAARO
CC1(C)CN(C(=O)c2noc3c2CCCCC3)CC[NH2+]1	ZINC000097103153	323207677	/nfs/dbraw/zinc/20/76/77/323207677.db2.gz	NFBNUBZYVDSLDG-UHFFFAOYSA-N	1	0	277.368	1.768	50	0		CDAARO
COC1CCC(CCNC2=[NH+]CCCCN2)CC1	ZINC000521396913	326829708	/nfs/dbraw/zinc/82/97/08/326829708.db2.gz	DIIGDHCTGITMKN-UHFFFAOYSA-N	1	0	253.390	1.911	50	0		CDAARO
CCc1ccccc1OCCN1C[C@H]2C[NH2+]C[C@@]2(CO)C1	ZINC001772705229	1159439972	/nfs/dbraw/zinc/43/99/72/1159439972.db2.gz	GAWAPFNLOXJMJS-WBVHZDCISA-N	1	0	290.407	1.142	50	0		CDAARO
Cc1cc(=O)[nH]c(CC[NH2+][C@H]2CCN(c3ccccc3)C2)n1	ZINC000670439306	482981296	/nfs/dbraw/zinc/98/12/96/482981296.db2.gz	RAZACIMDTXJAAC-AWEZNQCLSA-N	1	0	298.390	1.902	50	0		CDAARO
CC(C)(O)[C@@H]1CC[N@H+](Cc2ccc(OCCO)cc2)C1	ZINC000670444631	482991574	/nfs/dbraw/zinc/99/15/74/482991574.db2.gz	JLNFGVHLIUGRTR-CQSZACIVSA-N	1	0	279.380	1.651	50	0		CDAARO
O=C(NCC1(CO)CCC1)[C@@H]1CCC[N@@H+]2CCCC[C@H]12	ZINC000670450261	483011348	/nfs/dbraw/zinc/01/13/48/483011348.db2.gz	QQGIBJOBJACHOR-ZIAGYGMSSA-N	1	0	280.412	1.530	50	0		CDAARO
[NH3+][C@H]1CC[C@@H](n2cnc3cccc(F)c3c2=O)CC1	ZINC000670459786	483043552	/nfs/dbraw/zinc/04/35/52/483043552.db2.gz	WYNRQNGAWXZHHR-AOOOYVTPSA-N	1	0	261.300	1.978	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H]1CN(C(=O)c1cncc(O)c1)C2	ZINC000670461611	483045234	/nfs/dbraw/zinc/04/52/34/483045234.db2.gz	XIZBFXDZWBMVKN-AAEUAGOBSA-N	1	0	275.352	1.344	50	0		CDAARO
C[C@H](CN1CCN(C)CC1)[N@@H+]1CCC2(CCCC2)C1	ZINC000670471043	483072946	/nfs/dbraw/zinc/07/29/46/483072946.db2.gz	HDHQZPCYPJBNBZ-OAHLLOKOSA-N	1	0	265.445	1.888	50	0		CDAARO
CCC[N@@H+]1CC[C@@H](NC(=O)N(CC)CCn2cccn2)C1	ZINC000670471422	483074229	/nfs/dbraw/zinc/07/42/29/483074229.db2.gz	RULJBCOFEHEAOH-CQSZACIVSA-N	1	0	293.415	1.399	50	0		CDAARO
CC(C)(C)[NH2+]CC(=O)N1CCC(Nc2cccnn2)CC1	ZINC000084199559	483267506	/nfs/dbraw/zinc/26/75/06/483267506.db2.gz	JPBHINSBJSKTMK-UHFFFAOYSA-N	1	0	291.399	1.268	50	0		CDAARO
Cc1ccsc1[C@H](C)[NH2+]C[C@H]1CN2CCN1CC2	ZINC000090648934	483281851	/nfs/dbraw/zinc/28/18/51/483281851.db2.gz	PUANHGYPGMECAR-STQMWFEESA-N	1	0	265.426	1.707	50	0		CDAARO
CCCC[C@H]([NH2+][C@@H]1CCN(C(=O)C2CC2)C[C@@H]1C)C(N)=O	ZINC000084742899	483322386	/nfs/dbraw/zinc/32/23/86/483322386.db2.gz	VLLIJJKZNOCNLT-YUTCNCBUSA-N	1	0	295.427	1.267	50	0		CDAARO
CC[C@H](C(=O)NCc1csc(N)n1)[NH+]1CCCC1	ZINC000822555702	1161928388	/nfs/dbraw/zinc/92/83/88/1161928388.db2.gz	BWEQDERGKQDWIN-SNVBAGLBSA-N	1	0	268.386	1.216	50	0		CDAARO
CSc1cc(NC(=O)N2CCC[N@H+](C)CC2)ccn1	ZINC000096499975	534172669	/nfs/dbraw/zinc/17/26/69/534172669.db2.gz	QRHNQAUBXLNTPM-UHFFFAOYSA-N	1	0	280.397	1.973	50	0		CDAARO
Cc1cn2cc(C(=O)N3C[C@H]4CC[C@@H](C3)[N@H+](C)C4)ccc2n1	ZINC000219851135	534513289	/nfs/dbraw/zinc/51/32/89/534513289.db2.gz	NAIRVIUNRLOTFC-ZFWWWQNUSA-N	1	0	298.390	1.809	50	0		CDAARO
COc1ccc(C[NH2+]C[C@H]2COCCO2)cc1OC	ZINC000032578255	524072337	/nfs/dbraw/zinc/07/23/37/524072337.db2.gz	MRFIURSVARUYIG-LBPRGKRZSA-N	1	0	267.325	1.209	50	0		CDAARO
CC[N@H+](CCN1C(=O)CCC1=O)[C@H](C)c1cccc(O)c1	ZINC000096455324	528475560	/nfs/dbraw/zinc/47/55/60/528475560.db2.gz	ZWYOMCRDLIGTSY-GFCCVEGCSA-N	1	0	290.363	1.924	50	0		CDAARO
Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)C[NH+](C)C	ZINC000097162579	545522530	/nfs/dbraw/zinc/52/25/30/545522530.db2.gz	KTGBLBSWMXHZGA-JTQLQIEISA-N	1	0	266.389	1.685	50	0		CDAARO
COc1ncccc1C(=O)N1CCC[C@@H](c2ncc[nH]2)C1	ZINC000075552119	567903962	/nfs/dbraw/zinc/90/39/62/567903962.db2.gz	GJMGIDYKBLALIU-LLVKDONJSA-N	1	0	286.335	1.833	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(O)([C@H]([NH3+])C2CC2)CC1	ZINC000958528805	613974423	/nfs/dbraw/zinc/97/44/23/613974423.db2.gz	VUHZGJOGXOBFSU-LLVKDONJSA-N	1	0	270.373	1.486	50	0		CDAARO
CC(C)(C)c1cc(C[NH2+]CCN2CCCC[C@@H]2CO)[nH]n1	ZINC000952972820	614048160	/nfs/dbraw/zinc/04/81/60/614048160.db2.gz	UTWDJJJCPDMNLM-CQSZACIVSA-N	1	0	294.443	1.644	50	0		CDAARO
CC(C)C(=O)N1CCC[C@H]([NH2+]Cc2cnc[nH]2)C1	ZINC000952986185	614365977	/nfs/dbraw/zinc/36/59/77/614365977.db2.gz	XKEDSOGNUFZMGJ-NSHDSACASA-N	1	0	250.346	1.146	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1C(=O)NCc1cccc2nsnc21	ZINC000952993593	616180154	/nfs/dbraw/zinc/18/01/54/616180154.db2.gz	ZRNYTMMVPOLNGN-GFCCVEGCSA-N	1	0	290.392	1.792	50	0		CDAARO
COCC1(NC(=O)C[NH+]2CCCCCC2)CCCC1	ZINC000952982159	616784622	/nfs/dbraw/zinc/78/46/22/616784622.db2.gz	ZNYFRXFFXJEXPL-UHFFFAOYSA-N	1	0	268.401	1.938	50	0		CDAARO
CNCc1nnc(NCC2([NH+](C)C)CCCCC2)o1	ZINC001772705404	1159439906	/nfs/dbraw/zinc/43/99/06/1159439906.db2.gz	MWAOPGUICINUIU-UHFFFAOYSA-N	1	0	267.377	1.465	50	0		CDAARO
CN(C)Cc1nnc(N(C)CC[N@H+](C)C2CCCC2)o1	ZINC001772710593	1159444580	/nfs/dbraw/zinc/44/45/80/1159444580.db2.gz	YHGYKNCTNLXALW-UHFFFAOYSA-N	1	0	281.404	1.442	50	0		CDAARO
Cc1c[nH+]ccc1N1CC[C@@]2(C(=O)[O-])CCC[N@@H+](C)[C@@H]2C1	ZINC001704301168	1177680453	/nfs/dbraw/zinc/68/04/53/1177680453.db2.gz	NHAWAANOWCPXGN-ZBFHGGJFSA-N	1	0	289.379	1.765	50	0		CDAARO
Cc1ccc2n[nH]c(C[N@H+](C)C[C@@H]3COCCO3)c2c1	ZINC000023340222	740379701	/nfs/dbraw/zinc/37/97/01/740379701.db2.gz	VQLMLFMXVJGQLQ-GFCCVEGCSA-N	1	0	275.352	1.719	50	0		CDAARO
Cc1nonc1[C@@H](C)[NH2+]CCCNC(=O)c1cccs1	ZINC000863984645	739492568	/nfs/dbraw/zinc/49/25/68/739492568.db2.gz	XPEYSMGFBGBJOV-SECBINFHSA-N	1	0	294.380	1.910	50	0		CDAARO
C[N@@H+](Cc1ccnc(N)c1)C[C@H]1COc2ccccc2O1	ZINC000193302702	739925862	/nfs/dbraw/zinc/92/58/62/739925862.db2.gz	UONCFGJZRNIRSG-ZDUSSCGKSA-N	1	0	285.347	1.936	50	0		CDAARO
C[N@H+](CCc1cn[nH]c1)[C@H]1CCOC2(CCOCC2)C1	ZINC000077471648	740335851	/nfs/dbraw/zinc/33/58/51/740335851.db2.gz	PXCMTHQHWPMEHG-AWEZNQCLSA-N	1	0	279.384	1.612	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@H](Nc2ccc3nccnc3n2)C12CCC2	ZINC000857760846	740423572	/nfs/dbraw/zinc/42/35/72/740423572.db2.gz	RDDXGZJSTNKEGO-QWHCGFSZSA-N	1	0	283.379	1.683	50	0		CDAARO
C[C@@H](C[NH+]1CCCCCC1)NC(=O)Cc1cc[nH]n1	ZINC000185442558	741264883	/nfs/dbraw/zinc/26/48/83/741264883.db2.gz	BUJBGYHNKYOCMK-LBPRGKRZSA-N	1	0	264.373	1.333	50	0		CDAARO
Cc1nc(CO[C@@H]2CCC[N@@H+](C3CCN(C)CC3)C2)no1	ZINC000675017053	899873570	/nfs/dbraw/zinc/87/35/70/899873570.db2.gz	PGFMDQZGKGAMCA-CQSZACIVSA-N	1	0	294.399	1.453	50	0		CDAARO
Cc1ccsc1C(=O)N(CC[NH3+])C1CCOCC1	ZINC000675022025	899877574	/nfs/dbraw/zinc/87/75/74/899877574.db2.gz	IGXNMLKKAPSDHC-UHFFFAOYSA-N	1	0	268.382	1.636	50	0		CDAARO
CNc1ccccc1C[N@@H+]1CCO[C@@]2(CCOC2)C1	ZINC000952876925	910435495	/nfs/dbraw/zinc/43/54/95/910435495.db2.gz	IMYMWJCBFPEWIM-HNNXBMFYSA-N	1	0	262.353	1.720	50	0		CDAARO
CCCC[C@H]1C=CCN1C(=O)[C@@H]1CCC[N@H+](CC(N)=O)C1	ZINC000952867555	910461332	/nfs/dbraw/zinc/46/13/32/910461332.db2.gz	OYMAASWJWSBAPR-KGLIPLIRSA-N	1	0	293.411	1.141	50	0		CDAARO
C[N@@H+]1CCC[C@@H](Nc2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000823771495	925727178	/nfs/dbraw/zinc/72/71/78/925727178.db2.gz	WAGCXABTVIAPSG-CQSZACIVSA-N	1	0	288.395	1.824	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)N[C@H]1CC[C@H](O)CC1	ZINC000828865322	926203396	/nfs/dbraw/zinc/20/33/96/926203396.db2.gz	LFNUILXQKSYECC-AVGNSLFASA-N	1	0	254.374	1.281	50	0		CDAARO
COCCC1([NH+](C)C)CCN(C(=O)c2ccccn2)CC1	ZINC000581805284	927202094	/nfs/dbraw/zinc/20/20/94/927202094.db2.gz	WJCKBSRAJBFVMT-UHFFFAOYSA-N	1	0	291.395	1.655	50	0		CDAARO
CN(C)c1[nH]c2ccc(NCc3cnnn3C)cc2[nH+]1	ZINC000585118486	930979491	/nfs/dbraw/zinc/97/94/91/930979491.db2.gz	QOGDRVOOTCSHJB-UHFFFAOYSA-N	1	0	271.328	1.370	50	0		CDAARO
C[C@@H]1OC[C@@H]([NH2+]Cc2nncn2-c2ccccc2)[C@@H]1C	ZINC000585117587	930984180	/nfs/dbraw/zinc/98/41/80/930984180.db2.gz	MBONKBOJZTUFAQ-MBNYWOFBSA-N	1	0	272.352	1.780	50	0		CDAARO
Cc1cc(=O)c(C(=O)N[C@H]2C[C@H]([NH+](C)C)C23CCC3)c[nH]1	ZINC000585127794	931010502	/nfs/dbraw/zinc/01/05/02/931010502.db2.gz	JNXCZDPKIRMKPX-KBPBESRZSA-N	1	0	289.379	1.286	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3ccsc3)C[C@@H]2O)[nH]n1	ZINC001529100336	968980928	/nfs/dbraw/zinc/98/09/28/968980928.db2.gz	QKEZLKUNZITMLH-OCCSQVGLSA-N	1	0	277.393	1.815	50	0		CDAARO
Cc1nncn1CCN(C)CC[NH+]1CCCCCC1	ZINC001506419033	975157125	/nfs/dbraw/zinc/15/71/25/975157125.db2.gz	WAZOTURGXZVOOD-UHFFFAOYSA-N	1	0	265.405	1.394	50	0		CDAARO
CC(=O)NC(C)(C)C[C@H](C)[NH2+]CCc1nc(C)cc(C)n1	ZINC001506417798	975157217	/nfs/dbraw/zinc/15/72/17/975157217.db2.gz	BSKMJHBAFKZUFP-ZDUSSCGKSA-N	1	0	292.427	1.919	50	0		CDAARO
COC[C@@H](c1ccccn1)N(C)Cc1cncn1C	ZINC001506421453	975158045	/nfs/dbraw/zinc/15/80/45/975158045.db2.gz	PVBLINUKSPKPCS-AWEZNQCLSA-N	1	0	260.341	1.635	50	0		CDAARO
CN(C(=O)c1cnc(C(C)(C)C)s1)[C@@H]1CC[NH2+]C1	ZINC000179123067	342450624	/nfs/dbraw/zinc/45/06/24/342450624.db2.gz	ZHLMHXXLRJKRNR-SECBINFHSA-N	1	0	267.398	1.875	50	0		CDAARO
CCNC(=O)c1cccc(NC(=O)[C@@H]2CCC[NH2+]2)c1	ZINC000035053849	341986158	/nfs/dbraw/zinc/98/61/58/341986158.db2.gz	KGKVWMGPJHKRBE-LBPRGKRZSA-N	1	0	261.325	1.127	50	0		CDAARO
CO[C@@H](C)CC(=O)NC[C@@H]1CCC[N@@H+](C(C)C)C1	ZINC000107320117	398138763	/nfs/dbraw/zinc/13/87/63/398138763.db2.gz	QBYSCYXNMFQLFV-STQMWFEESA-N	1	0	256.390	1.648	50	0		CDAARO
Cc1ccccc1OCCC(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000584901282	341986740	/nfs/dbraw/zinc/98/67/40/341986740.db2.gz	DOHAOLAVWVGDGA-GASCZTMLSA-N	1	0	288.391	1.784	50	0		CDAARO
Cc1cccc(CNC(=O)C[C@H](C)[NH+]2CCOCC2)n1	ZINC000219827072	230396860	/nfs/dbraw/zinc/39/68/60/230396860.db2.gz	UEMKQPFEMQTVBV-ZDUSSCGKSA-N	1	0	277.368	1.117	50	0		CDAARO
Cc1n[nH]cc1CCCNC(=O)N1CC[N@@H+](C)[C@@H](C)[C@@H]1C	ZINC000095942746	185037304	/nfs/dbraw/zinc/03/73/04/185037304.db2.gz	MRWRIUNMJVPLOK-STQMWFEESA-N	1	0	293.415	1.385	50	0		CDAARO
CS(=O)(=O)CC[NH2+][C@H]1CCCc2ccc(F)cc21	ZINC000095987852	185056981	/nfs/dbraw/zinc/05/69/81/185056981.db2.gz	PPAPBXQRZYPLEH-ZDUSSCGKSA-N	1	0	271.357	1.837	50	0		CDAARO
COC(=O)[C@@]12CCC[C@@H]1C[N@H+](Cc1cncs1)C2	ZINC000096009046	185063814	/nfs/dbraw/zinc/06/38/14/185063814.db2.gz	ZJPINNYIJHGJJC-ZWNOBZJWSA-N	1	0	266.366	1.918	50	0		CDAARO
CCn1ccc(CN(C)C(=O)NC[C@H]2CCC[N@H+](C)C2)c1	ZINC000241287497	361752238	/nfs/dbraw/zinc/75/22/38/361752238.db2.gz	LLXMGDIFQPZXKL-CQSZACIVSA-N	1	0	292.427	1.991	50	0		CDAARO
CC(=O)Nc1ccn([C@H]2CC[N@@H+](C[C@@H](O)C(C)C)C2)n1	ZINC000241837494	361754795	/nfs/dbraw/zinc/75/47/95/361754795.db2.gz	SKOGHYBTNUHTDD-QWHCGFSZSA-N	1	0	280.372	1.105	50	0		CDAARO
CCOP(=O)(C[C@H]([NH3+])[S@@](=O)CC)OCC	ZINC000242495706	361758960	/nfs/dbraw/zinc/75/89/60/361758960.db2.gz	GMZBZXWOSQIQKN-GLEZIHRCSA-N	1	0	257.292	1.306	50	0		CDAARO
Cc1ccc2nc(C(=O)NCC[NH+]3CCCC3)cn2c1	ZINC000097939160	342101499	/nfs/dbraw/zinc/10/14/99/342101499.db2.gz	SDUXOTHDYNPFSD-UHFFFAOYSA-N	1	0	272.352	1.468	50	0		CDAARO
CC[C@H](C(=O)N[C@H]1C[NH2+]C[C@@H]1OC)c1ccc(OC)cc1	ZINC000195554050	342625830	/nfs/dbraw/zinc/62/58/30/342625830.db2.gz	SCBATRITYQFNPX-KKUMJFAQSA-N	1	0	292.379	1.292	50	0		CDAARO
C(Cc1nc([C@H]2CCOC2)no1)C[NH+]1CCCCC1	ZINC000096147972	185106991	/nfs/dbraw/zinc/10/69/91/185106991.db2.gz	VNSAPAKCOOGNMT-LBPRGKRZSA-N	1	0	265.357	1.992	50	0		CDAARO
CCOCC1CCN(C(=O)C[C@@H]([NH3+])C2CC2)CC1	ZINC000195559553	342628484	/nfs/dbraw/zinc/62/84/84/342628484.db2.gz	ZLBVVXIAFMDJFW-CYBMUJFWSA-N	1	0	254.374	1.389	50	0		CDAARO
C[C@@H]1C[C@H](C)CN(S(=O)(=O)N2CCCC[C@H]2C[NH3+])C1	ZINC000252205531	361833573	/nfs/dbraw/zinc/83/35/73/361833573.db2.gz	XBZQNYARGDTSTM-XQQFMLRXSA-N	1	0	289.445	1.022	50	0		CDAARO
[NH3+][C@H]1[C@@H]2CC[C@H]1CN(CC(=O)NCCc1ccccc1)C2	ZINC000244787578	361863784	/nfs/dbraw/zinc/86/37/84/361863784.db2.gz	PZQHXEPPYLPHCC-QLPKVWCKSA-N	1	0	287.407	1.014	50	0		CDAARO
CNc1nc(CN2C[C@H]3CC[C@@H](C2)[C@H]3[NH3+])cs1	ZINC000244866578	361866400	/nfs/dbraw/zinc/86/64/00/361866400.db2.gz	VYNNEUCTUGSVJS-JZYVYDRUSA-N	1	0	252.387	1.354	50	0		CDAARO
COCCn1cncc1C[N@@H+]1CCC[C@H](c2cc[nH]n2)C1	ZINC000244707982	361858977	/nfs/dbraw/zinc/85/89/77/361858977.db2.gz	KLHTWWDPNAMJGX-ZDUSSCGKSA-N	1	0	289.383	1.632	50	0		CDAARO
CN(CCC[NH+]1CCCCC1)[C@H]1CCCCNC1=O	ZINC000097103378	342192083	/nfs/dbraw/zinc/19/20/83/342192083.db2.gz	ZEDXYCYHRUDHMV-AWEZNQCLSA-N	1	0	267.417	1.463	50	0		CDAARO
C[C@@H](C(=O)[O-])[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000263058445	361917928	/nfs/dbraw/zinc/91/79/28/361917928.db2.gz	HEMRPEUUYQSFLW-MCIONIFRSA-N	1	0	298.427	1.671	50	0		CDAARO
C[C@H](C(=O)[O-])[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000263058448	361918038	/nfs/dbraw/zinc/91/80/38/361918038.db2.gz	HEMRPEUUYQSFLW-MGPQQGTHSA-N	1	0	298.427	1.671	50	0		CDAARO
C[C@@H](CC(=O)N1CCCCCC1)[NH2+][C@]1(C)CCOC1	ZINC000097231650	342205301	/nfs/dbraw/zinc/20/53/01/342205301.db2.gz	YLXOPQJUXHMDTF-DZGCQCFKSA-N	1	0	268.401	1.936	50	0		CDAARO
CC[NH+](CC)C[C@@H]1CCCN(CC2OCCO2)C1	ZINC000097232341	342205361	/nfs/dbraw/zinc/20/53/61/342205361.db2.gz	UPPSRCVYYADDGD-ZDUSSCGKSA-N	1	0	256.390	1.413	50	0		CDAARO
Cc1cc(S(=O)(=O)NCC[NH2+]C2CC2)sc1C	ZINC000097234937	342205677	/nfs/dbraw/zinc/20/56/77/342205677.db2.gz	SDQHPFGAHBEPDB-UHFFFAOYSA-N	1	0	274.411	1.395	50	0		CDAARO
CC[C@H](Cc1ccc(C)cc1)[N@H+](C)CC(=O)NC(N)=O	ZINC000096441566	529424231	/nfs/dbraw/zinc/42/42/31/529424231.db2.gz	NIQWSNGPUHBRLV-CYBMUJFWSA-N	1	0	277.368	1.443	50	0		CDAARO
COc1ccc(NC(=O)N2CC(C[NH+](C)C)C2)cc1	ZINC000585118879	362037886	/nfs/dbraw/zinc/03/78/86/362037886.db2.gz	GPLHUPUEUVGCSU-UHFFFAOYSA-N	1	0	263.341	1.721	50	0		CDAARO
c1cnc2nc(N3CCC([NH+]4CCOCC4)CC3)ccc2n1	ZINC000585117994	362046262	/nfs/dbraw/zinc/04/62/62/362046262.db2.gz	OSQBPEDKGUQDLN-UHFFFAOYSA-N	1	0	299.378	1.326	50	0		CDAARO
CCOc1c(F)cccc1C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178521765	362242048	/nfs/dbraw/zinc/24/20/48/362242048.db2.gz	UVWPOCOUYRWMNN-SNVBAGLBSA-N	1	0	266.316	1.645	50	0		CDAARO
CCc1nc(N2CC[C@H]3[NH2+]CCC[C@]3(CO)C2)ncc1C	ZINC000426545462	529742093	/nfs/dbraw/zinc/74/20/93/529742093.db2.gz	ZNCXKNNZOQECDB-GDBMZVCRSA-N	1	0	290.411	1.288	50	0		CDAARO
CCc1nn(C)c(CC)c1C[NH2+]C1(CO)CCOCC1	ZINC000096493579	529766550	/nfs/dbraw/zinc/76/65/50/529766550.db2.gz	QSKAXYLXJQRAEQ-UHFFFAOYSA-N	1	0	281.400	1.176	50	0		CDAARO
COc1ccnc(N2CC[NH+](C[C@@H]3CCCOC3)CC2)n1	ZINC000252485159	362385529	/nfs/dbraw/zinc/38/55/29/362385529.db2.gz	GOGYKHVFNRFQCX-ZDUSSCGKSA-N	1	0	292.383	1.034	50	0		CDAARO
O=C(C[NH2+][C@H]1CCCSC1)NCc1ccco1	ZINC000097084461	185526768	/nfs/dbraw/zinc/52/67/68/185526768.db2.gz	VROPAAVRVLLFGK-JTQLQIEISA-N	1	0	254.355	1.381	50	0		CDAARO
COC(=O)[C@@H](c1cccnc1)N1CC[NH+](CC(C)C)CC1	ZINC000084544273	178898833	/nfs/dbraw/zinc/89/88/33/178898833.db2.gz	DBYVPVFKTSCNQO-OAHLLOKOSA-N	1	0	291.395	1.569	50	0		CDAARO
O=C1N(Cc2ccccc2)CCN1[C@H]1CCC[NH2+]C1	ZINC000085347909	179029086	/nfs/dbraw/zinc/02/90/86/179029086.db2.gz	RWFMRUWZLKGIRS-AWEZNQCLSA-N	1	0	259.353	1.676	50	0		CDAARO
Cc1c[nH+]ccc1N1CCN(C(=O)C[C@H]2CCOC2)CC1	ZINC000584886537	349344943	/nfs/dbraw/zinc/34/49/43/349344943.db2.gz	VRFCYZMNLJFQEU-CQSZACIVSA-N	1	0	289.379	1.465	50	0		CDAARO
Cc1nonc1CNC(=O)[C@H](C)[NH+]1CCCCCC1	ZINC000584896608	349358274	/nfs/dbraw/zinc/35/82/74/349358274.db2.gz	CWCVSNMHUQLTAZ-NSHDSACASA-N	1	0	266.345	1.259	50	0		CDAARO
CC(C)C[N@@H+]1CCN(C(=O)C2CC=CC2)C[C@H]1CCO	ZINC000584887663	349346325	/nfs/dbraw/zinc/34/63/25/349346325.db2.gz	IGBAURGRLUBSJI-OAHLLOKOSA-N	1	0	280.412	1.504	50	0		CDAARO
CCOc1ccc(C[N@H+](C)C[C@@H]2CCOC2)cn1	ZINC000584887731	349346525	/nfs/dbraw/zinc/34/65/25/349346525.db2.gz	UJILXRUVEKLPFF-ZDUSSCGKSA-N	1	0	250.342	1.949	50	0		CDAARO
O=C(CCO)NCCC1CC[NH+](C2CCCC2)CC1	ZINC000584888815	349347005	/nfs/dbraw/zinc/34/70/05/349347005.db2.gz	WNILDLVZMXBAKI-UHFFFAOYSA-N	1	0	268.401	1.530	50	0		CDAARO
CCc1ccc2ncn(C[C@@H]3CC[N@H+](C)C3)c(=O)c2c1	ZINC000584889378	349348097	/nfs/dbraw/zinc/34/80/97/349348097.db2.gz	SBMKKXWXLHVLFU-CYBMUJFWSA-N	1	0	271.364	1.911	50	0		CDAARO
O=C(C1CCCC1)N1C[C@H](O)[C@@H]([NH+]2CCCCC2)C1	ZINC000584897368	349358725	/nfs/dbraw/zinc/35/87/25/349358725.db2.gz	MESBCSVXIPGEDX-KBPBESRZSA-N	1	0	266.385	1.234	50	0		CDAARO
Cc1nonc1CNC(=O)CC[C@@H](C)[NH+]1CCCC1	ZINC000584900051	349362493	/nfs/dbraw/zinc/36/24/93/349362493.db2.gz	WTXQNKDOHVJFLD-SNVBAGLBSA-N	1	0	266.345	1.259	50	0		CDAARO
CCOCCC(=O)N1C[C@H]([NH3+])[C@@H](c2ccccc2)C1	ZINC000091365109	180142648	/nfs/dbraw/zinc/14/26/48/180142648.db2.gz	BBFIMWMDHCXNEU-KGLIPLIRSA-N	1	0	262.353	1.366	50	0		CDAARO
CC(C)[C@H]1C[N@H+](CCCn2cccn2)C[C@@H]1N(C)C	ZINC000091664803	180221035	/nfs/dbraw/zinc/22/10/35/180221035.db2.gz	ZMFJVKPNEGJTQU-CABCVRRESA-N	1	0	264.417	1.791	50	0		CDAARO
Cc1cc(C)c2[nH]c(C[NH2+][C@@H]3CCCNC3=O)cc(=O)c2c1	ZINC000091680785	180226676	/nfs/dbraw/zinc/22/66/76/180226676.db2.gz	AMXHINHJEGJJBW-CQSZACIVSA-N	1	0	299.374	1.513	50	0		CDAARO
O=C(c1c[nH]nc1-c1ccccc1)N1[C@@H]2CC[C@H]1C[NH2+]C2	ZINC000091793680	180257593	/nfs/dbraw/zinc/25/75/93/180257593.db2.gz	HGJFWZXXEXRYDZ-BETUJISGSA-N	1	0	282.347	1.653	50	0		CDAARO
O=C(NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc2ccccn2c1	ZINC000129636527	187445272	/nfs/dbraw/zinc/44/52/72/187445272.db2.gz	OJWUFQVMTAZDPD-PBWFPOADSA-N	1	0	269.348	1.952	50	0		CDAARO
O=C(N[C@H]1CCC[N@H+](Cc2ccccc2)C1)[C@H]1CCCO1	ZINC000106059885	186100637	/nfs/dbraw/zinc/10/06/37/186100637.db2.gz	OMFBYUQFHOHFMH-JKSUJKDBSA-N	1	0	288.391	1.946	50	0		CDAARO
Cn1cncc1C[NH2+][C@H]1CCN(c2ccccc2)C1=O	ZINC000109352041	186249840	/nfs/dbraw/zinc/24/98/40/186249840.db2.gz	JAJSBJFJRYNTJS-AWEZNQCLSA-N	1	0	270.336	1.315	50	0		CDAARO
COc1ccc(CC[NH2+][C@@H]2CCOC2)cc1OC	ZINC000109429182	186251175	/nfs/dbraw/zinc/25/11/75/186251175.db2.gz	QJWFPNIJOOLWOO-GFCCVEGCSA-N	1	0	251.326	1.625	50	0		CDAARO
CC(C)N1C(=O)N[C@@]2(CC[N@H+](CCC(F)(F)F)C2)C1=O	ZINC000095402405	351397182	/nfs/dbraw/zinc/39/71/82/351397182.db2.gz	ODTVCAFKKZBXAT-LLVKDONJSA-N	1	0	293.289	1.344	50	0		CDAARO
CCOC(=O)c1nn(Cc2ccccn2)c2c1C[NH2+]CC2	ZINC000065396988	363033152	/nfs/dbraw/zinc/03/31/52/363033152.db2.gz	AWIGVLNVKNSQBA-UHFFFAOYSA-N	1	0	286.335	1.149	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)Cc1ccc(F)c(F)c1	ZINC000122595097	187040070	/nfs/dbraw/zinc/04/00/70/187040070.db2.gz	VEWNMMQKJULLLF-NSHDSACASA-N	1	0	268.307	1.718	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)Cc1ccc(F)c(F)c1	ZINC000122595322	187040107	/nfs/dbraw/zinc/04/01/07/187040107.db2.gz	VEWNMMQKJULLLF-LLVKDONJSA-N	1	0	268.307	1.718	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CN(C(=O)c2cccc(F)c2F)CCO1	ZINC000122896639	187058165	/nfs/dbraw/zinc/05/81/65/187058165.db2.gz	UXLQKZGYKUDKCA-KWQFWETISA-N	1	0	270.279	1.153	50	0		CDAARO
COc1cccc(C(=O)NC[C@@H](C)C[NH+](C)C)c1	ZINC000292417499	198280641	/nfs/dbraw/zinc/28/06/41/198280641.db2.gz	PQCJQUDBQDGYEB-LLVKDONJSA-N	1	0	250.342	1.623	50	0		CDAARO
Cc1cc(C)nc(NCCC[N@@H+]2CCC[C@H](O)C2)n1	ZINC000065431297	363246416	/nfs/dbraw/zinc/24/64/16/363246416.db2.gz	YQMNLKUAAXWZNL-ZDUSSCGKSA-N	1	0	264.373	1.352	50	0		CDAARO
CCOC(=O)[C@@]1(C(C)C)CC[N@H+](C[C@H](O)C(F)(F)F)C1	ZINC000194879650	363250334	/nfs/dbraw/zinc/25/03/34/363250334.db2.gz	QPHCDQWMHLTTEK-JQWIXIFHSA-N	1	0	297.317	1.821	50	0		CDAARO
c1ccc2c(c1)nc1n2CCN1CC[NH+]1CCCC1	ZINC000000499925	366130604	/nfs/dbraw/zinc/13/06/04/366130604.db2.gz	WDPFVNILUGMNKR-UHFFFAOYSA-N	1	0	256.353	1.952	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@@H](O)C2)cc2c1OCO2	ZINC000000210510	355896376	/nfs/dbraw/zinc/89/63/76/355896376.db2.gz	ZLADRTNSAUIYGW-LLVKDONJSA-N	1	0	265.309	1.381	50	0		CDAARO
COc1ccc(/C=C/C(=O)NCCC[NH+](C)C)cc1	ZINC000003156294	355995517	/nfs/dbraw/zinc/99/55/17/355995517.db2.gz	GDUVSJAJKODTDU-JXMROGBWSA-N	1	0	262.353	1.776	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@H](C)c1ccc([S@](C)=O)cc1	ZINC000097373431	356094664	/nfs/dbraw/zinc/09/46/64/356094664.db2.gz	NTLNYBMBBNLTFL-BIBXISHDSA-N	1	0	296.436	1.847	50	0		CDAARO
Cc1c(Cl)cccc1OCC(=O)N1CC[C@@H]([NH3+])C1	ZINC000299739460	356270240	/nfs/dbraw/zinc/27/02/40/356270240.db2.gz	ORZUSHRJCDGRSV-SNVBAGLBSA-N	1	0	268.744	1.587	50	0		CDAARO
CNC(=O)NC(=O)C[NH2+][C@@H](c1ccc(F)cc1)C(C)C	ZINC000012798556	356325332	/nfs/dbraw/zinc/32/53/32/356325332.db2.gz	FATMIGAMZCVCSU-CYBMUJFWSA-N	1	0	281.331	1.568	50	0		CDAARO
COc1cc2c(cc1OC)CN([C@H]1CCC[NH2+]C1)CC2	ZINC000037246713	356375501	/nfs/dbraw/zinc/37/55/01/356375501.db2.gz	DKRPVLVHNHDGIM-AWEZNQCLSA-N	1	0	276.380	1.814	50	0		CDAARO
CN1CC[NH+](CCC(=O)Nc2ccc3c(c2)CCC3)CC1	ZINC000019841405	356509414	/nfs/dbraw/zinc/50/94/14/356509414.db2.gz	ZYNIYGJXBYSUFK-UHFFFAOYSA-N	1	0	287.407	1.751	50	0		CDAARO
C[NH+]1CCN(CCNc2ccccc2Cl)CC1	ZINC000041324050	356553489	/nfs/dbraw/zinc/55/34/89/356553489.db2.gz	BHUMACUWHLIHSJ-UHFFFAOYSA-N	1	0	253.777	1.999	50	0		CDAARO
CC1(C(=O)NCC2(C(F)(F)F)CC[NH2+]CC2)CC1	ZINC000725264781	538455754	/nfs/dbraw/zinc/45/57/54/538455754.db2.gz	WJHXUSHVMMPKHY-UHFFFAOYSA-N	1	0	264.291	1.835	50	0		CDAARO
C[NH+]1CCN(C[C@H]2Cn3c4ccoc4cc3C(=O)O2)CC1	ZINC000022028426	356597946	/nfs/dbraw/zinc/59/79/46/356597946.db2.gz	DZFYXJYAKFHASE-NSHDSACASA-N	1	0	289.335	1.021	50	0		CDAARO
Cc1cc(NC(=O)CN2CC[NH2+]CC2)ccc1Cl	ZINC000022917515	356624330	/nfs/dbraw/zinc/62/43/30/356624330.db2.gz	ZFLWFFGHBLRKGT-UHFFFAOYSA-N	1	0	267.760	1.492	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2cccc(Br)c2)C1	ZINC000022942158	356625181	/nfs/dbraw/zinc/62/51/81/356625181.db2.gz	XJGDXLQPQHWGBT-LLVKDONJSA-N	1	0	255.159	1.982	50	0		CDAARO
OCC[C@H]1CN(CC2CC2)CC[N@@H+]1C1CCCC1	ZINC000023358122	356641773	/nfs/dbraw/zinc/64/17/73/356641773.db2.gz	AXORDGDWHNTXAZ-HNNXBMFYSA-N	1	0	252.402	1.708	50	0		CDAARO
O=S(=O)(NCC[NH+]1CCCCCC1)c1cccs1	ZINC000024682873	356659187	/nfs/dbraw/zinc/65/91/87/356659187.db2.gz	MECFKBUGOLJTOV-UHFFFAOYSA-N	1	0	288.438	1.902	50	0		CDAARO
CCSc1nc2c(cnn2CC[NH3+])c(NC(C)C)n1	ZINC000026421760	356692265	/nfs/dbraw/zinc/69/22/65/356692265.db2.gz	MHLMERYJBGOCKW-UHFFFAOYSA-N	1	0	280.401	1.717	50	0		CDAARO
CN(CCc1ccncc1)C(=O)[C@@H]([NH3+])c1ccccc1	ZINC000034758209	356819968	/nfs/dbraw/zinc/81/99/68/356819968.db2.gz	DYBFKWGLVXIFRZ-HNNXBMFYSA-N	1	0	269.348	1.783	50	0		CDAARO
C[NH2+][C@@H](C)c1ccc(N2CCCS2(=O)=O)cc1	ZINC000036880986	356889019	/nfs/dbraw/zinc/88/90/19/356889019.db2.gz	BZFLJRBUFXSNDN-JTQLQIEISA-N	1	0	254.355	1.507	50	0		CDAARO
Cc1cc(S(=O)(=O)N2CCN(C)CC2)ccc1Cl	ZINC000036173484	356864013	/nfs/dbraw/zinc/86/40/13/356864013.db2.gz	GSAOCEDHQIUXEH-UHFFFAOYSA-N	1	0	288.800	1.585	50	0		CDAARO
COC(=O)[C@@H](CC[NH2+]Cc1ccccc1)[C@H](C)O	ZINC000043214667	363571488	/nfs/dbraw/zinc/57/14/88/363571488.db2.gz	JGNJXWYXCHOBBP-AAEUAGOBSA-N	1	0	251.326	1.336	50	0		CDAARO
O=c1cc(C[NH+]2CCC(CO)CC2)c2ccc(O)cc2o1	ZINC000048347275	357179950	/nfs/dbraw/zinc/17/99/50/357179950.db2.gz	JOKJIQGQZNJJBS-UHFFFAOYSA-N	1	0	289.331	1.703	50	0		CDAARO
CCOc1ccccc1OCC[N@@H+]1CCC[C@@H](C(N)=O)C1	ZINC000065397651	357537091	/nfs/dbraw/zinc/53/70/91/357537091.db2.gz	XQELXAHXPMFDAM-CYBMUJFWSA-N	1	0	292.379	1.661	50	0		CDAARO
C[C@@H](CCn1cccn1)NC(=O)C[NH+]1CCCCCC1	ZINC000065435343	357541651	/nfs/dbraw/zinc/54/16/51/357541651.db2.gz	PYHAUFRVZHMOSE-AWEZNQCLSA-N	1	0	278.400	1.654	50	0		CDAARO
CNc1ccnc(N2CCC[N@H+](CC(C)C)CC2)n1	ZINC000065488870	357544347	/nfs/dbraw/zinc/54/43/47/357544347.db2.gz	IDFIDPJHPQZTKI-UHFFFAOYSA-N	1	0	263.389	1.686	50	0		CDAARO
CCc1nc(CN(C)C(=O)CC[C@@H]2CCCC[N@@H+]2C)no1	ZINC000065536464	357548345	/nfs/dbraw/zinc/54/83/45/357548345.db2.gz	RNVVOADDMGZFRZ-LBPRGKRZSA-N	1	0	294.399	1.855	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)OCc2ccccc2)C[C@@H]1F	ZINC000066351340	357563177	/nfs/dbraw/zinc/56/31/77/357563177.db2.gz	SYVUWEZGXXHYPH-NWDGAFQWSA-N	1	0	252.289	1.694	50	0		CDAARO
CN(CCCN1CC[NH2+]CC1)C(=O)OC(C)(C)C	ZINC000066349027	357563379	/nfs/dbraw/zinc/56/33/79/357563379.db2.gz	HAEMTQZTYRRCLI-UHFFFAOYSA-N	1	0	257.378	1.149	50	0		CDAARO
NC(=O)CC[N@@H+]1CCc2onc(-c3cccc(F)c3)c2C1	ZINC000067723294	357621708	/nfs/dbraw/zinc/62/17/08/357621708.db2.gz	CSICXCDUBMSAAN-UHFFFAOYSA-N	1	0	289.310	1.714	50	0		CDAARO
Cc1cc(C)n2ncc(CN3CCC[C@@]4(CC[NH2+]C4)C3)c2n1	ZINC000067727156	357621718	/nfs/dbraw/zinc/62/17/18/357621718.db2.gz	NNBMQFWSWWEOKN-KRWDZBQOSA-N	1	0	299.422	1.922	50	0		CDAARO
C[C@H](Cn1cncn1)[NH2+]CCN1CCc2ccccc2C1	ZINC000067818952	357629174	/nfs/dbraw/zinc/62/91/74/357629174.db2.gz	LZEGMTYEKXABJB-CQSZACIVSA-N	1	0	285.395	1.315	50	0		CDAARO
O=C(NCCC[NH+]1CCCC1)OCC(F)(F)F	ZINC000068584992	357651484	/nfs/dbraw/zinc/65/14/84/357651484.db2.gz	GCPHBYPWJAEBTE-UHFFFAOYSA-N	1	0	254.252	1.761	50	0		CDAARO
Cc1cc(C(=O)N[C@@H]2CC[C@@H]([NH3+])C2)cc2sc(N)nc21	ZINC000067909875	357636267	/nfs/dbraw/zinc/63/62/67/357636267.db2.gz	OUFDGNZKAMLWED-NXEZZACHSA-N	1	0	290.392	1.797	50	0		CDAARO
C[C@H](OC[C@@H]1CCCCO1)C(=O)N1CCC[C@H](C)[C@@H]1C[NH3+]	ZINC000247331799	357736609	/nfs/dbraw/zinc/73/66/09/357736609.db2.gz	VEETYBIGFIDZMU-AJNGGQMLSA-N	1	0	298.427	1.546	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H]1[C@H]2CCCO[C@@H]2C1(C)C	ZINC000183835657	283281242	/nfs/dbraw/zinc/28/12/42/283281242.db2.gz	INYCXPNRCBDPPO-UTUOFQBUSA-N	1	0	268.401	1.552	50	0		CDAARO
Cc1cc(C)n(CC2(CNC(=O)[C@H]3CC[C@@H]([NH3+])C3)CC2)n1	ZINC000072420527	357834020	/nfs/dbraw/zinc/83/40/20/357834020.db2.gz	XWRBGYJYEIVFEU-UONOGXRCSA-N	1	0	290.411	1.524	50	0		CDAARO
COc1ccc(SCC[NH2+]C[C@]2(O)CCC[NH2+]C2)cc1	ZINC000072454649	357837410	/nfs/dbraw/zinc/83/74/10/357837410.db2.gz	RNEDAVXEPHKQQA-HNNXBMFYSA-N	1	0	296.436	1.491	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)NCc1ccccc1F)[C@@H]1CCCO1	ZINC000097111733	357986833	/nfs/dbraw/zinc/98/68/33/357986833.db2.gz	INUITPNANDIHEM-RISCZKNCSA-N	1	0	280.343	1.599	50	0		CDAARO
CC(C)n1cncc1CSc1nnc(C[NH3+])n1C	ZINC000090236930	358143387	/nfs/dbraw/zinc/14/33/87/358143387.db2.gz	QRMNIKVMGSEPQM-UHFFFAOYSA-N	1	0	266.374	1.344	50	0		CDAARO
Cc1cn2cc(C(=O)N3CC[C@@H]([NH+](C)C)C3)ccc2n1	ZINC000082108867	358147188	/nfs/dbraw/zinc/14/71/88/358147188.db2.gz	OKOVLFYGAGJTLF-CYBMUJFWSA-N	1	0	272.352	1.419	50	0		CDAARO
Cn1ccnc1[C@@H]1CCCN(C(=O)Cc2ccccn2)C1	ZINC000082146682	358149735	/nfs/dbraw/zinc/14/97/35/358149735.db2.gz	ZFUVAYCVAFYGIY-CYBMUJFWSA-N	1	0	284.363	1.764	50	0		CDAARO
COc1cccc(CCC(=O)N2CCC[C@H]([NH3+])C2)c1	ZINC000195115672	358551278	/nfs/dbraw/zinc/55/12/78/358551278.db2.gz	GYDUOTWXRSDSQV-ZDUSSCGKSA-N	1	0	262.353	1.578	50	0		CDAARO
C[C@H](C[N@H+](C)CC(=O)N1CCOCC1)c1ccc(F)cc1	ZINC000195572801	358567429	/nfs/dbraw/zinc/56/74/29/358567429.db2.gz	IUAMEHXUFSBDNR-CYBMUJFWSA-N	1	0	294.370	1.720	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)N1CC(c2ccccn2)C1	ZINC000095377934	358689554	/nfs/dbraw/zinc/68/95/54/358689554.db2.gz	XDQHOERNYJWOGT-HNNXBMFYSA-N	1	0	273.380	1.882	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1NCc1nc(CCOC)no1	ZINC000095385459	358691449	/nfs/dbraw/zinc/69/14/49/358691449.db2.gz	OHTTVDGTCCLYHJ-UHFFFAOYSA-N	1	0	292.343	1.114	50	0		CDAARO
Cc1ccnc(N2CCCO[C@H](C[NH+]3CCCCC3)C2)n1	ZINC000095392013	358692869	/nfs/dbraw/zinc/69/28/69/358692869.db2.gz	PQMPMWAKCRWRBP-OAHLLOKOSA-N	1	0	290.411	1.866	50	0		CDAARO
C[C@]1(C(=O)NCCSc2ccccn2)CCC[NH2+]C1	ZINC000096153300	358709968	/nfs/dbraw/zinc/70/99/68/358709968.db2.gz	ZVQOPXITENPVOG-AWEZNQCLSA-N	1	0	279.409	1.680	50	0		CDAARO
Cc1nnc(CN2CCC([NH+]3CCCCC3)CC2)[nH]1	ZINC000244852503	358724661	/nfs/dbraw/zinc/72/46/61/358724661.db2.gz	UTOUQDOXAUVHOB-UHFFFAOYSA-N	1	0	263.389	1.563	50	0		CDAARO
Cc1cc(CN2CC[N@@H+](C3CCCC3)C[C@H](O)C2)on1	ZINC000097495189	358780840	/nfs/dbraw/zinc/78/08/40/358780840.db2.gz	YYTZJOZEHGVEEN-CQSZACIVSA-N	1	0	279.384	1.404	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)CCCc1cn[nH]c1	ZINC000097785546	358798725	/nfs/dbraw/zinc/79/87/25/358798725.db2.gz	CRDXRVSIRWSCLK-CYBMUJFWSA-N	1	0	264.373	1.333	50	0		CDAARO
CCOc1ccc(CC(=O)NCCc2c[nH]cn2)cc1	ZINC000013593264	366483979	/nfs/dbraw/zinc/48/39/79/366483979.db2.gz	VTAWMGBQVFQCHN-UHFFFAOYSA-N	1	0	273.336	1.710	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)c1ccc2nccnc2c1	ZINC000102534633	358881067	/nfs/dbraw/zinc/88/10/67/358881067.db2.gz	XKCJXJQGELBQRC-UHFFFAOYSA-N	1	0	270.336	1.455	50	0		CDAARO
Cc1nn(CCO)cc1C[N@@H+](C)[C@H](C)Cc1cnccn1	ZINC000216041275	358919824	/nfs/dbraw/zinc/91/98/24/358919824.db2.gz	FLFMASRURYHDIG-GFCCVEGCSA-N	1	0	289.383	1.037	50	0		CDAARO
COc1cccc(-c2cc3c(=O)n(CC[NH3+])ccn3n2)c1	ZINC000216697758	358958644	/nfs/dbraw/zinc/95/86/44/358958644.db2.gz	LITRBBJHRSNOQV-UHFFFAOYSA-N	1	0	284.319	1.130	50	0		CDAARO
CCN1CCC[C@@H]1C[NH2+]C[C@@H](O)COc1ccccc1	ZINC000022924101	359142998	/nfs/dbraw/zinc/14/29/98/359142998.db2.gz	MYZHMUCEOWWVOD-HUUCEWRRSA-N	1	0	278.396	1.500	50	0		CDAARO
COCC[N@@H+](Cc1cnc(N(C)C)nc1)CC1CC1	ZINC000220395976	359170512	/nfs/dbraw/zinc/17/05/12/359170512.db2.gz	KOAFTKQMJMJTEK-UHFFFAOYSA-N	1	0	264.373	1.401	50	0		CDAARO
C[NH+](C)[C@H]1[C@@H]2OCC[C@@H]2[C@@H]1NC(=O)Cc1ccsc1	ZINC000220469407	359175866	/nfs/dbraw/zinc/17/58/66/359175866.db2.gz	ZBNMWHXCLHNZCZ-YXCITZCRSA-N	1	0	280.393	1.124	50	0		CDAARO
O[C@H]1CCOC2(CC[NH+](Cc3ccoc3)CC2)C1	ZINC000257188250	359530518	/nfs/dbraw/zinc/53/05/18/359530518.db2.gz	DUZJPUCHDYADFT-ZDUSSCGKSA-N	1	0	251.326	1.786	50	0		CDAARO
CCC[C@H](C)C[NH+]1CCC(n2cc(CO)nn2)CC1	ZINC000063847042	359645823	/nfs/dbraw/zinc/64/58/23/359645823.db2.gz	MRCFVJLCYATGAM-LBPRGKRZSA-N	1	0	266.389	1.844	50	0		CDAARO
COc1ccc(C[NH2+][C@@H](C)C(=O)NC(C)C)cc1OC	ZINC000014169658	366537520	/nfs/dbraw/zinc/53/75/20/366537520.db2.gz	OPZNGSRXVQYALG-NSHDSACASA-N	1	0	280.368	1.707	50	0		CDAARO
Cc1cccc(CNC(=O)CN2CC[N@@H+](C)C(C)(C)C2)c1	ZINC000408516250	359899172	/nfs/dbraw/zinc/89/91/72/359899172.db2.gz	HXEINHNEODXNTP-UHFFFAOYSA-N	1	0	289.423	1.637	50	0		CDAARO
CN(CC[N@H+](C)C1CC1)C(=O)CCc1ccon1	ZINC000408517659	359901168	/nfs/dbraw/zinc/90/11/68/359901168.db2.gz	LWBXBEODAFPEAO-UHFFFAOYSA-N	1	0	251.330	1.160	50	0		CDAARO
CC1(C)CC[C@@H]1[NH2+]CCOc1ccc(S(N)(=O)=O)cc1	ZINC000408523294	359930832	/nfs/dbraw/zinc/93/08/32/359930832.db2.gz	IODCYJPXXZBFST-ZDUSSCGKSA-N	1	0	298.408	1.491	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[N@H+]2[C@H](CC[C@H]2CO)C1	ZINC000238098794	360220494	/nfs/dbraw/zinc/22/04/94/360220494.db2.gz	SIVMHISIWYDSFX-MNOVXSKESA-N	1	0	256.346	1.062	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@@H]1CCCN(C(=O)c2cnn(C)c2)C1	ZINC000409421182	360230014	/nfs/dbraw/zinc/23/00/14/360230014.db2.gz	WOESFOOTVSKCJT-CQSZACIVSA-N	1	0	287.367	1.711	50	0		CDAARO
CC[N@@H+]1CC[C@@H](CNC(=O)Nc2cccc(C)n2)C1	ZINC000360894710	360350287	/nfs/dbraw/zinc/35/02/87/360350287.db2.gz	DHIODEJEOSDAPH-LBPRGKRZSA-N	1	0	262.357	1.853	50	0		CDAARO
CC[C@@](C)(O)C[NH2+]C1CCN(Cc2ccccn2)CC1	ZINC000177959340	189081934	/nfs/dbraw/zinc/08/19/34/189081934.db2.gz	FIGSSOKTJWIHNX-MRXNPFEDSA-N	1	0	277.412	1.797	50	0		CDAARO
Cc1ccc(OCCNC(=O)N2CCC[C@H]([NH3+])C2)cc1C	ZINC000426398019	360664164	/nfs/dbraw/zinc/66/41/64/360664164.db2.gz	GYMGLGZLUFOTBP-AWEZNQCLSA-N	1	0	291.395	1.815	50	0		CDAARO
Cc1ccccc1[C@@H]1C[C@H]1C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178573154	189128406	/nfs/dbraw/zinc/12/84/06/189128406.db2.gz	BHEQMCGDGXCKAM-VHDGCEQUSA-N	1	0	258.365	1.906	50	0		CDAARO
COCCOc1ccccc1C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178583475	189128911	/nfs/dbraw/zinc/12/89/11/189128911.db2.gz	OHUVLXCYHNDYPW-GFCCVEGCSA-N	1	0	278.352	1.133	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2cncn2C(C)C)n1C	ZINC000426705820	360697658	/nfs/dbraw/zinc/69/76/58/360697658.db2.gz	PAZRWAXGZMTYSN-UHFFFAOYSA-N	1	0	280.401	1.604	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1cncc(C(=O)N(C)C)n1	ZINC000429198047	360777695	/nfs/dbraw/zinc/77/76/95/360777695.db2.gz	MDBLHIQLARHGIC-GFCCVEGCSA-N	1	0	291.399	1.465	50	0		CDAARO
Cc1cc(C)c(OCC(=O)N2CCC[C@@H]([NH3+])C2)c(C)c1	ZINC000191339547	238836254	/nfs/dbraw/zinc/83/62/54/238836254.db2.gz	XJAWSXSNAOSRGX-CQSZACIVSA-N	1	0	276.380	1.940	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)N(C)CCc1ccccn1	ZINC000105777817	361593082	/nfs/dbraw/zinc/59/30/82/361593082.db2.gz	VQVUNSBETSGORA-HNNXBMFYSA-N	1	0	290.411	1.750	50	0		CDAARO
Cc1ncsc1C(=O)N1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1	ZINC000184941034	189399379	/nfs/dbraw/zinc/39/93/79/189399379.db2.gz	AXEQUSCPSYJJOK-AEJSXWLSSA-N	1	0	251.355	1.261	50	0		CDAARO
Cn1nncc1C[NH2+]C1(c2cccc(F)c2)CCOCC1	ZINC000267497265	363834301	/nfs/dbraw/zinc/83/43/01/363834301.db2.gz	FTZLDGXUYPCTPC-UHFFFAOYSA-N	1	0	290.342	1.750	50	0		CDAARO
C[C@@H]1CN(C(=O)CO[C@@H]2CCCC[C@H]2C)CC[NH2+]1	ZINC000429342577	364325258	/nfs/dbraw/zinc/32/52/58/364325258.db2.gz	ACWTUKHACZLNOO-JHJVBQTASA-N	1	0	254.374	1.402	50	0		CDAARO
O=C(C1CC[NH+](C[C@H]2CCCOC2)CC1)N1CCCC1	ZINC000336386445	283759764	/nfs/dbraw/zinc/75/97/64/283759764.db2.gz	RXZUZAQKQREBSF-CQSZACIVSA-N	1	0	280.412	1.747	50	0		CDAARO
C[N@H+](Cc1ccns1)CC(C)(C)CN1CCOCC1	ZINC000585117451	364856592	/nfs/dbraw/zinc/85/65/92/364856592.db2.gz	DOIIKFZVNQGQPG-UHFFFAOYSA-N	1	0	283.441	1.933	50	0		CDAARO
Cc1ccc(C[NH2+]CC2(CS(C)(=O)=O)CC2)o1	ZINC000089656085	366900888	/nfs/dbraw/zinc/90/08/88/366900888.db2.gz	QJYARGXFBYJHSE-UHFFFAOYSA-N	1	0	257.355	1.502	50	0		CDAARO
COc1ncccc1NC(=O)N1CC[NH+](C(C)C)CC1	ZINC000089885199	366952720	/nfs/dbraw/zinc/95/27/20/366952720.db2.gz	OFTIXOALGHODPE-UHFFFAOYSA-N	1	0	278.356	1.648	50	0		CDAARO
CCC(=O)N1CC[C@H]([NH2+]Cc2nccn2C)[C@H](CC)C1	ZINC000089949195	366979134	/nfs/dbraw/zinc/97/91/34/366979134.db2.gz	VIDJXJXJSZPSAM-OLZOCXBDSA-N	1	0	278.400	1.547	50	0		CDAARO
COc1ccc(C(=O)N[C@H]2CC[NH2+]C[C@H]2C)c(OC)c1	ZINC000094344995	367391357	/nfs/dbraw/zinc/39/13/57/367391357.db2.gz	VUOLDKORNKBSSV-MFKMUULPSA-N	1	0	278.352	1.432	50	0		CDAARO
COC(=O)CC(C)(C)C(=O)N[C@H]1C[C@H](C)[N@@H+](C2CC2)C1	ZINC000252508582	367656958	/nfs/dbraw/zinc/65/69/58/367656958.db2.gz	XPIYNGPWQAOGKE-QWRGUYRKSA-N	1	0	282.384	1.317	50	0		CDAARO
CC(C)COCC[NH+]1CCC(n2cncn2)CC1	ZINC000252507997	367653036	/nfs/dbraw/zinc/65/30/36/367653036.db2.gz	WZSFBBODEZYPBF-UHFFFAOYSA-N	1	0	252.362	1.588	50	0		CDAARO
FC(F)(F)CN1CC[C@H]([NH2+][C@H]2CCN3CCCC[C@H]23)C1	ZINC000252517730	367741774	/nfs/dbraw/zinc/74/17/74/367741774.db2.gz	PYYKMKAJZAWCMR-RWMBFGLXSA-N	1	0	291.361	1.839	50	0		CDAARO
C[C@H](CNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2[NH2+]1)Cn1cccn1	ZINC000252537019	367793943	/nfs/dbraw/zinc/79/39/43/367793943.db2.gz	KELWMNCWQKZURU-TUVASFSCSA-N	1	0	290.411	1.556	50	0		CDAARO
CO[C@]1(C)C[C@H](NC(=O)[C@@H]2CCC[NH2+]C2)C1(C)C	ZINC000121685302	368054125	/nfs/dbraw/zinc/05/41/25/368054125.db2.gz	KOLFHEAYEQJMLV-UHIISALHSA-N	1	0	254.374	1.306	50	0		CDAARO
CC(C)(C)NC(=O)NCC1CC[NH+]([C@H]2CCOC2)CC1	ZINC000575606439	370615421	/nfs/dbraw/zinc/61/54/21/370615421.db2.gz	JMCWALOXAPRXRU-ZDUSSCGKSA-N	1	0	283.416	1.585	50	0		CDAARO
CC(C)(CO)NC(=O)c1cc(F)ccc1OCCC[NH3+]	ZINC000299792342	372765151	/nfs/dbraw/zinc/76/51/51/372765151.db2.gz	FJBRXRASHLEMCO-UHFFFAOYSA-N	1	0	284.331	1.054	50	0		CDAARO
Cc1cccc(-n2cc(CNC(=O)C[C@H]3CC[NH2+]C3)cn2)c1	ZINC000299781005	372756989	/nfs/dbraw/zinc/75/69/89/372756989.db2.gz	QNNZVMHVMDOCCC-CQSZACIVSA-N	1	0	298.390	1.797	50	0		CDAARO
CCN(Cc1ccc(OC)c(F)c1)C(=O)C[C@H](C)[NH3+]	ZINC000037800697	373342709	/nfs/dbraw/zinc/34/27/09/373342709.db2.gz	ZUZRMROTDGDEQS-JTQLQIEISA-N	1	0	268.332	1.920	50	0		CDAARO
C[NH+](C)[C@H]1CCN(C(=O)[C@@](C)(O)CCc2ccccc2)C1	ZINC000253392253	373680769	/nfs/dbraw/zinc/68/07/69/373680769.db2.gz	HHICDLAAOORSGV-RDJZCZTQSA-N	1	0	290.407	1.533	50	0		CDAARO
C[NH2+]CC(=O)Nc1cc(C)n(-c2cccc(F)c2)n1	ZINC000193142893	373682497	/nfs/dbraw/zinc/68/24/97/373682497.db2.gz	HTNWVGCEEPRHSW-UHFFFAOYSA-N	1	0	262.288	1.478	50	0		CDAARO
O=C(NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc(C2CC2)on1	ZINC000253393766	373683946	/nfs/dbraw/zinc/68/39/46/373683946.db2.gz	SWKPZDCGFSPUIV-ZACCUICWSA-N	1	0	261.325	1.565	50	0		CDAARO
Cc1nn(C)cc1C[N@H+]1C[C@@H](c2ccncc2)[C@H](CO)C1	ZINC000253415155	373722997	/nfs/dbraw/zinc/72/29/97/373722997.db2.gz	ZVCQTAFWWRZUAV-HOTGVXAUSA-N	1	0	286.379	1.331	50	0		CDAARO
O=C(CCc1ccsc1)NCC[C@@H]1CC[NH2+]C1	ZINC000253433244	373745268	/nfs/dbraw/zinc/74/52/68/373745268.db2.gz	UKGRRRHJTBEJLD-NSHDSACASA-N	1	0	252.383	1.797	50	0		CDAARO
COC(=O)[C@H]([N@@H+]1CC[C@@]2(CCOC2)C1)C1(OC)CCC1	ZINC000253431587	373745495	/nfs/dbraw/zinc/74/54/95/373745495.db2.gz	WKFBEGMBGKWGJN-GXTWGEPZSA-N	1	0	283.368	1.210	50	0		CDAARO
C[C@H](C(=O)Nc1ccc(C(N)=O)cc1)[N@@H+]1CCC[C@H](C)C1	ZINC000103309180	373949746	/nfs/dbraw/zinc/94/97/46/373949746.db2.gz	VFWKLJMZWUBNTP-NWDGAFQWSA-N	1	0	289.379	1.844	50	0		CDAARO
CCOc1ccccc1C[NH2+]CC1(O)CCOCC1	ZINC000112717047	374227012	/nfs/dbraw/zinc/22/70/12/374227012.db2.gz	UIIUVHWDPVRMJM-UHFFFAOYSA-N	1	0	265.353	1.716	50	0		CDAARO
CCOC[C@H](O)C[NH2+][C@]1(CO)C[C@H](C)CC(C)(C)C1	ZINC000095432069	374932203	/nfs/dbraw/zinc/93/22/03/374932203.db2.gz	ANXDBOQKBDETAP-UMVBOHGHSA-N	1	0	273.417	1.551	50	0		CDAARO
C[C@@H]1CCN(C[C@H](O)CN2CCOCC2)c2ccccc21	ZINC000095431540	374932352	/nfs/dbraw/zinc/93/23/52/374932352.db2.gz	LUYMOSFZUQQJHF-HUUCEWRRSA-N	1	0	290.407	1.693	50	0		CDAARO
C[N@H+](CCNC(=O)N[C@H](c1nccs1)C1CC1)C1CC1	ZINC000095405329	374910004	/nfs/dbraw/zinc/91/00/04/374910004.db2.gz	LLBQYCHLKXGTQD-LBPRGKRZSA-N	1	0	294.424	1.988	50	0		CDAARO
CCn1cc(NC(=O)[C@@H](C2CC2)[NH+]2CCCC2)ccc1=O	ZINC000097115142	375148840	/nfs/dbraw/zinc/14/88/40/375148840.db2.gz	JKENJDLDDQYYGA-OAHLLOKOSA-N	1	0	289.379	1.681	50	0		CDAARO
CC[C@H](O)CN1C(=O)CC[C@@H]1CC[NH2+]Cc1ccccc1	ZINC000299768946	375211528	/nfs/dbraw/zinc/21/15/28/375211528.db2.gz	HBXPXHXRUPXXLV-CVEARBPZSA-N	1	0	290.407	1.928	50	0		CDAARO
O=C(/C=C\c1ccccc1Cl)N1CC[NH2+]CC1	ZINC000493497282	375459535	/nfs/dbraw/zinc/45/95/35/375459535.db2.gz	PKJWWCRZJDDARI-WAYWQWQTSA-N	1	0	250.729	1.785	50	0		CDAARO
Cc1[nH]c2ccccc2c1C(=O)C(=O)NCCC[NH+](C)C	ZINC000004163505	375901296	/nfs/dbraw/zinc/90/12/96/375901296.db2.gz	WHFAMOXUVIYLMF-UHFFFAOYSA-N	1	0	287.363	1.727	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)C[C@@H]1OCCc2ccccc21	ZINC000124615647	376027804	/nfs/dbraw/zinc/02/78/04/376027804.db2.gz	IQAVOOPKGCYWIG-DOMZBBRYSA-N	1	0	274.364	1.511	50	0		CDAARO
C[NH2+]Cc1n[nH]c(=O)n1-c1cc(Cl)cc(Cl)c1	ZINC000065430446	376131703	/nfs/dbraw/zinc/13/17/03/376131703.db2.gz	PWMAWIUETIWHAU-UHFFFAOYSA-N	1	0	273.123	1.587	50	0		CDAARO
CC(C)NC(=O)[C@@H]1C[C@@H](n2cc(C3CCCC3)nn2)C[NH2+]1	ZINC000067947385	377322249	/nfs/dbraw/zinc/32/22/49/377322249.db2.gz	DSLXCNRMVYZFMC-OLZOCXBDSA-N	1	0	291.399	1.363	50	0		CDAARO
CCc1noc(CN(C)CC2CC[NH+](C)CC2)n1	ZINC000089295384	377812363	/nfs/dbraw/zinc/81/23/63/377812363.db2.gz	NOSAIBFTFXGWJO-UHFFFAOYSA-N	1	0	252.362	1.406	50	0		CDAARO
[NH3+][C@H]1Cc2ccc(I)cc2C1	ZINC000006094104	390166213	/nfs/dbraw/zinc/16/62/13/390166213.db2.gz	BIHPYCDDPGNWQO-VIFPVBQESA-N	1	0	259.090	1.717	50	0	in-vitro	CDAARO
c1cn(C[C@H]2CCC[N@@H+]2Cc2cn3cccnc3n2)cn1	ZINC000291424852	390438876	/nfs/dbraw/zinc/43/88/76/390438876.db2.gz	INAYNIKAUKAWSD-CQSZACIVSA-N	1	0	282.351	1.590	50	0		CDAARO
CC(C)[NH+]1CCC([N@H+](C)CCOC[C@@H]2CCCO2)CC1	ZINC000096421088	390514140	/nfs/dbraw/zinc/51/41/40/390514140.db2.gz	IIHREBQRRIHVLQ-INIZCTEOSA-N	1	0	284.444	1.987	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCNC(=O)CCN2CCCCO2)C1	ZINC000067446844	390571944	/nfs/dbraw/zinc/57/19/44/390571944.db2.gz	USHVKAUZTDXSHC-AWEZNQCLSA-N	1	0	283.416	1.252	50	0		CDAARO
COC(=O)[C@]1(C)CC[N@@H+]([C@H]2Cc3ccccc3[C@H]2O)C1	ZINC000271989883	391305992	/nfs/dbraw/zinc/30/59/92/391305992.db2.gz	PQPPUBZEKKLWJE-SQWLQELKSA-N	1	0	275.348	1.530	50	0		CDAARO
COc1ccc2c(c1)OC[C@@H](C(=O)N1CC[NH2+]C[C@@H]1C)C2	ZINC000125454283	391466341	/nfs/dbraw/zinc/46/63/41/391466341.db2.gz	FRMNMSCSAONGJC-AAEUAGOBSA-N	1	0	290.363	1.067	50	0		CDAARO
C[C@@H]1C[N@H+](Cc2nnc(-c3ccco3)o2)C[C@H]1CO	ZINC000190900346	130159832	/nfs/dbraw/zinc/15/98/32/130159832.db2.gz	QJEVYAOKBZLHHO-ZJUUUORDSA-N	1	0	263.297	1.390	50	0		CDAARO
Cc1ccccc1[C@H](O)CNC(=O)[C@H](C)[C@@H](C)[NH3+]	ZINC000192051915	130360325	/nfs/dbraw/zinc/36/03/25/130360325.db2.gz	SPRVIHKWFOFDIB-NQBHXWOUSA-N	1	0	250.342	1.128	50	0		CDAARO
Cc1ncccc1C[NH2+][C@]1(CO)COc2ccccc2C1	ZINC000527769524	391943404	/nfs/dbraw/zinc/94/34/04/391943404.db2.gz	QOJPWSKSDPGCHE-QGZVFWFLSA-N	1	0	284.359	1.846	50	0		CDAARO
CNc1nc(N2CC[C@](C)(O)C(C)(C)C2)cc(C)[nH+]1	ZINC000091793454	135073887	/nfs/dbraw/zinc/07/38/87/135073887.db2.gz	XTNXNDXBZWNZQT-AWEZNQCLSA-N	1	0	264.373	1.814	50	0		CDAARO
COC(=O)CN1CCC([NH2+][C@H]2CCc3ccccc32)CC1	ZINC000097095361	397958259	/nfs/dbraw/zinc/95/82/59/397958259.db2.gz	XWSCTMLAVNKLSS-INIZCTEOSA-N	1	0	288.391	1.901	50	0		CDAARO
C[C@H](Oc1ccc(F)c(F)c1)C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178530044	148064846	/nfs/dbraw/zinc/06/48/46/148064846.db2.gz	IBCFTXKFLAADGC-UWVGGRQHSA-N	1	0	284.306	1.539	50	0		CDAARO
CC[NH+](CC)CCNc1nc(C)cc(COC)c1C(N)=O	ZINC000004743222	170009803	/nfs/dbraw/zinc/00/98/03/170009803.db2.gz	ZCBMNUIJQGBNQQ-UHFFFAOYSA-N	1	0	294.399	1.389	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=S)NC1CC1)c1ccccc1	ZINC000006334597	170193187	/nfs/dbraw/zinc/19/31/87/170193187.db2.gz	SWJANHZPOPXMGK-ZDUSSCGKSA-N	1	0	263.410	1.916	50	0		CDAARO
C[NH+]1CCC(NC(=S)NCCc2ccccc2)CC1	ZINC000007777129	170301874	/nfs/dbraw/zinc/30/18/74/170301874.db2.gz	HIWFJHDSKWMLJR-UHFFFAOYSA-N	1	0	277.437	1.787	50	0		CDAARO
COc1c2c(c(CNC(C)=O)c3c1C[N@H+](C)CC3)OCO2	ZINC000008764974	170354958	/nfs/dbraw/zinc/35/49/58/170354958.db2.gz	ABHFDSKXRLSXPW-UHFFFAOYSA-N	1	0	292.335	1.048	50	0	biogenic	CDAARO
CC[NH+]1CCN(Cc2ccc(C(=O)OC)cc2)CC1	ZINC000020302757	171139633	/nfs/dbraw/zinc/13/96/33/171139633.db2.gz	NDZKUSCLDSKIKX-UHFFFAOYSA-N	1	0	262.353	1.611	50	0		CDAARO
COc1ccc2c(CN3CC[NH2+]CC3)cc(=O)oc2c1	ZINC000020348983	171154493	/nfs/dbraw/zinc/15/44/93/171154493.db2.gz	VVCKBJIHJAGMQA-UHFFFAOYSA-N	1	0	274.320	1.207	50	0		CDAARO
CCOc1cc2c(cc1C[NH2+][C@H](C)CO)O[C@H](C)C2	ZINC000035603841	172292168	/nfs/dbraw/zinc/29/21/68/172292168.db2.gz	YPNWKUOFHVPGPO-GHMZBOCLSA-N	1	0	265.353	1.879	50	0		CDAARO
COc1ccccc1OCCCN1CC[NH2+][C@H](C)C1	ZINC000040456403	174267688	/nfs/dbraw/zinc/26/76/88/174267688.db2.gz	UYAJBGAPEWLSDM-CYBMUJFWSA-N	1	0	264.369	1.758	50	0		CDAARO
Cc1cccnc1CN(C)c1cc(CC[NH3+])nc(C)n1	ZINC000067770614	175790266	/nfs/dbraw/zinc/79/02/66/175790266.db2.gz	WCMVHTKJVQCCSJ-UHFFFAOYSA-N	1	0	271.368	1.626	50	0		CDAARO
CNC(=O)c1ccc(-c2cccc3c2O[C@H](C[NH3+])C3)o1	ZINC000067855019	175797510	/nfs/dbraw/zinc/79/75/10/175797510.db2.gz	PAPSGVYHPBKFEX-JTQLQIEISA-N	1	0	272.304	1.568	50	0		CDAARO
C[C@@]1(Cn2cnc3ccccc3c2=O)[NH2+]CCc2nc[nH]c21	ZINC000067894258	175799686	/nfs/dbraw/zinc/79/96/86/175799686.db2.gz	MXSDGHMKUREPQR-INIZCTEOSA-N	1	0	295.346	1.181	50	0		CDAARO
CNC(=O)CC1CC[NH+](CC[C@@H](C)SC)CC1	ZINC000067975683	175805320	/nfs/dbraw/zinc/80/53/20/175805320.db2.gz	BHCQIGWRGNAIRB-LLVKDONJSA-N	1	0	258.431	1.976	50	0		CDAARO
CO[C@H]1CN(C(=O)c2cc3sccc3[nH]2)CC[C@H]1[NH3+]	ZINC000071757256	176260749	/nfs/dbraw/zinc/26/07/49/176260749.db2.gz	UELSWWZFLINJRK-KCJUWKMLSA-N	1	0	279.365	1.418	50	0		CDAARO
Cc1n[nH]c(C)c1CC[N@@H+]1CCC[C@H](N2CCCC2=O)C1	ZINC000071764061	176262029	/nfs/dbraw/zinc/26/20/29/176262029.db2.gz	QXHCNWIPXOMPBP-AWEZNQCLSA-N	1	0	290.411	1.656	50	0		CDAARO
O=C(NC[C@]1(O)CCC[NH2+]CC1)Nc1ccccc1	ZINC000072154734	176328561	/nfs/dbraw/zinc/32/85/61/176328561.db2.gz	PEGQZDCHPUIUCM-AWEZNQCLSA-N	1	0	263.341	1.313	50	0		CDAARO
Cc1nc(C(=O)N(C)C)cc(C2(C)CC[NH2+]CC2)n1	ZINC000072344516	176373122	/nfs/dbraw/zinc/37/31/22/176373122.db2.gz	JSKNKWLJJZYTEF-UHFFFAOYSA-N	1	0	262.357	1.128	50	0		CDAARO
CN(Cc1cc(C2CC2)on1)c1ncnc2c1CC[NH2+]CC2	ZINC000072476704	176407055	/nfs/dbraw/zinc/40/70/55/176407055.db2.gz	NSLKWBLRWGRDDS-UHFFFAOYSA-N	1	0	299.378	1.667	50	0		CDAARO
c1cc(CC[NH2+][C@@H]2CCOC3(CCOCC3)C2)ccn1	ZINC000077428611	177265593	/nfs/dbraw/zinc/26/55/93/177265593.db2.gz	PAJHIFVWCFVXNU-OAHLLOKOSA-N	1	0	276.380	1.942	50	0		CDAARO
C[NH2+][C@H](C)CNC(=O)c1cc(C)ccc1-n1ccnc1	ZINC000261802310	273973399	/nfs/dbraw/zinc/97/33/99/273973399.db2.gz	RYCSJXXOSPWCFT-GFCCVEGCSA-N	1	0	272.352	1.518	50	0		CDAARO
COc1nccnc1-c1cc(C)cc2c1O[C@H](C[NH3+])C2	ZINC000067851091	274170786	/nfs/dbraw/zinc/17/07/86/274170786.db2.gz	NNZPKEKWQDEFOJ-NSHDSACASA-N	1	0	271.320	1.723	50	0		CDAARO
C([C@H]1CCCCO1)N1CC[NH+]([C@H]2CCSC2)CC1	ZINC000097014617	275397497	/nfs/dbraw/zinc/39/74/97/275397497.db2.gz	JCZCSGBMCFDWEO-UONOGXRCSA-N	1	0	270.442	1.679	50	0		CDAARO
CC(C)CCN1CC2(CC[NH+]([C@@H](C)CO)CC2)OC1=O	ZINC000072433625	277353820	/nfs/dbraw/zinc/35/38/20/277353820.db2.gz	KUFVQLKTZNFMKJ-ZDUSSCGKSA-N	1	0	284.400	1.700	50	0		CDAARO
COc1ccc(C2[C@@H](C)N(O)C(C)(C)[N+]2=O)cc1	ZINC000000269048	277407993	/nfs/dbraw/zinc/40/79/93/277407993.db2.gz	QRRMSHOONXKTDS-SECBINFHSA-N	1	0	250.298	1.824	50	0		CDAARO
C[C@H]([NH2+][C@@H]1CCCN(CC(F)(F)F)C1=O)[C@@H]1CCCO1	ZINC000097108874	278271239	/nfs/dbraw/zinc/27/12/39/278271239.db2.gz	ULSNMHGOMUEZJE-AXFHLTTASA-N	1	0	294.317	1.697	50	0		CDAARO
Cc1ccc(C[NH2+]C2CCN(S(C)(=O)=O)CC2)cc1C	ZINC000035257494	279139993	/nfs/dbraw/zinc/13/99/93/279139993.db2.gz	XUEBTSKIOHGWLX-UHFFFAOYSA-N	1	0	296.436	1.817	50	0		CDAARO
CC(C)N(C)C(=O)[C@H](C)[NH2+][C@H]1CCCC[C@@H]1CO	ZINC000125118310	279345351	/nfs/dbraw/zinc/34/53/51/279345351.db2.gz	HTSJNNVPSBIAJK-XQQFMLRXSA-N	1	0	256.390	1.382	50	0		CDAARO
Cc1cc(C(=O)N2CCC[C@H]([NH+]3CCCC3)CC2)[nH]n1	ZINC000095399399	280326898	/nfs/dbraw/zinc/32/68/98/280326898.db2.gz	KAZIUTRVONLQCX-ZDUSSCGKSA-N	1	0	276.384	1.809	50	0		CDAARO
Cc1cc(C(=O)N2CC[NH2+]CC2)c2ccccc2n1	ZINC000011866597	280331076	/nfs/dbraw/zinc/33/10/76/280331076.db2.gz	UCVGPJNXQYJZMA-UHFFFAOYSA-N	1	0	255.321	1.589	50	0		CDAARO
CC1(C)CCC[C@H]([NH2+]C2CCN(S(C)(=O)=O)CC2)C1	ZINC000067846905	281050219	/nfs/dbraw/zinc/05/02/19/281050219.db2.gz	QUWBTSVIOZKVMZ-ZDUSSCGKSA-N	1	0	288.457	1.969	50	0		CDAARO
Cc1ccccc1N1CCC[N@H+](C[C@H]2COCCO2)CC1	ZINC000244874922	281346728	/nfs/dbraw/zinc/34/67/28/281346728.db2.gz	XJRKSJXYNLFGPW-INIZCTEOSA-N	1	0	290.407	1.923	50	0		CDAARO
Cc1cnc(C(=O)NC[C@@H](c2ccccc2)[NH+](C)C)cn1	ZINC000023198417	281574992	/nfs/dbraw/zinc/57/49/92/281574992.db2.gz	BNFAYNGDQLCKPZ-HNNXBMFYSA-N	1	0	284.363	1.818	50	0		CDAARO
COc1ccccc1CC(=O)N1CCCC[C@H]2C[NH2+]C[C@@H]21	ZINC000077010803	295358167	/nfs/dbraw/zinc/35/81/67/295358167.db2.gz	VANASYYVGCDCDD-GJZGRUSLSA-N	1	0	288.391	1.838	50	0		CDAARO
[NH3+]C1(C(=O)N2CC[C@](O)(C(F)(F)F)C2)CCCCC1	ZINC000261616211	303354443	/nfs/dbraw/zinc/35/44/43/303354443.db2.gz	TZOIBMWPNIDVTI-LLVKDONJSA-N	1	0	280.290	1.174	50	0		CDAARO
C[C@@H]([NH3+])CCNC(=O)c1csc(-c2ccoc2)n1	ZINC000178702186	315958853	/nfs/dbraw/zinc/95/88/53/315958853.db2.gz	YHMYKJAXMOXHQC-MRVPVSSYSA-N	1	0	265.338	1.870	50	0		CDAARO
CO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)c1cccc2c1NCCC2	ZINC000534644226	328330041	/nfs/dbraw/zinc/33/00/41/328330041.db2.gz	VHYCGMLTRRACKN-KBPBESRZSA-N	1	0	289.379	1.104	50	0		CDAARO
C[NH+](C)CC[C@@H](NC(=O)C1(C)COC1)c1ccccc1	ZINC000534631788	328331740	/nfs/dbraw/zinc/33/17/40/328331740.db2.gz	BNQVFJDVXCPMKA-CQSZACIVSA-N	1	0	276.380	1.832	50	0		CDAARO
Cc1cc(C(N)=O)c(N2CCC[C@@]3(CC[NH2+]C3)C2)nc1C	ZINC000534632449	328332125	/nfs/dbraw/zinc/33/21/25/328332125.db2.gz	AUOFLRKQJDHMCF-INIZCTEOSA-N	1	0	288.395	1.377	50	0		CDAARO
C[C@@H]([NH2+]CCc1csc(-c2cnccn2)n1)C(C)(C)O	ZINC000534652432	328337890	/nfs/dbraw/zinc/33/78/90/328337890.db2.gz	IHJOTMSUACMKRG-SNVBAGLBSA-N	1	0	292.408	1.892	50	0		CDAARO
Cc1ccccc1[C@@H](CNC(=O)C1(C)COC1)[NH+](C)C	ZINC000534654316	328338740	/nfs/dbraw/zinc/33/87/40/328338740.db2.gz	MUCQXEDJWHCHFF-CQSZACIVSA-N	1	0	276.380	1.750	50	0		CDAARO
CCCS(=O)(=O)N[C@@H](c1nccn1C)C(C)C	ZINC000534656636	328340083	/nfs/dbraw/zinc/34/00/83/328340083.db2.gz	QFLKHRQCWMFGNP-SNVBAGLBSA-N	1	0	259.375	1.447	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)[C@]2(C)CCCCO2)CC1	ZINC000534658192	328341265	/nfs/dbraw/zinc/34/12/65/328341265.db2.gz	JYERCOUJRQPYES-AWEZNQCLSA-N	1	0	268.401	1.936	50	0		CDAARO
Cc1nccn1C[C@@H](C)[NH2+]CC1(CN2CCOCC2)CC1	ZINC000534658727	328341398	/nfs/dbraw/zinc/34/13/98/328341398.db2.gz	JEEMYSNGHQWMQF-CQSZACIVSA-N	1	0	292.427	1.282	50	0		CDAARO
O=C(NCCOc1ccc(F)cc1)[C@H]1CCC[NH2+]CC1	ZINC000534665488	328344912	/nfs/dbraw/zinc/34/49/12/328344912.db2.gz	WPUUFALBUJQXEE-LBPRGKRZSA-N	1	0	280.343	1.710	50	0		CDAARO
CCNc1nc(C)c(C(=O)N2C[C@@H]3CC[N@H+](C)[C@@H]3C2)s1	ZINC000077421967	327132212	/nfs/dbraw/zinc/13/22/12/327132212.db2.gz	BLTPEPRRRXZTCQ-WDEREUQCSA-N	1	0	294.424	1.659	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCN(C(=O)c2ccnc(C3CC3)n2)C1	ZINC000299739378	482447813	/nfs/dbraw/zinc/44/78/13/482447813.db2.gz	NTUPSDCATRFZFZ-PWSUYJOCSA-N	1	0	274.368	1.553	50	0		CDAARO
C[C@H]1OCC[C@@H]1[NH2+]Cc1cccc(OCC(F)F)n1	ZINC000090971908	482522715	/nfs/dbraw/zinc/52/27/15/482522715.db2.gz	ZDXAWNDSQMAVNP-KOLCDFICSA-N	1	0	272.295	1.993	50	0		CDAARO
CCOC(=O)N1CCC(N2CCCC[C@H]([NH3+])C2)CC1	ZINC000082136932	482763488	/nfs/dbraw/zinc/76/34/88/482763488.db2.gz	QEHOKQVYVNWBJP-LBPRGKRZSA-N	1	0	269.389	1.421	50	0		CDAARO
COCC1(C(=O)NCC(C)(C)[NH+]2CCCC2)CCC1	ZINC000670444982	482995006	/nfs/dbraw/zinc/99/50/06/482995006.db2.gz	GXAIBPCJJSAFRY-UHFFFAOYSA-N	1	0	268.401	1.794	50	0		CDAARO
Cc1ncn(CCNC(=O)[C@@H](C)C[NH+]2CCCC2)c1C	ZINC000670452327	483018983	/nfs/dbraw/zinc/01/89/83/483018983.db2.gz	AGOIDFBMIGSEBM-LBPRGKRZSA-N	1	0	278.400	1.348	50	0		CDAARO
Cc1ncn(CCNC(=O)[C@H](C)C[NH+]2CCCC2)c1C	ZINC000670452326	483019312	/nfs/dbraw/zinc/01/93/12/483019312.db2.gz	AGOIDFBMIGSEBM-GFCCVEGCSA-N	1	0	278.400	1.348	50	0		CDAARO
CCC(CC)C(=O)N1CCOC[C@@H](C[NH+](C)C)C1	ZINC000670453955	483024047	/nfs/dbraw/zinc/02/40/47/483024047.db2.gz	QFVBPWYMXOLKBN-LBPRGKRZSA-N	1	0	256.390	1.459	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)c1cnc(C2CC2)nc1	ZINC000670458274	483039863	/nfs/dbraw/zinc/03/98/63/483039863.db2.gz	IJSKNCRPQYDMGK-UHFFFAOYSA-N	1	0	297.362	1.321	50	0		CDAARO
O=C(Cn1cccc1)NC1CC[NH+](C2CCOCC2)CC1	ZINC000670468172	483059457	/nfs/dbraw/zinc/05/94/57/483059457.db2.gz	DFWUYCZXDSGKGO-UHFFFAOYSA-N	1	0	291.395	1.248	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CN(C)Cc2ccc(OC)nc2)C1	ZINC000670473516	483083491	/nfs/dbraw/zinc/08/34/91/483083491.db2.gz	MIDMJMILMDAHFZ-OAHLLOKOSA-N	1	0	293.411	1.490	50	0		CDAARO
CC(C)[C@H](Cc1ccccc1)C(=O)NC[C@H](O)C[NH+](C)C	ZINC000084410508	483276596	/nfs/dbraw/zinc/27/65/96/483276596.db2.gz	ZYGSNLNBXIOWLY-HOTGVXAUSA-N	1	0	292.423	1.540	50	0		CDAARO
C[C@@H](C[NH3+])N(C)C(=O)c1ccccc1Br	ZINC000096482548	533786185	/nfs/dbraw/zinc/78/61/85/533786185.db2.gz	IFUWVMOYEYAWJF-QMMMGPOBSA-N	1	0	271.158	1.868	50	0		CDAARO
C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1CCN1CCOCC1	ZINC000340884957	525513669	/nfs/dbraw/zinc/51/36/69/525513669.db2.gz	LLBNVFZMNNUFBF-RBSFLKMASA-N	1	0	252.402	1.972	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)Nc1cnn(C(C)C)c1	ZINC000061683484	525587910	/nfs/dbraw/zinc/58/79/10/525587910.db2.gz	ZMXRDMSVPSVYJU-JTQLQIEISA-N	1	0	256.375	1.483	50	0		CDAARO
CC1(CNC(=O)[C@H]2OCCc3ccccc32)CC[NH2+]CC1	ZINC000129103233	527973869	/nfs/dbraw/zinc/97/38/69/527973869.db2.gz	ZGABSHMZPWRVFE-HNNXBMFYSA-N	1	0	288.391	1.806	50	0		CDAARO
CCO[C@H]1C[C@](CO)([NH2+]Cc2ncc[nH]2)C1(C)C	ZINC000186583623	535649893	/nfs/dbraw/zinc/64/98/93/535649893.db2.gz	XJKFTNOEEXPJMY-GXFFZTMASA-N	1	0	253.346	1.065	50	0		CDAARO
CNC(=O)NC(=O)C[NH2+][C@@H](Cc1ccc(F)cc1)C(C)C	ZINC000097049022	567903851	/nfs/dbraw/zinc/90/38/51/567903851.db2.gz	PSCARMCWQYSGIS-ZDUSSCGKSA-N	1	0	295.358	1.438	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@](O)([C@H]([NH3+])C(C)(C)C)C1	ZINC000958528549	613978829	/nfs/dbraw/zinc/97/88/29/613978829.db2.gz	QFGDSVRKXYGAKX-YGRLFVJLSA-N	1	0	272.389	1.732	50	0		CDAARO
Cc1cnn(C[C@@H](C)[NH2+]Cc2cc3n(n2)CCCC3)c1	ZINC000888094321	617754317	/nfs/dbraw/zinc/75/43/17/617754317.db2.gz	IBFILJRNCLKOQI-CYBMUJFWSA-N	1	0	273.384	1.903	50	0		CDAARO
CCc1ccc(C[NH+]2CCN(CCOCCO)CC2)cc1	ZINC000019607079	619366777	/nfs/dbraw/zinc/36/67/77/619366777.db2.gz	HKGBAVCVYRCKDK-UHFFFAOYSA-N	1	0	292.423	1.376	50	0		CDAARO
COc1ccc(F)c(C[N@@H+]2C[C@@H]3COCC[C@]3(CO)C2)c1	ZINC001772700787	1159436819	/nfs/dbraw/zinc/43/68/19/1159436819.db2.gz	HJNMUFSBFXZRHE-CZUORRHYSA-N	1	0	295.354	1.665	50	0		CDAARO
Cc1ccc(-n2cc(C[N@H+]3C[C@@H]4[C@H](O)C[C@@H]4C3)cn2)cc1	ZINC001772707652	1159442617	/nfs/dbraw/zinc/44/26/17/1159442617.db2.gz	WURXZFIMZPAAMH-HYVNUMGLSA-N	1	0	283.375	1.993	50	0		CDAARO
COc1ccc(C[NH+]2CCC([C@@H](O)CO)CC2)cc1F	ZINC001772711509	1159446220	/nfs/dbraw/zinc/44/62/20/1159446220.db2.gz	DEQJHOXNOAZBIG-AWEZNQCLSA-N	1	0	283.343	1.400	50	0		CDAARO
CN(C)c1nc(NCC[C@H]2CCC[N@@H+]2C)ncc1F	ZINC001704313012	1177685686	/nfs/dbraw/zinc/68/56/86/1177685686.db2.gz	DUYYIYRARFFNSP-SNVBAGLBSA-N	1	0	267.352	1.578	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3c(C)noc3C)C[C@H]2O)on1	ZINC001704343316	1177695876	/nfs/dbraw/zinc/69/58/76/1177695876.db2.gz	WBYKTXXFMBVCSH-IUODEOHRSA-N	1	0	291.351	1.623	50	0		CDAARO
C[C@H](COC[C@@H](O)C[NH+]1CCN(C)CC1)c1ccccc1	ZINC000020638937	742878334	/nfs/dbraw/zinc/87/83/34/742878334.db2.gz	NOFWBZNOYUENPG-WBVHZDCISA-N	1	0	292.423	1.415	50	0		CDAARO
COc1ccc(/C(C)=C/C(=O)N2CC[NH2+]C[C@H]2C)cc1	ZINC000124465006	743038273	/nfs/dbraw/zinc/03/82/73/743038273.db2.gz	MPAWJQFOGLVZLA-RSKUSDAESA-N	1	0	274.364	1.919	50	0		CDAARO
C[C@@H]1CC[NH2+][C@@H](C)[C@H]1NC(=O)Cc1ccc(O)cc1	ZINC000389081083	743322450	/nfs/dbraw/zinc/32/24/50/743322450.db2.gz	BAIPSSMXSHXLCA-ZETOZRRWSA-N	1	0	262.353	1.437	50	0		CDAARO
CC(C)NC(=O)C[NH2+][C@H]1CCN(Cc2ccccc2)C1	ZINC000035133261	743388873	/nfs/dbraw/zinc/38/88/73/743388873.db2.gz	LYFXREMNPVAKFQ-HNNXBMFYSA-N	1	0	275.396	1.375	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)C2=C(C)OCCO2)CC1	ZINC000952966729	743615149	/nfs/dbraw/zinc/61/51/49/743615149.db2.gz	WJLMCMRWSJGUJR-UHFFFAOYSA-N	1	0	268.357	1.255	50	0		CDAARO
O=C1CC2(C[NH2+]C2)N(Cc2c(F)cccc2Cl)CCN1	ZINC000864097155	746036160	/nfs/dbraw/zinc/03/61/60/746036160.db2.gz	OOYDEAGQOFECBQ-UHFFFAOYSA-N	1	0	297.761	1.143	50	0		CDAARO
Cc1cc(C(=O)N(C)CC[NH+]2CCC(C)CC2)n(C)n1	ZINC000019224481	748620716	/nfs/dbraw/zinc/62/07/16/748620716.db2.gz	SWEHGRFOOZQVOR-UHFFFAOYSA-N	1	0	278.400	1.532	50	0		CDAARO
C[C@@H]1CCC[C@H]([NH+]2CCN(CCOCCO)CC2)C1	ZINC000019635963	748697480	/nfs/dbraw/zinc/69/74/80/748697480.db2.gz	HZSLFDRTPGGPNO-CABCVRRESA-N	1	0	270.417	1.192	50	0		CDAARO
OC1CC[NH+](CCNc2ccc3cc[nH]c3n2)CC1	ZINC000072140153	748756531	/nfs/dbraw/zinc/75/65/31/748756531.db2.gz	DJOOBYBQSARSDD-UHFFFAOYSA-N	1	0	260.341	1.432	50	0		CDAARO
CON(C)C(=O)CC[N@@H+]1CC[C@@H](c2ccccn2)C1	ZINC000799189883	749328243	/nfs/dbraw/zinc/32/82/43/749328243.db2.gz	IEXOGDKCKOYUIW-GFCCVEGCSA-N	1	0	263.341	1.281	50	0		CDAARO
O=C(NC1(CO)CCSCC1)[C@@H]1CCC[C@@H]2CCC[N@@H+]21	ZINC000585121957	902286634	/nfs/dbraw/zinc/28/66/34/902286634.db2.gz	HOOMOXFGRVBWMI-OLZOCXBDSA-N	1	0	298.452	1.378	50	0		CDAARO
C[C@@H]1CCC(=O)N1c1cccc(NC(=O)CC[NH3+])c1	ZINC001506420349	909177716	/nfs/dbraw/zinc/17/77/16/909177716.db2.gz	DHHAJBUDTDIRJB-SNVBAGLBSA-N	1	0	261.325	1.489	50	0		CDAARO
CN(CC1=CCCOC1)C(=O)NC[C@@H]1[NH2+]CCCC1(C)C	ZINC000952852445	910408276	/nfs/dbraw/zinc/40/82/76/910408276.db2.gz	WHAFCIQZOCZVRT-AWEZNQCLSA-N	1	0	295.427	1.753	50	0		CDAARO
CC[C@H](C)C[NH+]1CCC(O)(c2ncnn2C)CC1	ZINC000952883471	910454004	/nfs/dbraw/zinc/45/40/04/910454004.db2.gz	XRWSDCAKJPGKRY-NSHDSACASA-N	1	0	252.362	1.145	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)c1ccc(Cl)cn1	ZINC000823350073	925686942	/nfs/dbraw/zinc/68/69/42/925686942.db2.gz	KEHBRNPDCJBLBP-RYUDHWBXSA-N	1	0	283.759	1.184	50	0		CDAARO
CN(C[C@H]1CCCO1)C(=O)C[NH+]1CCCCCC1	ZINC000823629715	925715732	/nfs/dbraw/zinc/71/57/32/925715732.db2.gz	OIYUAMJNQKLBSW-CYBMUJFWSA-N	1	0	254.374	1.500	50	0		CDAARO
COCCn1ccnc1CN1CC([N@@H+]2CCCC[C@@H]2C)C1	ZINC000824466323	925822212	/nfs/dbraw/zinc/82/22/12/925822212.db2.gz	PKTLNUCXMLOJDS-AWEZNQCLSA-N	1	0	292.427	1.588	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)c1c(Cl)cnn1C	ZINC000825253391	925856649	/nfs/dbraw/zinc/85/66/49/925856649.db2.gz	MHOQBUJLUBVYOO-UHFFFAOYSA-N	1	0	293.758	1.041	50	0		CDAARO
OC[C@H]1CCC[N@H+](CCNc2nccc3cccnc32)C1	ZINC000828711091	926169533	/nfs/dbraw/zinc/16/95/33/926169533.db2.gz	DEPIFKKRTBUUGB-ZDUSSCGKSA-N	1	0	286.379	1.746	50	0		CDAARO
O=C(NCC[N@H+]1CCCC[C@@H]1CO)c1ccc(F)c(O)c1	ZINC000828710771	926169651	/nfs/dbraw/zinc/16/96/51/926169651.db2.gz	CMGDBIBOXHCTSX-GFCCVEGCSA-N	1	0	296.342	1.108	50	0		CDAARO
CCc1nc(-c2ccc(C[NH+]3CCCC3)o2)n(CCO)n1	ZINC000828778338	926179605	/nfs/dbraw/zinc/17/96/05/926179605.db2.gz	IDQZAKLOUJVGHO-UHFFFAOYSA-N	1	0	290.367	1.689	50	0		CDAARO
OCc1ccc2c(c1)C[N@@H+](C[C@H]1CCCO1)CCO2	ZINC000828827022	926194191	/nfs/dbraw/zinc/19/41/91/926194191.db2.gz	KDHANUCPVVBLGZ-CQSZACIVSA-N	1	0	263.337	1.552	50	0		CDAARO
COCC(=O)N[C@@H]1C[N@H+](CC2CCCCC2)CC[C@@H]1CO	ZINC000581799298	927199109	/nfs/dbraw/zinc/19/91/09/927199109.db2.gz	PDXXZIXRDBUBRF-HUUCEWRRSA-N	1	0	298.427	1.012	50	0		CDAARO
CC1CCC2(CC1)OC[C@H](C[NH2+]Cc1cnn(C)c1)O2	ZINC000584908411	930677987	/nfs/dbraw/zinc/67/79/87/930677987.db2.gz	FOODVLUAMFLOPU-BLZCZZARSA-N	1	0	279.384	1.832	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1ccn2nccc2n1	ZINC000585079416	930852321	/nfs/dbraw/zinc/85/23/21/930852321.db2.gz	BNBXREXXZVTYET-GFCCVEGCSA-N	1	0	259.357	1.438	50	0		CDAARO
C[C@H]1CN(Cc2ccccn2)CCN1C(=O)Cc1cc[nH]n1	ZINC000585083108	930862667	/nfs/dbraw/zinc/86/26/67/930862667.db2.gz	WKMVWMUJERTYCO-ZDUSSCGKSA-N	1	0	299.378	1.080	50	0		CDAARO
NC(=O)[C@H]1CC[N@H+](Cc2ccc(C3OCCO3)cc2)C1	ZINC000585117764	930985149	/nfs/dbraw/zinc/98/51/49/930985149.db2.gz	WAPQOACLQORLHY-ZDUSSCGKSA-N	1	0	276.336	1.039	50	0		CDAARO
C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)Cc1ncc(Cl)s1	ZINC000585139484	931033864	/nfs/dbraw/zinc/03/38/64/931033864.db2.gz	AFFGZJUKSCWQMF-IUCAKERBSA-N	1	0	287.816	1.890	50	0		CDAARO
Cc1c(NC(=O)c2ccc(CC[NH3+])cc2)cnn1C	ZINC001263087950	943738103	/nfs/dbraw/zinc/73/81/03/943738103.db2.gz	WLBFLYHTQNXCAU-UHFFFAOYSA-N	1	0	258.325	1.482	50	0		CDAARO
CC[C@@H](C(=O)Nc1cnn(CC)c1C)[N@H+](C)CC	ZINC001529092559	968978192	/nfs/dbraw/zinc/97/81/92/968978192.db2.gz	VBADJCCWKLFEMH-LBPRGKRZSA-N	1	0	252.362	1.880	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CN(C)c2ccc(C(C)=O)cn2)C1	ZINC001529167925	969000252	/nfs/dbraw/zinc/00/02/52/969000252.db2.gz	SUXNTKAQOUOIOX-AWEZNQCLSA-N	1	0	291.395	1.689	50	0		CDAARO
Cc1ccncc1C(=O)Nc1nnc(CC[NH+](C)C)s1	ZINC001529173533	969005479	/nfs/dbraw/zinc/00/54/79/969005479.db2.gz	YCLXKAPJLGZELG-UHFFFAOYSA-N	1	0	291.380	1.598	50	0		CDAARO
CNc1nc(N[C@@H]2CCC[C@H]2[NH+](C)C)ncc1F	ZINC001506397215	975147929	/nfs/dbraw/zinc/14/79/29/975147929.db2.gz	JLHAGTHIMLJJFB-NXEZZACHSA-N	1	0	253.325	1.552	50	0		CDAARO
Cc1nncn1CCN1CC[NH+](CCc2ccccc2)CC1	ZINC001506397904	975147971	/nfs/dbraw/zinc/14/79/71/975147971.db2.gz	GJKLQKARJDHDDK-UHFFFAOYSA-N	1	0	299.422	1.447	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN(c2ccc(Cl)cn2)C1	ZINC001506407310	975151448	/nfs/dbraw/zinc/15/14/48/975151448.db2.gz	QUQPKOXTLCPHQV-NSHDSACASA-N	1	0	269.776	1.749	50	0		CDAARO
C[C@H](C[NH+]1CCCCCC1)N1C[C@@H]2C[C@@H](O)[C@@H](O)C[C@@H]2C1	ZINC001506411688	975154166	/nfs/dbraw/zinc/15/41/66/975154166.db2.gz	JTWJLOVBNYSZSG-UHDSXZAQSA-N	1	0	296.455	1.315	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](CNCc2cnc(C)nc2)C1	ZINC001506426372	975160447	/nfs/dbraw/zinc/16/04/47/975160447.db2.gz	GNWJAIRXXJTYJV-AWEZNQCLSA-N	1	0	278.400	1.233	50	0		CDAARO
Cc1cccc(C[NH+]2CCC(O)(Cn3ccnc3)CC2)n1	ZINC000097819626	230387616	/nfs/dbraw/zinc/38/76/16/230387616.db2.gz	XJGMAVKGIWBXKB-UHFFFAOYSA-N	1	0	286.379	1.614	50	0		CDAARO
Cc1cc(C(=O)N2CCN(C)[C@@H](CCO)C2)sc1C	ZINC000584902747	341987023	/nfs/dbraw/zinc/98/70/23/341987023.db2.gz	QVLCYAYMSWQDAM-LBPRGKRZSA-N	1	0	282.409	1.504	50	0		CDAARO
Cc1ccccc1CC(=O)N1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1	ZINC000185122791	230395841	/nfs/dbraw/zinc/39/58/41/230395841.db2.gz	WVMZCRDWAHFHFL-RRFJBIMHSA-N	1	0	258.365	1.733	50	0		CDAARO
CCOc1cc([C@H]([NH3+])CS(C)(=O)=O)ccc1OC	ZINC000095779321	185027893	/nfs/dbraw/zinc/02/78/93/185027893.db2.gz	BXUJVINGXQGNFD-SNVBAGLBSA-N	1	0	273.354	1.138	50	0		CDAARO
O=C(N[C@H]1CC[NH2+]C1)c1csc(-c2ccsc2)n1	ZINC000126974341	342005441	/nfs/dbraw/zinc/00/54/41/342005441.db2.gz	GOKODVUNVVAZSG-VIFPVBQESA-N	1	0	279.390	1.963	50	0		CDAARO
O=C(CCc1ccc(F)cc1)NC[C@@H]1CCC[NH2+]C1	ZINC000095971552	185048471	/nfs/dbraw/zinc/04/84/71/185048471.db2.gz	CWSNHDKEXNDIFI-CYBMUJFWSA-N	1	0	264.344	1.874	50	0		CDAARO
CN(CC1CCOCC1)C(=O)NCCC[NH+]1CCCCC1	ZINC000095982046	185054331	/nfs/dbraw/zinc/05/43/31/185054331.db2.gz	MPZVCVBKXCJCRD-UHFFFAOYSA-N	1	0	297.443	1.930	50	0		CDAARO
CC(=O)O[C@@H](CN1CC[NH+](C)CC1)c1ccccc1	ZINC000019360371	342088967	/nfs/dbraw/zinc/08/89/67/342088967.db2.gz	FRWDVKRXQFHYPY-HNNXBMFYSA-N	1	0	262.353	1.538	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@@H]2CO)c(OC)c1C	ZINC000006667497	342089130	/nfs/dbraw/zinc/08/91/30/342089130.db2.gz	JBDQEEDZWGBFQW-CYBMUJFWSA-N	1	0	265.353	1.969	50	0		CDAARO
O=C1COC[C@H]2C[NH2+]CC[C@H]2N1Cc1ccccc1	ZINC000096125447	185103722	/nfs/dbraw/zinc/10/37/22/185103722.db2.gz	VIDQLCPBPXTUGA-ZIAGYGMSSA-N	1	0	260.337	1.024	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)CC/C=C/c1ccccc1	ZINC000195553976	342625739	/nfs/dbraw/zinc/62/57/39/342625739.db2.gz	JHBRNYDEDNAXRU-WSQYCBKMSA-N	1	0	274.364	1.583	50	0		CDAARO
CCC(CC)n1nc(C)cc1C(=O)N[C@H]1C[NH2+]C[C@@H]1OC	ZINC000195554113	342625916	/nfs/dbraw/zinc/62/59/16/342625916.db2.gz	CZXYRTUZISPNER-JSGCOSHPSA-N	1	0	294.399	1.269	50	0		CDAARO
CO[C@@H]1CCN(C(=O)COC2CCCCC2)[C@H](C[NH3+])C1	ZINC000195557588	342626775	/nfs/dbraw/zinc/62/67/75/342626775.db2.gz	PWGRXQNIWJDVPK-GXTWGEPZSA-N	1	0	284.400	1.300	50	0		CDAARO
NC(=O)[C@@H](C[NH2+][C@H]1CCCSC1)Cc1ccc(F)cc1	ZINC000195561836	342628499	/nfs/dbraw/zinc/62/84/99/342628499.db2.gz	AVOVMYYDHOHUFD-OCCSQVGLSA-N	1	0	296.411	1.955	50	0		CDAARO
CCc1noc(CC)c1CC(=O)N1CC[NH2+]C[C@H]1C	ZINC000125305242	187178943	/nfs/dbraw/zinc/17/89/43/187178943.db2.gz	HPGQGJIUHVJNKC-SNVBAGLBSA-N	1	0	265.357	1.162	50	0		CDAARO
CCc1noc(CN(C)C(=O)C[C@H]([NH3+])c2ccccc2)n1	ZINC000119082344	342144354	/nfs/dbraw/zinc/14/43/54/342144354.db2.gz	IVTKBBGIBNBXJS-LBPRGKRZSA-N	1	0	288.351	1.681	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1ccc(N2CCCC2)c(F)c1	ZINC000125396944	187183114	/nfs/dbraw/zinc/18/31/14/187183114.db2.gz	GIWXXVDDYBSOLE-LBPRGKRZSA-N	1	0	291.370	1.860	50	0		CDAARO
CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)NO[C@H]1CCCCO1	ZINC000252514923	361855465	/nfs/dbraw/zinc/85/54/65/361855465.db2.gz	FCANMRQJAYKPBQ-STQMWFEESA-N	1	0	285.388	1.426	50	0		CDAARO
Cc1nc(CC[N@@H+](C)C[C@H]2COCCO2)cs1	ZINC000244882577	361867954	/nfs/dbraw/zinc/86/79/54/361867954.db2.gz	XUKRSXCHMCAMBK-LBPRGKRZSA-N	1	0	256.371	1.341	50	0		CDAARO
C[C@H](Cc1ccc(F)cc1)NC(=O)C[NH2+]C[C@H]1CCCO1	ZINC000097229055	342204876	/nfs/dbraw/zinc/20/48/76/342204876.db2.gz	GRUWFDVRQOFPOO-IUODEOHRSA-N	1	0	294.370	1.642	50	0		CDAARO
C[C@@H]([NH2+][C@H]1CCC(=O)N(C)C1)c1cccc(CO)c1	ZINC000097035125	185157518	/nfs/dbraw/zinc/15/75/18/185157518.db2.gz	YIFWYGUIGLDVPA-RISCZKNCSA-N	1	0	262.353	1.450	50	0		CDAARO
NC(=O)[C@H]1CC[N@H+](Cc2nc3cc(F)ccc3o2)C1	ZINC000584907887	539102303	/nfs/dbraw/zinc/10/23/03/539102303.db2.gz	XPIJJZNBDAWEIR-QMMMGPOBSA-N	1	0	263.272	1.274	50	0		CDAARO
COc1ccc(CN2C[C@]3(C)CCC[N@@H+]3C[C@@H]2CO)cc1	ZINC000072233627	342273249	/nfs/dbraw/zinc/27/32/49/342273249.db2.gz	ZUGGYBZWAOHVJU-WBVHZDCISA-N	1	0	290.407	1.726	50	0		CDAARO
CC(C)NS(=O)(=O)CC[NH2+][C@H](C)c1ccccc1	ZINC000173390385	365696126	/nfs/dbraw/zinc/69/61/26/365696126.db2.gz	CJBIORBOAYNJAG-GFCCVEGCSA-N	1	0	270.398	1.665	50	0		CDAARO
CC(C)(C)OC(=O)[C@H]1CCCC[N@@H+]1C[C@H]1CNC(=O)C1	ZINC000585094293	362021209	/nfs/dbraw/zinc/02/12/09/362021209.db2.gz	DPERJHVZHOMMST-VXGBXAGGSA-N	1	0	282.384	1.319	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)CCc1cccc(F)c1F	ZINC000126302796	187231510	/nfs/dbraw/zinc/23/15/10/187231510.db2.gz	IQGNXGRXPCTOCN-JTQLQIEISA-N	1	0	268.307	1.718	50	0		CDAARO
CCOc1c(F)cccc1C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178521775	362242412	/nfs/dbraw/zinc/24/24/12/362242412.db2.gz	UVWPOCOUYRWMNN-JTQLQIEISA-N	1	0	266.316	1.645	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CC[C@H](Nc2ccccc2)C1	ZINC000127900107	187339980	/nfs/dbraw/zinc/33/99/80/187339980.db2.gz	KTACGRJNZSCJIB-UONOGXRCSA-N	1	0	250.342	1.180	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)C[C@@H]2OCCc3ccccc32)C1	ZINC000179017712	362250958	/nfs/dbraw/zinc/25/09/58/362250958.db2.gz	QMQSZZOCLQXWSE-BBRMVZONSA-N	1	0	288.391	1.758	50	0		CDAARO
CSCC(=O)NC[C@@H](c1ccccc1)[NH+](C)C	ZINC000083847683	362255537	/nfs/dbraw/zinc/25/55/37/362255537.db2.gz	LIBXBKFBVQICSA-LBPRGKRZSA-N	1	0	252.383	1.769	50	0		CDAARO
Cc1n[nH]cc1C(=O)N(CC[NH+](C)C)Cc1cccs1	ZINC000084282471	362258933	/nfs/dbraw/zinc/25/89/33/362258933.db2.gz	RAKXOUHPIRSXJS-UHFFFAOYSA-N	1	0	292.408	1.984	50	0		CDAARO
CNC(=O)Cc1cccc(OCC[NH+]2CCCCC2)c1	ZINC000194438812	362356349	/nfs/dbraw/zinc/35/63/49/362356349.db2.gz	SQPMYPPBPUEIDH-UHFFFAOYSA-N	1	0	276.380	1.840	50	0		CDAARO
COc1ccnc(C[N@H+](C)[C@H](C)Cc2cnccn2)c1	ZINC000252482005	362385729	/nfs/dbraw/zinc/38/57/29/362385729.db2.gz	CWQOOUPTQOKBLE-GFCCVEGCSA-N	1	0	272.352	1.943	50	0		CDAARO
C[C@@H]([NH2+]CCS(=O)(=O)c1ccccc1)[C@@H]1CCCO1	ZINC000097108725	185535123	/nfs/dbraw/zinc/53/51/23/185535123.db2.gz	URJHRYJJCKRWBM-OCCSQVGLSA-N	1	0	283.393	1.617	50	0		CDAARO
CC[C@@](C)([NH2+]Cc1ccc(-n2ccnc2)cc1C)C(N)=O	ZINC000192114251	362610612	/nfs/dbraw/zinc/61/06/12/362610612.db2.gz	GWFFIKBNYJORRC-MRXNPFEDSA-N	1	0	286.379	1.924	50	0		CDAARO
C[C@@H](NC(=O)N1CCC[C@@H]1CO)C(C)(C)C[NH+](C)C	ZINC000085424373	179059554	/nfs/dbraw/zinc/05/95/54/179059554.db2.gz	NQDTUKJJCJOACV-VXGBXAGGSA-N	1	0	271.405	1.129	50	0		CDAARO
Cn1ccc(CN2CCO[C@@H](c3ccccc3)C2)cc1=O	ZINC000613407737	347716858	/nfs/dbraw/zinc/71/68/58/347716858.db2.gz	PJNYMCRHABBZND-MRXNPFEDSA-N	1	0	284.359	1.959	50	0		CDAARO
CC(C)C1=NO[C@H](C(=O)N(C)CC[NH+]2CCCC2)C1	ZINC000584896126	349357523	/nfs/dbraw/zinc/35/75/23/349357523.db2.gz	YURIABTYVOELFZ-ZDUSSCGKSA-N	1	0	267.373	1.342	50	0		CDAARO
CC(C)(C[NH2+][C@@H]1CCNC(=O)CC1)N1CCCC1	ZINC000584897078	349357994	/nfs/dbraw/zinc/35/79/94/349357994.db2.gz	DZEYVTNXSDSKHU-LBPRGKRZSA-N	1	0	253.390	1.119	50	0		CDAARO
O=C(CC1CCCC1)NCC[N@H+]1CCC[C@H](CO)C1	ZINC000584884668	349342144	/nfs/dbraw/zinc/34/21/44/349342144.db2.gz	OYMTYQFQYNVDHO-AWEZNQCLSA-N	1	0	268.401	1.387	50	0		CDAARO
Cc1cc(C[NH2+][C@@H](C)CNS(=O)(=O)C2CC2)cnc1C	ZINC000584885403	349343392	/nfs/dbraw/zinc/34/33/92/349343392.db2.gz	LPNQQBSVRQRICK-NSHDSACASA-N	1	0	297.424	1.258	50	0		CDAARO
O=C(CCC(F)(F)F)NCCC[N@H+]1CCC[C@@H](O)C1	ZINC000584887043	349345706	/nfs/dbraw/zinc/34/57/06/349345706.db2.gz	QIYDTUFDQLKLRI-SNVBAGLBSA-N	1	0	282.306	1.292	50	0		CDAARO
CCS(=O)(=O)NC[C@H](C)[NH2+]Cc1cnc(C)c(C)c1	ZINC000584894020	349354042	/nfs/dbraw/zinc/35/40/42/349354042.db2.gz	WBLLICANMDDTJS-NSHDSACASA-N	1	0	285.413	1.116	50	0		CDAARO
CN(CC1(CO)CCCC1)C(=O)C[C@H]1CCCC[N@@H+]1C	ZINC000584897475	349358842	/nfs/dbraw/zinc/35/88/42/349358842.db2.gz	XAPGSEXJTJSPHJ-CQSZACIVSA-N	1	0	282.428	1.872	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](C(=O)NCCC2(O)CCCC2)C1	ZINC000584894734	349355054	/nfs/dbraw/zinc/35/50/54/349355054.db2.gz	AHWJLZYBAUJJBU-AWEZNQCLSA-N	1	0	298.427	1.156	50	0		CDAARO
CC[N@@H+]1CC[C@H](CNC(=O)NCCc2csc(C)n2)C1	ZINC000089977181	179895911	/nfs/dbraw/zinc/89/59/11/179895911.db2.gz	AAFGRDYPELECER-GFCCVEGCSA-N	1	0	296.440	1.635	50	0		CDAARO
COc1ccc([C@H]2CN(C(=O)COC(C)C)C[C@@H]2[NH3+])cc1	ZINC000091321453	180134785	/nfs/dbraw/zinc/13/47/85/180134785.db2.gz	ZJCNDQZQUIHHNE-CABCVRRESA-N	1	0	292.379	1.373	50	0		CDAARO
COC[C@H](O)C[N@H+](C)[C@H](C)C(=O)NC1CCC(C)CC1	ZINC000110621418	350218090	/nfs/dbraw/zinc/21/80/90/350218090.db2.gz	QWCXMQZOFXRKJP-FKZOYECMSA-N	1	0	286.416	1.009	50	0		CDAARO
CCn1nc(CC(C)C)cc1C(=O)NCC[NH+]1CCCC1	ZINC000091643751	180213809	/nfs/dbraw/zinc/21/38/09/180213809.db2.gz	QYJNDPQRUQKSMO-UHFFFAOYSA-N	1	0	292.427	1.927	50	0		CDAARO
COCC[C@]1(CO)CCC[N@H+](CCC(=O)N2CCCC2)C1	ZINC000091656637	180218069	/nfs/dbraw/zinc/21/80/69/180218069.db2.gz	BWRXUTLSMWTXEP-MRXNPFEDSA-N	1	0	298.427	1.110	50	0		CDAARO
CN1CCO[C@H](C[NH2+]Cc2cc(F)ccc2F)C1	ZINC000105471288	186059730	/nfs/dbraw/zinc/05/97/30/186059730.db2.gz	FBEOYDQTPRORCU-GFCCVEGCSA-N	1	0	256.296	1.385	50	0		CDAARO
COc1ccc2c(c1)OC[C@@H](CNC(=O)C(C)(C)[NH3+])C2	ZINC000091943767	180290357	/nfs/dbraw/zinc/29/03/57/180290357.db2.gz	KYQJHDHKUNNORW-SNVBAGLBSA-N	1	0	278.352	1.100	50	0		CDAARO
Cc1cc(CNC(=O)CC[C@@H]2CCC[N@H+](C)C2)n(C)n1	ZINC000091908380	180284863	/nfs/dbraw/zinc/28/48/63/180284863.db2.gz	SDITWYPNWNRDDK-ZDUSSCGKSA-N	1	0	278.400	1.467	50	0		CDAARO
CC1(C)Cc2c(cnn2-c2ccccc2)[C@@H](NC(=O)C[NH3+])C1	ZINC000092002462	180304438	/nfs/dbraw/zinc/30/44/38/180304438.db2.gz	VPYCMYQUARCNQK-AWEZNQCLSA-N	1	0	298.390	1.961	50	0		CDAARO
CC1(C)Cc2c(cnn2-c2ccccc2)[C@H](NC(=O)C[NH3+])C1	ZINC000092002458	180304939	/nfs/dbraw/zinc/30/49/39/180304939.db2.gz	VPYCMYQUARCNQK-CQSZACIVSA-N	1	0	298.390	1.961	50	0		CDAARO
Cn1cc(C[NH+]2CCC(Nc3cccnn3)CC2)cn1	ZINC000105805899	186072948	/nfs/dbraw/zinc/07/29/48/186072948.db2.gz	NCNSFCPBQPPXAO-UHFFFAOYSA-N	1	0	272.356	1.287	50	0		CDAARO
CO[C@H](C)C(=O)N[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C	ZINC000108474658	186219094	/nfs/dbraw/zinc/21/90/94/186219094.db2.gz	KQORFPAOOVBLEK-GZBFAFLISA-N	1	0	276.380	1.658	50	0		CDAARO
C[NH+](C)C1(CNC(=O)Cc2ccccc2O)CCOCC1	ZINC000113991315	186602997	/nfs/dbraw/zinc/60/29/97/186602997.db2.gz	PYBUSISXVWPLGQ-UHFFFAOYSA-N	1	0	292.379	1.162	50	0		CDAARO
C[C@H](NC(=O)c1ccc2nccn2c1)[C@H]1CCCC[NH2+]1	ZINC000583652122	366020120	/nfs/dbraw/zinc/02/01/20/366020120.db2.gz	YXWSPNOUHGWRTJ-WCQYABFASA-N	1	0	272.352	1.595	50	0		CDAARO
CC[C@@H]1CN(C)c2ccccc2C[N@@H+]1C[C@H](O)COC	ZINC000088615025	366074223	/nfs/dbraw/zinc/07/42/23/366074223.db2.gz	KKWUYLCGNDRLEO-CABCVRRESA-N	1	0	278.396	1.724	50	0		CDAARO
CC(C)OCCC(=O)N1CCC([N@@H+]2CCO[C@H](C)C2)CC1	ZINC000124251190	187128931	/nfs/dbraw/zinc/12/89/31/187128931.db2.gz	GAHBQAOUOYKABP-CQSZACIVSA-N	1	0	298.427	1.513	50	0		CDAARO
O=C1NCC[C@@H]1[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000248800087	366149373	/nfs/dbraw/zinc/14/93/73/366149373.db2.gz	ZZTWAMPBWNLWEN-QEJZJMRPSA-N	1	0	274.364	1.632	50	0		CDAARO
CC(C)[NH+](C[C@H](O)CN1C(=O)NC(C)(C)C1=O)C(C)C	ZINC000001268785	355931358	/nfs/dbraw/zinc/93/13/58/355931358.db2.gz	KPHPLRCZTQMMLW-NSHDSACASA-N	1	0	285.388	1.001	50	0		CDAARO
COc1ccc(NC(=S)NCCC[NH+](C)C)cc1	ZINC000002817854	355983252	/nfs/dbraw/zinc/98/32/52/355983252.db2.gz	GHYLIYAPNWFHNT-UHFFFAOYSA-N	1	0	267.398	1.933	50	0		CDAARO
CC(C)c1ccc(OCC(=O)NCC[NH+](C)C)cc1	ZINC000001781561	355952360	/nfs/dbraw/zinc/95/23/60/355952360.db2.gz	AGJXGIUTYLPCEE-UHFFFAOYSA-N	1	0	264.369	1.867	50	0		CDAARO
COc1ccc(OCC(=O)OCC[NH+](C)C)cc1	ZINC000001900192	355954270	/nfs/dbraw/zinc/95/42/70/355954270.db2.gz	GIVPFOGRJAYKRR-UHFFFAOYSA-N	1	0	253.298	1.179	50	0		CDAARO
O=C1C[C@H]([NH2+]CCCCO)C(=O)N1c1ccc(Cl)cc1	ZINC000002192724	355963548	/nfs/dbraw/zinc/96/35/48/355963548.db2.gz	QPFMANWYZAYJAI-LBPRGKRZSA-N	1	0	296.754	1.334	50	0		CDAARO
C[C@H](O)C1CCN(C(=O)[C@H]2[NH2+]CCc3ccccc32)CC1	ZINC000195543395	363459007	/nfs/dbraw/zinc/45/90/07/363459007.db2.gz	LNVOSNSYMLUQSS-LRDDRELGSA-N	1	0	288.391	1.493	50	0		CDAARO
Cc1cccc(CS(=O)(=O)NCCC[NH+]2CCCC2)c1	ZINC000010539153	356260235	/nfs/dbraw/zinc/26/02/35/356260235.db2.gz	KXVDMTMFFQAVID-UHFFFAOYSA-N	1	0	296.436	1.900	50	0		CDAARO
Fc1ccc(-c2ccc(N3CC[NH2+]CC3)nn2)cc1	ZINC000011567984	356275444	/nfs/dbraw/zinc/27/54/44/356275444.db2.gz	TUCHPBXBRKHRJV-UHFFFAOYSA-N	1	0	258.300	1.692	50	0		CDAARO
Cc1ccccc1CS(=O)(=O)NCCC[NH+](C)C	ZINC000013675460	356352868	/nfs/dbraw/zinc/35/28/68/356352868.db2.gz	LUFWXBVQGRCGSM-UHFFFAOYSA-N	1	0	270.398	1.366	50	0		CDAARO
O=S(=O)(Cc1ccccc1)NC1CC[NH+](C2CC2)CC1	ZINC000014102491	356375036	/nfs/dbraw/zinc/37/50/36/356375036.db2.gz	IWTCFDQSWZLJHD-UHFFFAOYSA-N	1	0	294.420	1.733	50	0		CDAARO
C[C@@H](c1nc(N)nc(N(C)C)n1)[NH+]1CCCCCCC1	ZINC000032850926	356394513	/nfs/dbraw/zinc/39/45/13/356394513.db2.gz	PSILLBVYHBFUTF-NSHDSACASA-N	1	0	278.404	1.847	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)NCCc1ccccc1F	ZINC000019507983	356488617	/nfs/dbraw/zinc/48/86/17/356488617.db2.gz	MTXDWBWISNEPFU-UHFFFAOYSA-N	1	0	264.344	1.874	50	0		CDAARO
CN1CC[NH+](C2CCN(C(=O)c3cccs3)CC2)CC1	ZINC000019868135	356511956	/nfs/dbraw/zinc/51/19/56/356511956.db2.gz	LKHBZHSHFLHTGM-UHFFFAOYSA-N	1	0	293.436	1.600	50	0		CDAARO
COCc1ccc(CN2CC[N@H+](C(C)C)[C@@H](CCO)C2)o1	ZINC000019758618	356499873	/nfs/dbraw/zinc/49/98/73/356499873.db2.gz	BUPQBTWHRBCIHK-AWEZNQCLSA-N	1	0	296.411	1.703	50	0		CDAARO
CC/C=C(\C)C[N@@H+]1CCC[C@H](Cn2cc(CO)nn2)C1	ZINC000019761027	356501257	/nfs/dbraw/zinc/50/12/57/356501257.db2.gz	IIONNWVKESBWGY-GUVYXZIWSA-N	1	0	278.400	1.839	50	0		CDAARO
C1=C[C@@H](N2CC[NH+](C[C@H]3CCOC3)CC2)CCC1	ZINC000084137119	356526358	/nfs/dbraw/zinc/52/63/58/356526358.db2.gz	HKJWBGPMOFRXDG-HUUCEWRRSA-N	1	0	250.386	1.749	50	0		CDAARO
O=C(C[NH+]1CCCC1)N[C@H]1COc2ccc(Cl)cc21	ZINC000019928017	356517283	/nfs/dbraw/zinc/51/72/83/356517283.db2.gz	DVTJYGDXWAYTKF-LBPRGKRZSA-N	1	0	280.755	1.986	50	0		CDAARO
O=C(C[NH+]1CCCC1)N[C@@H]1COc2ccc(Cl)cc21	ZINC000019928015	356517848	/nfs/dbraw/zinc/51/78/48/356517848.db2.gz	DVTJYGDXWAYTKF-GFCCVEGCSA-N	1	0	280.755	1.986	50	0		CDAARO
CC(C)(C)CC(C)(C)NC(=O)NC[C@@H]1C[NH2+]CCOC1	ZINC000072156059	356635955	/nfs/dbraw/zinc/63/59/55/356635955.db2.gz	ZREBMEHVHSHLLC-LBPRGKRZSA-N	1	0	285.432	1.736	50	0		CDAARO
CCc1nnc(NC(=O)N2C[C@@H]3CCC[N@@H+]3C[C@H]2C)s1	ZINC000247174748	356715293	/nfs/dbraw/zinc/71/52/93/356715293.db2.gz	VLOMGYUAMHSGNV-ZJUUUORDSA-N	1	0	295.412	1.801	50	0		CDAARO
NNc1cc(N2CCN(c3ccccc3F)CC2)nc[nH+]1	ZINC000033268029	356796977	/nfs/dbraw/zinc/79/69/77/356796977.db2.gz	FYUMMMXKKHGORA-UHFFFAOYSA-N	1	0	288.330	1.228	50	0		CDAARO
O=C(OC[C@@H]1CCC[NH2+]C1)C(Cl)(Cl)Cl	ZINC000042768658	357079654	/nfs/dbraw/zinc/07/96/54/357079654.db2.gz	FBTYVGIYSPRIPD-ZCFIWIBFSA-N	1	0	260.548	1.899	50	0		CDAARO
COC(=O)c1ccccc1NC(=O)[C@H]1CCCC[NH2+]1	ZINC000036135397	357349313	/nfs/dbraw/zinc/34/93/13/357349313.db2.gz	ZQROKTOCCZZEEX-GFCCVEGCSA-N	1	0	262.309	1.554	50	0		CDAARO
C[C@@H](Oc1cccc(F)c1F)C(=O)N1CC[NH2+]CC1	ZINC000062615137	357477738	/nfs/dbraw/zinc/47/77/38/357477738.db2.gz	ISPDEVFDXFELFF-SECBINFHSA-N	1	0	270.279	1.164	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1ccc(C)s1	ZINC000095432142	357516633	/nfs/dbraw/zinc/51/66/33/357516633.db2.gz	BZLWLQCLRAICNE-SECBINFHSA-N	1	0	262.400	1.462	50	0		CDAARO
c1ncn(-c2ccc([C@@H]3[NH2+]CCc4nc[nH]c43)cc2)n1	ZINC000065394164	357536016	/nfs/dbraw/zinc/53/60/16/357536016.db2.gz	IKOFMRMRUHBZOX-ZDUSSCGKSA-N	1	0	266.308	1.226	50	0		CDAARO
CCc1cc(N[C@H]2CCCC[C@@H]2O)nc(N(C)C)[nH+]1	ZINC000065507446	357545904	/nfs/dbraw/zinc/54/59/04/357545904.db2.gz	JDSRTHOXBLBFJV-RYUDHWBXSA-N	1	0	264.373	1.820	50	0		CDAARO
CCCSc1ncc(CN2CCO[C@@H](C[NH3+])C2)cn1	ZINC000067755888	357625461	/nfs/dbraw/zinc/62/54/61/357625461.db2.gz	QEIBYSUXBCJFOA-LBPRGKRZSA-N	1	0	282.413	1.138	50	0		CDAARO
C[C@H](Cn1ccnc1)[NH2+]Cc1ccc2nonc2c1	ZINC000067563161	357612546	/nfs/dbraw/zinc/61/25/46/357612546.db2.gz	QFKLWOVHYMYTJF-SNVBAGLBSA-N	1	0	257.297	1.598	50	0		CDAARO
CC(C)(C)OC(=O)N[C@H]1C[NH2+]C[C@@H]1C(F)(F)F	ZINC000081118716	538889438	/nfs/dbraw/zinc/88/94/38/538889438.db2.gz	TTZLWOFPFKRYBC-BQBZGAKWSA-N	1	0	254.252	1.661	50	0		CDAARO
Nc1nc2c(c(N3CCC4(CCCC4)C3)n1)CC[NH2+]CC2	ZINC000072440818	357836284	/nfs/dbraw/zinc/83/62/84/357836284.db2.gz	DUSQYWXZJDGUCX-UHFFFAOYSA-N	1	0	287.411	1.518	50	0		CDAARO
COC(=O)c1ccc(Cl)c(CN2CCC[C@@H]2C(N)=O)c1	ZINC000097080378	357944109	/nfs/dbraw/zinc/94/41/09/357944109.db2.gz	HVBODJKCPJJJEA-GFCCVEGCSA-N	1	0	296.754	1.576	50	0		CDAARO
COC(=O)c1ccc(Cl)c(CN2CCC[C@H]2C(N)=O)c1	ZINC000097080379	357944308	/nfs/dbraw/zinc/94/43/08/357944308.db2.gz	HVBODJKCPJJJEA-LBPRGKRZSA-N	1	0	296.754	1.576	50	0		CDAARO
CCCN(CCC)C(=O)C[NH2+][C@@H]1CCC[C@]1(C)CO	ZINC000097105301	357967953	/nfs/dbraw/zinc/96/79/53/357967953.db2.gz	GHTNERPXLJXPEW-UKRRQHHQSA-N	1	0	270.417	1.776	50	0		CDAARO
[NH3+]C1(C(=O)Nn2cnc3ccccc32)Cc2ccccc2C1	ZINC000097228923	358043771	/nfs/dbraw/zinc/04/37/71/358043771.db2.gz	QNUWLSRUIQIWTQ-UHFFFAOYSA-N	1	0	292.342	1.603	50	0		CDAARO
O=C(/C=C\c1ccc(-n2ccnc2)cc1)N1CCOCC1	ZINC000098053867	358277501	/nfs/dbraw/zinc/27/75/01/358277501.db2.gz	XTPBGMKFCUGWRZ-UTCJRWHESA-N	1	0	283.331	1.744	50	0		CDAARO
CCN1CCC[C@H]1C[NH2+]CC(=O)NC1CCCCC1	ZINC000020054456	358319183	/nfs/dbraw/zinc/31/91/83/358319183.db2.gz	CFOKNTFHPVLPGY-AWEZNQCLSA-N	1	0	267.417	1.509	50	0		CDAARO
Cc1cc(OC[C@@H](O)C[NH2+][C@H](C)CCO)ccc1Cl	ZINC000020109929	358327482	/nfs/dbraw/zinc/32/74/82/358327482.db2.gz	ZEOGYNAGHYBYCU-NEPJUHHUSA-N	1	0	287.787	1.749	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F)[C@@H]1CC[NH2+]C1	ZINC000247448140	358340486	/nfs/dbraw/zinc/34/04/86/358340486.db2.gz	YRDHOFBTDRPKKO-ADEWGFFLSA-N	1	0	280.318	1.889	50	0		CDAARO
C[N@H+](CCc1ccncc1)Cc1cc(C(N)=O)cs1	ZINC000195562044	358565470	/nfs/dbraw/zinc/56/54/70/358565470.db2.gz	WYPYXPFAAIIAGW-UHFFFAOYSA-N	1	0	275.377	1.917	50	0		CDAARO
C[N@@H+]1CCOC[C@H](CNc2nnc(C3CCC3)o2)C1	ZINC000095363585	358685378	/nfs/dbraw/zinc/68/53/78/358685378.db2.gz	VBKPGZONHBMZFP-SNVBAGLBSA-N	1	0	266.345	1.327	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1C1CN(C(=O)c2cc(C3CC3)n[nH]2)C1	ZINC000095362932	358685742	/nfs/dbraw/zinc/68/57/42/358685742.db2.gz	KYQBLAUDROWPTF-LLVKDONJSA-N	1	0	288.395	1.986	50	0		CDAARO
C[C@H](NC(=O)CCC[NH+]1CCCCC1)c1nnc(N)s1	ZINC000095363552	358685800	/nfs/dbraw/zinc/68/58/00/358685800.db2.gz	FINDFICWXVRBFN-JTQLQIEISA-N	1	0	297.428	1.564	50	0		CDAARO
C[N@@H+]1CCC[C@H](Cn2ncc(N3CCCCC3)cc2=O)C1	ZINC000095366334	358686253	/nfs/dbraw/zinc/68/62/53/358686253.db2.gz	LBYSVVVPLIVWIB-AWEZNQCLSA-N	1	0	290.411	1.575	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)N[C@H](C)CCn2cccn2)CC1	ZINC000095379080	358689559	/nfs/dbraw/zinc/68/95/59/358689559.db2.gz	KZUSRYCRGCBMTE-CQSZACIVSA-N	1	0	292.427	1.898	50	0		CDAARO
CCc1cnc(N(C)C[C@H]2CC[N@H+](CCOC)C2)nc1	ZINC000095388919	358691910	/nfs/dbraw/zinc/69/19/10/358691910.db2.gz	GMJFKIBGKPIQTD-CQSZACIVSA-N	1	0	278.400	1.444	50	0		CDAARO
O=C1CN(C[C@H]2CCOc3ccccc3C2)CCN1	ZINC000095530267	358695798	/nfs/dbraw/zinc/69/57/98/358695798.db2.gz	ZQWPWDTXRPJXCU-LBPRGKRZSA-N	1	0	260.337	1.060	50	0		CDAARO
O[C@H]1C[C@H]2C[N@@H+](Cc3ccccc3Cl)C[C@H]2C[C@@H]1O	ZINC000097295164	358765021	/nfs/dbraw/zinc/76/50/21/358765021.db2.gz	DFPFXOMKNMAPFB-NEBZKDRISA-N	1	0	281.783	1.904	50	0		CDAARO
CNc1ncccc1C(=O)NCC[C@H]1CCC[N@@H+]1C	ZINC000097436939	358776368	/nfs/dbraw/zinc/77/63/68/358776368.db2.gz	SSFDHECXPZHEBM-LLVKDONJSA-N	1	0	262.357	1.337	50	0		CDAARO
c1nc(CN2CCC[N@H+](Cc3cccnc3)CC2)c[nH]1	ZINC000097745131	358796931	/nfs/dbraw/zinc/79/69/31/358796931.db2.gz	GJDIWWUZALNBHB-UHFFFAOYSA-N	1	0	271.368	1.513	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)CCCc1cn[nH]c1	ZINC000097785547	358799209	/nfs/dbraw/zinc/79/92/09/358799209.db2.gz	CRDXRVSIRWSCLK-ZDUSSCGKSA-N	1	0	264.373	1.333	50	0		CDAARO
C[NH+](C)[C@H]1CCN(Cc2cnc(N3CCCC3)s2)C1	ZINC000215059975	358871987	/nfs/dbraw/zinc/87/19/87/358871987.db2.gz	RQLCTSANFNPGLM-LBPRGKRZSA-N	1	0	280.441	1.879	50	0		CDAARO
Cc1nn(C)c2nc(N3C[C@H]4[C@H](C[NH+](C)C)[C@H]4C3)sc12	ZINC000101771625	358861452	/nfs/dbraw/zinc/86/14/52/358861452.db2.gz	PNESLEWACXXAPR-RTCCRHLQSA-N	1	0	291.424	1.582	50	0		CDAARO
COC[C@H]1CC[N@H+](Cc2cc(C(C)=O)cn2C)C1	ZINC000216224654	358932387	/nfs/dbraw/zinc/93/23/87/358932387.db2.gz	OASLGJQPRWMERK-LBPRGKRZSA-N	1	0	250.342	1.696	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1	ZINC000012328143	358999501	/nfs/dbraw/zinc/99/95/01/358999501.db2.gz	FFETVKZOZKCNOY-CYBMUJFWSA-N	1	0	262.353	1.984	50	0		CDAARO
[NH3+]C1CC(c2cc(NCCCc3ncc[nH]3)ncn2)C1	ZINC000220656868	359188410	/nfs/dbraw/zinc/18/84/10/359188410.db2.gz	BBMJFLNRBUOALK-UHFFFAOYSA-N	1	0	272.356	1.449	50	0		CDAARO
Nc1nc(C2CC([NH3+])C2)cc(N2CCc3ccccc3C2)n1	ZINC000223084222	359399728	/nfs/dbraw/zinc/39/97/28/359399728.db2.gz	JMFMWLAXMMOLTB-UHFFFAOYSA-N	1	0	295.390	1.826	50	0		CDAARO
CC(=O)NC(=O)C[N@H+](C)CCCOc1ccccc1	ZINC000408524076	359932049	/nfs/dbraw/zinc/93/20/49/359932049.db2.gz	XKDZEAFDTZIAOB-UHFFFAOYSA-N	1	0	264.325	1.050	50	0		CDAARO
CCCOCCN1CC[N@H+](C)[C@]2(C1)CCC(=O)N(C)CC2	ZINC000230180692	360258390	/nfs/dbraw/zinc/25/83/90/360258390.db2.gz	LNRZZFKCHRBGLS-MRXNPFEDSA-N	1	0	297.443	1.042	50	0		CDAARO
COC[C@@]1(O)CCOC2(CC[NH+](Cc3ccoc3)CC2)C1	ZINC000409420412	360224742	/nfs/dbraw/zinc/22/47/42/360224742.db2.gz	QYJNWPYLDIKWSA-OAHLLOKOSA-N	1	0	295.379	1.802	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@H]1CCCN(C(=O)c2ccnn2C)C1	ZINC000409421166	360230880	/nfs/dbraw/zinc/23/08/80/360230880.db2.gz	TYXYGKIEDWHNLB-ZDUSSCGKSA-N	1	0	287.367	1.711	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)[C@H]2CSc3ccccc32)C1	ZINC000092239197	283565201	/nfs/dbraw/zinc/56/52/01/283565201.db2.gz	KLEBOJXWEVYRFZ-PWSUYJOCSA-N	1	0	262.378	1.826	50	0		CDAARO
Cn1ccnc1-c1cccc(C(=O)NCC2CC[NH2+]CC2)c1	ZINC000426549184	360683224	/nfs/dbraw/zinc/68/32/24/360683224.db2.gz	OSZJEDUXSCPOPI-UHFFFAOYSA-N	1	0	298.390	1.817	50	0		CDAARO
CC[C@H](O)CSc1nnc(C[NH3+])n1-c1ccccc1C	ZINC000426359069	360658896	/nfs/dbraw/zinc/65/88/96/360658896.db2.gz	NHKLLZWQNDMPCS-NSHDSACASA-N	1	0	292.408	1.897	50	0		CDAARO
CCSCCNC(=O)Cn1nccc1[C@@H]1CCC[NH2+]C1	ZINC000426410442	360665757	/nfs/dbraw/zinc/66/57/57/360665757.db2.gz	GTPZPONPDKGUSH-GFCCVEGCSA-N	1	0	296.440	1.219	50	0		CDAARO
Cc1nc(C(F)(F)F)ncc1CN1CC[NH2+]C[C@@H]1C	ZINC000426701591	360697776	/nfs/dbraw/zinc/69/77/76/360697776.db2.gz	KBLFAMZTFJETQF-QMMMGPOBSA-N	1	0	274.290	1.598	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cc(C(C)C)n(C)n2)C1	ZINC000178984926	189159700	/nfs/dbraw/zinc/15/97/00/189159700.db2.gz	ZTEIEIHXCDEDRQ-NSHDSACASA-N	1	0	264.373	1.225	50	0		CDAARO
C[C@H](OCC1CC1)C(=O)N1CCC[C@@H](C)[C@H]1C[NH3+]	ZINC000299738569	200850586	/nfs/dbraw/zinc/85/05/86/200850586.db2.gz	CGJOUPOPMORZRW-NTZNESFSSA-N	1	0	254.374	1.387	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)Nc2ccnn2Cc2ccccc2)C1	ZINC000299771286	200865890	/nfs/dbraw/zinc/86/58/90/200865890.db2.gz	VPOOWPXPXQGAEJ-CYBMUJFWSA-N	1	0	285.351	1.496	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCC(C)(C)[NH3+])c(Cl)c1	ZINC000129646357	361199419	/nfs/dbraw/zinc/19/94/19/361199419.db2.gz	TXBINKZUWRDCKP-UHFFFAOYSA-N	1	0	276.789	1.664	50	0		CDAARO
Cc1ccccc1[C@H](O)CNC(=O)[C@@H]([NH3+])CC(C)C	ZINC000236694923	361359628	/nfs/dbraw/zinc/35/96/28/361359628.db2.gz	JHHWKBFXRVOILL-UONOGXRCSA-N	1	0	264.369	1.518	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@H](C)c1cccc(CO)c1	ZINC000183835605	189369144	/nfs/dbraw/zinc/36/91/44/189369144.db2.gz	CROQFUDJIKZMML-LLVKDONJSA-N	1	0	264.369	1.602	50	0		CDAARO
CC(=O)CSc1nc(C)cc(N2CCOCC2)n1	ZINC000005926452	363912712	/nfs/dbraw/zinc/91/27/12/363912712.db2.gz	KSKADVBGNDETMZ-UHFFFAOYSA-N	1	0	267.354	1.303	50	0		CDAARO
OCC[NH2+]C1CCN(c2nccc(C(F)(F)F)n2)CC1	ZINC000270569380	364657614	/nfs/dbraw/zinc/65/76/14/364657614.db2.gz	OCFADBPNVDSOBX-UHFFFAOYSA-N	1	0	290.289	1.046	50	0		CDAARO
Cc1cn2c(n1)[C@H](C[NH2+]Cc1c[nH]nc1C)CCC2	ZINC000089702108	366913983	/nfs/dbraw/zinc/91/39/83/366913983.db2.gz	FEBBGUYBAJVAFQ-LBPRGKRZSA-N	1	0	259.357	1.890	50	0		CDAARO
Cc1nccn1C[C@@H](C)C[NH+]1CCC2(CC1)OCCO2	ZINC000089735532	366922313	/nfs/dbraw/zinc/92/23/13/366922313.db2.gz	CGIBOHIAVXHNFO-ZDUSSCGKSA-N	1	0	279.384	1.667	50	0		CDAARO
NC(=O)C1(C[NH2+]Cc2cccc(F)c2)CCOCC1	ZINC000089775097	366929022	/nfs/dbraw/zinc/92/90/22/366929022.db2.gz	GXODKAVGDLUSLK-UHFFFAOYSA-N	1	0	266.316	1.197	50	0		CDAARO
O=S1(=O)CCC[C@@H]1C[NH2+]Cc1cccc2cccnc21	ZINC000089808006	366938313	/nfs/dbraw/zinc/93/83/13/366938313.db2.gz	ZBXCENZENRQGME-CQSZACIVSA-N	1	0	290.388	1.902	50	0		CDAARO
CCC(=O)N1CC[C@@H]([NH2+]Cc2ncc[nH]2)[C@@H](CC)C1	ZINC000089948782	366977731	/nfs/dbraw/zinc/97/77/31/366977731.db2.gz	UOVWEDSHSYVXLW-NWDGAFQWSA-N	1	0	264.373	1.536	50	0		CDAARO
Cc1nsc(N2CCC[N@H+](C[C@H]3CCOC3)CC2)n1	ZINC000252511018	367672432	/nfs/dbraw/zinc/67/24/32/367672432.db2.gz	CZKKTBCUVGEEKZ-GFCCVEGCSA-N	1	0	282.413	1.395	50	0		CDAARO
Cc1cnc(SCCCN2CC[NH+](C)CC2)nc1	ZINC000130637200	368066339	/nfs/dbraw/zinc/06/63/39/368066339.db2.gz	LTPHNUNSDAAELF-UHFFFAOYSA-N	1	0	266.414	1.515	50	0		CDAARO
C[C@@H]([NH2+]C[C@@H]1CN(C)CCN1C)c1ccccc1N(C)C	ZINC000093945021	296130030	/nfs/dbraw/zinc/13/00/30/296130030.db2.gz	YMQXQUKAMNASFG-HUUCEWRRSA-N	1	0	290.455	1.649	50	0		CDAARO
COC[C@@H]1[C@H](C(=O)Nc2ccc(OC)nc2)CCC[N@@H+]1C	ZINC000575557932	369134781	/nfs/dbraw/zinc/13/47/81/369134781.db2.gz	KXRNPEZIYYIGMW-CHWSQXEVSA-N	1	0	293.367	1.386	50	0		CDAARO
CCCn1cnnc1[C@H](C)NC(=O)C(C)(C)[NH+]1CCCC1	ZINC000426641538	284132345	/nfs/dbraw/zinc/13/23/45/284132345.db2.gz	NABRRZZFLZEHDN-LBPRGKRZSA-N	1	0	293.415	1.740	50	0		CDAARO
COc1nnc(NC(=O)N2C[C@H]3CCC[N@@H+]3C[C@@H]2C)s1	ZINC000276557538	193379978	/nfs/dbraw/zinc/37/99/78/193379978.db2.gz	PBRNOIJIFIGOPT-DTWKUNHWSA-N	1	0	297.384	1.247	50	0		CDAARO
c1cnc(CN2CCCC[C@@H]2CN2CCOCC2)nc1	ZINC000192047724	371792971	/nfs/dbraw/zinc/79/29/71/371792971.db2.gz	UYAYLJFGTCDGBI-CQSZACIVSA-N	1	0	276.384	1.163	50	0		CDAARO
CC(C)[NH+]1CCC(CCNC(=O)c2cncnc2)CC1	ZINC000299790087	372764259	/nfs/dbraw/zinc/76/42/59/372764259.db2.gz	APAWTSZQGUDPOB-UHFFFAOYSA-N	1	0	276.384	1.717	50	0		CDAARO
[NH3+][C@@H](CC(=O)NCc1ccccn1)c1ccc(F)cc1	ZINC000299803846	372772407	/nfs/dbraw/zinc/77/24/07/372772407.db2.gz	HEWCNLMOBFXOCD-AWEZNQCLSA-N	1	0	273.311	1.927	50	0		CDAARO
COc1cc2c(cc1CN1CC[N@H+](C)[C@H](CO)C1)CCC2	ZINC000225332051	373040091	/nfs/dbraw/zinc/04/00/91/373040091.db2.gz	CEBLAKLSOSYIJT-INIZCTEOSA-N	1	0	290.407	1.292	50	0		CDAARO
C[C@H](C(=O)NC[C@H](C)[S@](C)=O)N1[C@H](C)CC[C@@H]1C	ZINC000108131393	412812356	/nfs/dbraw/zinc/81/23/56/412812356.db2.gz	ZBPSOYDPUNBFPC-AABULAENSA-N	1	0	274.430	1.131	50	0		CDAARO
OCCCCN(CC1=CSC2=NCCCN12)C1CC1	ZINC000102733294	373713098	/nfs/dbraw/zinc/71/30/98/373713098.db2.gz	BHIRZPIKZDFKCO-UHFFFAOYSA-N	1	0	281.425	1.873	50	0		CDAARO
COc1ccc(C[NH2+]CC2(O)CCOCC2)cc1	ZINC000112717021	374227507	/nfs/dbraw/zinc/22/75/07/374227507.db2.gz	ORFPTULDTRKQGE-UHFFFAOYSA-N	1	0	251.326	1.326	50	0		CDAARO
COCC(=O)NC(C)(C)C[N@H+](C)Cc1ccccc1	ZINC000095436471	374937522	/nfs/dbraw/zinc/93/75/22/374937522.db2.gz	JCCJDFIHTLKOTD-UHFFFAOYSA-N	1	0	264.369	1.660	50	0		CDAARO
CC[NH+](CC)CCCNC(=O)N1CCOCC[C@H]1C	ZINC000095985090	375048279	/nfs/dbraw/zinc/04/82/79/375048279.db2.gz	UPMWRLPBKBBEFB-CYBMUJFWSA-N	1	0	271.405	1.539	50	0		CDAARO
C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)N1C(=O)[C@H]1CC[NH2+]C1	ZINC000299739579	375199292	/nfs/dbraw/zinc/19/92/92/375199292.db2.gz	QHYBCUIODLFKTP-VRKREXBASA-N	1	0	288.391	1.973	50	0		CDAARO
O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)C1CC1	ZINC000032247880	375921832	/nfs/dbraw/zinc/92/18/32/375921832.db2.gz	HEBDRGFKYPHGHS-OAHLLOKOSA-N	1	0	274.364	1.414	50	0		CDAARO
COc1ccc(CCN2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)cc1	ZINC000242324447	376021996	/nfs/dbraw/zinc/02/19/96/376021996.db2.gz	ZBIXTVOIBJNZMX-GJZGRUSLSA-N	1	0	292.423	1.625	50	0		CDAARO
CCCC[NH2+][C@@H]1CC(=O)N(c2ccc(OC)cc2)C1=O	ZINC000001826468	376085529	/nfs/dbraw/zinc/08/55/29/376085529.db2.gz	YOFIMPRZPGRQAZ-CYBMUJFWSA-N	1	0	276.336	1.717	50	0		CDAARO
CNc1nc(-c2cccc3c2O[C@H](C[NH3+])C3)ncc1F	ZINC000067539907	377141793	/nfs/dbraw/zinc/14/17/93/377141793.db2.gz	DJDKPJTZZAKUAB-VIFPVBQESA-N	1	0	274.299	1.587	50	0		CDAARO
O=C(Cc1cccc(O)c1)N1CCC[C@@]2(CC[NH2+]C2)C1	ZINC000067688544	377208366	/nfs/dbraw/zinc/20/83/66/377208366.db2.gz	MMFGKLINSGMCJX-INIZCTEOSA-N	1	0	274.364	1.537	50	0		CDAARO
O=C(Nn1cnc2ccccc21)C12CCC[NH+]1CCC2	ZINC000278592395	194059714	/nfs/dbraw/zinc/05/97/14/194059714.db2.gz	KNQMZIXQIZPGPQ-UHFFFAOYSA-N	1	0	270.336	1.735	50	0		CDAARO
COc1ccc([C@H](O)C[NH2+]C2CCOCC2)cc1	ZINC000037893118	184543646	/nfs/dbraw/zinc/54/36/46/184543646.db2.gz	CPTHSBQFSSENCA-CQSZACIVSA-N	1	0	251.326	1.497	50	0		CDAARO
COc1ccc(C(=O)NCC2CC[NH+](C)CC2)cc1	ZINC000023013380	262351693	/nfs/dbraw/zinc/35/16/93/262351693.db2.gz	XESCVDDPBRMMDD-UHFFFAOYSA-N	1	0	262.353	1.767	50	0		CDAARO
c1ccc(Cc2noc(CN3CC[NH2+]CC3)n2)cc1	ZINC000020282425	171132760	/nfs/dbraw/zinc/13/27/60/171132760.db2.gz	YYLIPKWIQNAZBH-UHFFFAOYSA-N	1	0	258.325	1.066	50	0		CDAARO
COc1cc(C(=O)N[C@@H]2CC[NH2+]C[C@H]2C)ccc1C	ZINC000094345029	184785865	/nfs/dbraw/zinc/78/58/65/184785865.db2.gz	ABCBDASMFUUMIT-DGCLKSJQSA-N	1	0	262.353	1.731	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@@H]1NC(=O)Cc1cccc(F)c1F	ZINC000094712187	184845998	/nfs/dbraw/zinc/84/59/98/184845998.db2.gz	HGNDBGXPLWRIFQ-SKDRFNHKSA-N	1	0	268.307	1.764	50	0		CDAARO
[NH3+][C@H]1CS(=O)(=O)Cc2ccc(Br)cc21	ZINC000012957350	390206670	/nfs/dbraw/zinc/20/66/70/390206670.db2.gz	PULIRAMXTGWLKW-VIFPVBQESA-N	1	0	276.155	1.377	50	0		CDAARO
CC[C@H](O)[C@H]1CCCC[N@@H+]1C[C@H](O)CN1CCC(C)CC1	ZINC000096424715	390516263	/nfs/dbraw/zinc/51/62/63/390516263.db2.gz	VOJUROBBYILNPW-ZACQAIPSSA-N	1	0	298.471	1.705	50	0		CDAARO
CCC1(CC)C(=O)NN(C2CC[NH+](C)CC2)C1=O	ZINC000071772675	390618853	/nfs/dbraw/zinc/61/88/53/390618853.db2.gz	YZDYYFMJUJPADV-UHFFFAOYSA-N	1	0	253.346	1.601	50	0		CDAARO
CCOC(=O)[C@@]12CC[NH2+][C@@H]1CCN2C(=O)OC(C)(C)C	ZINC000095707241	390911351	/nfs/dbraw/zinc/91/13/51/390911351.db2.gz	QLPXWVCIJGAGHW-QMTHXVAHSA-N	1	0	284.356	1.291	50	0		CDAARO
OC[C@@]1(O)CC[N@H+](Cc2cc3ccccc3s2)C1	ZINC000215574676	390995576	/nfs/dbraw/zinc/99/55/76/390995576.db2.gz	PIBZQBOXYFKAIK-CQSZACIVSA-N	1	0	263.362	1.830	50	0		CDAARO
O=C(N1CCC[C@@H](C2CC[NH2+]CC2)C1)C(F)(F)F	ZINC000390822121	391670943	/nfs/dbraw/zinc/67/09/43/391670943.db2.gz	GUNMZMXOTPEPKA-SNVBAGLBSA-N	1	0	264.291	1.787	50	0		CDAARO
COc1ccc(F)cc1CN1CC[N@H+](C[C@H](C)O)[C@@H](C)C1	ZINC000252475382	131135574	/nfs/dbraw/zinc/13/55/74/131135574.db2.gz	ZLZAZFBPLBOJRB-STQMWFEESA-N	1	0	296.386	1.721	50	0		CDAARO
C[C@@H]1C[C@H](C)C[N@H+]([C@H](C(=O)NC(N)=O)c2ccccc2)C1	ZINC000036312349	392433848	/nfs/dbraw/zinc/43/38/48/392433848.db2.gz	IKYGGGSLPZBIAC-SCRDCRAPSA-N	1	0	289.379	1.901	50	0		CDAARO
c1ccc([C@H]2CN(c3ncnc4c3CC[NH2+]C4)CCO2)cc1	ZINC000067921886	285493203	/nfs/dbraw/zinc/49/32/03/285493203.db2.gz	NTUAFVWJSAGSPK-MRXNPFEDSA-N	1	0	296.374	1.700	50	0		CDAARO
COC[C@@H](O)C[N@@H+]1CCc2cc(F)ccc2[C@@H]1C	ZINC000096415720	393183759	/nfs/dbraw/zinc/18/37/59/393183759.db2.gz	ITYQGQXFTMSJIG-GWCFXTLKSA-N	1	0	253.317	1.752	50	0		CDAARO
CC[C@H](O)CN1C[C@H](CC)[N@H+](CC(C)(C)O)C[C@H]1CC	ZINC000252500410	393382108	/nfs/dbraw/zinc/38/21/08/393382108.db2.gz	SVBXLJRYOZVQCU-ILXRZTDVSA-N	1	0	286.460	1.703	50	0		CDAARO
CC[N@H+](C)[C@@H](C)C(=O)Nc1ccc2c(c1)OCO2	ZINC000084760795	483324497	/nfs/dbraw/zinc/32/44/97/483324497.db2.gz	JSZCVJKTFKDMNQ-VIFPVBQESA-N	1	0	250.298	1.694	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)C1	ZINC000178593032	148068042	/nfs/dbraw/zinc/06/80/42/148068042.db2.gz	HMCSCYBYYWSGLP-LBPRGKRZSA-N	1	0	297.358	1.667	50	0		CDAARO
Cc1cc(C)c(S(=O)(=O)NCCC[NH+](C)C)c(C)c1	ZINC000002743232	169824415	/nfs/dbraw/zinc/82/44/15/169824415.db2.gz	SEBQJCFLWSXNGP-UHFFFAOYSA-N	1	0	284.425	1.842	50	0		CDAARO
Cc1cccc(OCCOCC[NH2+]CCO)c1C	ZINC000002981154	169846901	/nfs/dbraw/zinc/84/69/01/169846901.db2.gz	CADRWUYVXMNBQE-UHFFFAOYSA-N	1	0	253.342	1.281	50	0		CDAARO
OC[C@H]1CC[N@@H+](C2CCN(Cc3ccccc3)CC2)C1	ZINC000008729986	170350840	/nfs/dbraw/zinc/35/08/40/170350840.db2.gz	HGUHOOSPLSCJEM-INIZCTEOSA-N	1	0	274.408	1.965	50	0		CDAARO
[NH3+]C1CCN(C[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000011729524	170434234	/nfs/dbraw/zinc/43/42/34/170434234.db2.gz	HRBIZTJAMVKWIO-ZDUSSCGKSA-N	1	0	254.761	1.797	50	0		CDAARO
O=C(c1ccc(Br)cc1)N1CC[NH2+]CC1	ZINC000019679876	170838172	/nfs/dbraw/zinc/83/81/72/170838172.db2.gz	WLJZWLGUPJDGIL-UHFFFAOYSA-N	1	0	269.142	1.495	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC[C@H]([NH3+])C2)cc1C	ZINC000020432301	171197576	/nfs/dbraw/zinc/19/75/76/171197576.db2.gz	FTUVTSVREIPFDV-LBPRGKRZSA-N	1	0	268.382	1.415	50	0		CDAARO
C[N@@H+](Cc1cccc(-c2cn[nH]c2)c1)C[C@@H]1COCCO1	ZINC000020598716	171266482	/nfs/dbraw/zinc/26/64/82/171266482.db2.gz	AKJYMCSXTJYACP-MRXNPFEDSA-N	1	0	287.363	1.924	50	0		CDAARO
Cc1nc2sccn2c1CN1CC[N@@H+](C)[C@@H](CCO)C1	ZINC000020906370	171278826	/nfs/dbraw/zinc/27/88/26/171278826.db2.gz	VSQXXEXWWVJIPA-LBPRGKRZSA-N	1	0	294.424	1.203	50	0		CDAARO
CC(=O)c1c(C)[nH]c(C(=O)NC2CC[NH+](C)CC2)c1C	ZINC000021441785	171304076	/nfs/dbraw/zinc/30/40/76/171304076.db2.gz	XLIRNMJCHPUNKM-UHFFFAOYSA-N	1	0	277.368	1.658	50	0		CDAARO
CCOc1cc(CN2CC[NH+](C)CC2)ccc1OC	ZINC000022591436	171393121	/nfs/dbraw/zinc/39/31/21/171393121.db2.gz	SKPKQDRUYSZWEP-UHFFFAOYSA-N	1	0	264.369	1.841	50	0		CDAARO
Cc1ccc(Cl)cc1S(=O)(=O)N1CCC[C@@H]([NH3+])C1	ZINC000036297053	172590259	/nfs/dbraw/zinc/59/02/59/172590259.db2.gz	QPNGJBIMROAXGM-LLVKDONJSA-N	1	0	288.800	1.760	50	0		CDAARO
O=C([C@@H]1C[C@H](O)C[NH2+]1)N1CCC(c2ccccc2)CC1	ZINC000037804556	173744444	/nfs/dbraw/zinc/74/44/44/173744444.db2.gz	QYCAPEGBMQZOHB-GJZGRUSLSA-N	1	0	274.364	1.115	50	0		CDAARO
Ic1cnn(C2CC[NH2+]CC2)c1	ZINC000067802391	175793037	/nfs/dbraw/zinc/79/30/37/175793037.db2.gz	GYYVRUODGBPRHC-UHFFFAOYSA-N	1	0	277.109	1.412	50	0		CDAARO
Cc1ccc(NC(C)(C)C(=O)N2CC[C@H](C[NH3+])C2)cc1	ZINC000071416065	176160317	/nfs/dbraw/zinc/16/03/17/176160317.db2.gz	ILOYQKLXGMBJBM-CYBMUJFWSA-N	1	0	275.396	1.993	50	0		CDAARO
Cc1cccnc1C[NH+]1CCC(N2CCCC2=O)CC1	ZINC000071613978	176233589	/nfs/dbraw/zinc/23/35/89/176233589.db2.gz	QHQUGUVEMQPKDI-UHFFFAOYSA-N	1	0	273.380	1.977	50	0		CDAARO
CC(C)([NH3+])C(=O)N1CCO[C@@H](CCCc2ccccc2)C1	ZINC000071745822	176258122	/nfs/dbraw/zinc/25/81/22/176258122.db2.gz	FSKIUJYWJMSYKW-HNNXBMFYSA-N	1	0	290.407	1.974	50	0		CDAARO
CC(C)C[N@@H+]1CCN(Cc2ccccn2)C[C@@H]1CCO	ZINC000071763593	176262008	/nfs/dbraw/zinc/26/20/08/176262008.db2.gz	XQFSTZIQNICWPL-INIZCTEOSA-N	1	0	277.412	1.606	50	0		CDAARO
O=C(OCc1ccccc1)N1CC[C@@H]([NH2+]C2COC2)C1	ZINC000071792068	176263497	/nfs/dbraw/zinc/26/34/97/176263497.db2.gz	ZLFLPXLSIFBWSV-CYBMUJFWSA-N	1	0	276.336	1.386	50	0		CDAARO
CCCc1cc(NC[C@H]2C[NH2+]CCOC2)nc(C)n1	ZINC000072130637	176321270	/nfs/dbraw/zinc/32/12/70/176321270.db2.gz	FCOIJBIDKMPSPY-GFCCVEGCSA-N	1	0	264.373	1.385	50	0		CDAARO
OC[C@]1(O)CCC[N@H+](Cc2cc(-c3ccccn3)no2)C1	ZINC000072145454	176324818	/nfs/dbraw/zinc/32/48/18/176324818.db2.gz	RHNASZOIFOBRHY-HNNXBMFYSA-N	1	0	289.335	1.056	50	0		CDAARO
O=C(NCc1ncc[nH]1)c1ccccc1[C@@H]1CC[NH2+]C1	ZINC000072157628	176329276	/nfs/dbraw/zinc/32/92/76/176329276.db2.gz	LSRDZABNYZTHPH-LLVKDONJSA-N	1	0	270.336	1.417	50	0		CDAARO
Nc1cc[nH+]c(-c2cc(NCCO)nc3[nH]ccc32)c1	ZINC000072157623	176329385	/nfs/dbraw/zinc/32/93/85/176329385.db2.gz	KTGFGZDCDXMYMD-UHFFFAOYSA-N	1	0	269.308	1.611	50	0		CDAARO
O=S(=O)(NCC[C@H]1CC[NH2+]C1)c1ccccc1Cl	ZINC000110797203	227224593	/nfs/dbraw/zinc/22/45/93/227224593.db2.gz	SMRZLEQOAUBTCD-SNVBAGLBSA-N	1	0	288.800	1.618	50	0		CDAARO
c1c(-c2nc(C3CC3)no2)nnn1[C@H]1CCC[NH2+]C1	ZINC000096516262	261528261	/nfs/dbraw/zinc/52/82/61/261528261.db2.gz	WSWMHIZUHBYBHJ-VIFPVBQESA-N	1	0	260.301	1.130	50	0		CDAARO
CCOC(=O)C(C#N)=C1NC=C(c2ccccc2)C=[NH+]1	ZINC000002469012	263763762	/nfs/dbraw/zinc/76/37/62/263763762.db2.gz	FVFMNHLVPBWKLW-BUHFOSPRSA-N	1	0	267.288	2.000	50	0		CDAARO
C[C@@H]1CN(c2cc(-n3cccn3)nc(N)[nH+]2)C[C@@H](C)S1	ZINC000092917614	274360629	/nfs/dbraw/zinc/36/06/29/274360629.db2.gz	HADOLUXIXBORNO-NXEZZACHSA-N	1	0	290.396	1.575	50	0		CDAARO
Nc1ccc2c(c1)CCC[C@@H]2NC(=O)[C@H]1CC[C@H]([NH3+])C1	ZINC000263097171	274964831	/nfs/dbraw/zinc/96/48/31/274964831.db2.gz	NRZSMYVWLJKDBD-HUBLWGQQSA-N	1	0	273.380	1.890	50	0		CDAARO
O=C1N(CCCF)c2ccccc2NC12CC[NH2+]CC2	ZINC000085534015	275021380	/nfs/dbraw/zinc/02/13/80/275021380.db2.gz	MCZRCLDKMWEQNO-UHFFFAOYSA-N	1	0	277.343	1.927	50	0		CDAARO
c1cnn(Cc2ccccc2[C@H]2[NH2+]CCc3nc[nH]c32)c1	ZINC000065409507	275074335	/nfs/dbraw/zinc/07/43/35/275074335.db2.gz	PDMSTCKGCOTDJV-OAHLLOKOSA-N	1	0	279.347	1.890	50	0		CDAARO
Brc1cccc(O[C@H]2CCC[NH2+]C2)n1	ZINC000040434950	275373433	/nfs/dbraw/zinc/37/34/33/275373433.db2.gz	AQFZXAYKITWKCY-QMMMGPOBSA-N	1	0	257.131	1.975	50	0		CDAARO
CC(=O)Nc1ccc(OC[C@H](O)C[NH+]2CCCCC2)cc1	ZINC000000816539	277080824	/nfs/dbraw/zinc/08/08/24/277080824.db2.gz	MYRQKKRFNHLSRI-OAHLLOKOSA-N	1	0	292.379	1.871	50	0		CDAARO
COC(=O)[C@@H]1[C@@H]2CCC[N@@H+]2C[C@]12c1ccccc1NC2=O	ZINC000012296505	277373199	/nfs/dbraw/zinc/37/31/99/277373199.db2.gz	SACUHBGXWYEFEY-XEZPLFJOSA-N	1	0	286.331	1.144	50	0	biogenic	CDAARO
C[C@H](N1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)C(F)(F)F	ZINC000119310391	278232509	/nfs/dbraw/zinc/23/25/09/278232509.db2.gz	HEFQBLKYQXOKIC-SRVKXCTJSA-N	1	0	280.334	1.858	50	0		CDAARO
CC(C)(C)OC(=O)N1CCOC[C@]2(CCC[NH2+]C2)C1	ZINC000091303586	278403041	/nfs/dbraw/zinc/40/30/41/278403041.db2.gz	IRHPGRTVYQUDSJ-AWEZNQCLSA-N	1	0	270.373	1.624	50	0		CDAARO
C[C@@H]1C(=O)OC[C@@H]1C(=O)N1CCC[C@@H](C[NH+]2CCCC2)C1	ZINC000020727267	278436211	/nfs/dbraw/zinc/43/62/11/278436211.db2.gz	RADYVFJDGDWEBN-IHRRRGAJSA-N	1	0	294.395	1.130	50	0		CDAARO
CC(C)C[C@@H]([NH2+]CCS(C)(=O)=O)c1ccccn1	ZINC000096476765	279001874	/nfs/dbraw/zinc/00/18/74/279001874.db2.gz	VCMXOAXUCRFQFA-CYBMUJFWSA-N	1	0	270.398	1.803	50	0		CDAARO
Cc1nn2c(nc(C)cc2N[C@H]2CCC[NH2+]C2)c1C	ZINC000072430615	279217795	/nfs/dbraw/zinc/21/77/95/279217795.db2.gz	UJUYGCGJPBZFAL-LBPRGKRZSA-N	1	0	259.357	1.818	50	0		CDAARO
CCS(=O)(=O)NCC[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C	ZINC000097108739	280026169	/nfs/dbraw/zinc/02/61/69/280026169.db2.gz	OGXCHLIVQXYDQI-GRYCIOLGSA-N	1	0	262.419	1.340	50	0		CDAARO
CO[C@H](C)CS(=O)(=O)N[C@@H](C)C[NH+]1CCCCCC1	ZINC000195459980	294295561	/nfs/dbraw/zinc/29/55/61/294295561.db2.gz	WPUIUKMKEUJBBT-QWHCGFSZSA-N	1	0	292.445	1.205	50	0		CDAARO
NC(=O)[C@H]1CCCN1C1CC[NH+](CC2CCC2)CC1	ZINC000095981751	295151721	/nfs/dbraw/zinc/15/17/21/295151721.db2.gz	HVDZGBRRFCXTJC-CQSZACIVSA-N	1	0	265.401	1.201	50	0		CDAARO
CC(C)[C@H](CNC(=O)c1ccc(O)c(F)c1)[NH+](C)C	ZINC000534577367	328310347	/nfs/dbraw/zinc/31/03/47/328310347.db2.gz	FWNHPSRNZCLUKT-LBPRGKRZSA-N	1	0	268.332	1.847	50	0		CDAARO
COc1ccccc1C1CCN(C(=O)[C@H]2C=CC[NH2+]2)CC1	ZINC000534580390	328311634	/nfs/dbraw/zinc/31/16/34/328311634.db2.gz	DRVKUGPOVBFSMV-OAHLLOKOSA-N	1	0	286.375	1.929	50	0		CDAARO
CCN(Cc1cnn(CC)c1)C(=O)NC[C@@H](C)[NH+](C)C	ZINC000534584238	328311914	/nfs/dbraw/zinc/31/19/14/328311914.db2.gz	SMKOHKDPUUGQDQ-GFCCVEGCSA-N	1	0	281.404	1.385	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]C2CC[NH+](CC(=O)[O-])CC2)n1	ZINC000534647252	328342772	/nfs/dbraw/zinc/34/27/72/328342772.db2.gz	YUTUTSGWXBRUFF-GFCCVEGCSA-N	1	0	294.399	1.027	50	0		CDAARO
CCc1nnc(CNC(=O)C[NH+]2CCCCCCC2)o1	ZINC000534660433	328339189	/nfs/dbraw/zinc/33/91/89/328339189.db2.gz	ATQFUVHDRKSYBQ-UHFFFAOYSA-N	1	0	280.372	1.514	50	0		CDAARO
CCOC[C@H](O)C[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1	ZINC000096489086	323207489	/nfs/dbraw/zinc/20/74/89/323207489.db2.gz	DIIJGYMCKOAPRN-BFHYXJOUSA-N	1	0	267.373	1.163	50	0		CDAARO
C[C@@H]1C[C@@H](C)C[NH+](CC(=O)Nc2ccc(C(N)=O)cc2)C1	ZINC000007811627	326822078	/nfs/dbraw/zinc/82/20/78/326822078.db2.gz	XOZPKJRIOBNNHI-VXGBXAGGSA-N	1	0	289.379	1.702	50	0		CDAARO
C[C@H]1OCC[C@@H]1[NH2+]Cc1ccnc(OCC(F)F)c1	ZINC000091411391	482564561	/nfs/dbraw/zinc/56/45/61/482564561.db2.gz	UABMYZZZDSPKFA-KOLCDFICSA-N	1	0	272.295	1.993	50	0		CDAARO
CCC(CC)[NH2+]CCNc1cc(C)nc(COC)n1	ZINC000585092116	482826904	/nfs/dbraw/zinc/82/69/04/482826904.db2.gz	GBQOJTRILBVCIX-UHFFFAOYSA-N	1	0	266.389	1.543	50	0		CDAARO
COc1cccc(C[N@H+](C)CC[C@H]2CCS(=O)(=O)C2)c1	ZINC000670445461	482992845	/nfs/dbraw/zinc/99/28/45/482992845.db2.gz	LMWXSZJJKHKZJR-ZDUSSCGKSA-N	1	0	297.420	1.952	50	0		CDAARO
O=C(c1ccc(Cl)cn1)N1C[C@H](O)[C@@H]([NH+]2CCCC2)C1	ZINC000670452147	483014122	/nfs/dbraw/zinc/01/41/22/483014122.db2.gz	GHMOSCMEYZSUKN-STQMWFEESA-N	1	0	295.770	1.016	50	0		CDAARO
Cc1nncn1CC[N@@H+]1CC[C@@H](O)CC(C)(C)C1	ZINC000670456071	483032703	/nfs/dbraw/zinc/03/27/03/483032703.db2.gz	XHTKIKMAESTZCX-GFCCVEGCSA-N	1	0	252.362	1.069	50	0		CDAARO
Cc1ccoc1C(=O)NCC[N@@H+]1CCCC[C@@H]1CO	ZINC000670459793	483043667	/nfs/dbraw/zinc/04/36/67/483043667.db2.gz	PQVGUGPSGMSWCY-GFCCVEGCSA-N	1	0	266.341	1.165	50	0		CDAARO
COCCCCCN1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1	ZINC000083877877	483216033	/nfs/dbraw/zinc/21/60/33/483216033.db2.gz	MUFPQOBJDLKDNE-HNNXBMFYSA-N	1	0	297.443	1.042	50	0		CDAARO
Cc1ccc(CNC(=O)C[N@H+]2[C@H](C)C[C@@H](O)C[C@@H]2C)cc1	ZINC000242324307	524504753	/nfs/dbraw/zinc/50/47/53/524504753.db2.gz	YZXADBZBRUTTRE-MIFYACCESA-N	1	0	290.407	1.845	50	0		CDAARO
COc1ccccc1S(=O)(=O)N[C@H]1CCC[C@H]1C[NH3+]	ZINC000089091802	524706846	/nfs/dbraw/zinc/70/68/46/524706846.db2.gz	LGWWXCIFHKYCNG-QWRGUYRKSA-N	1	0	284.381	1.101	50	0		CDAARO
[NH3+][C@@H]1CCCC[C@H]1NC(=O)c1ncncc1Cl	ZINC000178467989	527343993	/nfs/dbraw/zinc/34/39/93/527343993.db2.gz	DIYVCFWAWWLPIB-RKDXNWHRSA-N	1	0	254.721	1.130	50	0		CDAARO
CCOC(=O)C(=O)OC[C@@H]1CCC[N@@H+]2CCCC[C@H]12	ZINC000004061345	528547035	/nfs/dbraw/zinc/54/70/35/528547035.db2.gz	QYUVRIIBUXNAHI-NWDGAFQWSA-N	1	0	269.341	1.357	50	0	biogenic	CDAARO
CC[NH+]1CCN([C@@H](C)CNc2nc(C)cc(C)n2)CC1	ZINC000096453473	529150943	/nfs/dbraw/zinc/15/09/43/529150943.db2.gz	XIKKUULYBQSMSL-AWEZNQCLSA-N	1	0	277.416	1.531	50	0		CDAARO
CCO[C@@H]1C[C@@](CO)([NH2+]Cc2ncc[nH]2)C1(C)C	ZINC000186583567	535438912	/nfs/dbraw/zinc/43/89/12/535438912.db2.gz	XJKFTNOEEXPJMY-MFKMUULPSA-N	1	0	253.346	1.065	50	0		CDAARO
Cc1ccc(CNC(=O)COC2CC[NH2+]CC2)s1	ZINC000111758486	538162675	/nfs/dbraw/zinc/16/26/75/538162675.db2.gz	YKYDVGITMQEHPR-UHFFFAOYSA-N	1	0	268.382	1.441	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]CCCN1CCCCCC1=O	ZINC000097159379	567905126	/nfs/dbraw/zinc/90/51/26/567905126.db2.gz	XCFIPKIVOMZVTA-UHFFFAOYSA-N	1	0	264.373	1.600	50	0		CDAARO
COC(=O)CCCC(=O)N1CCC[N@@H+](C(C)C)CC1	ZINC000097141969	567905155	/nfs/dbraw/zinc/90/51/55/567905155.db2.gz	GRLHHWBCBUTBGX-UHFFFAOYSA-N	1	0	270.373	1.272	50	0		CDAARO
O=c1c2cc(F)c(F)cc2ncn1[C@@H]1CCC[NH2+]C1	ZINC000757178348	577033626	/nfs/dbraw/zinc/03/36/26/577033626.db2.gz	UIVJLSISBYBELC-MRVPVSSYSA-N	1	0	265.263	1.599	50	0		CDAARO
CN(Cc1ccccn1)C(=O)CSCC[NH+]1CCCC1	ZINC001704348999	1177697382	/nfs/dbraw/zinc/69/73/82/1177697382.db2.gz	IESZKISGWKFLQV-UHFFFAOYSA-N	1	0	293.436	1.869	50	0		CDAARO
CCS(=O)(=O)c1cccc(-c2nc3c([nH]2)C[NH2+]CC3)c1	ZINC000095369649	752072963	/nfs/dbraw/zinc/07/29/63/752072963.db2.gz	HPHDSLCYVOVIRS-UHFFFAOYSA-N	1	0	291.376	1.516	50	0		CDAARO
O=C(N[C@H]1CC[N@H+](Cc2ccsc2)C1)C1CC1	ZINC000827696058	749858513	/nfs/dbraw/zinc/85/85/13/749858513.db2.gz	SIRAPBNYHPNSLC-LBPRGKRZSA-N	1	0	250.367	1.849	50	0		CDAARO
Cc1cnc2c(C(=O)N3CCC[C@@]4(CC[NH2+]C4)C3)cnn2c1	ZINC000067805564	749888723	/nfs/dbraw/zinc/88/87/23/749888723.db2.gz	BZJWIKVBOBUPAU-INIZCTEOSA-N	1	0	299.378	1.253	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@H]1NC(=O)Cc1ccc(O)cc1	ZINC000389081080	750871132	/nfs/dbraw/zinc/87/11/32/750871132.db2.gz	BAIPSSMXSHXLCA-HFAKWTLXSA-N	1	0	262.353	1.437	50	0		CDAARO
CC(C)[NH2+]C[C@]1(O)CCCN(Cc2ccccc2F)C1=O	ZINC000012716973	752699889	/nfs/dbraw/zinc/69/98/89/752699889.db2.gz	JJJSGDCWIPMPLN-MRXNPFEDSA-N	1	0	294.370	1.677	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@@H](CO)N(Cc2ccc(-c3cc[nH]n3)o2)C1	ZINC000067650214	752801475	/nfs/dbraw/zinc/80/14/75/752801475.db2.gz	YUMPEGCVWMXAKB-NEPJUHHUSA-N	1	0	290.367	1.167	50	0		CDAARO
O[C@@H]1CN(c2ncccn2)CC[N@H+](Cc2ccccc2)C1	ZINC000108411064	753729332	/nfs/dbraw/zinc/72/93/32/753729332.db2.gz	JQDGJOYSSUPDEI-HNNXBMFYSA-N	1	0	284.363	1.160	50	0		CDAARO
CCCCCOCC(=O)N[C@H](C[NH+](C)C)C(C)C	ZINC000585146010	896215825	/nfs/dbraw/zinc/21/58/25/896215825.db2.gz	HLQSBWGMTZKZCL-CYBMUJFWSA-N	1	0	258.406	1.896	50	0		CDAARO
OCc1csc(-c2cccc3c2OCC[NH2+]C3)n1	ZINC000952850132	910405152	/nfs/dbraw/zinc/40/51/52/910405152.db2.gz	UIRPBPIGGVEDPZ-UHFFFAOYSA-N	1	0	262.334	1.784	50	0		CDAARO
CCCCCc1nc([C@@H]([NH3+])CO)n(-c2cccc(C)n2)n1	ZINC000822859107	925652492	/nfs/dbraw/zinc/65/24/92/925652492.db2.gz	RQJJATONCOGIJY-LBPRGKRZSA-N	1	0	289.383	1.696	50	0		CDAARO
Cc1cnn(CCC[N@@H+]2CCC[C@@H](c3nnc[nH]3)C2)c1	ZINC000825253226	925857296	/nfs/dbraw/zinc/85/72/96/925857296.db2.gz	BSPULJMLGRBQGU-CYBMUJFWSA-N	1	0	274.372	1.579	50	0		CDAARO
Cc1nnc(CN2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)s1	ZINC000825296786	925863261	/nfs/dbraw/zinc/86/32/61/925863261.db2.gz	PMXGLJBVWAZBHU-DTIDVZRVSA-N	1	0	250.371	1.029	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)NCC2(COc3ccccc3)CC2)C1	ZINC000826951619	925926616	/nfs/dbraw/zinc/92/66/16/925926616.db2.gz	MMNBDJAMEVPLJW-ZDUSSCGKSA-N	1	0	289.379	1.588	50	0		CDAARO
CNc1nc(NCCC[N@@H+]2CCCC[C@@H]2CO)ncc1F	ZINC000828710921	926169068	/nfs/dbraw/zinc/16/90/68/926169068.db2.gz	PTPGIKDFPYZAJA-LLVKDONJSA-N	1	0	297.378	1.306	50	0		CDAARO
CCc1cnc(C)nc1NC[C@@H]1CCC[N@H+](CCO)C1	ZINC000828760371	926186626	/nfs/dbraw/zinc/18/66/26/926186626.db2.gz	AKTFENLGPSUBHI-ZDUSSCGKSA-N	1	0	278.400	1.464	50	0		CDAARO
COCCC1([NH+](C)C)CCN(C(=O)c2cccn2C)CC1	ZINC000581805080	927203428	/nfs/dbraw/zinc/20/34/28/927203428.db2.gz	SDPVZTKUUKITQF-UHFFFAOYSA-N	1	0	293.411	1.598	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@H](C[N@@H+]2CC[C@@H](C(N)=O)C2)C1	ZINC000584907101	930676996	/nfs/dbraw/zinc/67/69/96/930676996.db2.gz	PQTKIJUOLFCAEZ-VXGBXAGGSA-N	1	0	297.399	1.051	50	0		CDAARO
C/C(=C\C(=O)N1CC[NH2+]CC1)c1ccc(F)cc1F	ZINC000585086617	930888118	/nfs/dbraw/zinc/88/81/18/930888118.db2.gz	MNWUQSFHPYOOQZ-CSKARUKUSA-N	1	0	266.291	1.800	50	0		CDAARO
NC(=O)[C@@]1(c2ccccc2)CC[N@H+](Cc2cscn2)C1	ZINC000585087176	930900082	/nfs/dbraw/zinc/90/00/82/930900082.db2.gz	MIGKEINSDSQHBQ-HNNXBMFYSA-N	1	0	287.388	1.772	50	0		CDAARO
O=C(NC1(CO)CCSCC1)[C@H]1CCC[C@@H]2CCC[N@@H+]21	ZINC000585121956	930989468	/nfs/dbraw/zinc/98/94/68/930989468.db2.gz	HOOMOXFGRVBWMI-CHWSQXEVSA-N	1	0	298.452	1.378	50	0		CDAARO
O=c1cc2c(nn1CC1C[NH+](Cc3ccccc3)C1)CCC2	ZINC000585604834	932835716	/nfs/dbraw/zinc/83/57/16/932835716.db2.gz	UQIRWFHLISJRPA-UHFFFAOYSA-N	1	0	295.386	1.864	50	0		CDAARO
Cn1c(=O)c2ccccc2nc1OC[C@@H]1CCC[N@@H+]1C	ZINC000585654293	932837017	/nfs/dbraw/zinc/83/70/17/932837017.db2.gz	GSNCNNCCTFGGQU-NSHDSACASA-N	1	0	273.336	1.407	50	0		CDAARO
CCc1nc(N(C)CC[N@H+](C)C2CCCC2)no1	ZINC001529145938	968994693	/nfs/dbraw/zinc/99/46/93/968994693.db2.gz	QHXQSBQPPPENNO-UHFFFAOYSA-N	1	0	252.362	1.943	50	0		CDAARO
Cc1nc(C)c(C(=O)Nc2nnc(CC[NH+](C)C)s2)o1	ZINC001529179187	969004537	/nfs/dbraw/zinc/00/45/37/969004537.db2.gz	WCSMJGHRCHRVBA-UHFFFAOYSA-N	1	0	295.368	1.499	50	0		CDAARO
COc1cnc(N(C)CC[N@@H+]2CCCC[C@H]2C)nc1	ZINC001506414675	975155761	/nfs/dbraw/zinc/15/57/61/975155761.db2.gz	IDECUFCVLOKKQG-GFCCVEGCSA-N	1	0	264.373	1.796	50	0		CDAARO
Cc1cnc(C[N@H+](C)C[C@H](O)c2ccccc2)cn1	ZINC001506418832	975157175	/nfs/dbraw/zinc/15/71/75/975157175.db2.gz	VTVYMXZFIZVKGH-HNNXBMFYSA-N	1	0	257.337	1.950	50	0		CDAARO
CN1CC[NH+](C[C@@H]2CCCN(c3ncccc3F)C2)CC1	ZINC000084485938	342450850	/nfs/dbraw/zinc/45/08/50/342450850.db2.gz	LJYARSWZQDFWFN-AWEZNQCLSA-N	1	0	292.402	1.685	50	0		CDAARO
Cc1nn(C)c(C)c1C[NH2+][C@H]1CCN(c2ccccn2)C1	ZINC000096494393	230383678	/nfs/dbraw/zinc/38/36/78/230383678.db2.gz	VLVLDTKBCYQVCL-AWEZNQCLSA-N	1	0	285.395	1.800	50	0		CDAARO
Cc1cc(=O)c2cccc(C(=O)N3CC[C@H]([NH+](C)C)C3)c2[nH]1	ZINC000097657225	230386882	/nfs/dbraw/zinc/38/68/82/230386882.db2.gz	VFADRZCDUZGDSR-LBPRGKRZSA-N	1	0	299.374	1.613	50	0		CDAARO
C[C@@H]1CCC[NH2+][C@H]1CNC(=O)CC[C@H]1CCOC1	ZINC000401255958	342484375	/nfs/dbraw/zinc/48/43/75/342484375.db2.gz	AOTSVQLDPUHNQO-AGIUHOORSA-N	1	0	254.374	1.307	50	0		CDAARO
Cc1cnn(CCCNc2cc(C3CC([NH3+])C3)ncn2)c1	ZINC000223861694	230399199	/nfs/dbraw/zinc/39/91/99/230399199.db2.gz	FJRLJPWLYRNOOC-UHFFFAOYSA-N	1	0	286.383	1.688	50	0		CDAARO
CC1(C)CC(NC(=O)Cc2ccc[nH]2)CC(C)(C)[NH2+]1	ZINC000128361963	342531874	/nfs/dbraw/zinc/53/18/74/342531874.db2.gz	SBQFQJHYZXJJHE-UHFFFAOYSA-N	1	0	263.385	1.983	50	0		CDAARO
Cc1n[nH]cc1CCCNC(=O)N1CC[N@@H+](C)[C@H](C)[C@@H]1C	ZINC000095942745	185037523	/nfs/dbraw/zinc/03/75/23/185037523.db2.gz	MRWRIUNMJVPLOK-OLZOCXBDSA-N	1	0	293.415	1.385	50	0		CDAARO
Cc1ccc(OC(F)F)c(C[NH2+][C@@H](C)CC(N)=O)c1	ZINC000095969248	185047517	/nfs/dbraw/zinc/04/75/17/185047517.db2.gz	XQMYBBKOGKBOHN-VIFPVBQESA-N	1	0	272.295	1.950	50	0		CDAARO
CC[C@@H](COC)[NH2+][C@H](C)Cc1c(C)nn(C)c1C	ZINC000095968573	185048035	/nfs/dbraw/zinc/04/80/35/185048035.db2.gz	MCLHPUZVLMNTKN-MFKMUULPSA-N	1	0	253.390	1.983	50	0		CDAARO
CS(=O)(=O)C[C@H]([NH2+]C[C@H]1CCCOC1)c1ccccc1	ZINC000095985961	185056724	/nfs/dbraw/zinc/05/67/24/185056724.db2.gz	XJSGQGLYBXNZDK-HIFRSBDPSA-N	1	0	297.420	1.789	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@@H]1CC[N@H+](C[C@@H]2CCC(=O)N2)C1	ZINC000242302335	361755481	/nfs/dbraw/zinc/75/54/81/361755481.db2.gz	YRMIXWNIPSHKPC-RYUDHWBXSA-N	1	0	297.399	1.112	50	0		CDAARO
CC[NH+](CC)C[C@H](O)CN1CCN(c2ccccc2)CC1	ZINC000006831206	361786297	/nfs/dbraw/zinc/78/62/97/361786297.db2.gz	MOMXHXYSMHAGKJ-KRWDZBQOSA-N	1	0	291.439	1.511	50	0		CDAARO
CN1C(=O)N[C@@](C)([C@@H]2CCC[N@H+](CC3CCCC3)C2)C1=O	ZINC000089914242	539087671	/nfs/dbraw/zinc/08/76/71/539087671.db2.gz	YSPBOWPVBMNVAE-CJNGLKHVSA-N	1	0	293.411	1.829	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)[C@H](C)c1c(F)cccc1F	ZINC000195554089	342625751	/nfs/dbraw/zinc/62/57/51/342625751.db2.gz	CXGNCIGNRVUNIA-FXAINCCUSA-N	1	0	284.306	1.171	50	0		CDAARO
Cc1nnc(CN(C)CC[N@H+](C)C2CCCC2)o1	ZINC000244701013	361857356	/nfs/dbraw/zinc/85/73/56/361857356.db2.gz	JYIIBICMNPDSAE-UHFFFAOYSA-N	1	0	252.362	1.684	50	0		CDAARO
C[NH2+][C@@H](CC(C)C)C(=O)N(C)CCc1noc(C)n1	ZINC000244873383	361867961	/nfs/dbraw/zinc/86/79/61/361867961.db2.gz	WPLXBKUWKNTHRS-NSHDSACASA-N	1	0	268.361	1.013	50	0		CDAARO
C[C@@H]1C[C@H](C)CN(S(=O)(=O)N2CC[C@H]([NH3+])C[C@H]2C)C1	ZINC000252688201	361893653	/nfs/dbraw/zinc/89/36/53/361893653.db2.gz	NNQWSCJHIQOSQY-XQHKEYJVSA-N	1	0	289.445	1.021	50	0		CDAARO
CC1(C)CNC(=O)[C@@H]1[NH2+]C[C@H](c1ccco1)N1CCCC1	ZINC000585134639	342215611	/nfs/dbraw/zinc/21/56/11/342215611.db2.gz	DFVZVXRBZFVQHQ-OCCSQVGLSA-N	1	0	291.395	1.531	50	0		CDAARO
Clc1cccc(C[NH2+][C@H]2COC[C@H]2Oc2cn[nH]c2)c1	ZINC000685940927	539045918	/nfs/dbraw/zinc/04/59/18/539045918.db2.gz	KNZUSILKULFHNA-UONOGXRCSA-N	1	0	293.754	1.999	50	0		CDAARO
[NH3+][C@H]1COC[C@H]1Oc1cnn(Cc2ccccc2C2CC2)c1	ZINC000685941717	539045978	/nfs/dbraw/zinc/04/59/78/539045978.db2.gz	AHNCIVBIVSHTJE-DLBZAZTESA-N	1	0	299.374	1.914	50	0		CDAARO
C[C@H]1C[C@H](NCc2ccc3[nH]c(=O)[nH]c3c2)CC[N@@H+]1C	ZINC000585139877	342218591	/nfs/dbraw/zinc/21/85/91/342218591.db2.gz	GXSHNWUNOQWPRM-CMPLNLGQSA-N	1	0	274.368	1.841	50	0		CDAARO
Cc1ccnc(C[NH2+][C@@H]2CCC[C@H](S(C)(=O)=O)C2)c1	ZINC000392826402	539061307	/nfs/dbraw/zinc/06/13/07/539061307.db2.gz	LSOWCJBLNDBORA-OCCSQVGLSA-N	1	0	282.409	1.835	50	0		CDAARO
O[C@]1(Cn2ccnn2)CC[N@H+](Cc2cccc(F)c2)C1	ZINC000585081497	539103188	/nfs/dbraw/zinc/10/31/88/539103188.db2.gz	AFRXBIJLIHXGGP-CQSZACIVSA-N	1	0	276.315	1.054	50	0		CDAARO
O=C(NC[C@@H]1C[N@@H+]2CCC[C@@H]2CO1)c1cc(F)cc(F)c1	ZINC000058368280	539161039	/nfs/dbraw/zinc/16/10/39/539161039.db2.gz	DJGNYVXWWYTLQX-ZIAGYGMSSA-N	1	0	296.317	1.558	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N1CC(C[NH+](C)C)C1	ZINC000585114724	362033529	/nfs/dbraw/zinc/03/35/29/362033529.db2.gz	UXRYTLIASDVOCZ-UHFFFAOYSA-N	1	0	282.409	1.431	50	0		CDAARO
Cc1nc([C@H]2NC(=[NH2+])Nc3nc4ccccc4n32)cs1	ZINC000007030666	362194381	/nfs/dbraw/zinc/19/43/81/362194381.db2.gz	KBOSUZLBTABJHJ-NSHDSACASA-N	1	0	284.348	1.898	50	0		CDAARO
C[C@H](C(=O)N1CC[C@H](C[NH3+])C1)c1ccccc1F	ZINC000178581265	362246601	/nfs/dbraw/zinc/24/66/01/362246601.db2.gz	HKPLZQSDMFZEHQ-WDEREUQCSA-N	1	0	250.317	1.736	50	0		CDAARO
Cc1nn(C)c2nc(N(C)[C@H]3CC[N@H+](C)C3)sc12	ZINC000095515326	282285137	/nfs/dbraw/zinc/28/51/37/282285137.db2.gz	DMLAJBHVWYYFPS-VIFPVBQESA-N	1	0	265.386	1.479	50	0		CDAARO
CCSCC[C@@H](C)NC(=O)N1CCN(CC)CC1	ZINC000084789242	362271360	/nfs/dbraw/zinc/27/13/60/362271360.db2.gz	YIFQJPVYWZZPHY-GFCCVEGCSA-N	1	0	273.446	1.865	50	0		CDAARO
CCOC(=O)[C@H](C)NC1CCN(C(=O)C(C)C)CC1	ZINC000084791186	362272092	/nfs/dbraw/zinc/27/20/92/362272092.db2.gz	OOPWGVBTRVVSPT-NSHDSACASA-N	1	0	270.373	1.175	50	0		CDAARO
CCn1ccnc1CN1CC[NH+](C2CCSCC2)CC1	ZINC000252484367	362385074	/nfs/dbraw/zinc/38/50/74/362385074.db2.gz	FUWDRPZYANLWLN-UHFFFAOYSA-N	1	0	294.468	1.916	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CN(C)CCn1nc(C)cc1C	ZINC000252486475	362386661	/nfs/dbraw/zinc/38/66/61/362386661.db2.gz	HLPULYVMDMKBMK-OAHLLOKOSA-N	1	0	264.417	1.916	50	0		CDAARO
Nc1nc(N2CC(c3cccnc3)C2)cc([C@H]2C[C@@H](O)C2)[nH+]1	ZINC000252568961	362393085	/nfs/dbraw/zinc/39/30/85/362393085.db2.gz	VRRXMPUATSIEMA-BJHJDKERSA-N	1	0	297.362	1.296	50	0		CDAARO
CCc1c(C(=O)N2CCC[C@@H]([NH3+])C2)cnn1-c1ccccn1	ZINC000191329041	362414201	/nfs/dbraw/zinc/41/42/01/362414201.db2.gz	XPHSCEMFRAEYIA-GFCCVEGCSA-N	1	0	299.378	1.393	50	0		CDAARO
Nc1cc(CN2CCO[C@H](c3nccs3)C2)ccn1	ZINC000191490230	362446767	/nfs/dbraw/zinc/44/67/67/362446767.db2.gz	WTISXJNGIHOXLQ-NSHDSACASA-N	1	0	276.365	1.694	50	0		CDAARO
CCOC(=O)N1CCN(c2nc3ccccc3[nH]2)CC1	ZINC000041604445	345354855	/nfs/dbraw/zinc/35/48/55/345354855.db2.gz	DHXASPAWXTVGKD-UHFFFAOYSA-N	1	0	274.324	1.841	50	0		CDAARO
Cc1cc(=O)cc(C(=O)N2CCC3(C2)CC[NH2+]CC3)o1	ZINC000223011172	345574855	/nfs/dbraw/zinc/57/48/55/345574855.db2.gz	GNMOVCSINAJBHL-UHFFFAOYSA-N	1	0	276.336	1.164	50	0		CDAARO
O=C(c1cccc2c1OCCO2)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000127573156	187316909	/nfs/dbraw/zinc/31/69/09/187316909.db2.gz	IBRQLXIZJZGQQQ-NEPJUHHUSA-N	1	0	288.347	1.424	50	0		CDAARO
CCC[N@@H+]1CC[C@@H](NC(=O)c2cncc(F)c2)C1	ZINC000619901109	349954560	/nfs/dbraw/zinc/95/45/60/349954560.db2.gz	LZPDSLHEAICIIH-GFCCVEGCSA-N	1	0	251.305	1.435	50	0		CDAARO
c1cnn([C@@H]2CCCC[C@H]2[NH2+]CC2OCCO2)c1	ZINC000128391757	187367543	/nfs/dbraw/zinc/36/75/43/187367543.db2.gz	JCNUJXUYCKURJX-VXGBXAGGSA-N	1	0	251.330	1.329	50	0		CDAARO
[NH3+]C[C@H]1CN(c2ccc(Br)c(F)c2)C(=O)O1	ZINC000142375178	348752272	/nfs/dbraw/zinc/75/22/72/348752272.db2.gz	AFLKSCUXTJDCNS-ZETCQYMHSA-N	1	0	289.104	1.872	50	0		CDAARO
Cc1ocnc1C(=O)NC1CC[NH+](C2CCOCC2)CC1	ZINC000584885871	349343706	/nfs/dbraw/zinc/34/37/06/349343706.db2.gz	NPKLHIUPGLQAAQ-UHFFFAOYSA-N	1	0	293.367	1.356	50	0		CDAARO
Cn1ncnc1CC[NH2+][C@@H]1CCN(c2ccccc2)C1	ZINC000584886073	349343930	/nfs/dbraw/zinc/34/39/30/349343930.db2.gz	FHDQJEHTXWCIKB-CYBMUJFWSA-N	1	0	271.368	1.226	50	0		CDAARO
CCOCCC(=O)N1C[C@H]2CCC[C@@H](C1)[N@H+](C)C2	ZINC000584891566	349350612	/nfs/dbraw/zinc/35/06/12/349350612.db2.gz	VCPVMABWRXRDIY-STQMWFEESA-N	1	0	254.374	1.356	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@@H]1CCCC[NH2+]1	ZINC000104448259	186005630	/nfs/dbraw/zinc/00/56/30/186005630.db2.gz	AKEJDCMWDNCELD-JTQLQIEISA-N	1	0	253.371	1.552	50	0		CDAARO
COc1ccccc1OCC[N@@H+]1C[C@@H](C)[C@@](C)(O)C1	ZINC000091526574	180178677	/nfs/dbraw/zinc/17/86/77/180178677.db2.gz	WXEGCCHLJKNIKJ-DOMZBBRYSA-N	1	0	265.353	1.777	50	0		CDAARO
C[NH+](C)C[C@@H]1CN(c2ncnc3sccc32)C[C@@H]1CO	ZINC000091713084	180230774	/nfs/dbraw/zinc/23/07/74/180230774.db2.gz	RJCDIGDQVRIBIT-GHMZBOCLSA-N	1	0	292.408	1.298	50	0		CDAARO
CC(C)c1nccn1C[C@H](O)C[NH+]1C[C@@H](C)O[C@H](C)C1	ZINC000110694197	350268486	/nfs/dbraw/zinc/26/84/86/350268486.db2.gz	OQPUCFZDIPNVQJ-MGPQQGTHSA-N	1	0	281.400	1.477	50	0		CDAARO
COCC[NH+]1CCC(CN(C)c2ncccn2)CC1	ZINC000091988112	180299642	/nfs/dbraw/zinc/29/96/42/180299642.db2.gz	XQFOLKBCXFEWQJ-UHFFFAOYSA-N	1	0	264.373	1.271	50	0		CDAARO
CCCC[C@H]1C=CCN1C(=O)C[NH+]1CCC(C(N)=O)CC1	ZINC000092077138	180317972	/nfs/dbraw/zinc/31/79/72/180317972.db2.gz	PFQJZJLMYVEPFS-AWEZNQCLSA-N	1	0	293.411	1.141	50	0		CDAARO
CC[C@H]1CN(Cc2cscn2)CC[N@@H+]1C[C@H](C)O	ZINC000106906733	186149511	/nfs/dbraw/zinc/14/95/11/186149511.db2.gz	UWMUJMANAFNQGK-AAEUAGOBSA-N	1	0	269.414	1.420	50	0		CDAARO
Cc1ccc(NC(=O)C[N@H+]2CC[C@@H]([C@H](C)O)C2)cc1C	ZINC000108331186	186213358	/nfs/dbraw/zinc/21/33/58/186213358.db2.gz	GEPLEIFDXSMMMT-UONOGXRCSA-N	1	0	276.380	1.945	50	0		CDAARO
CC(C)C[C@H](CO)NC(=O)[C@H](C)[NH+]1[C@@H](C)CC[C@@H]1C	ZINC000110712744	186316376	/nfs/dbraw/zinc/31/63/76/186316376.db2.gz	PKKPOEDIGMNOJP-XDQVBPFNSA-N	1	0	270.417	1.771	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CN(C(=O)c2ccc(F)cc2F)CCO1	ZINC000122853146	187056157	/nfs/dbraw/zinc/05/61/57/187056157.db2.gz	AESPSNCJCAWSAN-QPUJVOFHSA-N	1	0	270.279	1.153	50	0		CDAARO
Cn1nc(C(=O)N2CC[C@@]3(C2)CCC[NH2+]C3)c2ccccc21	ZINC000067769670	282799341	/nfs/dbraw/zinc/79/93/41/282799341.db2.gz	VTCKHIZDWIEHOT-KRWDZBQOSA-N	1	0	298.390	1.789	50	0		CDAARO
CC[C@H](C)[C@H]([NH3+])C(=O)NCc1csc(N(C)C)n1	ZINC000155743661	188225043	/nfs/dbraw/zinc/22/50/43/188225043.db2.gz	ACOWSYJSUQLEAL-WPRPVWTQSA-N	1	0	270.402	1.199	50	0		CDAARO
C[NH+](C)CCc1c[nH]c2ccc(C[C@@H]3COC(=O)N3)cc12	ZINC000000005298	355879614	/nfs/dbraw/zinc/87/96/14/355879614.db2.gz	ULSDMUVEXKOYBU-CYBMUJFWSA-N	1	0	287.363	1.923	50	0	world	CDAARO
COc1cccc(OC)c1CN1CCC([NH3+])CC1	ZINC000000154317	355891665	/nfs/dbraw/zinc/89/16/65/355891665.db2.gz	KYCNALWNPRQSMP-UHFFFAOYSA-N	1	0	250.342	1.627	50	0		CDAARO
C[NH2+]C1CCN(Cc2c(OC)cccc2OC)CC1	ZINC000000154318	355891850	/nfs/dbraw/zinc/89/18/50/355891850.db2.gz	GDSOHLHQWSFYJN-UHFFFAOYSA-N	1	0	264.369	1.888	50	0		CDAARO
CCOC(=O)C[C@@H]([NH3+])c1cc(OC)cc(OC)c1	ZINC000002582559	355976040	/nfs/dbraw/zinc/97/60/40/355976040.db2.gz	PRMOXKMXQABQKA-GFCCVEGCSA-N	1	0	253.298	1.657	50	0		CDAARO
c1nn(Cc2ccccc2)cc1CN[C@@H]1CCC[NH2+]C1	ZINC000067740768	356007196	/nfs/dbraw/zinc/00/71/96/356007196.db2.gz	WSIUJQUKNRFNAR-MRXNPFEDSA-N	1	0	270.380	1.773	50	0		CDAARO
COc1ccc(CNCCC[NH+](C)C)c(OC)c1OC	ZINC000002518425	355972718	/nfs/dbraw/zinc/97/27/18/355972718.db2.gz	HZCFOTZCGAVWJC-UHFFFAOYSA-N	1	0	282.384	1.754	50	0		CDAARO
O=C1c2cccc3cccc(c32)C(=O)N1CCC[NH2+]CCO	ZINC000003892600	356012641	/nfs/dbraw/zinc/01/26/41/356012641.db2.gz	FFJKCIDNKQCLNM-UHFFFAOYSA-N	1	0	298.342	1.408	50	0		CDAARO
C[C@@H]([NH2+][C@@H](C)c1nnnn1-c1ccccc1)[C@@H]1CCCO1	ZINC000097373265	356094687	/nfs/dbraw/zinc/09/46/87/356094687.db2.gz	WFTZHWHSWLCKDZ-DYEKYZERSA-N	1	0	287.367	1.880	50	0		CDAARO
C[C@@H]1CCC[N@H+](CC(=O)Nc2cccc3nonc32)C1	ZINC000032578578	356305270	/nfs/dbraw/zinc/30/52/70/356305270.db2.gz	VQJJRYZBFHRQTN-SNVBAGLBSA-N	1	0	274.324	1.893	50	0		CDAARO
C[n+]1ccc(C(=O)NCc2ccc3c(c2)OCO3)cc1	ZINC000032604129	356306093	/nfs/dbraw/zinc/30/60/93/356306093.db2.gz	CBMUQIFZIHRPTF-UHFFFAOYSA-O	1	0	271.296	1.170	50	0		CDAARO
CCCOc1cccc(NC(=O)[C@@H]2C[C@@H](O)C[NH2+]2)c1	ZINC000037023452	356311192	/nfs/dbraw/zinc/31/11/92/356311192.db2.gz	ASKIRNXBYGQODG-YPMHNXCESA-N	1	0	264.325	1.137	50	0		CDAARO
CCCCCNC(=O)C1CCN([C@H](C)C(=O)OC)CC1	ZINC000032928799	356453916	/nfs/dbraw/zinc/45/39/16/356453916.db2.gz	ZEOQOQXRMQLPAV-GFCCVEGCSA-N	1	0	284.400	1.566	50	0		CDAARO
O=C1Nc2ccccc2/C1=C/NCCC[NH+]1CCOCC1	ZINC000018043592	356465426	/nfs/dbraw/zinc/46/54/26/356465426.db2.gz	XLFJMMUONWZWBX-OWBHPGMISA-N	1	0	287.363	1.292	50	0		CDAARO
COc1ccc(CN2CC[NH+](CCO)CC2)cc1C	ZINC000019607108	356493158	/nfs/dbraw/zinc/49/31/58/356493158.db2.gz	YBDCFTYLRYMEQC-UHFFFAOYSA-N	1	0	264.369	1.114	50	0		CDAARO
CCOCC[N@@H+]1CCN(Cc2cccnc2)C[C@H]1C	ZINC000246998285	356582636	/nfs/dbraw/zinc/58/26/36/356582636.db2.gz	BHLPRHGGBHPMGB-CQSZACIVSA-N	1	0	263.385	1.624	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1OC	ZINC000024865253	356663224	/nfs/dbraw/zinc/66/32/24/356663224.db2.gz	IKPIKVIWHDZQKS-MNOVXSKESA-N	1	0	293.367	1.498	50	0		CDAARO
O=C(NC1CC1)[C@H]([NH2+]C[C@H]1CCCO1)c1ccccc1	ZINC000024515311	356656638	/nfs/dbraw/zinc/65/66/38/356656638.db2.gz	CYUJPCVMCZCWRV-HUUCEWRRSA-N	1	0	274.364	1.775	50	0		CDAARO
CN1C[C@@H]([NH2+][C@H]2CC(C)(C)OC2(C)C)CCC1=O	ZINC000094424541	283204458	/nfs/dbraw/zinc/20/44/58/283204458.db2.gz	HEMMYKQKTAOQIR-QWRGUYRKSA-N	1	0	254.374	1.543	50	0		CDAARO
C[C@H]1COCCN1Cc1cc(=O)n2cc(Cl)ccc2n1	ZINC000026451881	356692942	/nfs/dbraw/zinc/69/29/42/356692942.db2.gz	FYCBEGYNOYFLIB-JTQLQIEISA-N	1	0	293.754	1.569	50	0		CDAARO
O=S(=O)(c1cccc(Cl)c1Cl)N1CCNCC1	ZINC000034781232	356820063	/nfs/dbraw/zinc/82/00/63/356820063.db2.gz	NZHUJPBMRNGSPP-UHFFFAOYSA-N	1	0	295.191	1.587	50	0		CDAARO
C[C@@H]([NH2+]C[C@H]1CCN(S(C)(=O)=O)C1)c1ccsc1	ZINC000090797589	356831497	/nfs/dbraw/zinc/83/14/97/356831497.db2.gz	DXKNFBOZLPELMJ-GHMZBOCLSA-N	1	0	288.438	1.680	50	0		CDAARO
CC(C)[NH+]1CCC(NC(=O)[C@@H]2Cc3ccccc3O2)CC1	ZINC000032780977	356787737	/nfs/dbraw/zinc/78/77/37/356787737.db2.gz	SDJCCJBHKOYKSQ-INIZCTEOSA-N	1	0	288.391	1.979	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCN(C)CC2)c(C)c1C	ZINC000035993524	356853890	/nfs/dbraw/zinc/85/38/90/356853890.db2.gz	JREOVLFUWFJUDX-UHFFFAOYSA-N	1	0	282.409	1.548	50	0		CDAARO
NNc1cc(C(F)(F)F)cc(N2CCOCC2)[nH+]1	ZINC000043179109	357087632	/nfs/dbraw/zinc/08/76/32/357087632.db2.gz	DRKFKCSUNOAHBG-UHFFFAOYSA-N	1	0	262.235	1.223	50	0		CDAARO
COC(=O)[C@H](CC(C)C)NC(=O)[C@@H]([NH3+])Cc1ccccc1	ZINC000053113531	357283046	/nfs/dbraw/zinc/28/30/46/357283046.db2.gz	HGVNLOSOAISYIT-KBPBESRZSA-N	1	0	292.379	1.260	50	0		CDAARO
CS[C@H]1CCC[C@@H]1[N@H+](C)CCN1C(=O)CCC1=O	ZINC000096441748	357473434	/nfs/dbraw/zinc/47/34/34/357473434.db2.gz	NVAOHARBGMASTR-QWRGUYRKSA-N	1	0	270.398	1.351	50	0		CDAARO
CC(C)NC(=O)C[NH2+][C@H](C)COc1ccccc1	ZINC000065395201	357537141	/nfs/dbraw/zinc/53/71/41/357537141.db2.gz	FSGSBTHYYKMCHC-GFCCVEGCSA-N	1	0	250.342	1.568	50	0		CDAARO
OCC(CO)[NH2+][C@H]1CCC[C@H]1Cc1ccc(F)cc1	ZINC000065528910	357548308	/nfs/dbraw/zinc/54/83/08/357548308.db2.gz	QNZIMAYGMBOSHN-WFASDCNBSA-N	1	0	267.344	1.480	50	0		CDAARO
O=C(NC1CC1)c1ccc(OC[C@@H]2CCC[NH2+]C2)cc1	ZINC000066323493	357562503	/nfs/dbraw/zinc/56/25/03/357562503.db2.gz	OLUZGBVUIVZMMK-GFCCVEGCSA-N	1	0	274.364	1.957	50	0		CDAARO
C[C@H](Cn1ccnc1)[NH2+]Cc1ccc(-n2cncn2)cc1	ZINC000067563278	357613360	/nfs/dbraw/zinc/61/33/60/357613360.db2.gz	YLEUQNYPIMEHJU-CYBMUJFWSA-N	1	0	282.351	1.642	50	0		CDAARO
Cc1ncc2c(c1CNC(=O)Cc1ccccc1)CC[NH2+]C2	ZINC000072458998	357837387	/nfs/dbraw/zinc/83/73/87/357837387.db2.gz	BXGUGKMDKAFTPL-UHFFFAOYSA-N	1	0	295.386	1.895	50	0		CDAARO
C[C@@H]1[C@H](C)[NH2+]CCN1Cc1ccc2c(c1)OCCO2	ZINC000097095776	357953215	/nfs/dbraw/zinc/95/32/15/357953215.db2.gz	XTMSOZFCPMPGTE-NWDGAFQWSA-N	1	0	262.353	1.640	50	0		CDAARO
NC(=O)[C@@H]1CCCC[C@H]1[NH2+]Cc1ccccc1F	ZINC000097113850	357982959	/nfs/dbraw/zinc/98/29/59/357982959.db2.gz	QPQSDZYZTPNSQW-DGCLKSJQSA-N	1	0	250.317	1.959	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)NC(=O)NC1CC1)[C@@H](C)c1ccccc1	ZINC000097110013	357985609	/nfs/dbraw/zinc/98/56/09/357985609.db2.gz	WGLKOWYAGKHJRB-VXGBXAGGSA-N	1	0	289.379	1.756	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C[C@@H](O)COc1ccccc1	ZINC000097159275	357998890	/nfs/dbraw/zinc/99/88/90/357998890.db2.gz	HWYAHDLRAUKGEP-CYBMUJFWSA-N	1	0	261.325	1.248	50	0		CDAARO
C[C@@H]([NH2+]CCNC(=O)c1ccn[nH]1)c1ccccc1F	ZINC000097236321	358049016	/nfs/dbraw/zinc/04/90/16/358049016.db2.gz	PRNIZDDZRXADKW-SNVBAGLBSA-N	1	0	276.315	1.629	50	0		CDAARO
Cc1nc[nH]c1CN1CCC([N@@H+]2CCC[C@H](O)C2)CC1	ZINC000072479130	358071001	/nfs/dbraw/zinc/07/10/01/358071001.db2.gz	SGQFDRHGRPLEEE-AWEZNQCLSA-N	1	0	278.400	1.139	50	0		CDAARO
Cc1nc[nH]c1CN1CCC([N@@H+]2CCC[C@@H](O)C2)CC1	ZINC000072479131	358071076	/nfs/dbraw/zinc/07/10/76/358071076.db2.gz	SGQFDRHGRPLEEE-CQSZACIVSA-N	1	0	278.400	1.139	50	0		CDAARO
CCCNC(=O)C(=O)NCC1CC[NH+](C2CCCC2)CC1	ZINC000023127376	358062310	/nfs/dbraw/zinc/06/23/10/358062310.db2.gz	UZHMZLJECWQRLW-UHFFFAOYSA-N	1	0	295.427	1.283	50	0		CDAARO
C[NH+]1CCN(C[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000019772772	358139579	/nfs/dbraw/zinc/13/95/79/358139579.db2.gz	JIFNRGXVPACIKK-ZDUSSCGKSA-N	1	0	284.787	1.327	50	0		CDAARO
COCC[N@@H+]1CCN(C[C@@H](O)c2ccc(F)cc2)C[C@H]1C	ZINC000247390147	358189492	/nfs/dbraw/zinc/18/94/92/358189492.db2.gz	XABBHGXHRYOLGN-CZUORRHYSA-N	1	0	296.386	1.512	50	0		CDAARO
Cc1cc(N[C@@H]2CCc3nnc(C(C)C)n3C2)nc(N)[nH+]1	ZINC000097199314	358187764	/nfs/dbraw/zinc/18/77/64/358187764.db2.gz	ZXEIILAULUDKHU-SNVBAGLBSA-N	1	0	287.371	1.509	50	0		CDAARO
Cc1cccc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)n1	ZINC000089688911	358428622	/nfs/dbraw/zinc/42/86/22/358428622.db2.gz	AQQDWTYIHOTPFO-OLZOCXBDSA-N	1	0	259.353	1.699	50	0		CDAARO
CCOC(=O)[C@@]1(C(C)C)CC[N@H+](Cc2nccn2C)C1	ZINC000194874045	358543604	/nfs/dbraw/zinc/54/36/04/358543604.db2.gz	KAYURZQWTIVROX-HNNXBMFYSA-N	1	0	279.384	1.831	50	0		CDAARO
[NH3+]CCC(=O)N1CCC[C@@H]1Cc1cccc(F)c1	ZINC000195542303	358559845	/nfs/dbraw/zinc/55/98/45/358559845.db2.gz	TUZWVDKEMLLRQE-CYBMUJFWSA-N	1	0	250.317	1.708	50	0		CDAARO
Cn1ccnc1CN1CCN(Cc2ccc(Cl)o2)CC1	ZINC000093108053	358585154	/nfs/dbraw/zinc/58/51/54/358585154.db2.gz	INUCQEPDMBAGBI-UHFFFAOYSA-N	1	0	294.786	1.984	50	0		CDAARO
C[C@@H]1C[N@H+](C2CCN(c3nccc(N)n3)CC2)C[C@H](C)O1	ZINC000095364653	358686968	/nfs/dbraw/zinc/68/69/68/358686968.db2.gz	MOXGQNIGFKCHRW-TXEJJXNPSA-N	1	0	291.399	1.137	50	0		CDAARO
Cc1cc(C(=O)N2C[C@@H](C(C)C)[C@H]([NH+](C)C)C2)[nH]n1	ZINC000095375347	358688839	/nfs/dbraw/zinc/68/88/39/358688839.db2.gz	UERKZLGCFUWGNR-WCQYABFASA-N	1	0	264.373	1.376	50	0		CDAARO
O=C(NCc1cc2n(n1)CCC[NH2+]C2)c1cc(Cl)c[nH]1	ZINC000097547622	358783896	/nfs/dbraw/zinc/78/38/96/358783896.db2.gz	QGZOIAXPPMQFSW-UHFFFAOYSA-N	1	0	293.758	1.288	50	0		CDAARO
CNC(=O)[C@@H]1CCCN(Cc2[nH]nc(C)c2Cl)C1	ZINC000097604114	358787561	/nfs/dbraw/zinc/78/75/61/358787561.db2.gz	YAIDVOWEYOTWLJ-SECBINFHSA-N	1	0	270.764	1.330	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)N(CCO)Cc1nccs1	ZINC000097711668	358793626	/nfs/dbraw/zinc/79/36/26/358793626.db2.gz	UPYRMYPWLJIVAD-GFCCVEGCSA-N	1	0	297.424	1.338	50	0		CDAARO
CO[C@@H]1CC[N@H+](Cc2cnc(N3CCCC3)s2)C1	ZINC000215789481	358903389	/nfs/dbraw/zinc/90/33/89/358903389.db2.gz	RVTBQNCUEDNLHA-LLVKDONJSA-N	1	0	267.398	1.964	50	0		CDAARO
C[C@H](CN1CCN(c2cnccn2)CC1)C(F)(F)F	ZINC000216089422	358924303	/nfs/dbraw/zinc/92/43/03/358924303.db2.gz	GHRNOELWBIOYIM-SNVBAGLBSA-N	1	0	274.290	1.797	50	0		CDAARO
Nc1ncccc1CN1CCCO[C@@H](C[NH+]2CCCC2)C1	ZINC000216115423	358926148	/nfs/dbraw/zinc/92/61/48/358926148.db2.gz	QRADBTFICCGRAI-HNNXBMFYSA-N	1	0	290.411	1.351	50	0		CDAARO
C[NH+](C)CCCOc1ccccc1CN1CCOCC1	ZINC000216449675	358945770	/nfs/dbraw/zinc/94/57/70/358945770.db2.gz	HXFDWACKGPLZEP-UHFFFAOYSA-N	1	0	278.396	1.849	50	0		CDAARO
c1nc(CO[C@H]2CCOC[C@H]2[NH2+]C2CCOCC2)cs1	ZINC000218841868	359068189	/nfs/dbraw/zinc/06/81/89/359068189.db2.gz	GYTYLIKWPYTXHZ-KGLIPLIRSA-N	1	0	298.408	1.586	50	0		CDAARO
Cc1nnc(CN(C)C(=O)[C@H](C)[NH+]2CCCCCC2)o1	ZINC000218884591	359069299	/nfs/dbraw/zinc/06/92/99/359069299.db2.gz	RGDUFIZFCGPJCG-NSHDSACASA-N	1	0	280.372	1.601	50	0		CDAARO
CCn1cc(Cl)c(C(=O)NCCC[NH+](C)C)n1	ZINC000028222729	359173679	/nfs/dbraw/zinc/17/36/79/359173679.db2.gz	NLVJYMWKVZQPLZ-UHFFFAOYSA-N	1	0	258.753	1.238	50	0		CDAARO
CC[NH+](CC)CCn1c(N)c(C(N)=O)sc1=S	ZINC000032952394	359270591	/nfs/dbraw/zinc/27/05/91/359270591.db2.gz	ASGXHRQGHVFQHL-UHFFFAOYSA-N	1	0	274.415	1.302	50	0		CDAARO
CCOC(=O)[C@]12CC[NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)C2	ZINC000261250124	359276259	/nfs/dbraw/zinc/27/62/59/359276259.db2.gz	ZMLGCFGHQXSXAH-ABAIWWIYSA-N	1	0	298.383	1.539	50	0		CDAARO
O=C(NCCCCC[NH+]1CCOCC1)c1ccncc1O	ZINC000222392873	359339239	/nfs/dbraw/zinc/33/92/39/359339239.db2.gz	JYUZNBJTMVRMAW-UHFFFAOYSA-N	1	0	293.367	1.020	50	0		CDAARO
O=C(c1ccco1)N1CCC[C@@H](C[NH+]2CCOCC2)CC1	ZINC000257182208	359443952	/nfs/dbraw/zinc/44/39/52/359443952.db2.gz	OUXTXFJIOLFLQY-CQSZACIVSA-N	1	0	292.379	1.854	50	0		CDAARO
Cc1c(F)cccc1C(=O)N1C[C@H]([NH+](C)C)C[C@H]1CO	ZINC000223763781	359454077	/nfs/dbraw/zinc/45/40/77/359454077.db2.gz	WZRALMLFDJDSIB-NEPJUHHUSA-N	1	0	280.343	1.271	50	0		CDAARO
CCN1CC[C@H]2C[N@H+](CC(C)C)C[C@@]2(c2nc(C)no2)C1	ZINC000257194140	359608425	/nfs/dbraw/zinc/60/84/25/359608425.db2.gz	SQQCOUFJPUSQQA-HOCLYGCPSA-N	1	0	292.427	1.929	50	0		CDAARO
[NH3+]C[C@H](O)c1ccccc1I	ZINC000008699508	283496105	/nfs/dbraw/zinc/49/61/05/283496105.db2.gz	CWLIBAOBIAUKPM-QMMMGPOBSA-N	1	0	263.078	1.283	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@@H]1CON=C(N)CN1CCOCC1	ZINC000408525188	359934189	/nfs/dbraw/zinc/93/41/89/359934189.db2.gz	OVZMTXVELRYXCA-CQSZACIVSA-N	1	0	298.431	1.080	50	0		CDAARO
CCN1C(=O)[C@@H]2CC3(CN2C1=O)CC[NH+](CC(C)C)CC3	ZINC000409419983	360229074	/nfs/dbraw/zinc/22/90/74/360229074.db2.gz	GLNCUHKABVFZGY-ZDUSSCGKSA-N	1	0	293.411	1.781	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)C1CCOCC1	ZINC000248153265	360415035	/nfs/dbraw/zinc/41/50/35/360415035.db2.gz	UWQPYIMAIHCPBB-ZIAGYGMSSA-N	1	0	266.385	1.498	50	0		CDAARO
CC(C)c1noc([C@@H](C)NC(=O)CCn2ccnc2)n1	ZINC000426612975	360653494	/nfs/dbraw/zinc/65/34/94/360653494.db2.gz	SWWITXKFGKMVBU-SNVBAGLBSA-N	1	0	277.328	1.657	50	0		CDAARO
C[NH+]1CCC(CCC(=O)NCCc2cc[nH]n2)CC1	ZINC000426620240	360689996	/nfs/dbraw/zinc/68/99/96/360689996.db2.gz	NUSRRMBEJRMAIG-UHFFFAOYSA-N	1	0	264.373	1.190	50	0		CDAARO
O=C(Cn1nccc1[C@@H]1CCC[NH2+]C1)N1CCCCCC1	ZINC000426396333	360663802	/nfs/dbraw/zinc/66/38/02/360663802.db2.gz	BLRKUAINFIGIIF-CQSZACIVSA-N	1	0	290.411	1.753	50	0		CDAARO
CCc1cc(CSc2nnc(C[NH3+])n2C)on1	ZINC000426424232	360668372	/nfs/dbraw/zinc/66/83/72/360668372.db2.gz	IYWSLBHCJYSLBY-UHFFFAOYSA-N	1	0	253.331	1.117	50	0		CDAARO
C[C@H](C(=O)N(C)Cc1cnc2ccccc2n1)[NH+](C)C	ZINC000426486005	360674958	/nfs/dbraw/zinc/67/49/58/360674958.db2.gz	FKVXJGBVQNFHJV-LLVKDONJSA-N	1	0	272.352	1.538	50	0		CDAARO
Cc1nc2ccccn2c1CC(=O)NC[C@@H]1C[C@H](F)C[NH2+]1	ZINC000426701637	360697597	/nfs/dbraw/zinc/69/75/97/360697597.db2.gz	PGNVIKOURXWVGB-RYUDHWBXSA-N	1	0	290.342	1.001	50	0		CDAARO
c1csc(C[N@@H+]2CC[C@@H](N3CCOCC3)C2)c1	ZINC000121082458	360791526	/nfs/dbraw/zinc/79/15/26/360791526.db2.gz	FDIBAPLNHBYGAD-GFCCVEGCSA-N	1	0	252.383	1.655	50	0		CDAARO
Cc1c(F)cccc1S(=O)(=O)NCC[C@@H](C)[NH3+]	ZINC000178909746	189153919	/nfs/dbraw/zinc/15/39/19/189153919.db2.gz	AWGKXEYXQSZONK-MRVPVSSYSA-N	1	0	260.334	1.150	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)Cc2ccc(OC)c(F)c2)C1	ZINC000178963744	189157720	/nfs/dbraw/zinc/15/77/20/189157720.db2.gz	SLQKUJAPLACOFD-LBPRGKRZSA-N	1	0	280.343	1.445	50	0		CDAARO
CC[C@@H](O)C[N@H+](CCOC)Cc1cc(OC)cc(OC)c1	ZINC000036095045	360907073	/nfs/dbraw/zinc/90/70/73/360907073.db2.gz	YQQBMMYFONHLEP-CQSZACIVSA-N	1	0	297.395	1.923	50	0		CDAARO
C[C@H](Oc1cccnc1)C(=O)N1C[C@@H](C)[NH2+][C@@H](C)C1	ZINC000246662705	360907425	/nfs/dbraw/zinc/90/74/25/360907425.db2.gz	DNTJGVCUHDJLMT-TUAOUCFPSA-N	1	0	263.341	1.058	50	0		CDAARO
NC(=O)c1ccc(-c2cc3c(c(F)c2)O[C@H](C[NH3+])C3)nc1	ZINC000299770683	200864788	/nfs/dbraw/zinc/86/47/88/200864788.db2.gz	VAPSUGSECGZISA-NSHDSACASA-N	1	0	287.294	1.249	50	0		CDAARO
CCCCc1ccc(NC(=O)NC[C@]2(O)CC[NH2+]C2)cc1	ZINC000299783698	200870685	/nfs/dbraw/zinc/87/06/85/200870685.db2.gz	XPJKEYPNIZRLCU-INIZCTEOSA-N	1	0	291.395	1.875	50	0		CDAARO
CCCCc1ccc(NC(=O)NC[C@@]2(O)CC[NH2+]C2)cc1	ZINC000299783701	200872982	/nfs/dbraw/zinc/87/29/82/200872982.db2.gz	XPJKEYPNIZRLCU-MRXNPFEDSA-N	1	0	291.395	1.875	50	0		CDAARO
O[C@H](Cn1ccc(C(F)(F)F)n1)C[NH+]1CCCC1	ZINC000000117340	364091787	/nfs/dbraw/zinc/09/17/87/364091787.db2.gz	BITXQCCVUCXHRC-VIFPVBQESA-N	1	0	263.263	1.359	50	0		CDAARO
Cn1c(CO)nnc1[C@H]1C[C@H]([NH2+]C2CCCC2)C1	ZINC000244734923	364400330	/nfs/dbraw/zinc/40/03/30/364400330.db2.gz	NOBAFWAGDHOYJD-HOMQSWHASA-N	1	0	250.346	1.086	50	0		CDAARO
CN(C(=O)c1ccc(F)cc1)C1CC[NH+](C)CC1	ZINC000012974260	364736134	/nfs/dbraw/zinc/73/61/34/364736134.db2.gz	XHUCNFPSRYQYMV-UHFFFAOYSA-N	1	0	250.317	1.992	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(C(=O)c2[nH]nc(N)c2Cl)CC1	ZINC000215621713	189696138	/nfs/dbraw/zinc/69/61/38/189696138.db2.gz	DULHNKJHXAFOOZ-MRVPVSSYSA-N	1	0	285.779	1.202	50	0		CDAARO
O=C(C[N@H+]1CC[C@@H](CO)C1)NCCCC1CCCCC1	ZINC000089818320	366939375	/nfs/dbraw/zinc/93/93/75/366939375.db2.gz	AXDYJVNDWIZIQH-OAHLLOKOSA-N	1	0	282.428	1.777	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@@H]1NC(=O)c1ccc(F)cc1F	ZINC000094345159	367416581	/nfs/dbraw/zinc/41/65/81/367416581.db2.gz	MDYHBLIXGBISPW-PELKAZGASA-N	1	0	254.280	1.693	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(CCO[C@@H]2CCCC[C@H]2C)C[C@H]1C	ZINC000252474547	367536522	/nfs/dbraw/zinc/53/65/22/367536522.db2.gz	HJKMFYUHPTUJKZ-WCXIOVBPSA-N	1	0	298.471	1.969	50	0		CDAARO
CCCC[C@H]([NH2+][C@H]1CCN(C(=O)C2CC2)C[C@H]1C)C(N)=O	ZINC000252517942	367744064	/nfs/dbraw/zinc/74/40/64/367744064.db2.gz	VLLIJJKZNOCNLT-XBFCOCLRSA-N	1	0	295.427	1.267	50	0		CDAARO
CCOC(=O)CC1CCN(C(=O)C2CC[NH2+]CC2)CC1	ZINC000252550351	368157865	/nfs/dbraw/zinc/15/78/65/368157865.db2.gz	SLHLJUPXEUOISS-UHFFFAOYSA-N	1	0	282.384	1.178	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N[C@@H]2CCC[C@@H]2C[NH3+])c1	ZINC000089091969	368833774	/nfs/dbraw/zinc/83/37/74/368833774.db2.gz	JSCNBGUWLKZFAG-ZYHUDNBSSA-N	1	0	286.372	1.540	50	0		CDAARO
CSCCC(=O)N1CCC[C@H](C[NH+]2CCN(C)CC2)C1	ZINC000368978987	369656361	/nfs/dbraw/zinc/65/63/61/369656361.db2.gz	HNAHOLKKWUDPPT-CQSZACIVSA-N	1	0	299.484	1.226	50	0		CDAARO
Cc1ccccc1C[NH2+]C1CCN(CC(=O)N(C)C)CC1	ZINC000037719036	369992778	/nfs/dbraw/zinc/99/27/78/369992778.db2.gz	BTXBURZMXNVKHS-UHFFFAOYSA-N	1	0	289.423	1.637	50	0		CDAARO
CC(C)C[C@H](CO)NC(=O)[C@H](C)[NH+]1[C@H](C)CC[C@H]1C	ZINC000245338936	370048575	/nfs/dbraw/zinc/04/85/75/370048575.db2.gz	PKKPOEDIGMNOJP-YIYPIFLZSA-N	1	0	270.417	1.771	50	0		CDAARO
CCSCC[NH2+]C[C@@]1(N2CCOCC2)CCSC1	ZINC000371939786	370431113	/nfs/dbraw/zinc/43/11/13/370431113.db2.gz	UJEWBKBJXILYGQ-ZDUSSCGKSA-N	1	0	290.498	1.537	50	0		CDAARO
COCC[N@@H+]1CCN(Cc2ccc3c[nH]nc3c2)C[C@@H]1C	ZINC000179509480	372285912	/nfs/dbraw/zinc/28/59/12/372285912.db2.gz	WKTRUTXYJLGOSV-ZDUSSCGKSA-N	1	0	288.395	1.715	50	0		CDAARO
CC(C)NC(=O)[C@@H]1C[C@@H]([NH3+])CN1Cc1cccc(Cl)c1	ZINC000299765884	372748648	/nfs/dbraw/zinc/74/86/48/372748648.db2.gz	CUBOCLCJUSRWBC-KGLIPLIRSA-N	1	0	295.814	1.766	50	0		CDAARO
Cn1cncc1C(=O)N[C@@H](CC[NH+](C)C)c1ccccc1	ZINC000299790884	372765297	/nfs/dbraw/zinc/76/52/97/372765297.db2.gz	CQDNIZAYUYNRPA-AWEZNQCLSA-N	1	0	286.379	1.843	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](CNC(=O)c2cncnc2)C1	ZINC000299775022	372752022	/nfs/dbraw/zinc/75/20/22/372752022.db2.gz	JBVMBFONKYHTOR-LBPRGKRZSA-N	1	0	262.357	1.328	50	0		CDAARO
Cc1ccccc1CCC(=O)NC[C@@]1(O)CCC[NH2+]C1	ZINC000299773973	372753090	/nfs/dbraw/zinc/75/30/90/372753090.db2.gz	HAZGNKQTIGDOMH-MRXNPFEDSA-N	1	0	276.380	1.158	50	0		CDAARO
CN(C)c1cccc(NC(=O)N2CC[C@H]([NH+](C)C)C2)c1	ZINC000299803120	372773026	/nfs/dbraw/zinc/77/30/26/372773026.db2.gz	XKPRVNGHSHOIRH-AWEZNQCLSA-N	1	0	276.384	1.920	50	0		CDAARO
O=C(NC[C@H]1CCC2(CC[NH2+]CC2)O1)c1ccco1	ZINC000299802810	372773082	/nfs/dbraw/zinc/77/30/82/372773082.db2.gz	WTILBKCJTLUREL-LLVKDONJSA-N	1	0	264.325	1.311	50	0		CDAARO
Cc1c[nH]cc1C(=O)N1CCC[C@@]2(CC[N@@H+](C)C2)C1	ZINC000581126004	372839679	/nfs/dbraw/zinc/83/96/79/372839679.db2.gz	RFTYOZBXWHIOGE-HNNXBMFYSA-N	1	0	261.369	1.881	50	0		CDAARO
C[NH+](C)CCNC(=O)c1scc2c1CCCC2	ZINC000000119128	373465039	/nfs/dbraw/zinc/46/50/39/373465039.db2.gz	WUIJZZKPGZRPHX-UHFFFAOYSA-N	1	0	252.383	1.918	50	0		CDAARO
CCCCS(=O)(=O)N1CC[C@@H]([NH+]2CCCCC2)C1	ZINC000341202084	373473829	/nfs/dbraw/zinc/47/38/29/373473829.db2.gz	BEFXZAHHADZALG-CYBMUJFWSA-N	1	0	274.430	1.677	50	0		CDAARO
[NH3+]CCCOC1CCN(C(=O)c2ccncc2Cl)CC1	ZINC000094070895	374812248	/nfs/dbraw/zinc/81/22/48/374812248.db2.gz	LVBQMIPVGHMBQQ-UHFFFAOYSA-N	1	0	297.786	1.705	50	0		CDAARO
CC(C)c1ccnc(N2CCO[C@H](CC[NH3+])C2)n1	ZINC000095353245	374887370	/nfs/dbraw/zinc/88/73/70/374887370.db2.gz	JGCCNVNFZHWMCI-LLVKDONJSA-N	1	0	250.346	1.154	50	0		CDAARO
CC(=O)N1CCN(CC[NH2+][C@@H](C)c2ccccc2C)CC1	ZINC000095420287	374922253	/nfs/dbraw/zinc/92/22/53/374922253.db2.gz	BJGVSEKWAZNOFT-HNNXBMFYSA-N	1	0	289.423	1.810	50	0		CDAARO
C[C@H](COc1cccc(F)c1)NC(=O)[C@@H]1CCCC[NH2+]1	ZINC000095426459	374927107	/nfs/dbraw/zinc/92/71/07/374927107.db2.gz	ZLSLKIDFLODKIK-RISCZKNCSA-N	1	0	280.343	1.851	50	0		CDAARO
Cc1cc(Cl)cc(C)c1C[NH2+]CCNS(C)(=O)=O	ZINC000095441222	374943164	/nfs/dbraw/zinc/94/31/64/374943164.db2.gz	HTKFWPMZIBVFNC-UHFFFAOYSA-N	1	0	290.816	1.596	50	0		CDAARO
CCOC(=O)C[C@H](C)SCC[N@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000095460232	374958062	/nfs/dbraw/zinc/95/80/62/374958062.db2.gz	WMIKAZSACAITDJ-RWMBFGLXSA-N	1	0	287.425	1.925	50	0		CDAARO
Cc1cc(NC(=O)C[NH2+][C@@H](C)c2ccncc2)n(C)n1	ZINC000095462530	374959351	/nfs/dbraw/zinc/95/93/51/374959351.db2.gz	GFHIFABXUJRLSO-NSHDSACASA-N	1	0	273.340	1.413	50	0		CDAARO
Cc1cc(NC(=O)C[NH2+][C@H](C)c2ccncc2)n(C)n1	ZINC000095462531	374959833	/nfs/dbraw/zinc/95/98/33/374959833.db2.gz	GFHIFABXUJRLSO-LLVKDONJSA-N	1	0	273.340	1.413	50	0		CDAARO
O=C(NCCN1CC[NH+](CC2CCC2)CC1)C1CCC1	ZINC000095404887	374908225	/nfs/dbraw/zinc/90/82/25/374908225.db2.gz	WKGQKVMEOGZZPA-UHFFFAOYSA-N	1	0	279.428	1.320	50	0		CDAARO
CCOC(=O)c1ccc(C[NH2+][C@H]2CCC(=O)N(C)C2)o1	ZINC000095988336	375048737	/nfs/dbraw/zinc/04/87/37/375048737.db2.gz	KJXNNFLWLCKLBJ-JTQLQIEISA-N	1	0	280.324	1.167	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCCN1C(=O)/C=C\c1cncc(F)c1	ZINC000493294771	375439151	/nfs/dbraw/zinc/43/91/51/375439151.db2.gz	WSRBQGVYEWUSNW-BAZLHCMFSA-N	1	0	277.343	1.962	50	0		CDAARO
NC(=O)c1ccc(/C=C\C(=O)N2CCCC[C@@H]2C[NH3+])cc1	ZINC000493315502	375441551	/nfs/dbraw/zinc/44/15/51/375441551.db2.gz	CRFZZMRVAOSYSF-DEBLGDTFSA-N	1	0	287.363	1.139	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)/C=C\c2ccccc2F)C1	ZINC000606441527	375823005	/nfs/dbraw/zinc/82/30/05/375823005.db2.gz	YSRUGJMNCAEABS-ZHRWSRJISA-N	1	0	262.328	1.907	50	0		CDAARO
C[C@H](CNC(=S)NC1CC1)[N@@H+]1CCCC[C@H]1C	ZINC000241693936	376018688	/nfs/dbraw/zinc/01/86/88/376018688.db2.gz	QIXTWBPORUQHCJ-GHMZBOCLSA-N	1	0	255.431	1.876	50	0		CDAARO
C[C@@H](C(=O)NCC(F)(F)F)[N@H+](C)C[C@H]1CCCCO1	ZINC000241942399	376022126	/nfs/dbraw/zinc/02/21/26/376022126.db2.gz	UMGFQTBMGKDCLS-VHSXEESVSA-N	1	0	282.306	1.554	50	0		CDAARO
Cc1ccc(C[N@H+]2CC[C@@H](N3CCOCC3)[C@H]2C)c(C)n1	ZINC000377648941	377050490	/nfs/dbraw/zinc/05/04/90/377050490.db2.gz	HFGHNDUDHIZSFL-NVXWUHKLSA-N	1	0	289.423	1.993	50	0		CDAARO
COCc1cc(CNc2nc(N(C)C)[nH+]c(C)c2C)[nH]n1	ZINC000067954743	377330043	/nfs/dbraw/zinc/33/00/43/377330043.db2.gz	MSTKJMUWJAIRGM-UHFFFAOYSA-N	1	0	290.371	1.641	50	0		CDAARO
Cc1ccccc1C[N@@H+]1CCCN(S(C)(=O)=O)CC1	ZINC000022892037	378665490	/nfs/dbraw/zinc/66/54/90/378665490.db2.gz	SVPYGKODUMTZNZ-UHFFFAOYSA-N	1	0	282.409	1.462	50	0		CDAARO
COCCC[NH2+]C[C@@H](O)COc1cccc2[nH]c(C)cc21	ZINC000004084739	184530943	/nfs/dbraw/zinc/53/09/43/184530943.db2.gz	NALDNEWIXOEXNR-CYBMUJFWSA-N	1	0	292.379	1.842	50	0		CDAARO
COCC[C@@H]1CCCC[N@H+](C[C@@H]2CCS(=O)(=O)C2)C1	ZINC000241965750	285144586	/nfs/dbraw/zinc/14/45/86/285144586.db2.gz	UVIGCKKYVRJHBO-KBPBESRZSA-N	1	0	289.441	1.560	50	0		CDAARO
O[C@@H]1c2ccccc2C[C@@H]1[N@@H+]1CCc2n[nH]cc2C1	ZINC000097034165	285339266	/nfs/dbraw/zinc/33/92/66/285339266.db2.gz	OLZWDSAQPFZIQJ-LSDHHAIUSA-N	1	0	255.321	1.426	50	0		CDAARO
CCc1cnc(NCCC[NH+]2CCC(O)CC2)nc1	ZINC000095387052	184963128	/nfs/dbraw/zinc/96/31/28/184963128.db2.gz	ATAFSPOYTMOENH-UHFFFAOYSA-N	1	0	264.373	1.298	50	0		CDAARO
Fc1cc(Br)cnc1N1CC[NH2+]CC1	ZINC000042684317	390429534	/nfs/dbraw/zinc/42/95/34/390429534.db2.gz	UUCKXISMUUDBLO-UHFFFAOYSA-N	1	0	260.110	1.393	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCNC(=O)CCN2CCCCO2)C1	ZINC000067446843	390572022	/nfs/dbraw/zinc/57/20/22/390572022.db2.gz	USHVKAUZTDXSHC-CQSZACIVSA-N	1	0	283.416	1.252	50	0		CDAARO
CCCc1nc2c(cnn2C)c(N2CC[NH2+][C@@H](C)C2)n1	ZINC000072156238	390625455	/nfs/dbraw/zinc/62/54/55/390625455.db2.gz	WTXRXMXBYDKLRO-JTQLQIEISA-N	1	0	274.372	1.114	50	0		CDAARO
CC(C)[C@H](O)C[N@@H+]1CC[C@@H]2[C@@H](CCC(=O)N2C2CC2)C1	ZINC000366596190	391404977	/nfs/dbraw/zinc/40/49/77/391404977.db2.gz	JQFASDZYGMLPOI-NWANDNLSSA-N	1	0	280.412	1.479	50	0		CDAARO
CO[C@@H]1CC[C@@]2(OC)CC[N@H+](Cc3[nH]cnc3C)[C@H]2C1	ZINC000299791142	391721791	/nfs/dbraw/zinc/72/17/91/391721791.db2.gz	CMJLGHHGYAEIRF-VHDGCEQUSA-N	1	0	279.384	1.877	50	0		CDAARO
COCCn1cc(C[NH2+][C@@H]2COC(C)(C)C2)cn1	ZINC000418158892	391769834	/nfs/dbraw/zinc/76/98/34/391769834.db2.gz	YNCMAXLWAXPXEX-LBPRGKRZSA-N	1	0	253.346	1.187	50	0		CDAARO
CC1(C)C[C@@H](O)CC[N@H+](CCCn2ccnc2)C1	ZINC000395349648	391807759	/nfs/dbraw/zinc/80/77/59/391807759.db2.gz	QZQIFXUTQFYYRH-ZDUSSCGKSA-N	1	0	251.374	1.756	50	0		CDAARO
C[C@@H]1CCN(S(C)(=O)=O)CC[N@@H+]1Cc1ccccc1	ZINC000098014182	391819475	/nfs/dbraw/zinc/81/94/75/391819475.db2.gz	RJZFTPCRSHCZAQ-CYBMUJFWSA-N	1	0	282.409	1.542	50	0		CDAARO
CC[C@@H]1COCCN1C(=O)C[C@@H]([NH3+])c1ccccc1	ZINC000036326650	392442556	/nfs/dbraw/zinc/44/25/56/392442556.db2.gz	JVASEWDVOCOGIL-ZIAGYGMSSA-N	1	0	262.353	1.714	50	0		CDAARO
CC1=CCC[C@H](C)[C@@H]1C[N@H+]1C[C@@H](C)O[C@@H](C(N)=O)C1	ZINC000249100770	392451095	/nfs/dbraw/zinc/45/10/95/392451095.db2.gz	PMKCMSBMXOZEQH-REWJHTLYSA-N	1	0	266.385	1.553	50	0		CDAARO
Cc1cc(Cl)ccc1S(=O)(=O)N1CCC([NH3+])CC1	ZINC000036753745	392957488	/nfs/dbraw/zinc/95/74/88/392957488.db2.gz	HWYPPGSNTRGZNT-UHFFFAOYSA-N	1	0	288.800	1.760	50	0		CDAARO
CCN1CC[NH+](C[C@@H](C)CNc2ncccc2F)CC1	ZINC000195575068	393304869	/nfs/dbraw/zinc/30/48/69/393304869.db2.gz	UWDCFJHZBQYYHU-ZDUSSCGKSA-N	1	0	280.391	1.906	50	0		CDAARO
Cc1cc(N(C)CCCO)nc(N2CCCCC2)[nH+]1	ZINC000065458207	134936983	/nfs/dbraw/zinc/93/69/83/134936983.db2.gz	QWXQBCJEASGSKM-UHFFFAOYSA-N	1	0	264.373	1.594	50	0		CDAARO
Cc1cc(=O)c(C(=O)N2CC[C@@H]([NH+]3CCCCC3)C2)c[nH]1	ZINC000220001228	140167739	/nfs/dbraw/zinc/16/77/39/140167739.db2.gz	YMZJYXGQCRMXBP-CYBMUJFWSA-N	1	0	289.379	1.384	50	0		CDAARO
O=C(Nc1ccc(Cl)cc1)N[C@@H]1[C@H]2C[NH2+]C[C@H]21	ZINC000252409564	140318729	/nfs/dbraw/zinc/31/87/29/140318729.db2.gz	KKCSWLBTOUZCAU-URLYPYJESA-N	1	0	251.717	1.679	50	0		CDAARO
Cc1nn2c(CN3CC[C@](C)(C[NH3+])C3)c(C)nc2s1	ZINC000261615181	140362685	/nfs/dbraw/zinc/36/26/85/140362685.db2.gz	CQAUHUZMNGZLEM-CYBMUJFWSA-N	1	0	279.413	1.578	50	0		CDAARO
Cc1ccc2[nH]cc(NC(=O)NCC[NH+](C)C)c(=O)c2c1	ZINC000004907873	170040086	/nfs/dbraw/zinc/04/00/86/170040086.db2.gz	FTSMAEBMIHUMHG-UHFFFAOYSA-N	1	0	288.351	1.520	50	0		CDAARO
C[NH2+]Cc1cccc(OCCN2CCOCC2)c1	ZINC000005177656	170074083	/nfs/dbraw/zinc/07/40/83/170074083.db2.gz	WLONZMUSMQJGID-UHFFFAOYSA-N	1	0	250.342	1.117	50	0		CDAARO
C[NH+](C)CCSc1nnc(-c2cccs2)n1N	ZINC000006177185	170180606	/nfs/dbraw/zinc/18/06/06/170180606.db2.gz	BGNBPBKJBTXMFV-UHFFFAOYSA-N	1	0	269.399	1.374	50	0		CDAARO
COc1cccc(C[NH2+]C2CCCCC2)c1OCC(N)=O	ZINC000006743127	170238547	/nfs/dbraw/zinc/23/85/47/170238547.db2.gz	YLRMWEVGAVFBJA-UHFFFAOYSA-N	1	0	292.379	1.982	50	0		CDAARO
COc1ccc(C2(C[NH2+]CCC(N)=O)CCOCC2)cc1	ZINC000006757478	170241445	/nfs/dbraw/zinc/24/14/45/170241445.db2.gz	DKBUVWOWOSBEID-UHFFFAOYSA-N	1	0	292.379	1.208	50	0		CDAARO
O=C(C[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1)NC(=O)NC1CC1	ZINC000008267134	170327375	/nfs/dbraw/zinc/32/73/75/170327375.db2.gz	XFOVAHPTPXAMRY-NWDGAFQWSA-N	1	0	279.384	1.487	50	0		CDAARO
CC(C)[C@H](NC(=O)CC[NH3+])c1nc2ccccc2[nH]1	ZINC000008992943	170361107	/nfs/dbraw/zinc/36/11/07/170361107.db2.gz	BHRPPZWANRLVHM-ZDUSSCGKSA-N	1	0	260.341	1.725	50	0		CDAARO
COc1cc(C)c(CN2CC[NH2+]CC2)cc1OC	ZINC000019770106	170856551	/nfs/dbraw/zinc/85/65/51/170856551.db2.gz	PAPSIFSFDBSMHX-UHFFFAOYSA-N	1	0	250.342	1.417	50	0		CDAARO
COc1ccc(OC)c(C[NH2+]CCNC(=O)C(C)C)c1	ZINC000020125363	171008393	/nfs/dbraw/zinc/00/83/93/171008393.db2.gz	LHQMELNAZLAXEZ-UHFFFAOYSA-N	1	0	280.368	1.566	50	0		CDAARO
Cc1nc(C(=O)NCCC[N@@H+]2CCC[C@H](CO)C2)cs1	ZINC000020232520	171094760	/nfs/dbraw/zinc/09/47/60/171094760.db2.gz	QCMFRIMIEWEPNT-LBPRGKRZSA-N	1	0	297.424	1.276	50	0		CDAARO
CC(C)OC[C@@H](O)C[NH+]1CCN(Cc2ccccc2)CC1	ZINC000020234162	171095149	/nfs/dbraw/zinc/09/51/49/171095149.db2.gz	XRZBMJMYZAJPFV-KRWDZBQOSA-N	1	0	292.423	1.590	50	0		CDAARO
Cc1ccsc1CN(C)C(=O)[C@@H]1C[N@H+](C)CC[C@H]1O	ZINC000020234498	171095511	/nfs/dbraw/zinc/09/55/11/171095511.db2.gz	GWNRKHMKZDKXMG-VXGBXAGGSA-N	1	0	282.409	1.328	50	0		CDAARO
Cc1c(O)ccc2c(CN3CC[NH+](C)CC3)cc(=O)oc12	ZINC000020412511	171183447	/nfs/dbraw/zinc/18/34/47/171183447.db2.gz	KKPBGCGKSZRATO-UHFFFAOYSA-N	1	0	288.347	1.554	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2ccccc2OC)CC1	ZINC000020608846	171267367	/nfs/dbraw/zinc/26/73/67/171267367.db2.gz	PPUIWJNZDKKYJN-UHFFFAOYSA-N	1	0	277.368	1.271	50	0		CDAARO
O=C(C[N@@H+]1CCC[C@@H]1c1ccccc1)N1CCNC1=O	ZINC000021417033	171303811	/nfs/dbraw/zinc/30/38/11/171303811.db2.gz	JBWDUFVSPOTILO-CYBMUJFWSA-N	1	0	273.336	1.375	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COc2ccc(C)c(C)c2)CC1	ZINC000021486893	171304447	/nfs/dbraw/zinc/30/44/47/171304447.db2.gz	XZKJGRNQGJJLJN-INIZCTEOSA-N	1	0	292.423	1.681	50	0		CDAARO
CC(C)C(=O)NC[C@H](c1ccsc1)N1CC[NH+](C)CC1	ZINC000022459820	171388065	/nfs/dbraw/zinc/38/80/65/171388065.db2.gz	KYSIMVUAPOYARS-CQSZACIVSA-N	1	0	295.452	1.809	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)c1ccc(=O)[nH]n1)c1ccccc1	ZINC000022622846	171394861	/nfs/dbraw/zinc/39/48/61/171394861.db2.gz	XLSBBMBYGBECJT-ZDUSSCGKSA-N	1	0	286.335	1.215	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)NC2CCCCC2)CC1	ZINC000038489552	174142630	/nfs/dbraw/zinc/14/26/30/174142630.db2.gz	ZDSQPHGDYFCIGH-UHFFFAOYSA-N	1	0	297.443	1.977	50	0		CDAARO
OCC(CO)[N@@H+]1CCC[C@@H](CCc2ccc(F)c(F)c2)C1	ZINC000071499075	176191916	/nfs/dbraw/zinc/19/19/16/176191916.db2.gz	FSOVEQOMSDOHHT-ZDUSSCGKSA-N	1	0	299.361	1.963	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)CCc1ccc(F)cc1	ZINC000071572199	176198132	/nfs/dbraw/zinc/19/81/32/176198132.db2.gz	YLUAGXKFYDAFDW-LLVKDONJSA-N	1	0	250.317	1.579	50	0		CDAARO
COCC1(NC(=O)[C@H]([NH3+])c2ccccc2)CCCC1	ZINC000071746466	176258436	/nfs/dbraw/zinc/25/84/36/176258436.db2.gz	FCJXVWUUUALZBS-CYBMUJFWSA-N	1	0	262.353	1.762	50	0		CDAARO
O=C([O-])[C@H]1CC2(C[N@@H+]1CCc1ccccc1)CC[NH2+]CC2	ZINC000072135201	176322341	/nfs/dbraw/zinc/32/23/41/176322341.db2.gz	FQXYEVURLQSPMY-OAHLLOKOSA-N	1	0	288.391	1.758	50	0		CDAARO
O=C(Cc1cccc(Cl)c1)NC[C@]1(O)CCC[NH2+]CC1	ZINC000072174176	176333718	/nfs/dbraw/zinc/33/37/18/176333718.db2.gz	NQOFDJUMAQYEPP-HNNXBMFYSA-N	1	0	296.798	1.503	50	0		CDAARO
O[C@]1(CN(Cc2cccnc2)Cc2cccnc2)CC[NH2+]C1	ZINC000072406730	176398056	/nfs/dbraw/zinc/39/80/56/176398056.db2.gz	MIEAHDMUBSZJBJ-QGZVFWFLSA-N	1	0	298.390	1.203	50	0		CDAARO
Cc1ccc(C)c(N2CCN(C[C@]3(O)CC[NH2+]C3)CC2)c1	ZINC000077301540	177250838	/nfs/dbraw/zinc/25/08/38/177250838.db2.gz	UYZJQWNRTXBEQF-KRWDZBQOSA-N	1	0	289.423	1.150	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)c1cc(C)nc2ccc(C)cc21	ZINC000077341564	177254600	/nfs/dbraw/zinc/25/46/00/177254600.db2.gz	DRGSSFINYRDZBG-HOTGVXAUSA-N	1	0	299.374	1.568	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1cc(Cl)c(Cl)n1C	ZINC000126316517	274604433	/nfs/dbraw/zinc/60/44/33/274604433.db2.gz	UXOFYZKDNOWEGV-ZETCQYMHSA-N	1	0	276.167	1.766	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@@]2(C[C@H](C[NH3+])CO2)C1	ZINC000091303591	275519292	/nfs/dbraw/zinc/51/92/92/275519292.db2.gz	CYIJGWKOFZHWLD-BXUZGUMPSA-N	1	0	270.373	1.751	50	0		CDAARO
COC(=O)N1CCC([NH2+][C@H](C)[C@@H]2CCCOC2)CC1	ZINC000096003152	277071115	/nfs/dbraw/zinc/07/11/15/277071115.db2.gz	PKPBMXWLQXWKAL-VXGBXAGGSA-N	1	0	270.373	1.622	50	0		CDAARO
C[C@@H](CO)[NH+]1CCC2(CC1)Nc1ccccc1NC2=O	ZINC000082146734	278288959	/nfs/dbraw/zinc/28/89/59/278288959.db2.gz	XACOOCQMADGGNQ-NSHDSACASA-N	1	0	275.352	1.266	50	0		CDAARO
C[C@@H](Cn1cncn1)[NH2+][C@@H](C)c1ccc2c(c1)OCCO2	ZINC000095421181	278302179	/nfs/dbraw/zinc/30/21/79/278302179.db2.gz	JHBWOEMLFHMZSK-RYUDHWBXSA-N	1	0	288.351	1.789	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN([C@H](C[NH3+])C(F)(F)F)CC1	ZINC000159832745	278400305	/nfs/dbraw/zinc/40/03/05/278400305.db2.gz	ZORBXJGFWLAHBD-SECBINFHSA-N	1	0	297.321	1.429	50	0		CDAARO
CC(C)C[C@H](C[NH3+])NS(=O)(=O)c1ccc(F)cc1	ZINC000095394025	279141958	/nfs/dbraw/zinc/14/19/58/279141958.db2.gz	FDRNHRYULKUPBS-LLVKDONJSA-N	1	0	274.361	1.477	50	0		CDAARO
Cc1nc(C(F)(F)F)ncc1CN1CC[NH2+]C[C@H]1C	ZINC000426701590	281855885	/nfs/dbraw/zinc/85/58/85/281855885.db2.gz	KBLFAMZTFJETQF-MRVPVSSYSA-N	1	0	274.290	1.598	50	0		CDAARO
CN(C)CC[NH2+][C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000022798647	289164735	/nfs/dbraw/zinc/16/47/35/289164735.db2.gz	JAPWWRPJNWOXFE-GFCCVEGCSA-N	1	0	271.405	1.537	50	0		CDAARO
C[C@@H]1CN(C(=O)/C=C\c2ccc3c(c2)CCO3)C[C@@H](C)[NH2+]1	ZINC000255145245	289358936	/nfs/dbraw/zinc/35/89/36/289358936.db2.gz	DEKQJCJFGBWWME-FSMZVQOTSA-N	1	0	286.375	1.844	50	0		CDAARO
C[C@H]1CN(C)c2ccccc2N(C(=O)[C@H]2CC[NH2+]C2)C1	ZINC000269273843	300229498	/nfs/dbraw/zinc/22/94/98/300229498.db2.gz	YYRYXWQJDRQPFZ-STQMWFEESA-N	1	0	273.380	1.715	50	0		CDAARO
C[NH+](C)C[C@@H]1CN(Cc2ccc3c[nH]nc3c2)CCO1	ZINC000179220520	315972978	/nfs/dbraw/zinc/97/29/78/315972978.db2.gz	MHDDMZQKICUJFF-CQSZACIVSA-N	1	0	274.368	1.325	50	0		CDAARO
Cc1cc(C)c2c(c1)C(=O)N1C[C@H]([NH+](C)C)C[C@H]1C(=O)N2	ZINC000534579070	328311133	/nfs/dbraw/zinc/31/11/33/328311133.db2.gz	MHOLUZNKSLQDJD-YPMHNXCESA-N	1	0	287.363	1.400	50	0		CDAARO
O=C(N[C@H]1COC[C@@H]1[NH+]1CCCC1)c1ccc(F)c(O)c1	ZINC000534632370	328331906	/nfs/dbraw/zinc/33/19/06/328331906.db2.gz	OJHVZNUGINKJPZ-STQMWFEESA-N	1	0	294.326	1.124	50	0		CDAARO
Cc1cc(N2CC[C@H]3C[NH2+]C[C@H]32)nc(-c2cccnc2)n1	ZINC000534637897	328334492	/nfs/dbraw/zinc/33/44/92/328334492.db2.gz	ZZPRVSDIFYNXBB-GXTWGEPZSA-N	1	0	281.363	1.645	50	0		CDAARO
O=C(NCCCc1ccccc1Cl)[C@H]1C=CC[NH2+]1	ZINC000534637843	328334689	/nfs/dbraw/zinc/33/46/89/328334689.db2.gz	PTQKTMQNBJOBQU-CYBMUJFWSA-N	1	0	264.756	1.917	50	0		CDAARO
O=C(NCc1ccc2c(c1)CCCO2)[C@@H]1C=CC[NH2+]1	ZINC000534653652	328338501	/nfs/dbraw/zinc/33/85/01/328338501.db2.gz	VESRVZWBZKEGKH-ZDUSSCGKSA-N	1	0	258.321	1.156	50	0		CDAARO
O=C(NCCCc1nc2ccccc2s1)[C@H]1C=CC[NH2+]1	ZINC000534653605	328338521	/nfs/dbraw/zinc/33/85/21/328338521.db2.gz	ZEGUQUKDYPTHOB-GFCCVEGCSA-N	1	0	287.388	1.873	50	0		CDAARO
C[N@H+](CC(=O)NCC[C@H]1CCCOC1)C1CCCC1	ZINC000534676119	328356283	/nfs/dbraw/zinc/35/62/83/328356283.db2.gz	CVOLYVLNBAWOBJ-CYBMUJFWSA-N	1	0	268.401	1.794	50	0		CDAARO
Cc1cc(NC(=O)[C@@H]([NH2+]C2CCOCC2)C(C)C)n(C)n1	ZINC000097238099	323208015	/nfs/dbraw/zinc/20/80/15/323208015.db2.gz	NRHXKIIVKXDJDG-AWEZNQCLSA-N	1	0	294.399	1.460	50	0		CDAARO
CCOC(=O)c1nnn(C2CC[NH2+]CC2)c1C(F)F	ZINC000536952957	330382624	/nfs/dbraw/zinc/38/26/24/330382624.db2.gz	MFGQKMIPZHOGEG-UHFFFAOYSA-N	1	0	274.271	1.317	50	0		CDAARO
C[C@H](CC(N)=O)[NH2+]CC1(c2c(F)cccc2F)CC1	ZINC000090965250	482522269	/nfs/dbraw/zinc/52/22/69/482522269.db2.gz	UGPYTHPUKQDSIX-SECBINFHSA-N	1	0	268.307	1.850	50	0		CDAARO
Cc1nc(C)c(C[NH2+]CC2(C(N)=O)CCOCC2)s1	ZINC000086250625	482706597	/nfs/dbraw/zinc/70/65/97/482706597.db2.gz	NOBCMCLANBLXMA-UHFFFAOYSA-N	1	0	283.397	1.132	50	0		CDAARO
CC(C)c1nnc(NCC[N@@H+]2CCC[C@@H](CO)C2)s1	ZINC000670435554	482971782	/nfs/dbraw/zinc/97/17/82/482971782.db2.gz	YQYUEYDRQLFCBM-LLVKDONJSA-N	1	0	284.429	1.778	50	0		CDAARO
CN(Cc1nncn1C)[C@H]1CCN(c2ccc(F)cc2)C1	ZINC000670437992	482980283	/nfs/dbraw/zinc/98/02/83/482980283.db2.gz	ZZBJKLFDIXRXQP-AWEZNQCLSA-N	1	0	289.358	1.665	50	0		CDAARO
COCC[C@@H]1C[N@@H+](C2Cc3ccccc3C2)CCO1	ZINC000670439692	482984284	/nfs/dbraw/zinc/98/42/84/482984284.db2.gz	AXGIXCNFJJXGQK-MRXNPFEDSA-N	1	0	261.365	1.891	50	0		CDAARO
CC(C)[N@@H+]1CCO[C@H](CC(=O)NCCC2(O)CCCC2)C1	ZINC000670447702	483001438	/nfs/dbraw/zinc/00/14/38/483001438.db2.gz	JUNLXKCSGOQRCA-CQSZACIVSA-N	1	0	298.427	1.297	50	0		CDAARO
Cc1cc(C)n(CC[N@H+](C)CC[C@H]2CCS(=O)(=O)C2)n1	ZINC000670462189	483047404	/nfs/dbraw/zinc/04/74/04/483047404.db2.gz	CSPVQQOZUWRIGH-AWEZNQCLSA-N	1	0	299.440	1.257	50	0		CDAARO
[NH3+]CCCCn1cnc2cccc(Cl)c2c1=O	ZINC000670474140	483084507	/nfs/dbraw/zinc/08/45/07/483084507.db2.gz	NVRPFTXWUJUESV-UHFFFAOYSA-N	1	0	251.717	1.789	50	0		CDAARO
COCCCCCN1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1	ZINC000083877874	483216119	/nfs/dbraw/zinc/21/61/19/483216119.db2.gz	MUFPQOBJDLKDNE-OAHLLOKOSA-N	1	0	297.443	1.042	50	0		CDAARO
C[C@H](CO)NC(=O)NC[C@H](c1ccc(Cl)cc1)[NH+](C)C	ZINC000084640293	483304601	/nfs/dbraw/zinc/30/46/01/483304601.db2.gz	ODAPDMHQAFDRFU-ZWNOBZJWSA-N	1	0	299.802	1.623	50	0		CDAARO
Cn1c(CC[NH3+])nnc1SCC[C@H]1CC1(F)F	ZINC000426698265	534683458	/nfs/dbraw/zinc/68/34/58/534683458.db2.gz	NTEHKBLYJYEZJD-ZETCQYMHSA-N	1	0	262.329	1.454	50	0		CDAARO
CC[C@H]1CN([C@H](C)c2nc(C)no2)CC[N@@H+]1CCOC	ZINC000106777180	529301007	/nfs/dbraw/zinc/30/10/07/529301007.db2.gz	KZKNJMURWDHMCV-YPMHNXCESA-N	1	0	282.388	1.482	50	0		CDAARO
Cn1cccc1C(=O)NC(=O)C[NH+]1CCCCCC1	ZINC000009593189	538217429	/nfs/dbraw/zinc/21/74/29/538217429.db2.gz	UBZLITQCPDVMHA-UHFFFAOYSA-N	1	0	263.341	1.158	50	0		CDAARO
CC1(C)OC[C@H](c2cn(CCCCC[NH3+])nn2)O1	ZINC000958528055	614840334	/nfs/dbraw/zinc/84/03/34/614840334.db2.gz	RASYZPBITWCCPZ-LLVKDONJSA-N	1	0	254.334	1.231	50	0		CDAARO
CCn1ncnc1CN(C)CC[N@H+](C)C1CCCC1	ZINC000952965729	615734844	/nfs/dbraw/zinc/73/48/44/615734844.db2.gz	CDLBAFFQIUVGJW-UHFFFAOYSA-N	1	0	265.405	1.604	50	0		CDAARO
O=C(N[C@H]1C[NH+]2CCC1CC2)c1cccc(CO)c1	ZINC000888095708	617756890	/nfs/dbraw/zinc/75/68/90/617756890.db2.gz	DEMWXYAXGKDAKH-AWEZNQCLSA-N	1	0	260.337	1.003	50	0		CDAARO
C[C@H](C[C@H]1CCC(=O)N1)[NH2+]C[C@H]1CCOC(C)(C)C1	ZINC000926557017	618066647	/nfs/dbraw/zinc/06/66/47/618066647.db2.gz	FKBHZDYYWXTCIJ-FRRDWIJNSA-N	1	0	268.401	1.838	50	0		CDAARO
CNCc1nnc(NCCC[N@H+](C)C2CCCC2)o1	ZINC001772702817	1159437692	/nfs/dbraw/zinc/43/76/92/1159437692.db2.gz	DZBVKKYERDZPDQ-UHFFFAOYSA-N	1	0	267.377	1.465	50	0		CDAARO
CCC[N@@H+]1CC[C@@H](Nc2ncc(F)c(N(C)C)n2)C1	ZINC001772712044	1159445130	/nfs/dbraw/zinc/44/51/30/1159445130.db2.gz	GMTRTHXKQUHROU-SNVBAGLBSA-N	1	0	267.352	1.578	50	0		CDAARO
CCNC(=O)c1ccnc(NCC(C)(C)[N@H+](C)CC)c1	ZINC001704307498	1177681754	/nfs/dbraw/zinc/68/17/54/1177681754.db2.gz	HZCWOXWCSJVCML-UHFFFAOYSA-N	1	0	278.400	1.974	50	0		CDAARO
C[C@@H](C[N@H+](C)CCn1cc(Cl)cn1)N1CCOCC1	ZINC001704352041	1177699464	/nfs/dbraw/zinc/69/94/64/1177699464.db2.gz	OGXMZRDQAPDCLN-LBPRGKRZSA-N	1	0	286.807	1.189	50	0		CDAARO
Cc1ccc2c(c1)ncn(CC[N@@H+]1CCC[C@H](O)C1)c2=O	ZINC000032540588	755535881	/nfs/dbraw/zinc/53/58/81/755535881.db2.gz	VNYYULOPTJECGY-ZDUSSCGKSA-N	1	0	287.363	1.162	50	0		CDAARO
CCc1ccc(CN2CC[N@H+](C)[C@@H](CCO)C2)cc1	ZINC000023360970	757239102	/nfs/dbraw/zinc/23/91/02/757239102.db2.gz	JONWZNVZVXBIFR-INIZCTEOSA-N	1	0	262.397	1.747	50	0		CDAARO
Cc1cc(N2CCN(C3CCCCC3)C(=O)C2)nc(N)[nH+]1	ZINC000032507807	757631414	/nfs/dbraw/zinc/63/14/14/757631414.db2.gz	FCWXQPDJQNNGBD-UHFFFAOYSA-N	1	0	289.383	1.349	50	0		CDAARO
CC(C)Cn1c(C[NH3+])nnc1Sc1cnccn1	ZINC000426707469	757972536	/nfs/dbraw/zinc/97/25/36/757972536.db2.gz	SAAHSQWRTLYWTA-UHFFFAOYSA-N	1	0	264.358	1.334	50	0		CDAARO
CC(C)[C@@H](CO)NC(=O)[C@@H]1CCC[N@@H+]2CCCC[C@H]12	ZINC000952878993	910436250	/nfs/dbraw/zinc/43/62/50/910436250.db2.gz	FLROTBLOAMAVDB-MGPQQGTHSA-N	1	0	268.401	1.384	50	0		CDAARO
C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1ccc(OCCO)cc1	ZINC000952884888	910458431	/nfs/dbraw/zinc/45/84/31/910458431.db2.gz	OTDLDEAFNLYKHH-STQMWFEESA-N	1	0	292.379	1.222	50	0		CDAARO
C[C@H](C[NH+]1CCCC1)c1nc(CC(N)=O)nn1C(C)(C)C	ZINC000822276830	925614564	/nfs/dbraw/zinc/61/45/64/925614564.db2.gz	SBWYTSMFCUMMMJ-LLVKDONJSA-N	1	0	293.415	1.260	50	0		CDAARO
CN(Cc1ccnn1C)C[C@@H]1CC[N@H+](C)C1(C)C	ZINC000823715245	925723219	/nfs/dbraw/zinc/72/32/19/925723219.db2.gz	ZFJADAWNPVYYBZ-LBPRGKRZSA-N	1	0	250.390	1.582	50	0		CDAARO
CCN(CC)C(=O)N1CC([N@H+](CC)C2CCOCC2)C1	ZINC000581794916	927202030	/nfs/dbraw/zinc/20/20/30/927202030.db2.gz	YATVQVULWIHHQA-UHFFFAOYSA-N	1	0	283.416	1.633	50	0		CDAARO
O=C(NCc1nccs1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21	ZINC000585122140	930988521	/nfs/dbraw/zinc/98/85/21/930988521.db2.gz	OMFJSSWRPHVFCR-QWRGUYRKSA-N	1	0	265.382	1.776	50	0		CDAARO
C[N@@H+]1CCC[C@H]1CCC(=O)NCc1nccs1	ZINC000585121814	930988872	/nfs/dbraw/zinc/98/88/72/930988872.db2.gz	AWVSNTSCJPHCNA-JTQLQIEISA-N	1	0	253.371	1.634	50	0		CDAARO
Cc1c(CNC(=O)[C@H]2CC[N@@H+]2C(C)(C)C)cnn1C	ZINC000585132220	931026244	/nfs/dbraw/zinc/02/62/44/931026244.db2.gz	QTFREZVSNCRUQV-GFCCVEGCSA-N	1	0	264.373	1.218	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@@H+](C3Cc4ccccc4C3)C[C@@H]2O)on1	ZINC001529125968	968988886	/nfs/dbraw/zinc/98/88/86/968988886.db2.gz	FSLNFOMDUDJUGF-QAPCUYQASA-N	1	0	298.386	1.986	50	0		CDAARO
COc1nc(N(C)CC[C@@H](C)[NH+]2CCCC2)ncc1F	ZINC001529180687	969007474	/nfs/dbraw/zinc/00/74/74/969007474.db2.gz	ILYGFPHQGDJFFF-LLVKDONJSA-N	1	0	282.363	1.935	50	0		CDAARO
C[NH+](C)CCc1nnc(NC(=O)Cn2cccc2)s1	ZINC001529195927	969011563	/nfs/dbraw/zinc/01/15/63/969011563.db2.gz	QYGOAIJXVVOMTP-UHFFFAOYSA-N	1	0	279.369	1.082	50	0		CDAARO
CC[C@@H]1CN(CCc2nccn2C)CC[N@@H+]1C(C)C	ZINC001506403743	975150542	/nfs/dbraw/zinc/15/05/42/975150542.db2.gz	VLZTZPGOORSXOQ-CQSZACIVSA-N	1	0	264.417	1.767	50	0		CDAARO
Cc1c(NC(=O)[C@H](C)C[NH+]2CCCCC2)cnn1C	ZINC001506401948	975150659	/nfs/dbraw/zinc/15/06/59/975150659.db2.gz	HHGPJPRWLNGJNY-LLVKDONJSA-N	1	0	264.373	1.789	50	0		CDAARO
CCC[N@@H+]1CCCN(CCn2cnnc2C)CC1	ZINC001506404389	975152196	/nfs/dbraw/zinc/15/21/96/975152196.db2.gz	DBIXBRIKYDCWOH-UHFFFAOYSA-N	1	0	251.378	1.004	50	0		CDAARO
CN(Cc1nc2cc(Cl)ccc2[nH]1)C(=O)[C@@H]1CCC[NH2+]1	ZINC001506408759	975152781	/nfs/dbraw/zinc/15/27/81/975152781.db2.gz	PPVVNOCJDGSHNR-NSHDSACASA-N	1	0	292.770	1.927	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(c2ncc(F)c(N3CCCC3)n2)C1	ZINC001506416756	975155586	/nfs/dbraw/zinc/15/55/86/975155586.db2.gz	LOCQEBCMWLECDW-LBPRGKRZSA-N	1	0	293.390	1.746	50	0		CDAARO
C[C@H](CN(C)C(=O)Cn1ccc(=O)cc1)C[NH+]1CCCC1	ZINC001506414883	975156266	/nfs/dbraw/zinc/15/62/66/975156266.db2.gz	IULMDQCYCVVFJR-CQSZACIVSA-N	1	0	291.395	1.039	50	0		CDAARO
CC(=O)N[C@@H]1CC[N@H+](CCc2nc3cc(C)ccc3[nH]2)C1	ZINC001506418864	975156707	/nfs/dbraw/zinc/15/67/07/975156707.db2.gz	KFRKUEPKDFIKNE-CYBMUJFWSA-N	1	0	286.379	1.624	50	0		CDAARO
Cc1c[nH+]ccc1NCCNc1ncc(Cl)cn1	ZINC001506421516	975158122	/nfs/dbraw/zinc/15/81/22/975158122.db2.gz	ISIPNZGDUAWPFE-UHFFFAOYSA-N	1	0	263.732	1.779	50	0		CDAARO
Cc1cccnc1N1CC[N@@H+](CC(C)C)[C@@H](CCO)C1	ZINC001506423285	975159208	/nfs/dbraw/zinc/15/92/08/975159208.db2.gz	DZXVCGVBRHIPRO-HNNXBMFYSA-N	1	0	277.412	1.919	50	0		CDAARO
CN1C[C@@H]([NH2+]C2CSCCSC2)CCC1=O	ZINC001506426875	975160761	/nfs/dbraw/zinc/16/07/61/975160761.db2.gz	TZSMTIKATLBAHW-VIFPVBQESA-N	1	0	260.428	1.045	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)CCc1nc(-c2ccoc2)no1	ZINC000124345757	187133777	/nfs/dbraw/zinc/13/37/77/187133777.db2.gz	YFTZGKQQYNLBFL-SNVBAGLBSA-N	1	0	290.323	1.083	50	0		CDAARO
COc1ccc2c(c1)C[C@H]([NH2+]CCc1ncnn1C)CC2	ZINC000584903489	341987274	/nfs/dbraw/zinc/98/72/74/341987274.db2.gz	GYXCZENSKMAUQM-CQSZACIVSA-N	1	0	286.379	1.513	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)/C=C/c1ccc(-n2ccnc2)cc1	ZINC000124469841	187138736	/nfs/dbraw/zinc/13/87/36/187138736.db2.gz	NSQVXHDSSXLMRW-BTKRWWFXSA-N	1	0	296.374	1.706	50	0		CDAARO
CN(C)C(=O)OCC[N@H+](C)[C@@H]1CCCc2c1cnn2C	ZINC000097373632	342002710	/nfs/dbraw/zinc/00/27/10/342002710.db2.gz	YVAOFWRYEZWLNF-GFCCVEGCSA-N	1	0	280.372	1.428	50	0		CDAARO
Cc1noc(C)c1CC(=O)N1CCC[C@@H]1C[NH+]1CCCC1	ZINC000095956047	185042696	/nfs/dbraw/zinc/04/26/96/185042696.db2.gz	XKICSXQGYQBIQJ-CQSZACIVSA-N	1	0	291.395	1.921	50	0		CDAARO
COc1ccc(C[N@@H+]2C[C@H](C(N)=O)CC[C@H]2C)c(OC)c1	ZINC000095982666	185053732	/nfs/dbraw/zinc/05/37/32/185053732.db2.gz	DBPIUQSOSNEJGU-DGCLKSJQSA-N	1	0	292.379	1.790	50	0		CDAARO
CN1CC[N@H+](C)Cc2ccc(NC(=O)c3cnccn3)cc21	ZINC000095986348	185056162	/nfs/dbraw/zinc/05/61/62/185056162.db2.gz	ANYIEZMHZACOMQ-UHFFFAOYSA-N	1	0	297.362	1.611	50	0		CDAARO
Cc1nsc(NC2CCN(c3nccn3C)CC2)n1	ZINC000239782592	361747051	/nfs/dbraw/zinc/74/70/51/361747051.db2.gz	CPNKONBWHCGPQA-UHFFFAOYSA-N	1	0	278.385	1.661	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](NC(=O)CC2Cc3ccccc3C2)C1	ZINC000240825091	361751222	/nfs/dbraw/zinc/75/12/22/361751222.db2.gz	QMRWLMJRDMEUKR-CABCVRRESA-N	1	0	258.365	1.788	50	0		CDAARO
C[C@@](O)(C[N@@H+]1CCC[C@@H](Cn2ccnn2)C1)C(F)(F)F	ZINC000241587905	361753232	/nfs/dbraw/zinc/75/32/32/361753232.db2.gz	OYBLWSZGJUEHQP-GHMZBOCLSA-N	1	0	292.305	1.303	50	0		CDAARO
CC(C)Oc1ccccc1CC(=O)N1CC[NH2+]C[C@H]1C	ZINC000125189566	187174273	/nfs/dbraw/zinc/17/42/73/187174273.db2.gz	LWXBTRMBCGWOFY-CYBMUJFWSA-N	1	0	276.380	1.837	50	0		CDAARO
O=C(NCc1cccc(OCC(F)F)n1)[C@H]1CCC[NH2+]1	ZINC000195555033	342626177	/nfs/dbraw/zinc/62/61/77/342626177.db2.gz	KLRGJYSEGMSIFW-SNVBAGLBSA-N	1	0	285.294	1.094	50	0		CDAARO
Cc1nc(CC[N@H+]2CCC[C@]3(CN(C)C(=O)O3)C2)cs1	ZINC000244659836	361855112	/nfs/dbraw/zinc/85/51/12/361855112.db2.gz	HJTPNSZQKOZLBM-AWEZNQCLSA-N	1	0	295.408	1.911	50	0		CDAARO
CCn1cc(C[N@H+](C)[C@@H]2Cc3ccccc3[C@@H]2O)cn1	ZINC000097034111	185157324	/nfs/dbraw/zinc/15/73/24/185157324.db2.gz	RNHQKNQMJUQKCG-CVEARBPZSA-N	1	0	271.364	1.993	50	0		CDAARO
COc1ccc(C[N@H+](C)CCn2cnnc2)cc1OC	ZINC000093808149	539036150	/nfs/dbraw/zinc/03/61/50/539036150.db2.gz	FWBWNAWCFCYZDZ-UHFFFAOYSA-N	1	0	276.340	1.427	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)COc1ccc(F)c(Cl)c1	ZINC000125902807	187204203	/nfs/dbraw/zinc/20/42/03/187204203.db2.gz	ZKHKJUVPRWJLPQ-VIFPVBQESA-N	1	0	286.734	1.678	50	0		CDAARO
CCc1ccc(C(=O)NCC2([NH+](C)C)CCOCC2)[nH]1	ZINC000426374437	529602910	/nfs/dbraw/zinc/60/29/10/529602910.db2.gz	VRBFKQQRTVQQIQ-UHFFFAOYSA-N	1	0	279.384	1.418	50	0		CDAARO
Cc1cc(-c2cnc3ncnn3c2[C@H]2CCC[NH2+]C2)on1	ZINC000095629435	343654457	/nfs/dbraw/zinc/65/44/57/343654457.db2.gz	WZRDXKDISPFCFD-JTQLQIEISA-N	1	0	284.323	1.555	50	0		CDAARO
Cc1ccc(OCCC(=O)N(C)[C@@H]2CC[NH2+]C2)c(C)c1	ZINC000179089187	362254027	/nfs/dbraw/zinc/25/40/27/362254027.db2.gz	FUVLQRGQNCDCGU-CQSZACIVSA-N	1	0	276.380	1.893	50	0		CDAARO
O[C@H]1CN(CCc2ccccn2)C[C@@H]1[NH+]1CCCCC1	ZINC000252489393	362387398	/nfs/dbraw/zinc/38/73/98/362387398.db2.gz	JQAIRQUVKJSWOY-HOTGVXAUSA-N	1	0	275.396	1.155	50	0		CDAARO
Cc1cccc(O[C@@H](C)C(=O)N2CCC[C@@H]([NH3+])C2)c1	ZINC000191365708	362427100	/nfs/dbraw/zinc/42/71/00/362427100.db2.gz	VAISZUWMUPEBKS-QWHCGFSZSA-N	1	0	262.353	1.712	50	0		CDAARO
NC(=O)C1([NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)CC1	ZINC000191488163	362444496	/nfs/dbraw/zinc/44/44/96/362444496.db2.gz	OUWFZWYPIFMUAG-JGVFFNPUSA-N	1	0	250.264	1.715	50	0		CDAARO
COCc1cc(CN(C)[C@H]2CC[N@H+](C)C2)ccc1OC	ZINC000230491345	345082824	/nfs/dbraw/zinc/08/28/24/345082824.db2.gz	YTLVWSPVMXRUPJ-HNNXBMFYSA-N	1	0	278.396	1.978	50	0		CDAARO
COc1ccc([C@@H]2CN(C)C(=O)[C@@]23CCC[NH2+]C3)cc1	ZINC000044137130	345421564	/nfs/dbraw/zinc/42/15/64/345421564.db2.gz	DXBJNJAMXPGLDM-GOEBONIOSA-N	1	0	274.364	1.621	50	0		CDAARO
CCCCCS(=O)(=O)N(C)[C@@H]1CC[N@H+](C)[C@H](C)C1	ZINC000097115498	185540226	/nfs/dbraw/zinc/54/02/26/185540226.db2.gz	GTWPBCMDLOQUKW-CHWSQXEVSA-N	1	0	276.446	1.921	50	0		CDAARO
CC(C)c1cc(N2CCO[C@H](CC[NH3+])C2)ncn1	ZINC000095372906	136516578	/nfs/dbraw/zinc/51/65/78/136516578.db2.gz	AXYNZIQLCRDKIH-LLVKDONJSA-N	1	0	250.346	1.154	50	0		CDAARO
O=C1NC2(CC[NH2+]CC2)NN1c1cccc(Cl)c1	ZINC000582468958	346223739	/nfs/dbraw/zinc/22/37/39/346223739.db2.gz	FIQZDVKJWBUOAZ-UHFFFAOYSA-N	1	0	266.732	1.454	50	0		CDAARO
CC(=O)N1CC[C@@H]([NH2+]Cc2occc2C)[C@@H](C)C1	ZINC000089701976	347607696	/nfs/dbraw/zinc/60/76/96/347607696.db2.gz	LFMUYMSYTNLEJY-WCQYABFASA-N	1	0	250.342	1.935	50	0		CDAARO
c1ccn2c(c1)nnc2CCC[NH2+][C@H]1CCSC1	ZINC000584896455	349357986	/nfs/dbraw/zinc/35/79/86/349357986.db2.gz	MFFUJHYXXWQXIH-NSHDSACASA-N	1	0	262.382	1.757	50	0		CDAARO
OCc1ccc2c(c1)C[N@H+]([C@@H]1CCCOC1)CCO2	ZINC000584886654	349344726	/nfs/dbraw/zinc/34/47/26/349344726.db2.gz	RXROTVFQFFHWQK-CQSZACIVSA-N	1	0	263.337	1.552	50	0		CDAARO
COc1cccc2ncn(C[C@]3(C)CC[N@H+](C)C3)c(=O)c21	ZINC000584886944	349345648	/nfs/dbraw/zinc/34/56/48/349345648.db2.gz	RDCNCHUJPCDKTP-MRXNPFEDSA-N	1	0	287.363	1.747	50	0		CDAARO
O=C(N1CCC[N@@H+](C2CCCCC2)CC1)C1(CO)CC1	ZINC000584894544	349354000	/nfs/dbraw/zinc/35/40/00/349354000.db2.gz	ROJMJSZPHJUQBD-UHFFFAOYSA-N	1	0	280.412	1.626	50	0		CDAARO
CC(C)C[N@@H+]1CCCN(C(=O)C[C@H]2CCCOC2)CC1	ZINC000584900182	349362374	/nfs/dbraw/zinc/36/23/74/349362374.db2.gz	RFXKONMUDRBAMV-OAHLLOKOSA-N	1	0	282.428	1.993	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@@H]1CCC[NH2+][C@H]1C	ZINC000091496978	180172645	/nfs/dbraw/zinc/17/26/45/180172645.db2.gz	AAYHRVOVMJWPEO-CMPLNLGQSA-N	1	0	286.372	1.553	50	0		CDAARO
Cc1cc(C)c2[nH]c(C[NH2+][C@H]3CCNC3=O)cc(=O)c2c1	ZINC000091664786	180220799	/nfs/dbraw/zinc/22/07/99/180220799.db2.gz	URCWQUBHWLQEGE-ZDUSSCGKSA-N	1	0	285.347	1.123	50	0		CDAARO
CC[C@H]1CN([C@H](C)C(=O)NCC(F)(F)F)CCS1	ZINC000110642229	350228219	/nfs/dbraw/zinc/22/82/19/350228219.db2.gz	JEMIXQRJLSFMKA-BDAKNGLRSA-N	1	0	284.347	1.881	50	0		CDAARO
COc1cccc([C@H]2CN(C3CCOCC3)C[C@@H]2[NH3+])c1	ZINC000091624893	180209388	/nfs/dbraw/zinc/20/93/88/180209388.db2.gz	QCPICBROWFVFQG-CVEARBPZSA-N	1	0	276.380	1.601	50	0		CDAARO
CC(C)=CC(=O)N1C[C@H](CO)[C@H](C[NH+]2CCCCCC2)C1	ZINC000091819330	180262911	/nfs/dbraw/zinc/26/29/11/180262911.db2.gz	QQXVABRGBWJJCX-HZPDHXFCSA-N	1	0	294.439	1.896	50	0		CDAARO
COCC[C@]1(CO)CCC[N@@H+](C2CCOCC2)C1	ZINC000091951389	180291452	/nfs/dbraw/zinc/29/14/52/180291452.db2.gz	XOPCFGIXBQZHSM-CQSZACIVSA-N	1	0	257.374	1.276	50	0		CDAARO
COCCn1ccnc1C[N@@H+]1C[C@@H](C)[C@](O)(C2CCC2)C1	ZINC000091965344	180293968	/nfs/dbraw/zinc/29/39/68/180293968.db2.gz	XNTVEJGTPVYBMT-CJNGLKHVSA-N	1	0	293.411	1.512	50	0		CDAARO
Cc1c[nH]c(C[N@H+]2C[C@@H](C)[C@](O)(C3CCC3)C2)c(C)c1=O	ZINC000091966332	180294295	/nfs/dbraw/zinc/29/42/95/180294295.db2.gz	DGTOQEFXHRNWBU-PXAZEXFGSA-N	1	0	290.407	1.975	50	0		CDAARO
OC[C@H]1CN(Cc2ccncc2)C[C@H]1C[NH+]1CCCCC1	ZINC000091997389	180303106	/nfs/dbraw/zinc/30/31/06/180303106.db2.gz	JMIUVQJCPNGQQF-IAGOWNOFSA-N	1	0	289.423	1.608	50	0		CDAARO
CCCOCCN1CC[N@H+](C)[C@@]2(C1)CCC(=O)N(C)CC2	ZINC000092081599	180319545	/nfs/dbraw/zinc/31/95/45/180319545.db2.gz	LNRZZFKCHRBGLS-INIZCTEOSA-N	1	0	297.443	1.042	50	0		CDAARO
NC(=O)CC[NH+]1CCC(c2nccn2CC2CCC2)CC1	ZINC000092097305	180323812	/nfs/dbraw/zinc/32/38/12/180323812.db2.gz	ICWUCPVIFYNZFM-UHFFFAOYSA-N	1	0	290.411	1.738	50	0		CDAARO
CC(C)Cc1cc(C(=O)N2C[C@H]([NH3+])[C@@H](C(C)C)C2)on1	ZINC000092098548	180324378	/nfs/dbraw/zinc/32/43/78/180324378.db2.gz	QHOCMVZMVYSPRE-OLZOCXBDSA-N	1	0	279.384	1.928	50	0		CDAARO
CS[C@@H]1CCC[C@H]1[N@H+](C)CC(=O)NC[C@@H]1CCCO1	ZINC000110642439	186308392	/nfs/dbraw/zinc/30/83/92/186308392.db2.gz	SXSUQYSCSBPSDK-YNEHKIRRSA-N	1	0	286.441	1.498	50	0		CDAARO
Cc1ccc(CC(=O)N[C@H](C)[C@H]2CCCC[NH2+]2)cn1	ZINC000583651846	366017880	/nfs/dbraw/zinc/01/78/80/366017880.db2.gz	UGDHREFFTITJIN-TZMCWYRMSA-N	1	0	261.369	1.579	50	0		CDAARO
CC(C)(O)c1cn(C2CN(Cc3ccccc3)C2)nn1	ZINC000096000065	351469180	/nfs/dbraw/zinc/46/91/80/351469180.db2.gz	CGMTWBWJLJATEY-UHFFFAOYSA-N	1	0	272.352	1.562	50	0		CDAARO
CSc1cccc(N2CC[NH+](CCO)CC2)c1	ZINC000096026855	351475205	/nfs/dbraw/zinc/47/52/05/351475205.db2.gz	UWUNSHMINJHCCR-UHFFFAOYSA-N	1	0	252.383	1.523	50	0		CDAARO
C[C@H]([NH3+])CCNS(=O)(=O)c1cc(F)ccc1Cl	ZINC000123899909	187114050	/nfs/dbraw/zinc/11/40/50/187114050.db2.gz	OKCVZAREWUKYND-ZETCQYMHSA-N	1	0	280.752	1.495	50	0		CDAARO
COc1ccc(C[NH2+]CC2(O)CCOCC2)c(OC)c1	ZINC000112717023	366125581	/nfs/dbraw/zinc/12/55/81/366125581.db2.gz	AEMZXDONAVJDBX-UHFFFAOYSA-N	1	0	281.352	1.335	50	0		CDAARO
CC[NH+]1CCC(CC(=O)NC[C@@H](O)c2cccnc2)CC1	ZINC000065466704	363282455	/nfs/dbraw/zinc/28/24/55/363282455.db2.gz	QIPYCMLBDDHQAN-OAHLLOKOSA-N	1	0	291.395	1.353	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)NC[C@H]1CCC[NH2+]C1	ZINC000036961718	363302057	/nfs/dbraw/zinc/30/20/57/363302057.db2.gz	LIJFCVKQBGEMHC-NSHDSACASA-N	1	0	286.372	1.412	50	0		CDAARO
C[C@H](NC(=O)[C@H]1C[C@H](O)C[NH2+]1)c1ccc2c(c1)CCCC2	ZINC000037030935	363316475	/nfs/dbraw/zinc/31/64/75/363316475.db2.gz	HYMTVKIFCYHIPP-KNXALSJPSA-N	1	0	288.391	1.465	50	0		CDAARO
COCCCNC(=O)C1CC[NH+](Cc2ccc(C)o2)CC1	ZINC000002828193	355983553	/nfs/dbraw/zinc/98/35/53/355983553.db2.gz	YOFMQQFQZYKMJT-UHFFFAOYSA-N	1	0	294.395	1.953	50	0		CDAARO
C[NH+](C)CCNC(=O)c1c(F)c(F)c(F)c(F)c1F	ZINC000002369534	355968443	/nfs/dbraw/zinc/96/84/43/355968443.db2.gz	DRQQLRSUWLWAQD-UHFFFAOYSA-N	1	0	282.212	1.674	50	0		CDAARO
Cc1noc(CN(C)C[C@@H]2COc3ccccc3O2)n1	ZINC000037143511	363460899	/nfs/dbraw/zinc/46/08/99/363460899.db2.gz	XHTHALFRFFXBGA-LLVKDONJSA-N	1	0	275.308	1.650	50	0		CDAARO
Cc1ncoc1C(=O)NCc1cccnc1N(C)C	ZINC000014980722	356402456	/nfs/dbraw/zinc/40/24/56/356402456.db2.gz	BBILQQQGGNAAEL-UHFFFAOYSA-N	1	0	260.297	1.374	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COc2ccc(C)cc2C)CC1	ZINC000019367642	356483234	/nfs/dbraw/zinc/48/32/34/356483234.db2.gz	ZMXRQPYWTHNBTE-MRXNPFEDSA-N	1	0	292.423	1.681	50	0		CDAARO
COc1ccc(CN2CC[NH+](C)CC2)c(OC)c1C	ZINC000019536223	356490402	/nfs/dbraw/zinc/49/04/02/356490402.db2.gz	WKCMCDISJCJQNF-UHFFFAOYSA-N	1	0	264.369	1.760	50	0		CDAARO
CN1CC[NH+](CCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000019590019	356492130	/nfs/dbraw/zinc/49/21/30/356492130.db2.gz	LZOGQKAWICAXSB-UHFFFAOYSA-N	1	0	281.787	1.916	50	0		CDAARO
Cc1ccc(C)c(OCCOCCNCC[NH3+])c1	ZINC000019772336	356501138	/nfs/dbraw/zinc/50/11/38/356501138.db2.gz	DDUAKWWIGIGYEN-UHFFFAOYSA-N	1	0	252.358	1.247	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@H](CO)C2)c(OC)c1OC	ZINC000023114943	356628590	/nfs/dbraw/zinc/62/85/90/356628590.db2.gz	GXDUQGITFQVULU-LBPRGKRZSA-N	1	0	295.379	1.917	50	0		CDAARO
NC(=O)CC[NH+]1CCN(Cc2cccc(Cl)c2)CC1	ZINC000025750922	356681145	/nfs/dbraw/zinc/68/11/45/356681145.db2.gz	AWINRAWQGAJHJW-UHFFFAOYSA-N	1	0	281.787	1.333	50	0		CDAARO
COC(=O)c1oc(C[NH+]2CCC(C(N)=O)CC2)cc1C	ZINC000025912370	356685819	/nfs/dbraw/zinc/68/58/19/356685819.db2.gz	NKAAJIJGZAFCRO-UHFFFAOYSA-N	1	0	280.324	1.072	50	0		CDAARO
C[C@H](c1ccccc1Cl)N1CCN([C@@H](C)C(N)=O)CC1	ZINC000029686031	356741065	/nfs/dbraw/zinc/74/10/65/356741065.db2.gz	WYMYQGIADAEYED-NEPJUHHUSA-N	1	0	295.814	1.892	50	0		CDAARO
C([NH2+][C@@H]1CCCOC1)C1(N2CCOCC2)CCCCC1	ZINC000154181778	356818808	/nfs/dbraw/zinc/81/88/08/356818808.db2.gz	HXQJAFREYRDKKD-OAHLLOKOSA-N	1	0	282.428	1.790	50	0		CDAARO
Cc1cccc(N2CCN(C(=O)[C@H]3CCC[NH2+]3)CC2)c1C	ZINC000037009259	356895939	/nfs/dbraw/zinc/89/59/39/356895939.db2.gz	WFZKABCJVXEXBL-OAHLLOKOSA-N	1	0	287.407	1.704	50	0		CDAARO
O=C(NCCC[NH+]1CCCC1)c1cc(Cl)ccn1	ZINC000037979658	356949500	/nfs/dbraw/zinc/94/95/00/356949500.db2.gz	IQWBGXUKXXCOEE-UHFFFAOYSA-N	1	0	267.760	1.951	50	0		CDAARO
Cc1cc(C)n(CCCC(=O)N2[C@@H]3CC[C@H]2C[NH2+]CC3)n1	ZINC000065453399	357542616	/nfs/dbraw/zinc/54/26/16/357542616.db2.gz	WFDHEKVYQCBFPJ-CABCVRRESA-N	1	0	290.411	1.633	50	0		CDAARO
COc1ccccc1CC(=O)NC[C@H]1CC[N@H+](C)C1	ZINC000066652582	357576500	/nfs/dbraw/zinc/57/65/00/357576500.db2.gz	ULIXRAHICVYATP-GFCCVEGCSA-N	1	0	262.353	1.306	50	0		CDAARO
C[C@H]1CN(C(=O)c2ccncc2Cl)C[C@H](C)[NH2+]1	ZINC000091456979	357602108	/nfs/dbraw/zinc/60/21/08/357602108.db2.gz	JCODPPZLVDVXQM-IUCAKERBSA-N	1	0	253.733	1.557	50	0		CDAARO
CCc1nnsc1C(=O)NC[C@@H]1CC[N@H+](CC(C)C)C1	ZINC000067885421	357635387	/nfs/dbraw/zinc/63/53/87/357635387.db2.gz	TWHLLESMHUBJPO-NSHDSACASA-N	1	0	296.440	1.808	50	0		CDAARO
CCN1c2ccc(Cl)cc2C(=O)NC12CC[NH2+]CC2	ZINC000070451500	357724843	/nfs/dbraw/zinc/72/48/43/357724843.db2.gz	WDSUCESCADQWKR-UHFFFAOYSA-N	1	0	279.771	1.989	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCCC2	ZINC000194132794	283281269	/nfs/dbraw/zinc/28/12/69/283281269.db2.gz	MPZYGQRISHGQGJ-JHJVBQTASA-N	1	0	280.412	1.696	50	0		CDAARO
CCCc1nc2c(cnn2C)c(NCC[NH+]2CCCC2)n1	ZINC000072420249	357834148	/nfs/dbraw/zinc/83/41/48/357834148.db2.gz	GLPVALBCIOQLBU-UHFFFAOYSA-N	1	0	288.399	1.824	50	0		CDAARO
Cn1c(CN2CCCC2)nnc1[C@@H]1CCC[N@H+](C)C1	ZINC000072474881	357838127	/nfs/dbraw/zinc/83/81/27/357838127.db2.gz	RXIQZSQYKYEZLW-GFCCVEGCSA-N	1	0	263.389	1.220	50	0		CDAARO
COC(=O)[C@H](O)C1CC[NH+](CCc2ccccc2F)CC1	ZINC000097095657	357953268	/nfs/dbraw/zinc/95/32/68/357953268.db2.gz	QRQCZMPYWWJUJV-OAHLLOKOSA-N	1	0	295.354	1.614	50	0		CDAARO
CN(C)CC(=O)Nc1ccc(OC2CC[NH+](C)CC2)nc1	ZINC000097104314	357968633	/nfs/dbraw/zinc/96/86/33/357968633.db2.gz	VFSUSSSNVBHBKJ-UHFFFAOYSA-N	1	0	292.383	1.055	50	0		CDAARO
Cc1cc(S(=O)(=O)N2CC[C@@H]([NH3+])C2)sc1C	ZINC000097234957	358050476	/nfs/dbraw/zinc/05/04/76/358050476.db2.gz	AOJJTGZVJACOEZ-SECBINFHSA-N	1	0	260.384	1.087	50	0		CDAARO
O=C(NCc1cc2n(n1)CC[NH2+]C2)OCc1ccccc1	ZINC000082108121	358146721	/nfs/dbraw/zinc/14/67/21/358146721.db2.gz	VFMNMENNNZLOQY-UHFFFAOYSA-N	1	0	286.335	1.413	50	0		CDAARO
Cc1cn2cc(C(=O)N[C@@H](C)Cn3cncn3)ccc2n1	ZINC000082139000	358148916	/nfs/dbraw/zinc/14/89/16/358148916.db2.gz	QEGZHVXKFQRHIF-NSHDSACASA-N	1	0	284.323	1.053	50	0		CDAARO
COc1cccc([C@@H](C[NH2+]CC(=O)NC(C)C)N(C)C)c1	ZINC000020070524	358320945	/nfs/dbraw/zinc/32/09/45/358320945.db2.gz	MCDIFBWQRPZJFQ-OAHLLOKOSA-N	1	0	293.411	1.412	50	0		CDAARO
CO[C@H]1CCN(C(=O)CCc2ccsc2)[C@@H](C[NH3+])C1	ZINC000195557565	358560474	/nfs/dbraw/zinc/56/04/74/358560474.db2.gz	WAAWANDTJORIIL-OLZOCXBDSA-N	1	0	282.409	1.645	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCC(=O)NCCc2cnccn2)C1	ZINC000095371199	358687793	/nfs/dbraw/zinc/68/77/93/358687793.db2.gz	MWFSXNZWNTUUFR-ZDUSSCGKSA-N	1	0	276.384	1.257	50	0		CDAARO
Cc1ccc2nc(C(=O)N[C@@H]3CCC[NH2+]C3)c(F)n2c1	ZINC000097098754	358751110	/nfs/dbraw/zinc/75/11/10/358751110.db2.gz	WTDIIHDCLACKKD-SNVBAGLBSA-N	1	0	276.315	1.264	50	0		CDAARO
O=C(NCc1cccc(-c2ccccc2)c1)[C@@H]1C[NH2+]CCO1	ZINC000097244153	358760291	/nfs/dbraw/zinc/76/02/91/358760291.db2.gz	TXPIYYMRFHCYGQ-KRWDZBQOSA-N	1	0	296.370	1.958	50	0		CDAARO
COc1ccc(C[NH2+]C[C@H]2COC(C)(C)O2)cc1	ZINC000098210151	358816926	/nfs/dbraw/zinc/81/69/26/358816926.db2.gz	ATGSXACUMXKXAL-ZDUSSCGKSA-N	1	0	251.326	1.936	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)c2cccc(-c3ncc[nH]3)c2)C1	ZINC000097527243	358782543	/nfs/dbraw/zinc/78/25/43/358782543.db2.gz	ZVWLLMFUHZGJNM-LBPRGKRZSA-N	1	0	256.309	1.250	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@@H](CO)N(Cc2ccc(F)c(F)c2)C1	ZINC000097696315	358793599	/nfs/dbraw/zinc/79/35/99/358793599.db2.gz	ARSFVYDTERABQV-NEPJUHHUSA-N	1	0	270.323	1.462	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@@H](CO)N(Cc2ccc3ccccc3n2)C1	ZINC000215902481	358909892	/nfs/dbraw/zinc/90/98/92/358909892.db2.gz	IBPPOBZMLMGJAC-CVEARBPZSA-N	1	0	285.391	1.732	50	0		CDAARO
CCNC(=O)NC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1C	ZINC000012775855	359000095	/nfs/dbraw/zinc/00/00/95/359000095.db2.gz	KEEOPGVHSKSFMK-NEPJUHHUSA-N	1	0	277.368	1.880	50	0		CDAARO
CCCS(=O)(=O)NCc1ccc(C[NH+](C)C)cc1	ZINC000092980198	359075817	/nfs/dbraw/zinc/07/58/17/359075817.db2.gz	IJJWIFWGVIZBMQ-UHFFFAOYSA-N	1	0	270.398	1.578	50	0		CDAARO
CN(CCC[NH+](C)C)c1cc(C2CC(O)C2)ncn1	ZINC000220379988	359170035	/nfs/dbraw/zinc/17/00/35/359170035.db2.gz	TXGIQDQRWKNFNO-UHFFFAOYSA-N	1	0	264.373	1.103	50	0		CDAARO
Cc1cc[nH+]c(NCCn2cnc3nccnc3c2=O)c1	ZINC000032529626	359222613	/nfs/dbraw/zinc/22/26/13/359222613.db2.gz	FHDPSPRDOKVZEU-UHFFFAOYSA-N	1	0	282.307	1.002	50	0		CDAARO
CC(C)[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc(C(N)=O)cc2)C1	ZINC000408520384	359907521	/nfs/dbraw/zinc/90/75/21/359907521.db2.gz	BMGYMKTYOFYXTB-CQSZACIVSA-N	1	0	289.379	1.340	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)N[C@H]1CCCC[C@@H]1CO	ZINC000231315710	360054716	/nfs/dbraw/zinc/05/47/16/360054716.db2.gz	QDVBLSFGMSFNRX-OLZOCXBDSA-N	1	0	254.374	1.043	50	0		CDAARO
O=C([C@@H]1CCCO1)N1CCC([NH+]2CCCCC2)CC1	ZINC000082348813	360079242	/nfs/dbraw/zinc/07/92/42/360079242.db2.gz	HBVVLJMOOMYCOQ-AWEZNQCLSA-N	1	0	266.385	1.642	50	0		CDAARO
NNc1nc(N)nc(C23CC4CC(CC(C4)C2)C3)[nH+]1	ZINC000000163117	283533072	/nfs/dbraw/zinc/53/30/72/283533072.db2.gz	KEGVOBDLHVFDRZ-UHFFFAOYSA-N	1	0	260.345	1.207	50	0		CDAARO
Cc1cc(C)c(CN2CCC[C@@H]([NH3+])C2)cc1Cn1cncn1	ZINC000426478117	360565192	/nfs/dbraw/zinc/56/51/92/360565192.db2.gz	NWGGGKMKLCQWKD-QGZVFWFLSA-N	1	0	299.422	1.866	50	0		CDAARO
Cc1sc2ccccc2c1CN1C[C@@H]([NH3+])[C@H](O)C1	ZINC000426551111	360683594	/nfs/dbraw/zinc/68/35/94/360683594.db2.gz	LPIDZPNDIYTFMG-CHWSQXEVSA-N	1	0	262.378	1.714	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cccnc2NC(C)C)C1	ZINC000178975134	189158843	/nfs/dbraw/zinc/15/88/43/189158843.db2.gz	OQHOFWZQJARHSM-LBPRGKRZSA-N	1	0	276.384	1.583	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)[C@@H]1CCCO1)c1cccs1	ZINC000036079480	360842070	/nfs/dbraw/zinc/84/20/70/360842070.db2.gz	QWPOANHMPNVXFA-MNOVXSKESA-N	1	0	268.382	1.646	50	0		CDAARO
[NH3+][C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2Cl)C1	ZINC000036297002	361462425	/nfs/dbraw/zinc/46/24/25/361462425.db2.gz	QEIGVIMXQDLBBR-SECBINFHSA-N	1	0	292.763	1.591	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)NC23CC4CC(CC(C4)C2)C3)C1	ZINC000050228888	361593423	/nfs/dbraw/zinc/59/34/23/361593423.db2.gz	KYPZCIXZKZJKHN-OEXLFXSVSA-N	1	0	263.385	1.698	50	0		CDAARO
COc1cc(CN2CC[NH2+]CC2(C)C)cc(OC)c1	ZINC000088138503	364243814	/nfs/dbraw/zinc/24/38/14/364243814.db2.gz	WTNBVSXFDXSITN-UHFFFAOYSA-N	1	0	264.369	1.888	50	0		CDAARO
CN(Cc1cc[nH]n1)c1cc(C2CC([NH3+])C2)ncn1	ZINC000222485347	189731199	/nfs/dbraw/zinc/73/11/99/189731199.db2.gz	HPZNSRIICMPXQW-UHFFFAOYSA-N	1	0	258.329	1.041	50	0		CDAARO
CC[N@H+](C)C[C@@H]1CCN(c2nc3ccccc3c(=O)[nH]2)C1	ZINC000089960857	366985349	/nfs/dbraw/zinc/98/53/49/366985349.db2.gz	PYPWNTAGPJYAQE-LBPRGKRZSA-N	1	0	286.379	1.701	50	0		CDAARO
CNC(=O)c1cccc(C[N@H+](C)[C@H]2CCSC2)c1	ZINC000089935567	366970540	/nfs/dbraw/zinc/97/05/40/366970540.db2.gz	MMBWMAWFTPKFGE-ZDUSSCGKSA-N	1	0	264.394	1.984	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@@H]1NC(=O)c1ccc(F)cc1F	ZINC000094345160	367418823	/nfs/dbraw/zinc/41/88/23/367418823.db2.gz	MDYHBLIXGBISPW-UFBFGSQYSA-N	1	0	254.280	1.693	50	0		CDAARO
C[C@H](COc1ccccc1)NC(=O)C[NH+]1CCCC1	ZINC000000394454	367501802	/nfs/dbraw/zinc/50/18/02/367501802.db2.gz	CFSHHPUWWPSARG-CYBMUJFWSA-N	1	0	262.353	1.666	50	0		CDAARO
COCC1(CNC(=O)NCC[N@H+]2CC=C(C)CC2)CCC1	ZINC000252492387	367637444	/nfs/dbraw/zinc/63/74/44/367637444.db2.gz	MKOSJRROCADWIP-UHFFFAOYSA-N	1	0	295.427	1.754	50	0		CDAARO
CC[C@H]1CCCCCN1C(=O)[C@@H]1CN(C)CCO1	ZINC000089948274	370197680	/nfs/dbraw/zinc/19/76/80/370197680.db2.gz	UUJYQBIYORHNFR-STQMWFEESA-N	1	0	254.374	1.498	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](NC(=O)N2C[C@@H]3[C@H](C2)C3(C)C)C1	ZINC000252669114	371205757	/nfs/dbraw/zinc/20/57/57/371205757.db2.gz	GNHFDXCALNMQCL-MELADBBJSA-N	1	0	295.427	1.395	50	0		CDAARO
CCc1n[nH]cc1C(=O)NCCCOC1CC[NH+](C)CC1	ZINC000299793516	372766636	/nfs/dbraw/zinc/76/66/36/372766636.db2.gz	GLCTXWZZUJLSOW-UHFFFAOYSA-N	1	0	294.399	1.203	50	0		CDAARO
Cc1nc(NCCCn2cncn2)cc([C@H]2C[C@@H]([NH3+])C2)n1	ZINC000244899574	189914781	/nfs/dbraw/zinc/91/47/81/189914781.db2.gz	ZMEBNMOBADWIAA-TXEJJXNPSA-N	1	0	287.371	1.083	50	0		CDAARO
COC[C@@H]1CCCC[N@H+](CCN2CCO[C@@H](C)C2)C1	ZINC000253397256	373685389	/nfs/dbraw/zinc/68/53/89/373685389.db2.gz	LRMVODRVXHRKCK-LSDHHAIUSA-N	1	0	270.417	1.456	50	0		CDAARO
C[NH2+]CC(=O)N[C@H](Cc1cccc(OC)c1)C1CC1	ZINC000253426934	373734219	/nfs/dbraw/zinc/73/42/19/373734219.db2.gz	JFJTULJHIKUWPO-CQSZACIVSA-N	1	0	262.353	1.352	50	0		CDAARO
OC1(C[NH2+]Cc2cccc3[nH]ccc32)CCOCC1	ZINC000112717386	374227982	/nfs/dbraw/zinc/22/79/82/374227982.db2.gz	OCSXXVNFLWYBKA-UHFFFAOYSA-N	1	0	260.337	1.799	50	0		CDAARO
O=C(NCC1=COCCO1)[C@@H]1CC[N@@H+](C2CCCCC2)C1	ZINC000095407366	374909220	/nfs/dbraw/zinc/90/92/20/374909220.db2.gz	NJOBEGMCXVMKFT-CYBMUJFWSA-N	1	0	294.395	1.645	50	0		CDAARO
COC(=O)c1ccc(C[N@@H+]2C[C@@H](C)[C@](C)(C(=O)OC)C2)o1	ZINC000282532486	375093182	/nfs/dbraw/zinc/09/31/82/375093182.db2.gz	QJKPBFWRJYWXBH-MEBBXXQBSA-N	1	0	295.335	1.697	50	0		CDAARO
CCn1cc(C[N@@H+]2C[C@@H]3CCC[C@]3(C(=O)OC)C2)cn1	ZINC000097084938	375146672	/nfs/dbraw/zinc/14/66/72/375146672.db2.gz	LTJKLFIWQCAKNF-ZFWWWQNUSA-N	1	0	277.368	1.678	50	0		CDAARO
COC[C@@H]1CCC[N@H+](CC(=O)NCc2ccc(F)cc2)C1	ZINC000056908349	375385593	/nfs/dbraw/zinc/38/55/93/375385593.db2.gz	AKTIMTBBKWTPKI-CQSZACIVSA-N	1	0	294.370	1.800	50	0		CDAARO
C[NH+](C)CC(C)(C)NC(=O)c1ccncc1Cl	ZINC000308669198	375822567	/nfs/dbraw/zinc/82/25/67/375822567.db2.gz	CFIYKGPSWKRVNF-UHFFFAOYSA-N	1	0	255.749	1.805	50	0		CDAARO
[NH3+]CCc1ccc(C(=O)NCCC[C@H]2CCOC2)cc1	ZINC000401986896	375829446	/nfs/dbraw/zinc/82/94/46/375829446.db2.gz	DQLUJDZUHWLOSS-AWEZNQCLSA-N	1	0	276.380	1.734	50	0		CDAARO
c1cnn(CC[N@@H+]2CC[C@H](CNc3ccccn3)C2)c1	ZINC000065452088	376132917	/nfs/dbraw/zinc/13/29/17/376132917.db2.gz	XCRZYQAVEJTBGV-CQSZACIVSA-N	1	0	271.368	1.712	50	0		CDAARO
CS[C@@H]1CCC[C@@H]1[N@H+](C)CC(=O)NC[C@H]1CCCO1	ZINC000245339449	378071792	/nfs/dbraw/zinc/07/17/92/378071792.db2.gz	SXSUQYSCSBPSDK-FRRDWIJNSA-N	1	0	286.441	1.498	50	0		CDAARO
NC(=O)[C@@H]1CCC[N@H+](CCn2ccnc2-c2ccncc2)C1	ZINC000071776774	379636017	/nfs/dbraw/zinc/63/60/17/379636017.db2.gz	ILALBXOWVXCAIK-CQSZACIVSA-N	1	0	299.378	1.142	50	0		CDAARO
Cc1cc(N2CCS(=O)(=O)CC2)c2ccccc2[nH+]1	ZINC000084927178	291938560	/nfs/dbraw/zinc/93/85/60/291938560.db2.gz	PPENZJJELOISFR-UHFFFAOYSA-N	1	0	276.361	1.778	50	0		CDAARO
O=C(N1CCC[C@@H]([C@@H]2CCCC[NH2+]2)C1)C(F)(F)F	ZINC000306254363	256865198	/nfs/dbraw/zinc/86/51/98/256865198.db2.gz	OTDXOACONCIDHG-ZJUUUORDSA-N	1	0	264.291	1.929	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CC[NH2+]C[C@@H]2C)cc1C	ZINC000094345758	184786320	/nfs/dbraw/zinc/78/63/20/184786320.db2.gz	LPKFTHHJNNUUHS-JSGCOSHPSA-N	1	0	282.409	1.580	50	0		CDAARO
CC[C@H]([NH2+]C[C@H]1CCCO1)C(=O)Nc1cc(C)on1	ZINC000028624081	390255745	/nfs/dbraw/zinc/25/57/45/390255745.db2.gz	RPVQLHHCGROIMC-MNOVXSKESA-N	1	0	267.329	1.469	50	0		CDAARO
CN1CCC([N@H+](C)Cc2ccc3c(c2)OCCO3)CC1	ZINC000034687707	390404828	/nfs/dbraw/zinc/40/48/28/390404828.db2.gz	VNUMNIZCILEGHP-UHFFFAOYSA-N	1	0	276.380	1.984	50	0		CDAARO
C[C@H]1C[N@H+](C)CC[C@@H]1N(C)C(=O)CCOCC(F)(F)F	ZINC000096422446	390518936	/nfs/dbraw/zinc/51/89/36/390518936.db2.gz	KZVWNVRTBQICIR-QWRGUYRKSA-N	1	0	296.333	1.754	50	0		CDAARO
C[C@@](CO)([NH2+]CCCN1CCOC1=O)C1CCCCC1	ZINC000096420069	390514241	/nfs/dbraw/zinc/51/42/41/390514241.db2.gz	XLXYCVMUYSEVNA-HNNXBMFYSA-N	1	0	284.400	1.750	50	0		CDAARO
CC(C)[N@H+](C)CC(=O)NC[C@@]1(C)CCCC[C@@H]1O	ZINC000096450849	390522438	/nfs/dbraw/zinc/52/24/38/390522438.db2.gz	LAHTXJTZEGNJJI-GXTWGEPZSA-N	1	0	256.390	1.384	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1C(=O)/C=C/c1cscn1	ZINC000089937788	390947764	/nfs/dbraw/zinc/94/77/64/390947764.db2.gz	LJTHYDJLQYLIET-HMDXOVGESA-N	1	0	251.355	1.319	50	0		CDAARO
CCCc1ncncc1C(=O)N(C)[C@H]1CC[N@H+](C)C1	ZINC000215951946	391002208	/nfs/dbraw/zinc/00/22/08/391002208.db2.gz	TXWUEFKGLDLWNT-NSHDSACASA-N	1	0	262.357	1.205	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1C(=O)NCCCc1ccc(O)cc1	ZINC000417739839	391002948	/nfs/dbraw/zinc/00/29/48/391002948.db2.gz	GTEXQTXKBRMDSL-CQSZACIVSA-N	1	0	291.395	1.848	50	0		CDAARO
CC(C)C[N@@H+]1CCCN(C(=O)[C@H]2CCOC2)CC1	ZINC000368820882	391041831	/nfs/dbraw/zinc/04/18/31/391041831.db2.gz	DTRGMZFADGNWBQ-ZDUSSCGKSA-N	1	0	254.374	1.213	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)N1CCC(C)CC1)C1CCOCC1	ZINC000096492015	533344511	/nfs/dbraw/zinc/34/45/11/533344511.db2.gz	DQLKYYFJCWLOHB-CYBMUJFWSA-N	1	0	268.401	1.650	50	0		CDAARO
COc1ccc(CN2CC[N@H+](C)[C@H](CCO)C2)cc1	ZINC000104405403	533561233	/nfs/dbraw/zinc/56/12/33/533561233.db2.gz	NHRPSWIXONYTTC-CQSZACIVSA-N	1	0	264.369	1.194	50	0		CDAARO
CC(C)[C@H]([NH2+][C@H]1CCCC[C@@H]1C)C(=O)NC(N)=O	ZINC000006085212	391651220	/nfs/dbraw/zinc/65/12/20/391651220.db2.gz	FZFSRBWGDBJSTF-DCAQKATOSA-N	1	0	255.362	1.374	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](CN(C)C(=O)c2csnc2N)C1	ZINC000299785040	391721730	/nfs/dbraw/zinc/72/17/30/391721730.db2.gz	LSXVNFWSVHZQKS-LLVKDONJSA-N	1	0	296.440	1.775	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1Cn1c(=O)[nH]c2ccccc2c1=O	ZINC000025464126	391820107	/nfs/dbraw/zinc/82/01/07/391820107.db2.gz	OJCZDAMNWBYHOJ-LLVKDONJSA-N	1	0	273.336	1.174	50	0		CDAARO
O=C(Cn1ccc(C(F)(F)F)n1)NC[C@H]1CCC[NH2+]C1	ZINC000261714904	131164488	/nfs/dbraw/zinc/16/44/88/131164488.db2.gz	JRUXWPPWFZHKPS-VIFPVBQESA-N	1	0	290.289	1.018	50	0		CDAARO
Cn1cccc1C(=O)N1C[C@@H](c2ccccc2)[C@H]([NH3+])C1	ZINC000262231049	131202961	/nfs/dbraw/zinc/20/29/61/131202961.db2.gz	NXNNEPJNIHFAPB-UONOGXRCSA-N	1	0	269.348	1.592	50	0		CDAARO
Cn1cncc1C[NH2+][C@H]1CCN(Cc2ccccc2)C1=O	ZINC000263865417	131349005	/nfs/dbraw/zinc/34/90/05/131349005.db2.gz	YHJUAHLEPJCURJ-HNNXBMFYSA-N	1	0	284.363	1.311	50	0		CDAARO
Cc1ccccc1[C@H](O)CNC(=O)[C@@H]1CC[C@H]([NH3+])C1	ZINC000269215434	132133749	/nfs/dbraw/zinc/13/37/49/132133749.db2.gz	JSNJIIRXFLSJHM-MBNYWOFBSA-N	1	0	262.353	1.272	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)COc2cccc(F)c2)C1	ZINC000195107580	393062091	/nfs/dbraw/zinc/06/20/91/393062091.db2.gz	KAPSEGSMYGXLGN-LLVKDONJSA-N	1	0	252.289	1.154	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]Cc1ccnc(N2CCOCC2)c1	ZINC000097159171	134512765	/nfs/dbraw/zinc/51/27/65/134512765.db2.gz	AAHGARCSFJTVNQ-UHFFFAOYSA-N	1	0	287.367	1.240	50	0		CDAARO
O=C(Nc1cccnn1)N1CCN(c2ccccn2)CC1	ZINC000089883822	135060913	/nfs/dbraw/zinc/06/09/13/135060913.db2.gz	XWKVNSUMWVLGDX-UHFFFAOYSA-N	1	0	284.323	1.226	50	0		CDAARO
CCO[C@H]1C[C@@](CO)([NH2+]Cc2ncc[nH]2)C1(C)C	ZINC000186583583	140065260	/nfs/dbraw/zinc/06/52/60/140065260.db2.gz	XJKFTNOEEXPJMY-GWCFXTLKSA-N	1	0	253.346	1.065	50	0		CDAARO
Cc1ccc(-n2cc(C(=O)N3CCC([NH3+])CC3)nn2)cc1	ZINC000057509423	292035838	/nfs/dbraw/zinc/03/58/38/292035838.db2.gz	DFXUOYMHTJTJKX-UHFFFAOYSA-N	1	0	285.351	1.139	50	0		CDAARO
COC[C@@]1(C(=O)Nc2cc(C)cc(F)c2)CC[NH2+]C1	ZINC000261591960	140359097	/nfs/dbraw/zinc/35/90/97/140359097.db2.gz	MFFYIQPDCYNODU-CQSZACIVSA-N	1	0	266.316	1.699	50	0		CDAARO
Cc1cccc(-c2nc3[nH]c(C[NH2+]C(C)C)cc(=O)n3n2)c1	ZINC000101748019	397817791	/nfs/dbraw/zinc/81/77/91/397817791.db2.gz	AJBALBMMIRZQBF-UHFFFAOYSA-N	1	0	297.362	1.891	50	0		CDAARO
CCOCCN(CC)C(=O)[C@H]1CCCCC[C@H]1[NH3+]	ZINC000094753873	286079928	/nfs/dbraw/zinc/07/99/28/286079928.db2.gz	IFNCCYJLTLHBSL-QWHCGFSZSA-N	1	0	256.390	1.779	50	0		CDAARO
CCO[C@@H]1C[C@H](O)C12CC[NH+](C[C@H](O)C(F)(F)F)CC2	ZINC000181715380	286410592	/nfs/dbraw/zinc/41/05/92/286410592.db2.gz	CCENWSOZKFLRMB-GARJFASQSA-N	1	0	297.317	1.162	50	0		CDAARO
COCCCNC(=O)C[N@@H+]1CCS[C@H]2CCCC[C@H]21	ZINC000245910220	292357151	/nfs/dbraw/zinc/35/71/51/292357151.db2.gz	VWAYERBHOGOFSH-OLZOCXBDSA-N	1	0	286.441	1.499	50	0		CDAARO
CC1CC[NH+](C[C@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000002692800	169820670	/nfs/dbraw/zinc/82/06/70/169820670.db2.gz	PCRLUFLYQKUTQV-ZDUSSCGKSA-N	1	0	293.363	1.887	50	0		CDAARO
COc1ccc(C(=O)CSc2nc(N)cc(N)[nH+]2)cc1	ZINC000004935026	170042413	/nfs/dbraw/zinc/04/24/13/170042413.db2.gz	WFNARAXZUSLBRF-UHFFFAOYSA-N	1	0	290.348	1.625	50	0		CDAARO
C[C@@H]([NH2+]Cc1ccc(OCC(N)=O)cc1)c1ccccn1	ZINC000020123278	171004015	/nfs/dbraw/zinc/00/40/15/171004015.db2.gz	RFDREZCRYRSQCY-GFCCVEGCSA-N	1	0	285.347	1.797	50	0		CDAARO
COc1cc(OC)cc(C(=O)N2CCC(C[NH3+])CC2)c1	ZINC000020182503	171045966	/nfs/dbraw/zinc/04/59/66/171045966.db2.gz	JTPVFEQACUPCDE-UHFFFAOYSA-N	1	0	278.352	1.515	50	0		CDAARO
Cn1nccc1CN1CCC([N@@H+]2CCC[C@H](CO)C2)CC1	ZINC000020599307	171266138	/nfs/dbraw/zinc/26/61/38/171266138.db2.gz	WYMBJWKSIRKKOH-AWEZNQCLSA-N	1	0	292.427	1.089	50	0		CDAARO
O=C1c2ccccc2C(=O)N1CCC[N@H+]1CCC[C@H](O)C1	ZINC000020941850	171282256	/nfs/dbraw/zinc/28/22/56/171282256.db2.gz	BVCIOXLIVIATCZ-LBPRGKRZSA-N	1	0	288.347	1.129	50	0		CDAARO
O=C(C(=O)N1CCC[N@@H+]2CCC[C@@H]2C1)c1ccco1	ZINC000020997917	171283983	/nfs/dbraw/zinc/28/39/83/171283983.db2.gz	ILXMOKGXHJJKTH-LLVKDONJSA-N	1	0	262.309	1.159	50	0		CDAARO
O=C(Nc1ccc(Br)cn1)[C@@H]1CCC[NH2+]C1	ZINC000034939007	171898745	/nfs/dbraw/zinc/89/87/45/171898745.db2.gz	LURZDHQDKHLCGG-MRVPVSSYSA-N	1	0	284.157	1.782	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)c1c[nH]c2ccccc12	ZINC000035206719	172050906	/nfs/dbraw/zinc/05/09/06/172050906.db2.gz	OZCGVSFLTBBFJL-UHFFFAOYSA-N	1	0	257.337	1.994	50	0		CDAARO
COc1ccc([C@@H]2C[C@H]2C(=O)N2CC[NH2+]CC2)cc1	ZINC000038478359	174142159	/nfs/dbraw/zinc/14/21/59/174142159.db2.gz	FYOXQDYKWMVTEZ-UONOGXRCSA-N	1	0	260.337	1.231	50	0		CDAARO
c1ccc(-n2nnnc2SC[C@H]2CCC[NH2+]2)cc1	ZINC000043497183	175058012	/nfs/dbraw/zinc/05/80/12/175058012.db2.gz	FTFSIOZMNMTPIK-SNVBAGLBSA-N	1	0	261.354	1.506	50	0		CDAARO
C[C@@H](NCCC[NH+]1CCCC1)C(=O)NC1CCCC1	ZINC000058552781	175626611	/nfs/dbraw/zinc/62/66/11/175626611.db2.gz	PHXVKWMIDYPWTF-CYBMUJFWSA-N	1	0	267.417	1.509	50	0		CDAARO
CCn1nc(C)c(C[NH2+][C@@H](C)Cn2ccnc2)c1C	ZINC000071278619	176108403	/nfs/dbraw/zinc/10/84/03/176108403.db2.gz	RZOIYQAYVSFHQJ-NSHDSACASA-N	1	0	261.373	1.895	50	0		CDAARO
Cc1cnn(CCC(=O)N2CCC3(CC[NH2+]CC3)CC2)c1	ZINC000071551706	176196406	/nfs/dbraw/zinc/19/64/06/176196406.db2.gz	DKOTUOVVSTUAJK-UHFFFAOYSA-N	1	0	290.411	1.574	50	0		CDAARO
CC(C)c1nc(N2CCC[C@](O)(C[NH+](C)C)CC2)no1	ZINC000072143245	176324485	/nfs/dbraw/zinc/32/44/85/176324485.db2.gz	JTELDSFXBJLINZ-CQSZACIVSA-N	1	0	282.388	1.476	50	0		CDAARO
COc1c(C)cnc(C[N@@H+]2CCC[C@@](O)(CO)C2)c1C	ZINC000072152608	176327346	/nfs/dbraw/zinc/32/73/46/176327346.db2.gz	IDSBDDQJMQEIPG-HNNXBMFYSA-N	1	0	280.368	1.026	50	0		CDAARO
CN(C(=O)NC[C@@H]1C[NH2+]CCOC1)c1ccccc1	ZINC000072162346	176330004	/nfs/dbraw/zinc/33/00/04/176330004.db2.gz	CWKQPGUERURDHF-LBPRGKRZSA-N	1	0	263.341	1.068	50	0		CDAARO
O=C([O-])[C@@H]1CC2(C[N@H+]1Cc1cccc(O)c1)CC[NH2+]CC2	ZINC000072163444	176330555	/nfs/dbraw/zinc/33/05/55/176330555.db2.gz	QPKDCJJNEIIWHJ-AWEZNQCLSA-N	1	0	290.363	1.421	50	0		CDAARO
O[C@@]1(CN(Cc2cccnc2)Cc2cccnc2)CC[NH2+]C1	ZINC000072406729	176398125	/nfs/dbraw/zinc/39/81/25/176398125.db2.gz	MIEAHDMUBSZJBJ-KRWDZBQOSA-N	1	0	298.390	1.203	50	0		CDAARO
CCc1ccc(-n2cnnc2)cc1NC(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000072432587	176402666	/nfs/dbraw/zinc/40/26/66/176402666.db2.gz	KNOAQVCIJKKLJC-QWHCGFSZSA-N	1	0	299.378	1.896	50	0		CDAARO
CSc1cccc(C[N@@H+]2CCOC[C@H](O)C2)c1	ZINC000077286564	177249328	/nfs/dbraw/zinc/24/93/28/177249328.db2.gz	QEHKZPDLHHHLQH-GFCCVEGCSA-N	1	0	253.367	1.602	50	0		CDAARO
O[C@H]1COCC[N@@H+](C2CCN(Cc3ccccc3)CC2)C1	ZINC000077320757	177252543	/nfs/dbraw/zinc/25/25/43/177252543.db2.gz	OFVCMANMBHJEQI-QGZVFWFLSA-N	1	0	290.407	1.344	50	0		CDAARO
CC[C@H]1COCC[N@@H+]1CCC(=O)NCc1ccc(F)cc1	ZINC000077406845	177263742	/nfs/dbraw/zinc/26/37/42/177263742.db2.gz	HQMMYBFOBXYALR-HNNXBMFYSA-N	1	0	294.370	1.943	50	0		CDAARO
COCc1cc(C[N@@H+]2CCOC[C@H](CO)C2)ccc1OC	ZINC000077555734	177280763	/nfs/dbraw/zinc/28/07/63/177280763.db2.gz	MZEJDMIWBGBYTO-AWEZNQCLSA-N	1	0	295.379	1.282	50	0		CDAARO
[NH3+]C[C@@H](CO)Cc1cc(F)cc(Br)c1	ZINC000086697041	260396474	/nfs/dbraw/zinc/39/64/74/260396474.db2.gz	GFBQXGJHHNWFEB-QMMMGPOBSA-N	1	0	262.122	1.698	50	0		CDAARO
NC(=O)c1ccc(-c2cccc3c2O[C@@H](C[NH3+])C3)cc1	ZINC000067771802	274953416	/nfs/dbraw/zinc/95/34/16/274953416.db2.gz	CKYWBSRDPWTMLJ-CYBMUJFWSA-N	1	0	268.316	1.715	50	0		CDAARO
CNC(=O)c1nn(C)c2c1C[C@@H]([NH+]1CCCCCC1)CC2	ZINC000014536374	277019567	/nfs/dbraw/zinc/01/95/67/277019567.db2.gz	JWRTYJKEMBENOZ-LBPRGKRZSA-N	1	0	290.411	1.513	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)c2cc3ccccc3oc2=O)CC1	ZINC000013323343	277049659	/nfs/dbraw/zinc/04/96/59/277049659.db2.gz	GMMVFZYLLMFKGP-UHFFFAOYSA-N	1	0	286.331	1.571	50	0		CDAARO
COC(=O)N1CCC[C@H]([NH2+][C@@H](C)CCn2cccn2)C1	ZINC000097049728	277071955	/nfs/dbraw/zinc/07/19/55/277071955.db2.gz	VFKWOTXCTXWHKI-STQMWFEESA-N	1	0	280.372	1.482	50	0		CDAARO
CN1CCC[C@](O)(C[NH2+]C2(c3ccccc3)CC2)C1=O	ZINC000011997321	277085251	/nfs/dbraw/zinc/08/52/51/277085251.db2.gz	LCCRQFVYHVPDCK-INIZCTEOSA-N	1	0	274.364	1.249	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)[C@@H]2CCOc3ccccc32)C1	ZINC000111189054	277279626	/nfs/dbraw/zinc/27/96/26/277279626.db2.gz	MNBQZSURIZHWTP-GXTWGEPZSA-N	1	0	274.364	1.621	50	0		CDAARO
CC(C)=CC(=O)N1CCN(C)C2(CC[NH+](C)CC2)C1	ZINC000067803548	277321848	/nfs/dbraw/zinc/32/18/48/277321848.db2.gz	BOQAABUDQDEMTK-UHFFFAOYSA-N	1	0	265.401	1.191	50	0		CDAARO
CC(C)(C)OC(=O)C[C@H]1C[C@@H](CC[NH3+])OC(C)(C)O1	ZINC000004284042	278377072	/nfs/dbraw/zinc/37/70/72/278377072.db2.gz	HWSHVKNLMBMKSR-GHMZBOCLSA-N	1	0	273.373	1.977	50	0	in-vitro	CDAARO
CC1CCN(c2nc3c(c(N(C)C)n2)C[NH2+]CC3)CC1	ZINC000034676557	278552235	/nfs/dbraw/zinc/55/22/35/278552235.db2.gz	QZNHEHNIBLNDGZ-UHFFFAOYSA-N	1	0	275.400	1.425	50	0		CDAARO
CC(C)C[NH+]1CCN([C@@H]2CCCN(C(C)C)C2=O)CC1	ZINC000095963652	278895928	/nfs/dbraw/zinc/89/59/28/278895928.db2.gz	GIUZJTSKNFJIDE-OAHLLOKOSA-N	1	0	281.444	1.659	50	0		CDAARO
C[C@@H]1c2ccsc2CC[N@H+]1CCC(=O)NC(N)=O	ZINC000011474107	279143630	/nfs/dbraw/zinc/14/36/30/279143630.db2.gz	FPXFWIYLTLFSNX-MRVPVSSYSA-N	1	0	267.354	1.252	50	0		CDAARO
CC(C)C[C@H](CO)NC(=O)NCC[N@@H+]1CCCC[C@H]1C	ZINC000252475119	279169750	/nfs/dbraw/zinc/16/97/50/279169750.db2.gz	SVXQLUCUCPMFBU-ZIAGYGMSSA-N	1	0	285.432	1.567	50	0		CDAARO
C[C@@H]1CN(C(=O)CO[C@H]2CCC[C@@H](C)C2)C[C@@H]1[NH+](C)C	ZINC000107323092	279300715	/nfs/dbraw/zinc/30/07/15/279300715.db2.gz	FSLIQTBXLQIBFL-KBXIAJHMSA-N	1	0	282.428	1.990	50	0		CDAARO
Nc1ccc2c(c1)CCC[C@@H]2NC(=O)[C@@H]1CC[C@H]([NH3+])C1	ZINC000263097173	279700716	/nfs/dbraw/zinc/70/07/16/279700716.db2.gz	NRZSMYVWLJKDBD-XUJVJEKNSA-N	1	0	273.380	1.890	50	0		CDAARO
CCS(=O)(=O)N1CC[NH+](C2CCC(C)CC2)CC1	ZINC000019851652	280013934	/nfs/dbraw/zinc/01/39/34/280013934.db2.gz	PVZHQVIWUPXBBB-UHFFFAOYSA-N	1	0	274.430	1.532	50	0		CDAARO
C[NH+](C)C1CN(C(=O)c2cc(-c3ccccc3)n[nH]2)C1	ZINC000095448385	289062719	/nfs/dbraw/zinc/06/27/19/289062719.db2.gz	YLEIZKAQRKAIHL-UHFFFAOYSA-N	1	0	270.336	1.463	50	0		CDAARO
C[C@H](C(=O)NC(=O)NC(C)(C)C)[N@@H+]1CCC[C@H](C)C1	ZINC000105706810	289330744	/nfs/dbraw/zinc/33/07/44/289330744.db2.gz	SAJPJOGBTXJTKG-WDEREUQCSA-N	1	0	269.389	1.731	50	0		CDAARO
[NH3+]C[C@H]1CCC[C@H]1NS(=O)(=O)c1cc(F)cc(F)c1	ZINC000089091610	295273779	/nfs/dbraw/zinc/27/37/79/295273779.db2.gz	OSULEEQSACYXDR-PRHODGIISA-N	1	0	290.335	1.371	50	0		CDAARO
[NH3+][C@H]1CCC[C@@H](C(=O)N2CCCC3(CCOCC3)C2)C1	ZINC000361722700	303483907	/nfs/dbraw/zinc/48/39/07/303483907.db2.gz	BMJHRJJNZBACRK-KGLIPLIRSA-N	1	0	280.412	1.923	50	0		CDAARO
COc1ccnc(N[C@H]2CCC[N@H+](Cc3cccnc3)C2)n1	ZINC000534578189	328310827	/nfs/dbraw/zinc/31/08/27/328310827.db2.gz	UXFIQANLSNOOMT-AWEZNQCLSA-N	1	0	299.378	1.957	50	0		CDAARO
C[C@@H](CCC(=O)NCc1cscn1)[NH+]1CCN(C)CC1	ZINC000534581096	328311759	/nfs/dbraw/zinc/31/17/59/328311759.db2.gz	HBDAYBKWYYYLFS-LBPRGKRZSA-N	1	0	296.440	1.175	50	0		CDAARO
Cc1cc2ccccc2n1CCNC(=O)[C@H]1C=CC[NH2+]1	ZINC000534584536	328314636	/nfs/dbraw/zinc/31/46/36/328314636.db2.gz	NVUXVWNPLFGPMA-CQSZACIVSA-N	1	0	269.348	1.594	50	0		CDAARO
CSCC(=O)NC[C@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534586677	328315489	/nfs/dbraw/zinc/31/54/89/328315489.db2.gz	VVCPBPOEEOHBTG-LLVKDONJSA-N	1	0	256.415	1.730	50	0		CDAARO
O=C1CC[C@H]([NH2+]CCCOC2CCCCC2)CCN1	ZINC000534587732	328316365	/nfs/dbraw/zinc/31/63/65/328316365.db2.gz	OACKRXNOVSXZNU-ZDUSSCGKSA-N	1	0	268.401	1.984	50	0		CDAARO
Cc1ccc(F)c(C(=O)NC[C@@H](O)C[NH+](C)C)c1Cl	ZINC000534592646	328318644	/nfs/dbraw/zinc/31/86/44/328318644.db2.gz	FAGJWTBPMSYLHC-SECBINFHSA-N	1	0	288.750	1.440	50	0		CDAARO
CN(Cc1nc2cc(Cl)ccc2[nH]1)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000534646568	328329999	/nfs/dbraw/zinc/32/99/99/328329999.db2.gz	GTAOZGYHMCQWME-NSHDSACASA-N	1	0	290.754	1.703	50	0		CDAARO
CC(C)(C[NH+]1CCCCCC1)NC(=O)C1(C)COC1	ZINC000534644171	328330085	/nfs/dbraw/zinc/33/00/85/328330085.db2.gz	GVVHZQPWIJALHK-UHFFFAOYSA-N	1	0	268.401	1.794	50	0		CDAARO
O=C(CCCc1ccc(F)cc1)NC[C@@H]1CC[NH2+]C[C@H]1O	ZINC000534637016	328334087	/nfs/dbraw/zinc/33/40/87/328334087.db2.gz	OXCRQQCFLRZFRH-DZGCQCFKSA-N	1	0	294.370	1.235	50	0		CDAARO
C[NH+](C)Cc1ccccc1CNC(=O)N1CC[C@@H](CO)C1	ZINC000304331967	328378638	/nfs/dbraw/zinc/37/86/38/328378638.db2.gz	WPNBXSIVTDDTIO-CYBMUJFWSA-N	1	0	291.395	1.272	50	0		CDAARO
CC(C)n1nnnc1C[NH2+][C@@H]1CC(C)(C)OC1(C)C	ZINC000097100320	323207325	/nfs/dbraw/zinc/20/73/25/323207325.db2.gz	RFBNQTUXXHCXDM-SNVBAGLBSA-N	1	0	267.377	1.690	50	0		CDAARO
COC(=O)[C@H](CC[NH2+]Cc1ccccc1)[C@H](C)O	ZINC000043214665	328754159	/nfs/dbraw/zinc/75/41/59/328754159.db2.gz	JGNJXWYXCHOBBP-WCQYABFASA-N	1	0	251.326	1.336	50	0		CDAARO
CC(C)c1cc(CSc2nnc(CC[NH3+])n2C)no1	ZINC000426544802	330511854	/nfs/dbraw/zinc/51/18/54/330511854.db2.gz	MRXAIRLMPMLNSA-UHFFFAOYSA-N	1	0	281.385	1.720	50	0		CDAARO
O=C1C[C@@H](C[N@H+]2CCC[C@H](C(F)(F)F)C2)CN1	ZINC000585094222	482828800	/nfs/dbraw/zinc/82/88/00/482828800.db2.gz	RYKWCKUWFKNANI-BDAKNGLRSA-N	1	0	250.264	1.397	50	0		CDAARO
CN1C(=O)CCC12CC[NH+]([C@@H]1CCSC1)CC2	ZINC000670462995	483050350	/nfs/dbraw/zinc/05/03/50/483050350.db2.gz	WJYZWFJQQAELNQ-LLVKDONJSA-N	1	0	254.399	1.579	50	0		CDAARO
CC[C@@H]1CN(C(=O)c2nc(C)ncc2Cl)C[C@H]1[NH+](C)C	ZINC000084735549	483320310	/nfs/dbraw/zinc/32/03/10/483320310.db2.gz	BZQMGPDBQLHRLG-ZYHUDNBSSA-N	1	0	296.802	1.851	50	0		CDAARO
CCC(=O)N1CC[C@@H]([NH2+]Cc2c[nH]nc2C)[C@@H](CC)C1	ZINC000084736283	483320680	/nfs/dbraw/zinc/32/06/80/483320680.db2.gz	ZGNYSJSCJZNGMM-GXTWGEPZSA-N	1	0	278.400	1.845	50	0		CDAARO
CC[C@@H](C(=O)NCc1csc(N)n1)[NH+]1CCCC1	ZINC000822555696	1161928396	/nfs/dbraw/zinc/92/83/96/1161928396.db2.gz	BWEQDERGKQDWIN-JTQLQIEISA-N	1	0	268.386	1.216	50	0		CDAARO
COc1cc(C)ccc1OCC(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179098481	522277326	/nfs/dbraw/zinc/27/73/26/522277326.db2.gz	BDJUJKPLUJFZCP-GFCCVEGCSA-N	1	0	278.352	1.203	50	0		CDAARO
COc1ccccc1C[NH2+]CCCSc1nnnn1C	ZINC000004993803	524484807	/nfs/dbraw/zinc/48/48/07/524484807.db2.gz	UJEHTICHPZYQAA-UHFFFAOYSA-N	1	0	293.396	1.491	50	0		CDAARO
CC(C)(C)[NH2+]CCNC(=O)[C@@H]1COc2ccccc21	ZINC000096437208	526328989	/nfs/dbraw/zinc/32/89/89/526328989.db2.gz	OPKPHIGHSZKTQA-GFCCVEGCSA-N	1	0	262.353	1.667	50	0		CDAARO
NC(=O)C1CC[NH+](C[C@H](O)CC2CCCC2)CC1	ZINC000188636448	526857666	/nfs/dbraw/zinc/85/76/66/526857666.db2.gz	PFOWLVFVYLCNOA-CYBMUJFWSA-N	1	0	254.374	1.125	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)O[C@H](C)C(=O)N(C)C(C)C	ZINC000408525663	528502729	/nfs/dbraw/zinc/50/27/29/528502729.db2.gz	PFSWLFJVTJZEIP-OLZOCXBDSA-N	1	0	286.416	1.796	50	0		CDAARO
C[C@H]([NH3+])c1cccc(S(=O)(=O)C(F)(F)F)c1	ZINC000114691317	538338337	/nfs/dbraw/zinc/33/83/37/538338337.db2.gz	XMXLRIGZCMVDGP-LURJTMIESA-N	1	0	253.245	2.000	50	0		CDAARO
NC[C@@H]1CC[C@H]([C@@H]2CC[C@@H](C(F)(F)F)NC2)C[NH2+]1	ZINC000757211922	574906575	/nfs/dbraw/zinc/90/65/75/574906575.db2.gz	JJIVXKCAOKVNDZ-VLEAKVRGSA-N	1	0	265.323	1.244	50	0		CDAARO
C[C@H]1CC[NH2+]C[C@H]1c1ccc(NS(C)(=O)=O)cc1	ZINC000757213911	577036411	/nfs/dbraw/zinc/03/64/11/577036411.db2.gz	RZIZQCUAZLZPGL-GXFFZTMASA-N	1	0	268.382	1.771	50	0		CDAARO
CC(C)NC(=O)CN(C)CCC[NH+]1CCC(F)(F)CC1	ZINC000952992604	613913943	/nfs/dbraw/zinc/91/39/43/613913943.db2.gz	PUVYGUNNSGGRPE-UHFFFAOYSA-N	1	0	291.386	1.564	50	0		CDAARO
C[C@H](Oc1cccnc1)C(=O)N1[C@@H](C)CC(C[NH3+])C[C@@H]1C	ZINC000888095976	617757697	/nfs/dbraw/zinc/75/76/97/617757697.db2.gz	MPMINJQHOOISDC-AVGNSLFASA-N	1	0	291.395	1.823	50	0		CDAARO
CCCn1ncc(C[N@@H+]2C[C@@H]3COCC[C@]3(CO)C2)c1C	ZINC001772708870	1159442630	/nfs/dbraw/zinc/44/26/30/1159442630.db2.gz	KQVLCDXLNAAGAI-HZPDHXFCSA-N	1	0	293.411	1.432	50	0		CDAARO
CC[N@H+](CCC(=O)NC1CCCCCC1)[C@@H](C)C(N)=O	ZINC001704314652	1177686343	/nfs/dbraw/zinc/68/63/43/1177686343.db2.gz	VXMGQWYSEVPJEE-LBPRGKRZSA-N	1	0	283.416	1.411	50	0		CDAARO
COCCOCC[N@@H+]1CCC[C@]2(CCC[C@H]2O)C1	ZINC001704339347	1177695574	/nfs/dbraw/zinc/69/55/74/1177695574.db2.gz	RGIYGIQOZSILNJ-ZIAGYGMSSA-N	1	0	257.374	1.276	50	0		CDAARO
CN1C[C@]2(CCC[N@H+](CCc3ccccn3)CC2)OC1=O	ZINC000072145599	768875806	/nfs/dbraw/zinc/87/58/06/768875806.db2.gz	ZSJDNUCMRIUBBD-MRXNPFEDSA-N	1	0	289.379	1.931	50	0		CDAARO
Cc1nc(C[NH2+][C@H]2CCCN(C(=O)C(C)C)C2)n(C)c1C	ZINC000952978040	770103585	/nfs/dbraw/zinc/10/35/85/770103585.db2.gz	WZWPONZUXKWIFN-AWEZNQCLSA-N	1	0	292.427	1.774	50	0		CDAARO
O=C(c1ccco1)N1CCC[C@@H]([NH2+]Cc2ncc[nH]2)C1	ZINC000952981520	771415752	/nfs/dbraw/zinc/41/57/52/771415752.db2.gz	ZRTKWVJZCLFFTN-LLVKDONJSA-N	1	0	274.324	1.397	50	0		CDAARO
COc1cccc(CC[C@H]2CCC[N@@H+](C(CO)CO)C2)c1	ZINC000071771487	772093904	/nfs/dbraw/zinc/09/39/04/772093904.db2.gz	DOZJALHNHNLKPO-OAHLLOKOSA-N	1	0	293.407	1.693	50	0		CDAARO
O=C(NCCc1ccc(F)cc1)[C@@H]1[NH2+]CC12CCOCC2	ZINC000852772060	772218196	/nfs/dbraw/zinc/21/81/96/772218196.db2.gz	JOZMTKIUYIAMRK-AWEZNQCLSA-N	1	0	292.354	1.253	50	0		CDAARO
CC(C)Cc1nc(CN2CC[C@H]3C[NH2+]C[C@H]32)no1	ZINC000077300730	772525442	/nfs/dbraw/zinc/52/54/42/772525442.db2.gz	FQKANEUTYVBKHQ-WDEREUQCSA-N	1	0	250.346	1.062	50	0		CDAARO
OC[C@H]1CCC[N@H+](CCNCc2cnccc2Cl)C1	ZINC000952868640	910417651	/nfs/dbraw/zinc/41/76/51/910417651.db2.gz	BVZZVAIXCAJLCF-LBPRGKRZSA-N	1	0	283.803	1.529	50	0		CDAARO
C[C@H](C[NH+](C)C)NCc1nncn1C1CCCCC1	ZINC000821209130	925567934	/nfs/dbraw/zinc/56/79/34/925567934.db2.gz	VXAGZXNYXHGUNF-GFCCVEGCSA-N	1	0	265.405	1.823	50	0		CDAARO
CC(C)[N@@H+]1CC[C@@H](CN(C)Cc2ccnn2C)C1	ZINC000823715042	925722160	/nfs/dbraw/zinc/72/21/60/925722160.db2.gz	JTDXGNYLJUBPNF-ZDUSSCGKSA-N	1	0	250.390	1.582	50	0		CDAARO
CS[C@H](C)C(=O)N1CCC(O)(C[NH+]2CCCC2)CC1	ZINC000824870952	925838929	/nfs/dbraw/zinc/83/89/29/925838929.db2.gz	HJZBETODBTVYRN-GFCCVEGCSA-N	1	0	286.441	1.187	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)NCCCC(C)(C)CO	ZINC000828655363	926157358	/nfs/dbraw/zinc/15/73/58/926157358.db2.gz	JIUJNDIDMATLGH-ZDUSSCGKSA-N	1	0	270.417	1.776	50	0		CDAARO
CC[N@@H+]1CC[C@H](N(C)S(=O)(=O)c2ccsc2)C1	ZINC000585081742	930853025	/nfs/dbraw/zinc/85/30/25/930853025.db2.gz	SHVYDQOAFWKEPP-JTQLQIEISA-N	1	0	274.411	1.463	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1CCC(=O)NCc1nccs1	ZINC000585121815	930989026	/nfs/dbraw/zinc/98/90/26/930989026.db2.gz	AWVSNTSCJPHCNA-SNVBAGLBSA-N	1	0	253.371	1.634	50	0		CDAARO
C=CC(=O)Nc1ccc(N2CC[NH+](CC)CC2)cc1	ZINC001353214099	967786068	/nfs/dbraw/zinc/78/60/68/967786068.db2.gz	JGGPPJZOYWRAAT-UHFFFAOYSA-N	1	0	259.353	1.953	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]Cc2cc(=O)[nH]c(C)n2)n1	ZINC001506416224	975155777	/nfs/dbraw/zinc/15/57/77/975155777.db2.gz	FEKXSUBEUSSJOK-SNVBAGLBSA-N	1	0	275.356	1.482	50	0		CDAARO
Cc1cc(C[NH2+][C@H](C)CN2CCOCC2)cnc1C	ZINC000584902719	341986924	/nfs/dbraw/zinc/98/69/24/341986924.db2.gz	WLIAATHYJSMVHK-CYBMUJFWSA-N	1	0	263.385	1.509	50	0		CDAARO
Cc1ccc(OC2CN(C(=O)N[C@@H](C)C[NH+](C)C)C2)cc1	ZINC000426647866	230425656	/nfs/dbraw/zinc/42/56/56/230425656.db2.gz	DCTQBCFAIHSTPM-ZDUSSCGKSA-N	1	0	291.395	1.718	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+][C@@H](C)Cn2cncn2)C12CCCC2	ZINC000095987843	185056959	/nfs/dbraw/zinc/05/69/59/185056959.db2.gz	YFSPACUHLLVHFM-MELADBBJSA-N	1	0	278.400	1.994	50	0		CDAARO
COC(=O)c1ccc(C(=O)N[C@@H]2CCC[N@H+](C)[C@H]2C)cc1	ZINC000096009718	185064832	/nfs/dbraw/zinc/06/48/32/185064832.db2.gz	BOQPVRDYAIEFLT-SMDDNHRTSA-N	1	0	290.363	1.686	50	0		CDAARO
COCC1(CNC(=O)c2cccc(C[NH3+])c2)CCC1	ZINC000388671154	342090049	/nfs/dbraw/zinc/09/00/49/342090049.db2.gz	CRIYDZGQYDVANE-UHFFFAOYSA-N	1	0	262.353	1.692	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)c1cc(F)c(F)cc1Cl	ZINC000195544782	342626663	/nfs/dbraw/zinc/62/66/63/342626663.db2.gz	PCSWXJPMFVDXGM-QWRGUYRKSA-N	1	0	290.697	1.335	50	0		CDAARO
Cc1ccc(NC(=O)N2C[C@H](O)[C@@H]([NH+]3CCCC3)C2)s1	ZINC000095407150	539088070	/nfs/dbraw/zinc/08/80/70/539088070.db2.gz	VWXIDEQMGIQRPP-RYUDHWBXSA-N	1	0	295.408	1.729	50	0		CDAARO
COC[C@H]1CC[N@H+](CCC(=O)NCc2ccccc2F)C1	ZINC000244831496	361864781	/nfs/dbraw/zinc/86/47/81/361864781.db2.gz	UERQVBUMCNWLDC-ZDUSSCGKSA-N	1	0	294.370	1.800	50	0		CDAARO
CCc1nc(CN2CC[NH2+][C@H](c3ccccc3)C2)no1	ZINC000244872944	361866242	/nfs/dbraw/zinc/86/62/42/361866242.db2.gz	WHJDHYBTZFAPBX-ZDUSSCGKSA-N	1	0	272.352	1.779	50	0		CDAARO
O=c1cc(CN2[C@@H]3CC[C@H]2C[NH2+]CC3)nc2sccn21	ZINC000244852707	361866461	/nfs/dbraw/zinc/86/64/61/361866461.db2.gz	UXEXKAQXLPXZJK-NEPJUHHUSA-N	1	0	290.392	1.082	50	0		CDAARO
O=C(N[C@@H]([C@H]1C[C@@H](O)C1)C1CC[NH2+]CC1)c1ccsc1	ZINC000244852528	361866503	/nfs/dbraw/zinc/86/65/03/361866503.db2.gz	UUAQFAMOSLTJHU-HZSPNIEDSA-N	1	0	294.420	1.617	50	0		CDAARO
Cc1cn2c(n1)CC[C@@H](NC(=O)Cc1csc(C)n1)C2	ZINC000097198698	342217025	/nfs/dbraw/zinc/21/70/25/342217025.db2.gz	ODDPZYCQKFBWEM-LLVKDONJSA-N	1	0	290.392	1.630	50	0		CDAARO
CC1(C)C[C@@H]([NH2+]CC[C@H]2CCOC2=O)C(C)(C)O1	ZINC000119832407	342270672	/nfs/dbraw/zinc/27/06/72/342270672.db2.gz	KVYGHHCBOMYYLC-WDEREUQCSA-N	1	0	255.358	1.875	50	0		CDAARO
C[NH2+]CC(=O)N1CCC(OCc2ccccc2F)CC1	ZINC000252479618	342381720	/nfs/dbraw/zinc/38/17/20/342381720.db2.gz	BIRWCOPEEIQQOL-UHFFFAOYSA-N	1	0	280.343	1.553	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)[C@H]2COc3ccc(Cl)cc3C2)C1	ZINC000178516680	362245255	/nfs/dbraw/zinc/24/52/55/362245255.db2.gz	PAIOCXSARRSALD-ZYHUDNBSSA-N	1	0	294.782	1.698	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)COc2ccc(F)cc2F)C1	ZINC000178979897	362250525	/nfs/dbraw/zinc/25/05/25/362250525.db2.gz	UKNBKJMRSVLUSX-JTQLQIEISA-N	1	0	284.306	1.412	50	0		CDAARO
COc1cccc([C@@H]2CC[N@@H+]2CCn2cc[nH]c2=O)c1	ZINC000252480644	362384806	/nfs/dbraw/zinc/38/48/06/362384806.db2.gz	CBSREUDANZITJQ-AWEZNQCLSA-N	1	0	273.336	1.632	50	0		CDAARO
[NH3+][C@H]1C[C@@H](c2cc(NCc3cnc4cnccn34)ncn2)C1	ZINC000253378426	362426126	/nfs/dbraw/zinc/42/61/26/362426126.db2.gz	FDLJLWPSUXDWNM-PHIMTYICSA-N	1	0	295.350	1.336	50	0		CDAARO
Cc1nnc2n1C[C@H]([NH2+]Cc1c[nH]nc1C(C)(C)C)CC2	ZINC000065565465	282363223	/nfs/dbraw/zinc/36/32/23/282363223.db2.gz	NTVSMIGZXFCSGS-GFCCVEGCSA-N	1	0	288.399	1.712	50	0		CDAARO
C[C@H](NC(=O)N1CCC[C@@H](O)C1)C(C)(C)C[NH+](C)C	ZINC000085423140	179059308	/nfs/dbraw/zinc/05/93/08/179059308.db2.gz	PKVLMGRRLYCPJV-NWDGAFQWSA-N	1	0	271.405	1.129	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN1C(=O)c1cc2ccccc2o1	ZINC000085470068	179075455	/nfs/dbraw/zinc/07/54/55/179075455.db2.gz	DYRKMEAYYSEGMX-ZDUSSCGKSA-N	1	0	288.347	1.835	50	0		CDAARO
CCCCCOCC(=O)Nc1cnn(CC[NH+](C)C)c1	ZINC000130203788	346637875	/nfs/dbraw/zinc/63/78/75/346637875.db2.gz	MRCLHSRIKOEETR-UHFFFAOYSA-N	1	0	282.388	1.590	50	0		CDAARO
CC(=O)N1CC[C@H]([NH2+]Cc2occc2C)[C@H](C)C1	ZINC000089701979	347608044	/nfs/dbraw/zinc/60/80/44/347608044.db2.gz	LFMUYMSYTNLEJY-YPMHNXCESA-N	1	0	250.342	1.935	50	0		CDAARO
C=C1C(C(=O)OCC)[N+](=O)c2cc(F)c(F)cc2N1O	ZINC000137203838	348750447	/nfs/dbraw/zinc/75/04/47/348750447.db2.gz	KFEFYDXVDAJNGS-UHFFFAOYSA-N	1	0	285.226	1.556	50	0		CDAARO
C=CC(=O)Nc1cc(N)ccc1N1CC[NH+](C)CC1	ZINC000222157940	348756485	/nfs/dbraw/zinc/75/64/85/348756485.db2.gz	YUBPMZNUZHIOBP-UHFFFAOYSA-N	1	0	260.341	1.145	50	0		CDAARO
[NH3+]CCc1ccc(C(=O)N[C@H]2CCc3c[nH]nc3C2)cc1	ZINC000584885847	349344314	/nfs/dbraw/zinc/34/43/14/349344314.db2.gz	RWTDAKCNWBLAIL-AWEZNQCLSA-N	1	0	284.363	1.198	50	0		CDAARO
COc1cccc2ncn(C[C@@]3(C)CC[N@H+](C)C3)c(=O)c21	ZINC000584886943	349345389	/nfs/dbraw/zinc/34/53/89/349345389.db2.gz	RDCNCHUJPCDKTP-INIZCTEOSA-N	1	0	287.363	1.747	50	0		CDAARO
CO[C@H]1[C@@H]2CC[C@H]1CN(C(=O)[C@]1(C)CCC[NH2+]C1)C2	ZINC000584900429	349362485	/nfs/dbraw/zinc/36/24/85/349362485.db2.gz	NAYKBWVXPGZLDU-UKTARXLSSA-N	1	0	266.385	1.260	50	0		CDAARO
Cc1c(Br)cccc1C[NH+](CCO)CCO	ZINC000090525926	179996891	/nfs/dbraw/zinc/99/68/91/179996891.db2.gz	MRQNFCZBAGUFOT-UHFFFAOYSA-N	1	0	288.185	1.544	50	0		CDAARO
COCc1nsc(N2CCC[C@H]([NH+]3CCCC3)C2)n1	ZINC000091453427	180159402	/nfs/dbraw/zinc/15/94/02/180159402.db2.gz	DPLZPPHULZGYMK-NSHDSACASA-N	1	0	282.413	1.749	50	0		CDAARO
Cc1ncnc(N2C[C@H](O)[C@@H]([NH+]3CCCCC3)C2)c1C	ZINC000091548278	180188352	/nfs/dbraw/zinc/18/83/52/180188352.db2.gz	WZCMDOMKFUNIHZ-KBPBESRZSA-N	1	0	276.384	1.129	50	0		CDAARO
Cc1nc(C[N@@H+]2CC[C@@](O)(C3CCC3)[C@H](C)C2)cc(=O)[nH]1	ZINC000091966364	180293703	/nfs/dbraw/zinc/29/37/03/180293703.db2.gz	JKVBSNVENIVMKN-BZNIZROVSA-N	1	0	291.395	1.451	50	0		CDAARO
O=C(NC[C@@H]1CC[N@@H+](C2CC2)C1)c1cncc(O)c1	ZINC000109042539	186241513	/nfs/dbraw/zinc/24/15/13/186241513.db2.gz	DJUJGPJFFAGTRM-JTQLQIEISA-N	1	0	261.325	1.001	50	0		CDAARO
COC[C@@H]1CCN(C(=O)[C@@H]2CCCC[N@@H+]2C(C)C)C1	ZINC000110618621	186306025	/nfs/dbraw/zinc/30/60/25/186306025.db2.gz	TYLQKQOETFMNHF-KGLIPLIRSA-N	1	0	268.401	1.744	50	0		CDAARO
COC(=O)[C@@]1(C[NH3+])CC12CCN(C(=O)OC(C)(C)C)CC2	ZINC000260029966	351198339	/nfs/dbraw/zinc/19/83/39/351198339.db2.gz	CKVCWEBYSLEJNT-HNNXBMFYSA-N	1	0	298.383	1.526	50	0		CDAARO
Cn1nccc1C[NH2+][C@H]1CCC[C@@H]1NC(=O)OC(C)(C)C	ZINC000122895874	187057970	/nfs/dbraw/zinc/05/79/70/187057970.db2.gz	WGQOAFFFPSMXRI-STQMWFEESA-N	1	0	294.399	1.956	50	0		CDAARO
CC(=O)NC(=S)Nc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000000359981	355905963	/nfs/dbraw/zinc/90/59/63/355905963.db2.gz	VXJFQUDVAXHXOP-UHFFFAOYSA-N	1	0	292.408	1.271	50	0		CDAARO
Cc1cc(N2CCN(c3ccccc3)CC2)nc(N)[nH+]1	ZINC000000384257	355907755	/nfs/dbraw/zinc/90/77/55/355907755.db2.gz	QBWUYIYCOLJTLR-UHFFFAOYSA-N	1	0	269.352	1.694	50	0		CDAARO
C[NH+](C)CC(=O)NC[C@@](C)(O)c1ccccc1Cl	ZINC000097379049	356106969	/nfs/dbraw/zinc/10/69/69/356106969.db2.gz	QAUMAQWREVDGSU-CYBMUJFWSA-N	1	0	270.760	1.225	50	0		CDAARO
C[C@H]1CCCN(S(=O)(=O)c2ccc(C[NH3+])cc2)C1	ZINC000011849281	356280584	/nfs/dbraw/zinc/28/05/84/356280584.db2.gz	MNZZDOSKBMCICP-NSHDSACASA-N	1	0	268.382	1.566	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)COc2ccc3c(c2)CCC3)CC1	ZINC000013323013	356343442	/nfs/dbraw/zinc/34/34/42/356343442.db2.gz	UFMMPXLBSGLVCJ-UHFFFAOYSA-N	1	0	288.391	1.718	50	0		CDAARO
CCC[NH+]1CCN(C(=O)COc2cccc(C)c2)CC1	ZINC000013331464	356344353	/nfs/dbraw/zinc/34/43/53/356344353.db2.gz	CTYMOHQMRFEGEY-UHFFFAOYSA-N	1	0	276.380	1.928	50	0		CDAARO
OCCOCC[NH2+]Cc1ccc(Br)cc1	ZINC000015416536	356415965	/nfs/dbraw/zinc/41/59/65/356415965.db2.gz	SFMMTSNBHGAYCI-UHFFFAOYSA-N	1	0	274.158	1.548	50	0		CDAARO
CO[C@@H]1C=CC2=CC[N@@H+]3CC[C@@H]4COC(=O)C=C4[C@]23C1	ZINC000015204175	356409036	/nfs/dbraw/zinc/40/90/36/356409036.db2.gz	IXPDLJKEPLTCOU-KFNAQCHYSA-N	1	0	273.332	1.445	50	0		CDAARO
C[C@@H](CC[N@@H+]1CCN2C(=O)NC[C@@H]2C1)c1ccccc1	ZINC000194060018	358505531	/nfs/dbraw/zinc/50/55/31/358505531.db2.gz	MEMUXWHMRHTWFB-DZGCQCFKSA-N	1	0	273.380	1.890	50	0		CDAARO
COc1cccc(CN2CCC[N@H+](C)CC2)c1OC	ZINC000019537055	356491389	/nfs/dbraw/zinc/49/13/89/356491389.db2.gz	QJUHQOIRWIHOBL-UHFFFAOYSA-N	1	0	264.369	1.841	50	0		CDAARO
O=C([C@@H]1CCCC[NH2+]1)N1CCN(Cc2ccccc2)CC1	ZINC000019413204	356484742	/nfs/dbraw/zinc/48/47/42/356484742.db2.gz	UOXKEPYIIWANER-INIZCTEOSA-N	1	0	287.407	1.473	50	0		CDAARO
Cc1ccc(C)c(O[C@@H](C)C(=O)N2CC[NH2+]CC2)c1	ZINC000019423729	356484980	/nfs/dbraw/zinc/48/49/80/356484980.db2.gz	AJCYJXCFWXNEEF-ZDUSSCGKSA-N	1	0	262.353	1.503	50	0		CDAARO
CC(C)=CC[N@@H+]1CCC[C@H](Cn2cc(CCCO)nn2)C1	ZINC000019145887	356476103	/nfs/dbraw/zinc/47/61/03/356476103.db2.gz	ZXPPVKFKJIVMHK-HNNXBMFYSA-N	1	0	292.427	1.881	50	0		CDAARO
Cn1ccnc1[C@@H](c1ccccc1)N1CC[NH2+]CC1	ZINC000019735768	356497790	/nfs/dbraw/zinc/49/77/90/356497790.db2.gz	BISLYFJHPWWIIU-CQSZACIVSA-N	1	0	256.353	1.415	50	0		CDAARO
COc1cc(C[NH2+]CCN(C)C)cc(OC)c1OC	ZINC000019735351	356498311	/nfs/dbraw/zinc/49/83/11/356498311.db2.gz	MIOQNCSZYODKSU-UHFFFAOYSA-N	1	0	268.357	1.364	50	0		CDAARO
O=C(CN1CC[NH2+]CC1)Nc1ccccc1Cl	ZINC000019797589	356504862	/nfs/dbraw/zinc/50/48/62/356504862.db2.gz	PEUDTGQBHWMHRS-UHFFFAOYSA-N	1	0	253.733	1.184	50	0		CDAARO
CC[NH+]1CCN(CC(=O)N2c3ccccc3C[C@@H]2C)CC1	ZINC000019899632	356515159	/nfs/dbraw/zinc/51/51/59/356515159.db2.gz	JMNXWFGBYXLBAQ-AWEZNQCLSA-N	1	0	287.407	1.602	50	0		CDAARO
O=C(c1cccnc1)N1CCC([NH+]2CC=CC2)CC1	ZINC000102057587	538451722	/nfs/dbraw/zinc/45/17/22/538451722.db2.gz	NLUNVYUQSMFEGM-UHFFFAOYSA-N	1	0	257.337	1.558	50	0		CDAARO
COC(=O)c1ccc(OC[C@@H](O)C[NH2+]C(C)C)cc1	ZINC000026781690	356699593	/nfs/dbraw/zinc/69/95/93/356699593.db2.gz	IKLHTJKCEKYJKI-LBPRGKRZSA-N	1	0	267.325	1.211	50	0	in-vitro	CDAARO
COc1ccc2c(c1)C[C@H]([NH2+]CC(=O)NC(C)C)CC2	ZINC000067919906	356760850	/nfs/dbraw/zinc/76/08/50/356760850.db2.gz	IKNINQVCHDITRV-CQSZACIVSA-N	1	0	276.380	1.667	50	0		CDAARO
COC[C@H]([NH2+][C@H]1CCN(c2ccccn2)C1)C(C)C	ZINC000090802807	356834022	/nfs/dbraw/zinc/83/40/22/356834022.db2.gz	GSRSYQGRUUSQGE-KBPBESRZSA-N	1	0	263.385	1.921	50	0		CDAARO
CC[C@@H](CO)[NH2+]C[C@@H](O)COc1cc(C)ccc1C	ZINC000026781349	356823524	/nfs/dbraw/zinc/82/35/24/356823524.db2.gz	HYEIYIKEUWTZCS-UONOGXRCSA-N	1	0	267.369	1.404	50	0		CDAARO
CC(C)C[N@@H+]1CCN(Cc2ccoc2)[C@@H](CCO)C1	ZINC000032523739	356781531	/nfs/dbraw/zinc/78/15/31/356781531.db2.gz	TYQLEBGYFUCJNH-HNNXBMFYSA-N	1	0	266.385	1.804	50	0		CDAARO
CCc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000035993513	356854117	/nfs/dbraw/zinc/85/41/17/356854117.db2.gz	WGLMSHBIMICEGP-UHFFFAOYSA-N	1	0	268.382	1.185	50	0		CDAARO
Cc1cccc2c(=O)n(CC[NH+]3CCC(O)CC3)cnc12	ZINC000043016891	357084642	/nfs/dbraw/zinc/08/46/42/357084642.db2.gz	YTDXFLFNDNQFDF-UHFFFAOYSA-N	1	0	287.363	1.162	50	0		CDAARO
CC(C)(C)OC(=O)c1cccc(N2CC[NH2+]CC2)n1	ZINC000043179078	357087752	/nfs/dbraw/zinc/08/77/52/357087752.db2.gz	IWFGULANJYMPIT-UHFFFAOYSA-N	1	0	263.341	1.447	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1C[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)[C@@H]2C1	ZINC000096502771	357519165	/nfs/dbraw/zinc/51/91/65/357519165.db2.gz	HXMAPJYHAWSQGG-DGAVXFQQSA-N	1	0	298.427	1.992	50	0		CDAARO
CC(C)OCC[NH2+]CCC(=O)NC1CCCCC1	ZINC000065386843	357535513	/nfs/dbraw/zinc/53/55/13/357535513.db2.gz	RWTDHBFSYPUNDN-UHFFFAOYSA-N	1	0	256.390	1.840	50	0		CDAARO
CCOC(=O)c1nn(CCC(C)C)c2c1C[NH2+]CC2	ZINC000065395562	357536344	/nfs/dbraw/zinc/53/63/44/357536344.db2.gz	KBUILVKZTITQTG-UHFFFAOYSA-N	1	0	265.357	1.752	50	0		CDAARO
COc1cccc(C[C@@H](C)[NH2+]CCc2nnc(N)s2)c1	ZINC000065397045	357536597	/nfs/dbraw/zinc/53/65/97/357536597.db2.gz	BNWLEHKLVMWCJU-SNVBAGLBSA-N	1	0	292.408	1.892	50	0		CDAARO
Cn1cc(C2=CC[N@H+](CCC(=O)N3CCCC3)CC2)cn1	ZINC000065398792	357538135	/nfs/dbraw/zinc/53/81/35/357538135.db2.gz	FBIGEISLNVBHDO-UHFFFAOYSA-N	1	0	288.395	1.522	50	0		CDAARO
O=c1c2c3c(sc2ncn1Cc1ccncc1)C[NH2+]CC3	ZINC000065398652	357538210	/nfs/dbraw/zinc/53/82/10/357538210.db2.gz	NJLBTGQEQYXZGW-UHFFFAOYSA-N	1	0	298.371	1.547	50	0		CDAARO
Cn1nc(-c2nc(Cc3ccccc3)no2)c2c1CC[NH2+]C2	ZINC000066323511	357562338	/nfs/dbraw/zinc/56/23/38/357562338.db2.gz	JZQSXGNCNIIJOP-UHFFFAOYSA-N	1	0	295.346	1.707	50	0		CDAARO
O=C(c1coc2ccccc12)N1C[C@H]2C[NH2+]C[C@H]2C1	ZINC000090320696	357653876	/nfs/dbraw/zinc/65/38/76/357653876.db2.gz	GEWYONHBOOJKDL-PHIMTYICSA-N	1	0	256.305	1.724	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)Cc2cccs2)C1	ZINC000070172264	357712490	/nfs/dbraw/zinc/71/24/90/357712490.db2.gz	CRYPLHDLLGYSBZ-GHMZBOCLSA-N	1	0	252.383	1.876	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COCc2ccccc2)CC1	ZINC000019790728	358142303	/nfs/dbraw/zinc/14/23/03/358142303.db2.gz	JLCAHOLJNZHZOZ-INIZCTEOSA-N	1	0	278.396	1.202	50	0		CDAARO
CCC[C@@H]1CN(C(=O)Cn2ccccc2=O)C[C@H]1[NH+](C)C	ZINC000082109404	358147123	/nfs/dbraw/zinc/14/71/23/358147123.db2.gz	LFCHFFBFGRPLMH-ZIAGYGMSSA-N	1	0	291.395	1.037	50	0		CDAARO
CCCc1cc(C(=O)NCC[N@@H+]2CCC[C@H](CO)C2)no1	ZINC000082114801	358147945	/nfs/dbraw/zinc/14/79/45/358147945.db2.gz	SJCAQZBUIXHVFF-LBPRGKRZSA-N	1	0	295.383	1.061	50	0		CDAARO
Cc1cc(OC[C@@H](O)C[NH2+][C@@H](C)CCO)ccc1Cl	ZINC000020109928	358327150	/nfs/dbraw/zinc/32/71/50/358327150.db2.gz	ZEOGYNAGHYBYCU-RYUDHWBXSA-N	1	0	287.787	1.749	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1S(=O)(=O)c1cc(C)c(C)s1	ZINC000195555316	358557928	/nfs/dbraw/zinc/55/79/28/358557928.db2.gz	UASBPVGUNBNMQM-LLVKDONJSA-N	1	0	288.438	1.737	50	0		CDAARO
O=C(/C=C/c1cccc(F)c1)NCC1CC[NH2+]CC1	ZINC000195542759	358559878	/nfs/dbraw/zinc/55/98/78/358559878.db2.gz	KUKUHODEUAYRGA-SNAWJCMRSA-N	1	0	262.328	1.955	50	0		CDAARO
C[C@H](CCc1cccc(F)c1)[N@@H+]1CCO[C@@H](CO)C1	ZINC000195558418	358564393	/nfs/dbraw/zinc/56/43/93/358564393.db2.gz	KCTJGCIJPLHBAV-IUODEOHRSA-N	1	0	267.344	1.840	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@@H]2CO)cc2c1OCO2	ZINC000023280122	358656137	/nfs/dbraw/zinc/65/61/37/358656137.db2.gz	BSHNYWYYKXRJGT-LLVKDONJSA-N	1	0	265.309	1.381	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CN2C(=O)COc3ccc(F)cc32)C1	ZINC000095357632	358684491	/nfs/dbraw/zinc/68/44/91/358684491.db2.gz	BZRLDVPLCDXMBN-LLVKDONJSA-N	1	0	278.327	1.893	50	0		CDAARO
Cc1nnc(N2CCCO[C@@H](C[NH+]3CCCC3)C2)o1	ZINC000095360550	358685671	/nfs/dbraw/zinc/68/56/71/358685671.db2.gz	GPXUDUBYTRKJBH-LBPRGKRZSA-N	1	0	266.345	1.069	50	0		CDAARO
Cc1noc([C@@H]2CCC[N@@H+](C3CCOCC3)C2)n1	ZINC000095454197	358693973	/nfs/dbraw/zinc/69/39/73/358693973.db2.gz	DUQMXOJCAZWVKU-LLVKDONJSA-N	1	0	251.330	1.736	50	0		CDAARO
CC[NH+]1CCC(Cc2nc(CN3CCOCC3)no2)CC1	ZINC000096165720	358711845	/nfs/dbraw/zinc/71/18/45/358711845.db2.gz	VGCMDLBBTHTNAT-UHFFFAOYSA-N	1	0	294.399	1.176	50	0		CDAARO
Cc1n[nH]c(CN2CCC[C@@]3(CC[NH2+]C3)C2)c1Cl	ZINC000097532346	358782411	/nfs/dbraw/zinc/78/24/11/358782411.db2.gz	GKJVDHFCFQKPNB-ZDUSSCGKSA-N	1	0	268.792	1.947	50	0		CDAARO
CNC(=O)[C@H]1CCCN(Cc2[nH]nc(C)c2Cl)C1	ZINC000097604113	358787378	/nfs/dbraw/zinc/78/73/78/358787378.db2.gz	YAIDVOWEYOTWLJ-VIFPVBQESA-N	1	0	270.764	1.330	50	0		CDAARO
c1cc2nonc2c(CN2CC[C@H]3CC[C@@H](C2)[NH2+]3)c1	ZINC000097694638	358793880	/nfs/dbraw/zinc/79/38/80/358793880.db2.gz	CPGCIICOJZYMIW-NEPJUHHUSA-N	1	0	258.325	1.549	50	0		CDAARO
CSCCC[NH+]1CCN(c2ncnc(C)c2C)CC1	ZINC000097742811	358795977	/nfs/dbraw/zinc/79/59/77/358795977.db2.gz	GXMOQYBOIYXUCW-UHFFFAOYSA-N	1	0	280.441	1.969	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)c1cccc2nccnc21	ZINC000097785515	358798880	/nfs/dbraw/zinc/79/88/80/358798880.db2.gz	CXSOHLJOWGTBDF-UHFFFAOYSA-N	1	0	270.336	1.455	50	0		CDAARO
O=C(CCOc1ccccc1)N1CC[N@@H+]2CCC[C@@H]2C1	ZINC000215266380	358881902	/nfs/dbraw/zinc/88/19/02/358881902.db2.gz	ASNZJIMHGNIBIC-CQSZACIVSA-N	1	0	274.364	1.762	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)NCCC2=CSC3=NCCCN23)C1	ZINC000102553732	358882118	/nfs/dbraw/zinc/88/21/18/358882118.db2.gz	PMOXOLKKZQGNKI-WDEREUQCSA-N	1	0	294.424	1.270	50	0		CDAARO
CC(C)[C@@H](NC(=O)CCC[NH+]1CCCC1)c1ncnn1C	ZINC000219311816	359087675	/nfs/dbraw/zinc/08/76/75/359087675.db2.gz	GYXIASRXNNGWOW-CQSZACIVSA-N	1	0	293.415	1.504	50	0		CDAARO
CSc1ncc(C(=O)N2CC[N@@H+]3CCC[C@@H]3C2)cn1	ZINC000219631933	359108591	/nfs/dbraw/zinc/10/85/91/359108591.db2.gz	NFYOTUCAWMJVEN-LLVKDONJSA-N	1	0	278.381	1.119	50	0		CDAARO
O=C(CCc1ccccc1)C(=O)NC[C@H]1CCCCC[NH2+]1	ZINC000219901951	359137094	/nfs/dbraw/zinc/13/70/94/359137094.db2.gz	TYLAQYZVNCHZBC-OAHLLOKOSA-N	1	0	288.391	1.837	50	0		CDAARO
CN1CCC[C@@H]1c1nc(C2CN(C(=O)C3CCC3)C2)no1	ZINC000257178186	359143229	/nfs/dbraw/zinc/14/32/29/359143229.db2.gz	FXMQCOXUVQADAY-GFCCVEGCSA-N	1	0	290.367	1.562	50	0		CDAARO
Nc1nnc(N2CCC([NH+]3CCCCC3)CC2)s1	ZINC000033413695	359327450	/nfs/dbraw/zinc/32/74/50/359327450.db2.gz	JIZQXTXPYMFBSI-UHFFFAOYSA-N	1	0	267.402	1.575	50	0		CDAARO
CCc1ccc([C@H](C)[NH2+][C@H](C)C(=O)NC(N)=O)cc1	ZINC000024990407	359332678	/nfs/dbraw/zinc/33/26/78/359332678.db2.gz	FQPAYLZJLFVBNR-VHSXEESVSA-N	1	0	263.341	1.483	50	0		CDAARO
[NH3+][C@H]1C[C@@H](c2cc(N3CCC(c4cc[nH]n4)CC3)ncn2)C1	ZINC000223404990	359423739	/nfs/dbraw/zinc/42/37/39/359423739.db2.gz	HYSOQAFOKNPFCC-JOCQHMNTSA-N	1	0	298.394	1.788	50	0		CDAARO
CN(Cc1[nH]nc2c1CCC2)c1cc(C2CC([NH3+])C2)ncn1	ZINC000223186869	359406860	/nfs/dbraw/zinc/40/68/60/359406860.db2.gz	FEEFZFNSOJBWQJ-UHFFFAOYSA-N	1	0	298.394	1.530	50	0		CDAARO
Cc1cccnc1C(=O)NCCCOC1CC[NH+](C)CC1	ZINC000223789396	359456145	/nfs/dbraw/zinc/45/61/45/359456145.db2.gz	YQCRWUCUHTUNHF-UHFFFAOYSA-N	1	0	291.395	1.621	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)c2ccnc(C3CC3)n2)C1	ZINC000261805363	359569418	/nfs/dbraw/zinc/56/94/18/359569418.db2.gz	WETNABLWEHCQBA-LLVKDONJSA-N	1	0	260.341	1.178	50	0		CDAARO
COc1cccc(C[N@@H+]2CCOCCNC(=O)CC2)c1	ZINC000257194891	359610254	/nfs/dbraw/zinc/61/02/54/359610254.db2.gz	UWSABNAOEZDBQM-UHFFFAOYSA-N	1	0	278.352	1.034	50	0		CDAARO
CCn1cnc2c1ncnc2N1CCC[N@H+](CC)C[C@@H]1C	ZINC000408523515	359931032	/nfs/dbraw/zinc/93/10/32/359931032.db2.gz	KSBQYSMPGKNDKJ-LBPRGKRZSA-N	1	0	288.399	1.767	50	0		CDAARO
CC[C@H](Sc1nnc(C[NH3+])n1CC(C)C)C(=O)N(C)C	ZINC000426501773	360677490	/nfs/dbraw/zinc/67/74/90/360677490.db2.gz	NQNUBVSBBGGETE-JTQLQIEISA-N	1	0	299.444	1.352	50	0		CDAARO
Cc1nc(NCC[NH+]2CCCC2)cc([C@H]2CCOC2)n1	ZINC000426549142	360683138	/nfs/dbraw/zinc/68/31/38/360683138.db2.gz	KKDYBHGNJVCXJT-ZDUSSCGKSA-N	1	0	276.384	1.219	50	0		CDAARO
O=C(c1cccc(-c2c[nH]cn2)c1)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000426389209	360662764	/nfs/dbraw/zinc/66/27/64/360662764.db2.gz	DVSNCZBLSHQMIV-HNNXBMFYSA-N	1	0	296.374	1.997	50	0		CDAARO
O=C(Nc1ccc(Cl)cc1)N1C[C@@H]2[NH2+]CCO[C@H]2C1	ZINC000426438809	360670727	/nfs/dbraw/zinc/67/07/27/360670727.db2.gz	HSCDBDPWDPJNAC-RYUDHWBXSA-N	1	0	281.743	1.545	50	0		CDAARO
COc1cc(C(=O)N2CC[C@@H](C[NH3+])C2)ccc1OC(C)C	ZINC000178574859	189128316	/nfs/dbraw/zinc/12/83/16/189128316.db2.gz	STDSPEUZMYIZBH-LBPRGKRZSA-N	1	0	292.379	1.903	50	0		CDAARO
COc1ccccc1OCCC(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178534877	189124731	/nfs/dbraw/zinc/12/47/31/189124731.db2.gz	XYNQOHBXGLSGEX-LBPRGKRZSA-N	1	0	278.352	1.271	50	0		CDAARO
Cc1cc(C)c(OCC(=O)N(C)[C@@H]2CC[NH2+]C2)c(C)c1	ZINC000179097081	189168814	/nfs/dbraw/zinc/16/88/14/189168814.db2.gz	VMFAQLWIKIPDKK-CQSZACIVSA-N	1	0	276.380	1.811	50	0		CDAARO
O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)[C@H]1CCCO1	ZINC000036090449	360895668	/nfs/dbraw/zinc/89/56/68/360895668.db2.gz	QAERRSINMWMGRW-GXTWGEPZSA-N	1	0	278.352	1.712	50	0		CDAARO
Cc1c[nH]c([C@@H](C)NC(=O)CSCc2nc(C)no2)n1	ZINC000426523311	360980991	/nfs/dbraw/zinc/98/09/91/360980991.db2.gz	BKLFNQRXOXLFQV-MRVPVSSYSA-N	1	0	295.368	1.520	50	0		CDAARO
Cc1nnc(CN(C)C(=O)NCCC2CC[NH+](C)CC2)o1	ZINC000426571447	361017753	/nfs/dbraw/zinc/01/77/53/361017753.db2.gz	INUQOXAKHGLECF-UHFFFAOYSA-N	1	0	295.387	1.251	50	0		CDAARO
CCCc1ccc(S(=O)(=O)N2CCC([NH3+])CC2)cc1	ZINC000036176513	361200464	/nfs/dbraw/zinc/20/04/64/361200464.db2.gz	NQFDXRDQQLZJBU-UHFFFAOYSA-N	1	0	282.409	1.751	50	0		CDAARO
Cc1ccccc1[C@@H](CN1CCOCC1)[NH2+]C[C@H](C)O	ZINC000183277785	189353030	/nfs/dbraw/zinc/35/30/30/189353030.db2.gz	ZUAQQTDNDIILLT-GOEBONIOSA-N	1	0	278.396	1.339	50	0		CDAARO
COc1cc(C)c(S(=O)(=O)N2CCC[C@@H]([NH3+])C2)c(C)c1	ZINC000036296970	361461022	/nfs/dbraw/zinc/46/10/22/361461022.db2.gz	ATDVKODZNPCLHC-GFCCVEGCSA-N	1	0	298.408	1.424	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N(C)C1CC[NH2+]CC1	ZINC000036299957	361490118	/nfs/dbraw/zinc/49/01/18/361490118.db2.gz	GDMJBKIBAUYEQE-UHFFFAOYSA-N	1	0	286.372	1.507	50	0		CDAARO
COc1ccc(S(=O)(=O)N(C)C2CC[NH2+]CC2)cc1C	ZINC000036300056	361491379	/nfs/dbraw/zinc/49/13/79/361491379.db2.gz	VYFHDZQHUUBGQN-UHFFFAOYSA-N	1	0	298.408	1.376	50	0		CDAARO
Cc1nc(-c2ccc(N3CC[NH2+]CC3)cc2)cc(=O)[nH]1	ZINC000082575698	361585239	/nfs/dbraw/zinc/58/52/39/361585239.db2.gz	CTSQPHCHBWPSOI-UHFFFAOYSA-N	1	0	270.336	1.155	50	0		CDAARO
O=S(=O)(NC[C@H]1CCC[NH2+]C1)c1ccccc1F	ZINC000019271221	364073027	/nfs/dbraw/zinc/07/30/27/364073027.db2.gz	QYJOEXAESIUATJ-JTQLQIEISA-N	1	0	272.345	1.104	50	0		CDAARO
O=C(NCC1CC[NH+]([C@H]2CCOC2)CC1)c1ccsc1	ZINC000575415680	364803444	/nfs/dbraw/zinc/80/34/44/364803444.db2.gz	OAMGQYNWEWQCLY-AWEZNQCLSA-N	1	0	294.420	1.979	50	0		CDAARO
Cc1ccc(COC[C@@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1	ZINC000016579257	364850398	/nfs/dbraw/zinc/85/03/98/364850398.db2.gz	NAFHMESIBRXAPD-UXLLHSPISA-N	1	0	293.407	1.982	50	0		CDAARO
CCCN(C(=O)c1ncncc1Cl)[C@H]1CC[NH2+]C1	ZINC000178887393	364956687	/nfs/dbraw/zinc/95/66/87/364956687.db2.gz	DEPHKCKVTUSSLD-VIFPVBQESA-N	1	0	268.748	1.344	50	0		CDAARO
Cc1ccc(-n2nnnc2N2CC[C@H]([NH+]3CCCC3)C2)cc1	ZINC000089643099	366895713	/nfs/dbraw/zinc/89/57/13/366895713.db2.gz	OLOSJWZNKIOACF-HNNXBMFYSA-N	1	0	298.394	1.645	50	0		CDAARO
Cc1c(CNC(=O)[C@H](C)[N@H+]2[C@H](C)CC[C@@H]2C)cnn1C	ZINC000089882974	366951022	/nfs/dbraw/zinc/95/10/22/366951022.db2.gz	IPKCOFQOZAPJSF-LOWVWBTDSA-N	1	0	278.400	1.606	50	0		CDAARO
CC[C@@H]1CN(C(=O)C(C)C)CC[C@H]1[NH2+]Cc1ncc[nH]1	ZINC000089948773	366976459	/nfs/dbraw/zinc/97/64/59/366976459.db2.gz	PTEMDDUWTYWSGN-CHWSQXEVSA-N	1	0	278.400	1.782	50	0		CDAARO
COc1c2ccccc2oc1C(=O)NCC[NH+](C)C	ZINC000252493617	367641471	/nfs/dbraw/zinc/64/14/71/367641471.db2.gz	NEJAJMIRUYBUSJ-UHFFFAOYSA-N	1	0	262.309	1.733	50	0		CDAARO
Cc1ccc([C@H](C)NC(=O)[C@H]2CSCN2)cc1F	ZINC000094956638	367747379	/nfs/dbraw/zinc/74/73/79/367747379.db2.gz	JNTSLYWHEQXDMN-JOYOIKCWSA-N	1	0	268.357	1.974	50	0		CDAARO
COC(=O)[C@@H]1CC[N@H+](C[C@@H](O)C(F)(F)F)C[C@H]1C	ZINC000249088693	284059173	/nfs/dbraw/zinc/05/91/73/284059173.db2.gz	NOFMBKAGFXNTPR-IWSPIJDZSA-N	1	0	269.263	1.041	50	0		CDAARO
C[NH+]1CCC(OCCCNC(=O)Cn2cccc2)CC1	ZINC000299762541	372749187	/nfs/dbraw/zinc/74/91/87/372749187.db2.gz	XBDBMBYTRMWLPD-UHFFFAOYSA-N	1	0	279.384	1.105	50	0		CDAARO
CC(C)[C@H]([NH2+]CC(=O)NC1CCCC1)C(C)(C)O	ZINC000241707043	189904687	/nfs/dbraw/zinc/90/46/87/189904687.db2.gz	QMDUUZHLLHJJKQ-ZDUSSCGKSA-N	1	0	256.390	1.430	50	0		CDAARO
CCN(CC)c1ccc2cc(C(N)=O)c(=[NH2+])oc2c1	ZINC000004058740	372987502	/nfs/dbraw/zinc/98/75/02/372987502.db2.gz	MOIMPUQANPQHJY-UHFFFAOYSA-N	1	0	259.309	1.857	50	0		CDAARO
Cc1c[nH+]ccc1NCCNc1cc([C@H]2C[C@@H](O)C2)ncn1	ZINC000244874736	189914027	/nfs/dbraw/zinc/91/40/27/189914027.db2.gz	XGIKTKXRZMZJPY-BETUJISGSA-N	1	0	299.378	1.942	50	0		CDAARO
Nc1nc(N2CCCCC2)nc(N2CCCCC2)[nH+]1	ZINC000000270569	373637845	/nfs/dbraw/zinc/63/78/45/373637845.db2.gz	ASSKKCTXCCCXLQ-UHFFFAOYSA-N	1	0	262.361	1.434	50	0		CDAARO
Cc1noc([C@@H]2C[N@H+](Cc3ccc(C)cc3)C[C@H]2CO)n1	ZINC000253415117	373724286	/nfs/dbraw/zinc/72/42/86/373724286.db2.gz	ZROUDHMNESHCBD-LSDHHAIUSA-N	1	0	287.363	1.894	50	0		CDAARO
Cc1cnn(C[C@@H]2CCCN2[C@H]2C[C@@H](C)OC2=O)c1	ZINC000253603482	373937941	/nfs/dbraw/zinc/93/79/41/373937941.db2.gz	GFCRDEIAHUNAFV-AGIUHOORSA-N	1	0	263.341	1.360	50	0		CDAARO
CCOC(=O)CSc1nnc(CCCCC[NH3+])o1	ZINC000002354562	374073366	/nfs/dbraw/zinc/07/33/66/374073366.db2.gz	WBYOVBJGVZRJSM-UHFFFAOYSA-N	1	0	273.358	1.396	50	0		CDAARO
CCCCN(C(=O)C[NH2+][C@H](C(N)=O)[C@@H](C)CC)[C@H](C)CC	ZINC000095463761	374960069	/nfs/dbraw/zinc/96/00/69/374960069.db2.gz	SLDJXPORQCVWFB-GUTXKFCHSA-N	1	0	299.459	1.903	50	0		CDAARO
COC1(CNC(=O)N[C@@H]2CC[C@@H]([NH+](C)C)C2)CCC1	ZINC000097055297	375142607	/nfs/dbraw/zinc/14/26/07/375142607.db2.gz	HZIBXRDLVHMJDC-VXGBXAGGSA-N	1	0	269.389	1.337	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C[C@@]1(N2CCOCC2)CCSC1	ZINC000097160054	375151414	/nfs/dbraw/zinc/15/14/14/375151414.db2.gz	KJLHOAWXKHROTE-AWEZNQCLSA-N	1	0	296.440	1.016	50	0		CDAARO
CC(C)(CO)[NH2+]C[C@@H](O)Cn1cc(C=O)c2ccccc21	ZINC000002709125	375299653	/nfs/dbraw/zinc/29/96/53/375299653.db2.gz	BFKIQKIMSQSQNH-CYBMUJFWSA-N	1	0	290.363	1.175	50	0		CDAARO
C[C@@H]1CN(C(=O)/C=C\c2ccc3c(c2)CCO3)CC[NH2+]1	ZINC000493243658	375428014	/nfs/dbraw/zinc/42/80/14/375428014.db2.gz	XUXDYUDGHNNSPS-KTLBGCOUSA-N	1	0	272.348	1.455	50	0		CDAARO
C[C@H](O)C[NH2+]CC(=O)Nc1ccc(Cl)cc1F	ZINC000003338912	375653560	/nfs/dbraw/zinc/65/35/60/375653560.db2.gz	LTAKHORQJRDBMC-ZETCQYMHSA-N	1	0	260.696	1.388	50	0		CDAARO
CC[C@@H](CO)[NH2+]CC(=O)Nc1cc(Cl)ccc1C	ZINC000003440315	375697505	/nfs/dbraw/zinc/69/75/05/375697505.db2.gz	MWCMAZFDGMMEGN-NSHDSACASA-N	1	0	270.760	1.947	50	0		CDAARO
COc1cccc(C[NH2+]CC(C)(C)N2CCOCC2)n1	ZINC000189425526	377270498	/nfs/dbraw/zinc/27/04/98/377270498.db2.gz	UTFRYCPRTBUQLV-UHFFFAOYSA-N	1	0	279.384	1.291	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cccc(-c3n[nH]c(C)n3)c2)C1	ZINC000429449366	377795077	/nfs/dbraw/zinc/79/50/77/377795077.db2.gz	RZVPSNGSGDJSSR-LBPRGKRZSA-N	1	0	299.378	1.462	50	0		CDAARO
Cc1ccc(Br)cc1CNC(=O)C[NH+](C)C	ZINC000189811474	378285154	/nfs/dbraw/zinc/28/51/54/378285154.db2.gz	YVYDKVHMQLKBFU-UHFFFAOYSA-N	1	0	285.185	1.935	50	0		CDAARO
COCC[N@@H+]1CC[C@H](OC(C)=O)[C@@H]2CCCC[C@H]21	ZINC000230026007	285060671	/nfs/dbraw/zinc/06/06/71/285060671.db2.gz	COHAZZNQVVNWKS-MCIONIFRSA-N	1	0	255.358	1.829	50	0		CDAARO
O=[n+]1c2cc(F)c(F)cc2n(O)c2c1CCCC2	ZINC000104201147	285191639	/nfs/dbraw/zinc/19/16/39/285191639.db2.gz	FWZILGQFQICAMF-UHFFFAOYSA-N	1	0	253.228	1.950	50	0		CDAARO
COc1ccc(S(=O)(=O)NC2(C[NH3+])CCCC2)c(C)c1	ZINC000095432063	184981467	/nfs/dbraw/zinc/98/14/67/184981467.db2.gz	HUGHKWQELNYMDG-UHFFFAOYSA-N	1	0	298.408	1.553	50	0		CDAARO
CCOCC[NH+]1CCC(C(=O)Nc2ncccn2)CC1	ZINC000096421072	390514080	/nfs/dbraw/zinc/51/40/80/390514080.db2.gz	XHHDPBJQSBSBSK-UHFFFAOYSA-N	1	0	278.356	1.164	50	0		CDAARO
C[C@H]1[NH2+]CCN(Cc2ccc3c(c2)OCCO3)[C@@H]1C	ZINC000097095775	390676635	/nfs/dbraw/zinc/67/66/35/390676635.db2.gz	XTMSOZFCPMPGTE-VXGBXAGGSA-N	1	0	262.353	1.640	50	0		CDAARO
CCOC(=O)CC[N@@H+]1CCC[C@@H]1CC(=O)OCC	ZINC000001722004	391152905	/nfs/dbraw/zinc/15/29/05/391152905.db2.gz	RSMIWMXMSGRQMM-LLVKDONJSA-N	1	0	257.330	1.357	50	0		CDAARO
CC1(C)C[C@@H]([NH2+]Cc2ccc(S(C)(=O)=O)s2)CO1	ZINC000418010394	391288806	/nfs/dbraw/zinc/28/88/06/391288806.db2.gz	JPSUKORVFQYMMX-SECBINFHSA-N	1	0	289.422	1.809	50	0		CDAARO
CCCN1C[C@@H](C[NH2+][C@@H]2CCCSC2)CC1=O	ZINC000421356230	391849724	/nfs/dbraw/zinc/84/97/24/391849724.db2.gz	WQZCLGSWYHXIIP-VXGBXAGGSA-N	1	0	256.415	1.730	50	0		CDAARO
CC1=CCC[C@H](C)[C@H]1C[N@H+](C)C[C@@H](O)CN1CCOCC1	ZINC000249116937	392461384	/nfs/dbraw/zinc/46/13/84/392461384.db2.gz	SLFDQKPTHQTVGG-BBWFWOEESA-N	1	0	296.455	1.604	50	0		CDAARO
CCOC(CN1CC[C@H]2CC[N@H+](C)C[C@H]21)OCC	ZINC000253417100	392718271	/nfs/dbraw/zinc/71/82/71/392718271.db2.gz	QBFKFYOKDYAHRC-CHWSQXEVSA-N	1	0	256.390	1.412	50	0		CDAARO
O=C(C[NH2+]C1CC1)N1CCN(c2ccccc2F)CC1	ZINC000037488056	392873807	/nfs/dbraw/zinc/87/38/07/392873807.db2.gz	BEKDOBCNYOSFLT-UHFFFAOYSA-N	1	0	277.343	1.226	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)c2cncn2-c2ccccc2)C1	ZINC000269103624	132113011	/nfs/dbraw/zinc/11/30/11/132113011.db2.gz	AZCKCDUDHZRIFR-GFCCVEGCSA-N	1	0	270.336	1.436	50	0		CDAARO
C[NH+](C)C[C@H]1CCN(CCn2cc(Cl)cn2)C1	ZINC000459345585	393104533	/nfs/dbraw/zinc/10/45/33/393104533.db2.gz	NUISUICWTBTFBL-LLVKDONJSA-N	1	0	256.781	1.420	50	0		CDAARO
O=C(/C=C\c1c(F)cccc1F)N1CCC[NH2+]CC1	ZINC000493780638	393441605	/nfs/dbraw/zinc/44/16/05/393441605.db2.gz	DMZVKHFEZUPKNQ-WAYWQWQTSA-N	1	0	266.291	1.800	50	0		CDAARO
O=C(NCC[C@H]1CCC[NH2+]C1)c1ccc2nccn2c1	ZINC000179128966	140012882	/nfs/dbraw/zinc/01/28/82/140012882.db2.gz	DDHMREJTWWNMCZ-GFCCVEGCSA-N	1	0	272.352	1.454	50	0		CDAARO
Cc1nc(C)c(CCNC(=O)C2(C[NH3+])CCOCC2)s1	ZINC000262313541	140423814	/nfs/dbraw/zinc/42/38/14/140423814.db2.gz	QRGRRNFWNOGGKB-UHFFFAOYSA-N	1	0	297.424	1.174	50	0		CDAARO
CCN(C)C(=O)CC[N@H+](Cc1cnn(C)c1)C(C)C	ZINC000084760727	483324262	/nfs/dbraw/zinc/32/42/62/483324262.db2.gz	FYKDMAFZBRTULV-UHFFFAOYSA-N	1	0	266.389	1.499	50	0		CDAARO
C[C@@H](Nc1c(=O)c(=O)c1NCC[NH+](C)C)c1ccccc1	ZINC000102942753	397881968	/nfs/dbraw/zinc/88/19/68/397881968.db2.gz	AJAODSKHQVPHMZ-LLVKDONJSA-N	1	0	287.363	1.429	50	0		CDAARO
C[C@H](CC(=O)OC(C)(C)C)[NH2+]Cc1nnc2ccccn21	ZINC000183818765	148317949	/nfs/dbraw/zinc/31/79/49/148317949.db2.gz	LFGPSGZKCKSDKX-LLVKDONJSA-N	1	0	290.367	1.939	50	0		CDAARO
COCCCNC(=O)C1CC[NH+](CC(C)C)CC1	ZINC000002828192	292355845	/nfs/dbraw/zinc/35/58/45/292355845.db2.gz	HYYYDVQHIJCKGE-UHFFFAOYSA-N	1	0	256.390	1.507	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1cc(F)c(F)c(F)c1F	ZINC000003173776	169864449	/nfs/dbraw/zinc/86/44/49/169864449.db2.gz	SVSHPKUIOSRLOM-UHFFFAOYSA-N	1	0	278.249	1.925	50	0		CDAARO
C[C@H]1CCC[N@H+](CC(=O)NC(=O)NCc2ccccc2)C1	ZINC000008490120	170337610	/nfs/dbraw/zinc/33/76/10/170337610.db2.gz	BRIQLCCRNJMDMP-ZDUSSCGKSA-N	1	0	289.379	1.744	50	0		CDAARO
Cc1nnc(NCC2(CN3CC[NH+](C)CC3)CC2)s1	ZINC000534675023	411829548	/nfs/dbraw/zinc/82/95/48/411829548.db2.gz	HOTPKNGUKGTQNT-UHFFFAOYSA-N	1	0	281.429	1.286	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC[C@H]2CCC[NH2+]C2)cc1C	ZINC000020432268	171196741	/nfs/dbraw/zinc/19/67/41/171196741.db2.gz	IQJFYTIYNJMKIP-ZDUSSCGKSA-N	1	0	282.409	1.581	50	0		CDAARO
Cc1noc2ncnc(NCCC[NH+]3CCCC3)c12	ZINC000020575153	171256116	/nfs/dbraw/zinc/25/61/16/171256116.db2.gz	MFAWYXGMMLQQRR-UHFFFAOYSA-N	1	0	261.329	1.824	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)Nc2ccc(F)cc2F)CC1	ZINC000020595162	171263979	/nfs/dbraw/zinc/26/39/79/171263979.db2.gz	OHSXRSNFVWIGEL-UHFFFAOYSA-N	1	0	297.349	1.931	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000020608845	171267426	/nfs/dbraw/zinc/26/74/26/171267426.db2.gz	YHGCFFRKDOFTLV-UHFFFAOYSA-N	1	0	265.332	1.402	50	0		CDAARO
C(Cc1[nH]nc2c1CCCC2)C[N@@H+]1CCCOCC1	ZINC000020868605	171277383	/nfs/dbraw/zinc/27/73/83/171277383.db2.gz	AQACBUZVLBXGPE-UHFFFAOYSA-N	1	0	263.385	1.943	50	0		CDAARO
O=C(C[NH2+]Cc1cc(Br)cs1)NC1CC1	ZINC000035247253	172078080	/nfs/dbraw/zinc/07/80/80/172078080.db2.gz	UMPORODWMKCAPO-UHFFFAOYSA-N	1	0	289.198	1.879	50	0		CDAARO
CC(=O)N1CCC([N@H+](CCO)Cc2ccccc2C)CC1	ZINC000065526124	175747358	/nfs/dbraw/zinc/74/73/58/175747358.db2.gz	HCULHJTYUGMUDX-UHFFFAOYSA-N	1	0	290.407	1.800	50	0		CDAARO
C[NH2+]CC(=O)NCCSc1ccc(Cl)cc1	ZINC000071750852	176260199	/nfs/dbraw/zinc/26/01/99/176260199.db2.gz	MFRQHRFBXZMDIE-UHFFFAOYSA-N	1	0	258.774	1.768	50	0		CDAARO
CN(Cc1cc(-c2ccccc2)n[nH]1)C[C@@]1(O)CC[NH2+]C1	ZINC000077287790	177249038	/nfs/dbraw/zinc/24/90/38/177249038.db2.gz	IRNXIMXMHGBMGD-MRXNPFEDSA-N	1	0	286.379	1.233	50	0		CDAARO
COc1ccc(CNC(=O)[C@@H]2CCCC[N@@H+]2C)cc1F	ZINC000078646005	177365705	/nfs/dbraw/zinc/36/57/05/177365705.db2.gz	SHTACHLHHQUWFS-ZDUSSCGKSA-N	1	0	280.343	1.935	50	0		CDAARO
Ic1ccc(N2CC[NH2+]CC2)cc1	ZINC000002529312	274916297	/nfs/dbraw/zinc/91/62/97/274916297.db2.gz	CFZRRGPCDUOJHX-UHFFFAOYSA-N	1	0	288.132	1.701	50	0		CDAARO
C(CN1CCOC[C@@H]1C1CC1)C[N@@H+]1CCOC[C@H]1C1CC1	ZINC000121562423	275392343	/nfs/dbraw/zinc/39/23/43/275392343.db2.gz	OBQUJAPAAQFGOA-CALCHBBNSA-N	1	0	294.439	1.598	50	0		CDAARO
CN1CCC([N@@H+]2CCC[C@H](C(=O)NC3CC3)C2)CC1	ZINC000012574533	277027235	/nfs/dbraw/zinc/02/72/35/277027235.db2.gz	DYTPRJZEWBJYCO-LBPRGKRZSA-N	1	0	265.401	1.071	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2ccc3nccn3c2)[C@@H]1C[NH3+]	ZINC000179223482	278478010	/nfs/dbraw/zinc/47/80/10/278478010.db2.gz	MXNUFPGUPSUPEG-DGCLKSJQSA-N	1	0	272.352	1.534	50	0		CDAARO
Cc1ccc(OCCC(=O)N(C)[C@H]2CC[NH2+]C2)cc1C	ZINC000179120134	278836645	/nfs/dbraw/zinc/83/66/45/278836645.db2.gz	FXUBFQIRONYXDV-AWEZNQCLSA-N	1	0	276.380	1.893	50	0		CDAARO
C[C@@H]1[C@@H](C)CCCN1C(=O)c1csc(CC[NH3+])n1	ZINC000090953600	279078727	/nfs/dbraw/zinc/07/87/27/279078727.db2.gz	JLHLPFLQXGVFJT-VHSXEESVSA-N	1	0	267.398	1.905	50	0		CDAARO
Cc1nn(C)cc1CN1CC[N@@H+](C)C[C@H]1C(C)C	ZINC000108472692	279212460	/nfs/dbraw/zinc/21/24/60/279212460.db2.gz	FCYYNVAHLGKSPP-AWEZNQCLSA-N	1	0	250.390	1.501	50	0		CDAARO
CC[N@@H+]1CCC[C@]2(CCCN(C(=O)Cn3ccnn3)C2)C1	ZINC000299772060	279336866	/nfs/dbraw/zinc/33/68/66/279336866.db2.gz	XHWASUNCBYGWNH-HNNXBMFYSA-N	1	0	291.399	1.003	50	0		CDAARO
CCS(=O)(=O)N1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1	ZINC000019850706	280015312	/nfs/dbraw/zinc/01/53/12/280015312.db2.gz	DSKJNSAMSJTGHR-CHWSQXEVSA-N	1	0	274.430	1.532	50	0		CDAARO
Cc1ccc(C)c([C@H]2CN(C(=O)CC[NH3+])[C@H](C)CO2)c1	ZINC000119066057	280799668	/nfs/dbraw/zinc/79/96/68/280799668.db2.gz	LKEVFEUBNCOJDV-UKRRQHHQSA-N	1	0	276.380	1.941	50	0		CDAARO
CN(C)CC[NH2+]C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000022798633	289165240	/nfs/dbraw/zinc/16/52/40/289165240.db2.gz	UGCKCQWVNFAHKT-UHFFFAOYSA-N	1	0	271.405	1.537	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)/C=C\c2cccc(F)c2)C1	ZINC000255105245	289356310	/nfs/dbraw/zinc/35/63/10/289356310.db2.gz	TVRAPDFLXCCHHK-SZZPACECSA-N	1	0	262.328	1.907	50	0		CDAARO
C[C@H]1CN(CC[N@@H+]2CCCC[C@@H]2c2ccnn2C)CCO1	ZINC000253398428	300258110	/nfs/dbraw/zinc/25/81/10/300258110.db2.gz	POSADKDFIMECRH-GOEBONIOSA-N	1	0	292.427	1.668	50	0		CDAARO
C[C@H]1COCC[C@H]1[NH2+]Cc1ccc(S(C)(=O)=O)cc1	ZINC000191752827	300357270	/nfs/dbraw/zinc/35/72/70/300357270.db2.gz	MDAWBTPEJDIOLW-SMDDNHRTSA-N	1	0	283.393	1.605	50	0		CDAARO
CN(C)c1cncc(NCCCOC2CC[NH+](C)CC2)n1	ZINC000534576750	328310169	/nfs/dbraw/zinc/31/01/69/328310169.db2.gz	OJKGHLAMECPDTD-UHFFFAOYSA-N	1	0	293.415	1.455	50	0		CDAARO
CCC[C@@H](CNC(=O)c1ccc(F)c(O)c1)[NH+](C)C	ZINC000534577660	328310512	/nfs/dbraw/zinc/31/05/12/328310512.db2.gz	XFNMJIXETLUVFE-NSHDSACASA-N	1	0	268.332	1.991	50	0		CDAARO
O=C(CCC[NH+]1Cc2ccccc2C1)NCC1(CO)CC1	ZINC000534591443	328318392	/nfs/dbraw/zinc/31/83/92/328318392.db2.gz	AEJUYMHMJKPWDQ-UHFFFAOYSA-N	1	0	288.391	1.671	50	0		CDAARO
C[NH+](C)[C@@H](Cc1ccccc1)C(=O)NCc1cc[nH]n1	ZINC000534630518	328331153	/nfs/dbraw/zinc/33/11/53/328331153.db2.gz	DYGMOZXYRYQOQR-AWEZNQCLSA-N	1	0	272.352	1.199	50	0		CDAARO
CCOCCC(=O)NC[C@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534632921	328332089	/nfs/dbraw/zinc/33/20/89/328332089.db2.gz	KDAKHUCZTYMVNX-CYBMUJFWSA-N	1	0	268.401	1.794	50	0		CDAARO
Cc1cccc([C@H](CNC(=O)c2cncnc2)[NH+](C)C)c1	ZINC000534637756	328334676	/nfs/dbraw/zinc/33/46/76/328334676.db2.gz	AIKWFYVHQFXSFY-HNNXBMFYSA-N	1	0	284.363	1.818	50	0		CDAARO
O=C(COCc1ccccc1)N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000534653041	328338166	/nfs/dbraw/zinc/33/81/66/328338166.db2.gz	POAOGKFIYYSDSA-GEEKYZPCSA-N	1	0	286.375	1.412	50	0		CDAARO
COC(C)(C)C(=O)NC[C@@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534660556	328339538	/nfs/dbraw/zinc/33/95/38/328339538.db2.gz	SEUVSOTYNXGFEG-LBPRGKRZSA-N	1	0	268.401	1.792	50	0		CDAARO
Cc1nc([C@H]2CCC[N@H+](CCO)C2)cc(N2CCCC2)n1	ZINC000072438460	327110530	/nfs/dbraw/zinc/11/05/30/327110530.db2.gz	ZVEIPVONXBJCDA-AWEZNQCLSA-N	1	0	290.411	1.557	50	0		CDAARO
Cc1nn(C)c2nc(C)nc(N(C)C[C@@H]3CCC[N@@H+]3C)c12	ZINC000072438066	327110575	/nfs/dbraw/zinc/11/05/75/327110575.db2.gz	AFXHVTLNYFGBEC-LBPRGKRZSA-N	1	0	288.399	1.511	50	0		CDAARO
CSC[C@@H]1CCCN(c2cc(C)[nH+]c(N)n2)C1	ZINC000091412025	482448606	/nfs/dbraw/zinc/44/86/06/482448606.db2.gz	JGMKDTWPPRZYGG-SNVBAGLBSA-N	1	0	252.387	1.947	50	0		CDAARO
O=C1C[C@@H](C[N@H+]2CCC[C@H](CC(F)(F)F)C2)CN1	ZINC000585094494	482829941	/nfs/dbraw/zinc/82/99/41/482829941.db2.gz	RNWVYRUULWSLRB-NXEZZACHSA-N	1	0	264.291	1.787	50	0		CDAARO
C[C@H](C[NH+]1CCN(C)CC1)N1CC(Oc2ccccc2)C1	ZINC000670448376	483003536	/nfs/dbraw/zinc/00/35/36/483003536.db2.gz	RAPFKKYXEZUKLD-OAHLLOKOSA-N	1	0	289.423	1.386	50	0		CDAARO
CCC[C@@H](CNC(=O)Cc1ccc(CO)cc1)[NH+](C)C	ZINC000670448643	483004504	/nfs/dbraw/zinc/00/45/04/483004504.db2.gz	AISXDYBFZWYDBC-HNNXBMFYSA-N	1	0	278.396	1.568	50	0		CDAARO
Cc1n[nH]cc1CN(C)C(=O)C[C@H]1C[N@H+](C(C)C)CCO1	ZINC000670449769	483010001	/nfs/dbraw/zinc/01/00/01/483010001.db2.gz	FBEBINDOQAZLSY-AWEZNQCLSA-N	1	0	294.399	1.176	50	0		CDAARO
O=C(NC[C@@H]1CCC[NH2+]1)c1cccnc1N1CCCCC1	ZINC000178755005	483158509	/nfs/dbraw/zinc/15/85/09/483158509.db2.gz	VIDRTAKECKVIFO-ZDUSSCGKSA-N	1	0	288.395	1.554	50	0		CDAARO
C[C@@H](CN1CCOC1=O)[NH2+]Cc1cccc2c[nH]nc21	ZINC000084051437	483235953	/nfs/dbraw/zinc/23/59/53/483235953.db2.gz	UUMCHIFRYAWMNP-JTQLQIEISA-N	1	0	274.324	1.493	50	0		CDAARO
Cn1cc([C@@H]2OCC[C@@H]2C[NH2+]Cc2cscn2)cn1	ZINC000084317616	483272109	/nfs/dbraw/zinc/27/21/09/483272109.db2.gz	GCCSGSNBCQKYOG-ZWNOBZJWSA-N	1	0	278.381	1.744	50	0		CDAARO
CCC(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1CCn1cccn1	ZINC000084718647	483317652	/nfs/dbraw/zinc/31/76/52/483317652.db2.gz	UIGPWOPFHNWAJL-HUUCEWRRSA-N	1	0	290.411	1.749	50	0		CDAARO
C[C@@H]1CN(C(=O)c2cc(-c3ccncc3)on2)CC[NH2+]1	ZINC000188456157	524851619	/nfs/dbraw/zinc/85/16/19/524851619.db2.gz	UBDPUHDERHBBOD-SNVBAGLBSA-N	1	0	272.308	1.171	50	0		CDAARO
CCC[N@@H+]1CCC[C@H]1C(=O)NC[C@](C)(O)c1cccs1	ZINC000096450328	528230079	/nfs/dbraw/zinc/23/00/79/528230079.db2.gz	JGBWQIIYDUQEED-WFASDCNBSA-N	1	0	296.436	1.946	50	0		CDAARO
CCOCC[N@@H+]1CCN([C@H](C)c2nc(C)no2)C[C@@H]1CC	ZINC000106777338	528756681	/nfs/dbraw/zinc/75/66/81/528756681.db2.gz	VGHPIHGAJPZZMI-OCCSQVGLSA-N	1	0	296.415	1.872	50	0		CDAARO
COc1ccccc1N1CCN([C@H]2CCC[NH2+]C2)CC1	ZINC000037246745	537071263	/nfs/dbraw/zinc/07/12/63/537071263.db2.gz	BXHPSALNYNHLJP-AWEZNQCLSA-N	1	0	275.396	1.569	50	0		CDAARO
COc1cc(C(=O)NC[C@H]2CC[N@H+](C)C2)c2ccccc2n1	ZINC000067723725	538301456	/nfs/dbraw/zinc/30/14/56/538301456.db2.gz	LAPNYWFIDLSUFR-GFCCVEGCSA-N	1	0	299.374	1.925	50	0		CDAARO
c1ncn2c1C[N@@H+](C1CSCCSC1)CCC2	ZINC000072165578	567902689	/nfs/dbraw/zinc/90/26/89/567902689.db2.gz	KISNPZFBXQYVFM-UHFFFAOYSA-N	1	0	269.439	1.937	50	0		CDAARO
CCCCc1ncc(C[N@H+](C)[C@@H](C)CC(N)=O)[nH]1	ZINC000952990118	614491126	/nfs/dbraw/zinc/49/11/26/614491126.db2.gz	KLOHTGMGIGDDJG-JTQLQIEISA-N	1	0	252.362	1.448	50	0		CDAARO
CC[C@H](C(=O)NC1(CO)CCCCC1)[N@H+](C)CC	ZINC000952974596	615605708	/nfs/dbraw/zinc/60/57/08/615605708.db2.gz	OJGPJRVIIQOUIY-GFCCVEGCSA-N	1	0	256.390	1.528	50	0		CDAARO
C[C@]1([NH3+])CCCC[C@H]1C(=O)NCCCc1cc(=O)[nH][nH]1	ZINC000888096793	617759611	/nfs/dbraw/zinc/75/96/11/617759611.db2.gz	QWIRLWFPQLTZKE-FZMZJTMJSA-N	1	0	280.372	1.072	50	0		CDAARO
CC(C)[C@H](O)C[N@@H+]1CC[C@@](CO)(c2cccc(F)c2)C1	ZINC000888101428	617766489	/nfs/dbraw/zinc/76/64/89/617766489.db2.gz	VJJSBVPODGPLCP-HZPDHXFCSA-N	1	0	281.371	1.778	50	0		CDAARO
CCCCCOCC(=O)N1C[C@@]2(C)C[NH+](C)C[C@]2(C)C1	ZINC000585128845	1164214987	/nfs/dbraw/zinc/21/49/87/1164214987.db2.gz	PCDJFVFWJZGOFK-HZPDHXFCSA-N	1	0	282.428	1.993	50	0		CDAARO
Cc1c[nH+]ccc1N1CCCN(c2cnccn2)CC1	ZINC001704309199	1177682463	/nfs/dbraw/zinc/68/24/63/1177682463.db2.gz	OALXEOREHONIBU-UHFFFAOYSA-N	1	0	269.352	1.897	50	0		CDAARO
COc1ccc(C(=O)NCCNc2cc[nH+]cc2C)cn1	ZINC001704354119	1177698480	/nfs/dbraw/zinc/69/84/80/1177698480.db2.gz	SNTRYHJBLJWJAY-UHFFFAOYSA-N	1	0	286.335	1.057	50	0		CDAARO
CC1(C)[NH2+]CC[C@H]1NC(=O)N1CCc2ccccc21	ZINC000864094056	774700291	/nfs/dbraw/zinc/70/02/91/774700291.db2.gz	BVVYCIBBKLXOIA-CYBMUJFWSA-N	1	0	259.353	1.899	50	0		CDAARO
Cc1cc(C)n(CCN(C)c2cc(C)[nH+]c(N)n2)n1	ZINC000032580859	774866487	/nfs/dbraw/zinc/86/64/87/774866487.db2.gz	IHSHJBVNMSBCCZ-UHFFFAOYSA-N	1	0	260.345	1.317	50	0		CDAARO
[NH3+]CC[C@H]1CN(c2cnc3ccc(Cl)cc3n2)CCO1	ZINC000032598415	775536238	/nfs/dbraw/zinc/53/62/38/775536238.db2.gz	KQCMMPFSAVPKOM-NSHDSACASA-N	1	0	292.770	1.837	50	0		CDAARO
C[N@H+](CCn1ccnc1)Cc1ccccc1OCCO	ZINC000215770699	775622990	/nfs/dbraw/zinc/62/29/90/775622990.db2.gz	BLQIMQMTSPISJQ-UHFFFAOYSA-N	1	0	275.352	1.386	50	0		CDAARO
CC(C)[N@@H+]1CCN(Cc2nccs2)C[C@@H]1CCO	ZINC000022913707	775787818	/nfs/dbraw/zinc/78/78/18/775787818.db2.gz	HOYUMKJDCMMFBZ-LBPRGKRZSA-N	1	0	269.414	1.420	50	0		CDAARO
COC(=O)C[N@H+](C)[C@H]1CCC(=O)N(CCCC(C)C)CC1	ZINC000019770338	776174584	/nfs/dbraw/zinc/17/45/84/776174584.db2.gz	BMKIJRQYFFEQMZ-AWEZNQCLSA-N	1	0	298.427	1.909	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2cc(OC)ccn2)n1C	ZINC000426571616	776423841	/nfs/dbraw/zinc/42/38/41/776423841.db2.gz	OMNHFPGSAITEJA-UHFFFAOYSA-N	1	0	279.369	1.230	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000864097323	777126574	/nfs/dbraw/zinc/12/65/74/777126574.db2.gz	STKOQDUZSWJHSA-KGLIPLIRSA-N	1	0	264.369	1.110	50	0		CDAARO
CC(C)CN1CC[N@H+](C2CCCC2)[C@@H](CCO)C1	ZINC000019771239	779346564	/nfs/dbraw/zinc/34/65/64/779346564.db2.gz	RGSCLQYAIVYKSQ-HNNXBMFYSA-N	1	0	254.418	1.954	50	0		CDAARO
Cc1nc(CO[C@@H]2CCC[N@H+](Cc3ccccn3)C2)no1	ZINC000675018322	899870555	/nfs/dbraw/zinc/87/05/55/899870555.db2.gz	PPOFGWXAOHKCNU-CQSZACIVSA-N	1	0	288.351	1.954	50	0		CDAARO
CCCN(CCC)C(=O)CN1C=NC2=[NH+][C@@H](C)CCN21	ZINC000952882740	910452230	/nfs/dbraw/zinc/45/22/30/910452230.db2.gz	JAWJUGMHJXVKSA-LBPRGKRZSA-N	1	0	279.388	1.344	50	0		CDAARO
CC(=O)N1CCC[NH2+]CCNC(=O)C[C@H]1c1ccccc1	ZINC000952865454	910461047	/nfs/dbraw/zinc/46/10/47/910461047.db2.gz	YHERYRYPXDKXBV-HNNXBMFYSA-N	1	0	289.379	1.076	50	0		CDAARO
CN(Cc1cc(C(C)(C)C)n[nH]1)[C@@H]1CCC[NH2+]C1	ZINC000067649928	936618915	/nfs/dbraw/zinc/61/89/15/936618915.db2.gz	OVBZOABYDHQFIS-GFCCVEGCSA-N	1	0	250.390	1.891	50	0		CDAARO
CC[NH+](CC)[C@H]1CCOC2(CCN(C(=O)COC)CC2)C1	ZINC000581784441	927197673	/nfs/dbraw/zinc/19/76/73/927197673.db2.gz	ZJLVSQOUWWHGTC-AWEZNQCLSA-N	1	0	298.427	1.515	50	0		CDAARO
O=C(NC1(CO)CCSCC1)[C@@H]1CC[C@@H]2CCCC[N@@H+]21	ZINC000585122214	930988831	/nfs/dbraw/zinc/98/88/31/930988831.db2.gz	QWNZUBFGTWXJAR-STQMWFEESA-N	1	0	298.452	1.378	50	0		CDAARO
CCCCCOCC(=O)N1CC[C@H]([NH+]2CCC2)C1	ZINC000585127928	931010770	/nfs/dbraw/zinc/01/07/70/931010770.db2.gz	MXPCXUXXMSHFGZ-ZDUSSCGKSA-N	1	0	254.374	1.500	50	0		CDAARO
Cc1cc(C(=O)N2CCN(C3CC3)C[C@@H]2C)ns1	ZINC000585130650	931020298	/nfs/dbraw/zinc/02/02/98/931020298.db2.gz	XNZWBJBHLOBKTG-VIFPVBQESA-N	1	0	265.382	1.760	50	0		CDAARO
CC(=O)NC(C)(C)C[C@@H](C)[N@H+](C)Cc1cc[nH]n1	ZINC001506401416	975150238	/nfs/dbraw/zinc/15/02/38/975150238.db2.gz	JEPMJSLGSADKSS-SNVBAGLBSA-N	1	0	252.362	1.535	50	0		CDAARO
CCc1noc(NC(=O)[C@H]2CC[N@H+](CCOC)C2)c1C	ZINC001506406932	975151300	/nfs/dbraw/zinc/15/13/00/975151300.db2.gz	SFTXLMQNNZDLSU-NSHDSACASA-N	1	0	281.356	1.452	50	0		CDAARO
CCn1cc(C(=O)Nc2nnc(CC[NH+](C)C)s2)cn1	ZINC001506408452	975153315	/nfs/dbraw/zinc/15/33/15/975153315.db2.gz	FCMSEXGTTFMHLM-UHFFFAOYSA-N	1	0	294.384	1.111	50	0		CDAARO
CSCCN1CCN(c2ccncc2F)CC1	ZINC001506421024	975158147	/nfs/dbraw/zinc/15/81/47/975158147.db2.gz	MZSBNUCHCVPFPN-UHFFFAOYSA-N	1	0	255.362	1.706	50	0		CDAARO
c1cn(CCC[NH2+][C@H]2CCN(c3ccccc3)C2)nn1	ZINC001506421391	975158506	/nfs/dbraw/zinc/15/85/06/975158506.db2.gz	PEQFMAIGEJFUBY-AWEZNQCLSA-N	1	0	271.368	1.537	50	0		CDAARO
Cc1ccc(C[NH2+][C@H](CO)Cc2ccc(O)cc2)o1	ZINC000190518145	342453509	/nfs/dbraw/zinc/45/35/09/342453509.db2.gz	AFMXOHBTSWZOSH-ZDUSSCGKSA-N	1	0	261.321	1.987	50	0		CDAARO
CN1CCO[C@@H](C[NH2+]Cc2ccc(OCC3CC3)cc2)C1	ZINC000190960384	342456503	/nfs/dbraw/zinc/45/65/03/342456503.db2.gz	XQKJTXKPCVWEHI-KRWDZBQOSA-N	1	0	290.407	1.896	50	0		CDAARO
C[C@H](CCN=c1[nH]ccs1)[NH+]1CCN(C)CC1	ZINC000584902514	341986998	/nfs/dbraw/zinc/98/69/98/341986998.db2.gz	BQYKJDRLFDYXPC-LLVKDONJSA-N	1	0	254.403	1.003	50	0		CDAARO
CC[C@@H](CNc1cc(C)[nH+]c(C)c1)N1CCOCC1	ZINC000584902966	341987071	/nfs/dbraw/zinc/98/70/71/341987071.db2.gz	IUACUWHTPDRWMI-HNNXBMFYSA-N	1	0	263.385	1.643	50	0		CDAARO
O=C(NCC[NH2+]C1CCCCCC1)[C@@H]1CCCOC1	ZINC000122238377	230394286	/nfs/dbraw/zinc/39/42/86/230394286.db2.gz	SZBBZJIKTBYMNI-CYBMUJFWSA-N	1	0	268.401	1.842	50	0		CDAARO
Cc1cc(C)cc(N(C)C(=O)[C@H]([NH3+])CCS(C)(=O)=O)c1	ZINC000095956297	185042806	/nfs/dbraw/zinc/04/28/06/185042806.db2.gz	QMORIXLNJCUIRT-CYBMUJFWSA-N	1	0	298.408	1.028	50	0		CDAARO
Cc1ccnc(N2CC[C@H](OCC[NH+]3CCCCC3)C2)n1	ZINC000095974195	185050207	/nfs/dbraw/zinc/05/02/07/185050207.db2.gz	RJWGNEQKQUYMPT-HNNXBMFYSA-N	1	0	290.411	1.866	50	0		CDAARO
CN(C(=O)c1ccc(-n2cccn2)c(F)c1)[C@@H]1CC[NH2+]C1	ZINC000179103095	398220885	/nfs/dbraw/zinc/22/08/85/398220885.db2.gz	AGTDKHCPGURXAX-GFCCVEGCSA-N	1	0	288.326	1.445	50	0		CDAARO
CS(=O)(=O)NCC[NH2+]C1(c2cccc(Cl)c2)CC1	ZINC000095985309	185054942	/nfs/dbraw/zinc/05/49/42/185054942.db2.gz	SCCJCZAHGQNOQI-UHFFFAOYSA-N	1	0	288.800	1.468	50	0		CDAARO
CC[C@H](O)C[NH+]1CCC(NC(=O)NCC(F)(F)F)CC1	ZINC000095986855	185056332	/nfs/dbraw/zinc/05/63/32/185056332.db2.gz	XTDKFNGEIUVQTE-JTQLQIEISA-N	1	0	297.321	1.083	50	0		CDAARO
COC(=O)c1ccccc1C[N@@H+]1CC[C@H](C)[C@@H](O)C1	ZINC000096009866	185064919	/nfs/dbraw/zinc/06/49/19/185064919.db2.gz	VCBBIMYGAMXTRU-FZMZJTMJSA-N	1	0	263.337	1.676	50	0		CDAARO
Cc1cccc2c1ncnc2N1CCO[C@H]2CC[N@@H+](C)C[C@H]21	ZINC000242263388	361754560	/nfs/dbraw/zinc/75/45/60/361754560.db2.gz	XYPKNWLFYIBACQ-CABCVRRESA-N	1	0	298.390	1.848	50	0		CDAARO
CO[C@@H]1CCN(C(=O)CC[C@@H]2CC[C@@H](C)O2)[C@@H](C[NH3+])C1	ZINC000242292506	361755860	/nfs/dbraw/zinc/75/58/60/361755860.db2.gz	YMWFGDNPQADZJC-YIYPIFLZSA-N	1	0	284.400	1.299	50	0		CDAARO
COCC1(CNC(=O)c2ccc(C[NH3+])cc2)CCC1	ZINC000311836516	342089850	/nfs/dbraw/zinc/08/98/50/342089850.db2.gz	PWJKLQNGIWVOTM-UHFFFAOYSA-N	1	0	262.353	1.692	50	0		CDAARO
CC[NH+]1CCC(c2nc([C@@H]3CCOC3)no2)CC1	ZINC000096133584	185104314	/nfs/dbraw/zinc/10/43/14/185104314.db2.gz	FRMDVGZHLDUPKI-LLVKDONJSA-N	1	0	251.330	1.773	50	0		CDAARO
COCC[NH2+]CC(=O)N1CC[C@@H](C)CC[C@@H]1C(C)C	ZINC000195543551	342626664	/nfs/dbraw/zinc/62/66/64/342626664.db2.gz	YZJAPHCEABGTRI-UONOGXRCSA-N	1	0	270.417	1.896	50	0		CDAARO
CCC(O)(CC)C[N@@H+]1CCCC[C@H](N2CCN(C)CC2)C1	ZINC000195553353	342626836	/nfs/dbraw/zinc/62/68/36/342626836.db2.gz	MXLLXSXRVMEAPU-INIZCTEOSA-N	1	0	297.487	1.639	50	0		CDAARO
O=C(c1cncc(F)c1)N1CC([NH+]2CCCCC2)C1	ZINC000244707912	361858658	/nfs/dbraw/zinc/85/86/58/361858658.db2.gz	KJWPCPCPMJZRKQ-UHFFFAOYSA-N	1	0	263.316	1.531	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1ccc(C(C)=O)cc1	ZINC000097229363	342204796	/nfs/dbraw/zinc/20/47/96/342204796.db2.gz	ULLXXDRBMIGRGQ-GFCCVEGCSA-N	1	0	284.381	1.295	50	0		CDAARO
CCCCC[N@@H+]1CCC[C@@H]1CNC(=O)c1cnn(C)c1	ZINC000585136764	342215985	/nfs/dbraw/zinc/21/59/85/342215985.db2.gz	RMPHMYNQFBVTEV-CQSZACIVSA-N	1	0	278.400	1.805	50	0		CDAARO
COc1ccc(C[NH2+]CCS(=O)(=O)NC(C)C)cc1	ZINC000669369048	539071623	/nfs/dbraw/zinc/07/16/23/539071623.db2.gz	YGMGWXRCDSNBDF-UHFFFAOYSA-N	1	0	286.397	1.113	50	0		CDAARO
Cc1c(C(=O)N2CC[NH2+]C[C@@H]2C)cnn1C(C)(C)C	ZINC000125637206	187193967	/nfs/dbraw/zinc/19/39/67/187193967.db2.gz	UQSGYHGSBDSFIM-JTQLQIEISA-N	1	0	264.373	1.380	50	0		CDAARO
C[C@H]1C[N@H+](C)C[C@H]1NS(=O)(=O)CCC(C)(C)C	ZINC000107142607	349664807	/nfs/dbraw/zinc/66/48/07/349664807.db2.gz	VEDSYNSMJWCTKW-WDEREUQCSA-N	1	0	262.419	1.292	50	0		CDAARO
O=C(N[C@@H]1CC[NH2+]C1)c1csc(-c2ccoc2)n1	ZINC000127904179	342289914	/nfs/dbraw/zinc/28/99/14/342289914.db2.gz	ONLFPPSRXLZEMT-SECBINFHSA-N	1	0	263.322	1.495	50	0		CDAARO
CSC1(C[NH2+]Cc2cnn3c2CCC3)CCOCC1	ZINC000594930654	342974879	/nfs/dbraw/zinc/97/48/79/342974879.db2.gz	YIULRBHHADDRIU-UHFFFAOYSA-N	1	0	281.425	1.831	50	0		CDAARO
CO[C@H](C[NH2+]CCc1ccncc1C)[C@@H]1CCOC1	ZINC000585117412	362046410	/nfs/dbraw/zinc/04/64/10/362046410.db2.gz	BKKSGWQSUHKYSX-HUUCEWRRSA-N	1	0	264.369	1.574	50	0		CDAARO
CC(=O)NCC1CC[NH+](CC2(O)CCCCC2)CC1	ZINC000065511143	342406006	/nfs/dbraw/zinc/40/60/06/342406006.db2.gz	LUPNHKCENSBFFT-UHFFFAOYSA-N	1	0	268.401	1.530	50	0		CDAARO
C(CN1CCOCC1)Sc1nnc(C2CC2)n1C1CC1	ZINC000036612129	362205374	/nfs/dbraw/zinc/20/53/74/362205374.db2.gz	FSNKAPOKLWXYDD-UHFFFAOYSA-N	1	0	294.424	1.915	50	0		CDAARO
COc1cc(C)ccc1OCC(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178567303	362246552	/nfs/dbraw/zinc/24/65/52/362246552.db2.gz	CBQXRSLRVWTHOH-LBPRGKRZSA-N	1	0	278.352	1.190	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNC(=O)c2cc(Cl)c[nH]2)C1	ZINC000068494527	343550595	/nfs/dbraw/zinc/55/05/95/343550595.db2.gz	OBGIWXPSOWXUSV-JTQLQIEISA-N	1	0	285.775	1.366	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)C[C@@H]2OCCc3ccccc32)C1	ZINC000179017723	362251041	/nfs/dbraw/zinc/25/10/41/362251041.db2.gz	QMQSZZOCLQXWSE-CJNGLKHVSA-N	1	0	288.391	1.758	50	0		CDAARO
CCNC(=O)N1CC[C@@H]([NH2+][C@H](C)c2cnn(C(C)C)c2)C1	ZINC000090412327	362331014	/nfs/dbraw/zinc/33/10/14/362331014.db2.gz	WLWKSMUGPVANSM-TZMCWYRMSA-N	1	0	293.415	1.918	50	0		CDAARO
CCNC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2cnn(C(C)C)c2)C1	ZINC000090412324	362331518	/nfs/dbraw/zinc/33/15/18/362331518.db2.gz	WLWKSMUGPVANSM-GXTWGEPZSA-N	1	0	293.415	1.918	50	0		CDAARO
C[NH2+][C@@H](CC(C)C)C(=O)NCc1nc(CSC)no1	ZINC000252499090	362388427	/nfs/dbraw/zinc/38/84/27/362388427.db2.gz	RVIRRVIHLXFJHY-VIFPVBQESA-N	1	0	286.401	1.183	50	0		CDAARO
COC[C@H]1CC[N@H+](CC(=O)NCc2ccccc2C)C1	ZINC000252503901	362390604	/nfs/dbraw/zinc/39/06/04/362390604.db2.gz	VHAUNBPEIBGVRH-AWEZNQCLSA-N	1	0	276.380	1.580	50	0		CDAARO
C[C@@H](CCNC(=O)N[C@@H]1C=C[C@H](CO)C1)[NH+]1CCCCC1	ZINC000097107989	185534403	/nfs/dbraw/zinc/53/44/03/185534403.db2.gz	SUUTUHKJYLNAHN-SOUVJXGZSA-N	1	0	295.427	1.487	50	0		CDAARO
O=C(CCOc1ccccc1)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000127584864	187318456	/nfs/dbraw/zinc/31/84/56/187318456.db2.gz	KGZNZBNKLHVOJT-KGLIPLIRSA-N	1	0	274.364	1.808	50	0		CDAARO
CO[C@H](C)C(=O)NCCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000085455795	179068014	/nfs/dbraw/zinc/06/80/14/179068014.db2.gz	CUBSDDODTHRBQN-FRRDWIJNSA-N	1	0	272.389	1.027	50	0		CDAARO
CC[C@H](NC(=O)N1CC[C@H](C[NH+](C)C)C1)c1noc(C)n1	ZINC000130233577	346647008	/nfs/dbraw/zinc/64/70/08/346647008.db2.gz	FCNQJRMTYWTAEI-NEPJUHHUSA-N	1	0	295.387	1.422	50	0		CDAARO
C[C@]1(O)CC[N@@H+]([C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000089908120	179880712	/nfs/dbraw/zinc/88/07/12/179880712.db2.gz	WADUQEFWEPFWRH-WBVHZDCISA-N	1	0	288.391	1.634	50	0		CDAARO
O=C(N1CCCC1)N1CCC([NH2+][C@@H]2CCSC2)CC1	ZINC000584889167	349348031	/nfs/dbraw/zinc/34/80/31/349348031.db2.gz	CRFLIKGZGBEDPY-CYBMUJFWSA-N	1	0	283.441	1.762	50	0		CDAARO
C[NH2+]CC(=O)N[C@@H]1CCCc2nc(-c3ccccc3)ncc21	ZINC000091304841	180131384	/nfs/dbraw/zinc/13/13/84/180131384.db2.gz	MSNADHPBLZLXTD-CQSZACIVSA-N	1	0	296.374	1.857	50	0		CDAARO
Cc1cnc(N)nc1NCCC[N@H+]1CCC[C@@H](C)C1	ZINC000091616656	180208566	/nfs/dbraw/zinc/20/85/66/180208566.db2.gz	XNIZGCGQTHJELH-LLVKDONJSA-N	1	0	263.389	1.901	50	0		CDAARO
CC[C@]1(CO)CCCN(C(=O)C[NH+]2CCCC2)C1	ZINC000091593972	180201464	/nfs/dbraw/zinc/20/14/64/180201464.db2.gz	UJLTYAHEEFACQO-AWEZNQCLSA-N	1	0	254.374	1.093	50	0		CDAARO
Cc1nnc(SCCNc2cc(C)[nH+]c(N)n2)s1	ZINC000091951357	180291230	/nfs/dbraw/zinc/29/12/30/180291230.db2.gz	CJLBNWNUJOZZDI-UHFFFAOYSA-N	1	0	282.398	1.731	50	0		CDAARO
CCCn1ncc(C(=O)N2CC[NH2+][C@H](C)C2)c1C	ZINC000091915244	180286022	/nfs/dbraw/zinc/28/60/22/180286022.db2.gz	ZEZYWJNKCXAZEZ-SNVBAGLBSA-N	1	0	250.346	1.035	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)c1	ZINC000091986229	180298888	/nfs/dbraw/zinc/29/88/88/180298888.db2.gz	RHBYPXZRTYRRQP-YPMHNXCESA-N	1	0	298.383	1.492	50	0		CDAARO
C[N@H+](C[C@@H](O)c1ccc2c(c1)OCO2)C[C@@H]1CCCO1	ZINC000106108645	186102627	/nfs/dbraw/zinc/10/26/27/186102627.db2.gz	MJHRUNBKNYWDAQ-QWHCGFSZSA-N	1	0	279.336	1.560	50	0		CDAARO
COCC[N@@H+]1CCN(Cc2c(C)noc2C)C[C@@H]1C	ZINC000106776561	186134945	/nfs/dbraw/zinc/13/49/45/186134945.db2.gz	XMRQKLUSTISZCT-NSHDSACASA-N	1	0	267.373	1.444	50	0		CDAARO
COC(=O)c1sccc1NC(=O)NC1CC[NH+](C)CC1	ZINC000013736860	365965989	/nfs/dbraw/zinc/96/59/89/365965989.db2.gz	JMGLITHSSFVQBU-UHFFFAOYSA-N	1	0	297.380	1.750	50	0		CDAARO
Cc1ccc2[nH]c([C@H]3CCC[N@@H+]([C@H]4CCNC4=O)C3)nc2c1	ZINC000108489603	186219975	/nfs/dbraw/zinc/21/99/75/186219975.db2.gz	BGRAIOFQXOHUIS-WFASDCNBSA-N	1	0	298.390	1.939	50	0		CDAARO
Cc1ccc(N2CC[C@@H]([N@@H+]3CC[C@@H](CCO)C3)C2=O)cc1	ZINC000110621278	186306898	/nfs/dbraw/zinc/30/68/98/186306898.db2.gz	HIDISNYLAILDFY-GOEBONIOSA-N	1	0	288.391	1.805	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1ccc2c(c1)C[C@@H](C)O2	ZINC000124919855	351385734	/nfs/dbraw/zinc/38/57/34/351385734.db2.gz	OTGLZHXRWPQFTE-ZYHUDNBSSA-N	1	0	298.408	1.416	50	0		CDAARO
C[C@@H]1C[C@H](CNC(=O)NC[C@@H]2CCCC[N@H+](C)C2)[C@@H](C)O1	ZINC000624207759	351481505	/nfs/dbraw/zinc/48/15/05/351481505.db2.gz	PXGYLTIJZICRKH-APIJFGDWSA-N	1	0	297.443	1.831	50	0		CDAARO
COC(=O)[C@@H]1CCCCC[C@H]1[NH2+]Cc1nnc(C)n1C	ZINC000097099595	351600075	/nfs/dbraw/zinc/60/00/75/351600075.db2.gz	LNZDVKWXQHOOQY-VXGBXAGGSA-N	1	0	280.372	1.335	50	0		CDAARO
C[NH+](C)CCN(Cc1ccccn1)C(=O)[C@@H]1CCCCO1	ZINC000122718401	187047580	/nfs/dbraw/zinc/04/75/80/187047580.db2.gz	NZHDMVKQVNSLKY-HNNXBMFYSA-N	1	0	291.395	1.541	50	0		CDAARO
COC[C@@H]([NH2+][C@@H]1CCN(c2ccccn2)C1)C(C)C	ZINC000090802803	358489563	/nfs/dbraw/zinc/48/95/63/358489563.db2.gz	GSRSYQGRUUSQGE-ZIAGYGMSSA-N	1	0	263.385	1.921	50	0		CDAARO
C[C@H](C(=O)Nc1ccccc1)[N@@H+]1CCC[C@@H](C(N)=O)C1	ZINC000013116948	358491343	/nfs/dbraw/zinc/49/13/43/358491343.db2.gz	ROPNVYRSPYBUGY-VXGBXAGGSA-N	1	0	275.352	1.211	50	0		CDAARO
COc1ccc(C[NH+](C)C)c(OC(=O)N(C)C)c1	ZINC000000316564	355904438	/nfs/dbraw/zinc/90/44/38/355904438.db2.gz	ZORLMZCXPLXRQG-UHFFFAOYSA-N	1	0	252.314	1.817	50	0		CDAARO
COC(=O)CCc1ccc(OC[C@H](O)C[NH2+]C(C)C)cc1	ZINC000000000257	355879726	/nfs/dbraw/zinc/87/97/26/355879726.db2.gz	AQNDDEOPVVGCPG-CQSZACIVSA-N	1	0	295.379	1.530	50	0	fda	CDAARO
CCOc1ccc2[nH]c(=O)c(C[NH2+]CCCO)cc2c1	ZINC000002584229	355977528	/nfs/dbraw/zinc/97/75/28/355977528.db2.gz	GMQKFIXQQXFZFQ-UHFFFAOYSA-N	1	0	276.336	1.399	50	0		CDAARO
Cc1ccc(C[NH+]2CCC(C(=O)N3CCOCC3)CC2)o1	ZINC000004552921	356036149	/nfs/dbraw/zinc/03/61/49/356036149.db2.gz	SGFRBDFPJHKGPF-UHFFFAOYSA-N	1	0	292.379	1.659	50	0		CDAARO
COc1ccc(NC(=O)[C@@H]2CCC[NH2+]2)cc1OC	ZINC000011754449	356279230	/nfs/dbraw/zinc/27/92/30/356279230.db2.gz	XOABJPWPOIDRSO-JTQLQIEISA-N	1	0	250.298	1.394	50	0		CDAARO
O=C(Cc1noc2ccccc21)N1CC[C@H]2C[NH2+]C[C@H]21	ZINC000036236863	356236606	/nfs/dbraw/zinc/23/66/06/356236606.db2.gz	JUODWYKMEPBYTK-GXFFZTMASA-N	1	0	271.320	1.191	50	0		CDAARO
COc1ccccc1O[C@H](C)C(=O)NC1CC[NH+](C)CC1	ZINC000012380628	356296295	/nfs/dbraw/zinc/29/62/95/356296295.db2.gz	NGJKADAQUYRZHE-GFCCVEGCSA-N	1	0	292.379	1.673	50	0		CDAARO
[NH3+]CCCNC(=O)c1cccc(Br)c1	ZINC000019430861	356485610	/nfs/dbraw/zinc/48/56/10/356485610.db2.gz	XLAVKJAJILOEIR-UHFFFAOYSA-N	1	0	257.131	1.528	50	0		CDAARO
CCN1CCC([N@@H+]2CCC[C@@H](C(=O)NC3CC3)C2)CC1	ZINC000019225406	356477803	/nfs/dbraw/zinc/47/78/03/356477803.db2.gz	ZCFWWTKTZWQHDT-CYBMUJFWSA-N	1	0	279.428	1.461	50	0		CDAARO
CC(C)=CCC[C@@H](C)C[NH+]1CCN(CCOCCO)CC1	ZINC000019632853	356494227	/nfs/dbraw/zinc/49/42/27/356494227.db2.gz	YHQTWPCGEFEOQU-QGZVFWFLSA-N	1	0	298.471	1.995	50	0		CDAARO
Cc1cc(C)cc(OCCOCCNCC[NH3+])c1	ZINC000019772434	356501232	/nfs/dbraw/zinc/50/12/32/356501232.db2.gz	UGGKKZVHUKGVAM-UHFFFAOYSA-N	1	0	252.358	1.247	50	0		CDAARO
CCN(CC)CC[NH2+]Cc1ccc2c(c1)n(C)c(=O)n2C	ZINC000020059863	356524178	/nfs/dbraw/zinc/52/41/78/356524178.db2.gz	NXNIOFLDNSEEJQ-UHFFFAOYSA-N	1	0	290.411	1.308	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COc2c(C)cccc2C)CC1	ZINC000019901376	356515141	/nfs/dbraw/zinc/51/51/41/356515141.db2.gz	HOMSNASLMWMFTE-MRXNPFEDSA-N	1	0	292.423	1.681	50	0		CDAARO
COc1ccc(C(=O)NC[C@H]2CC[N@H+](C)C2)c(O)c1	ZINC000037647356	356515949	/nfs/dbraw/zinc/51/59/49/356515949.db2.gz	VXJMSUBDGCDVKF-SNVBAGLBSA-N	1	0	264.325	1.082	50	0		CDAARO
COc1ccc(N2C(=O)C[C@H]([NH2+]C3CC3)C2=O)cc1	ZINC000019929912	356517447	/nfs/dbraw/zinc/51/74/47/356517447.db2.gz	DBEPSKCIPJVWBE-LBPRGKRZSA-N	1	0	260.293	1.079	50	0		CDAARO
CCC[NH+]1CCN(Cc2cn3ccccc3n2)CC1	ZINC000023253441	356637698	/nfs/dbraw/zinc/63/76/98/356637698.db2.gz	IUVVFPHAIZWXRH-UHFFFAOYSA-N	1	0	258.369	1.862	50	0		CDAARO
COc1cc(C[NH+]2CCC(C(N)=O)CC2)cc2c1OCO2	ZINC000023281719	356638625	/nfs/dbraw/zinc/63/86/25/356638625.db2.gz	FDUJJHQQINAAJH-UHFFFAOYSA-N	1	0	292.335	1.121	50	0		CDAARO
C[NH+]1CCN(C(C)(C)CNC(=O)Nc2ccccc2)CC1	ZINC000025511676	356676268	/nfs/dbraw/zinc/67/62/68/356676268.db2.gz	MCDMCQHDEBNXJA-UHFFFAOYSA-N	1	0	290.411	1.834	50	0		CDAARO
c1ccc2c(c1)CC[C@H]([NH2+]CCCN1CCOCC1)C2	ZINC000023283149	356736447	/nfs/dbraw/zinc/73/64/47/356736447.db2.gz	PJSGTWUZEKFVHJ-KRWDZBQOSA-N	1	0	274.408	1.856	50	0		CDAARO
CO[C@H](C[NH2+]C(C)(C)C)c1ccc(O)c(CO)c1	ZINC000034605308	356817582	/nfs/dbraw/zinc/81/75/82/356817582.db2.gz	UMHASVFLCHGDPW-CYBMUJFWSA-N	1	0	253.342	1.960	50	0	in-vitro	CDAARO
C[NH+](C)CCC1CCN(C(=O)C[C@@H]2CCOC2)CC1	ZINC000351974375	356825262	/nfs/dbraw/zinc/82/52/62/356825262.db2.gz	HJEHLTZKUKIIKX-AWEZNQCLSA-N	1	0	268.401	1.603	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCC2([NH3+])CCCCC2)cc1	ZINC000036266737	356868945	/nfs/dbraw/zinc/86/89/45/356868945.db2.gz	XDERYKUCBRNSFK-UHFFFAOYSA-N	1	0	282.409	1.935	50	0		CDAARO
COCCn1cc(C[NH2+]C[C@H]2CCCn3ccnc32)cn1	ZINC000083912252	357110768	/nfs/dbraw/zinc/11/07/68/357110768.db2.gz	AJTZSZKCEUGLNT-CQSZACIVSA-N	1	0	289.383	1.393	50	0		CDAARO
COC(=O)c1ccccc1COC[C@@H]1CCC[NH2+]C1	ZINC000042782945	357080356	/nfs/dbraw/zinc/08/03/56/357080356.db2.gz	OBXYPPBYBUYBRP-GFCCVEGCSA-N	1	0	263.337	1.989	50	0		CDAARO
C[C@@H](CO)N1CC[NH+](CCSc2ccccc2)CC1	ZINC000095407687	357215071	/nfs/dbraw/zinc/21/50/71/357215071.db2.gz	NTRNKHADASFRGZ-AWEZNQCLSA-N	1	0	280.437	1.777	50	0		CDAARO
Cc1ccc(C)c([C@H]2CN(C(=O)[C@H](C)[NH3+])[C@@H](C)CO2)c1	ZINC000119065771	357251830	/nfs/dbraw/zinc/25/18/30/357251830.db2.gz	FUKXZIYTYDHLJE-KCQAQPDRSA-N	1	0	276.380	1.939	50	0		CDAARO
COC(=O)c1cc(N)ccc1N1CC[NH2+]C[C@@H]1C(C)C	ZINC000052507982	357274687	/nfs/dbraw/zinc/27/46/87/357274687.db2.gz	VTZFLRMASHDESD-CQSZACIVSA-N	1	0	277.368	1.490	50	0		CDAARO
CC[C@@H](CO)N(Cc1[nH]cnc1C)Cc1cccnc1	ZINC000055166959	357329535	/nfs/dbraw/zinc/32/95/35/357329535.db2.gz	DZVAEQNXWLMPJV-AWEZNQCLSA-N	1	0	274.368	1.886	50	0		CDAARO
[NH3+]C12C[C@H]3C[C@@H](C1)CC(n1cnc(Cl)n1)(C3)C2	ZINC000066442592	357567472	/nfs/dbraw/zinc/56/74/72/357567472.db2.gz	XNDSAQJNRNFACM-LRSDLPTKSA-N	1	0	252.749	1.938	50	0		CDAARO
COc1ccccc1-n1c(=O)[nH]nc1C1CC[NH+](C)CC1	ZINC000065372942	357533653	/nfs/dbraw/zinc/53/36/53/357533653.db2.gz	OCNHTLQOGFDUKM-UHFFFAOYSA-N	1	0	288.351	1.378	50	0		CDAARO
CN(CCc1cn[nH]c1)C(=O)CC[C@@H]1CCCC[N@@H+]1C	ZINC000065410255	357539298	/nfs/dbraw/zinc/53/92/98/357539298.db2.gz	PHBWJLAXMUGNFB-AWEZNQCLSA-N	1	0	278.400	1.675	50	0		CDAARO
COC[C@H](C)[NH2+]CC1(N2CCOCC2)CCCCC1	ZINC000065431214	357541654	/nfs/dbraw/zinc/54/16/54/357541654.db2.gz	LSUSEXQABXELOZ-AWEZNQCLSA-N	1	0	270.417	1.646	50	0		CDAARO
CC(C)C(=O)N1CCC(C[NH2+][C@@H](C)Cn2cncn2)CC1	ZINC000065530633	357548322	/nfs/dbraw/zinc/54/83/22/357548322.db2.gz	JTSRCTYEBGSSPH-ZDUSSCGKSA-N	1	0	293.415	1.151	50	0		CDAARO
O=C(CNC(=O)c1ccccc1)Nc1cnc2n1CCCC2	ZINC000067821431	357630142	/nfs/dbraw/zinc/63/01/42/357630142.db2.gz	WEGQKCNGEGKEHT-UHFFFAOYSA-N	1	0	298.346	1.588	50	0		CDAARO
CCC1CCC(C(=O)NCC(=O)N2CC[C@@H](C[NH3+])C2)CC1	ZINC000067605293	357614579	/nfs/dbraw/zinc/61/45/79/357614579.db2.gz	PXZDSHQLHXTDCJ-MOKVOYLWSA-N	1	0	295.427	1.126	50	0		CDAARO
Cc1cc(=O)c(C(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)c[nH]1	ZINC000067946494	357638848	/nfs/dbraw/zinc/63/88/48/357638848.db2.gz	OXAOYBMWCRGANB-ZDUSSCGKSA-N	1	0	291.395	1.391	50	0		CDAARO
[NH3+]C[C@@H]1CN(c2cccc(C(F)(F)F)c2)C(=O)O1	ZINC000096949816	357850871	/nfs/dbraw/zinc/85/08/71/357850871.db2.gz	KWWWRVVZSFNUIC-SECBINFHSA-N	1	0	260.215	1.989	50	0		CDAARO
c1cn(C[C@@H]2CCCO2)c(-c2cc3n(n2)CCC[NH2+]C3)n1	ZINC000072423068	357833923	/nfs/dbraw/zinc/83/39/23/357833923.db2.gz	YVKVHCWNAYHFJP-ZDUSSCGKSA-N	1	0	287.367	1.419	50	0		CDAARO
Cc1ccsc1CN1CCC[C@](O)(C[NH+](C)C)C1	ZINC000072421927	357834142	/nfs/dbraw/zinc/83/41/42/357834142.db2.gz	UKHLSCMOJFKVIP-AWEZNQCLSA-N	1	0	268.426	1.945	50	0		CDAARO
c1ccc(CCCCNc2ncnc3c2CC[NH2+]CC3)nc1	ZINC000072474312	357837636	/nfs/dbraw/zinc/83/76/36/357837636.db2.gz	QDGYLZAXOLEKGT-UHFFFAOYSA-N	1	0	297.406	1.995	50	0		CDAARO
COc1cccc2c1OCCCN(C[C@]1(O)CC[NH2+]C1)C2	ZINC000077385452	358017931	/nfs/dbraw/zinc/01/79/31/358017931.db2.gz	VFAZAEVTTKZLSF-INIZCTEOSA-N	1	0	292.379	1.004	50	0		CDAARO
CCc1ccc(C[NH2+]C[C@@H]2COC3(CCOCC3)O2)o1	ZINC000097231492	358049084	/nfs/dbraw/zinc/04/90/84/358049084.db2.gz	FWHUXSPBXDXEEK-CQSZACIVSA-N	1	0	281.352	1.854	50	0		CDAARO
NS(=O)(=O)c1ccc(CC[NH2+]Cc2ccccn2)cc1	ZINC000019872487	358205957	/nfs/dbraw/zinc/20/59/57/358205957.db2.gz	INQKQTFGTLNELI-UHFFFAOYSA-N	1	0	291.376	1.061	50	0		CDAARO
NC(=O)COc1ccc(C[NH2+]Cc2ccc(F)cc2)cc1	ZINC000019943497	358226191	/nfs/dbraw/zinc/22/61/91/358226191.db2.gz	SOYPYHXYORQBEE-UHFFFAOYSA-N	1	0	288.322	1.980	50	0		CDAARO
Cc1nn(C)c(C)c1/C=C\C(=O)N1CC[N@@H+](C)C[C@@H]1C	ZINC000098055879	358344510	/nfs/dbraw/zinc/34/45/10/358344510.db2.gz	OULHUDVALSPHSW-ZADCQDASSA-N	1	0	276.384	1.213	50	0		CDAARO
CC(C)C[NH+](CCNC(=O)CN1CCCC1=O)CC(C)C	ZINC000027734438	358549785	/nfs/dbraw/zinc/54/97/85/358549785.db2.gz	BDXBVRVWHFAHHO-UHFFFAOYSA-N	1	0	297.443	1.339	50	0		CDAARO
[NH3+]CC1CCN(c2cnn(CC3CCC3)c(=O)c2)CC1	ZINC000095376669	358689504	/nfs/dbraw/zinc/68/95/04/358689504.db2.gz	BKSRDFLCKJUJAJ-UHFFFAOYSA-N	1	0	276.384	1.219	50	0		CDAARO
C[N@@H+]1CCC[C@H](Cn2c(=O)cnc3ccccc32)C1	ZINC000095379373	358689802	/nfs/dbraw/zinc/68/98/02/358689802.db2.gz	IQUCAXHUEXKDMS-LBPRGKRZSA-N	1	0	257.337	1.738	50	0		CDAARO
CCc1[nH+]c(N)nc(NCc2cc(OC)ccn2)c1C	ZINC000095384113	358690322	/nfs/dbraw/zinc/69/03/22/358690322.db2.gz	GWAFCPJUQIPBKL-UHFFFAOYSA-N	1	0	273.340	1.945	50	0		CDAARO
O=C(NCC[C@@H]1CCC[NH2+]1)c1ccc(-c2nc[nH]n2)cc1	ZINC000096164133	358711911	/nfs/dbraw/zinc/71/19/11/358711911.db2.gz	KMYOCEGOAXAKCM-ZDUSSCGKSA-N	1	0	285.351	1.344	50	0		CDAARO
Cc1nnc([C@@H]2CCC[N@H+](CCCn3ccnc3C)C2)[nH]1	ZINC000244858595	358725197	/nfs/dbraw/zinc/72/51/97/358725197.db2.gz	VOBSXJJZTPALNA-CQSZACIVSA-N	1	0	288.399	1.888	50	0		CDAARO
Cc1[nH]c(=O)c(C(=O)N2CC[NH2+][C@@H](C)C2)c(C)c1Cl	ZINC000097495466	358780749	/nfs/dbraw/zinc/78/07/49/358780749.db2.gz	RCFYKICJVLDVGD-ZETCQYMHSA-N	1	0	283.759	1.079	50	0		CDAARO
O=C(NCc1ccon1)C1CC[NH+](C2CCOCC2)CC1	ZINC000097602319	358787837	/nfs/dbraw/zinc/78/78/37/358787837.db2.gz	CEAPXDHXDZTBLP-UHFFFAOYSA-N	1	0	293.367	1.182	50	0		CDAARO
O=C(NCCc1c[nH]cn1)c1ccc(C[NH+]2CCCC2)cc1	ZINC000097698830	358793908	/nfs/dbraw/zinc/79/39/08/358793908.db2.gz	CHQMHDAAMAJSAX-UHFFFAOYSA-N	1	0	298.390	1.978	50	0		CDAARO
Cc1ccc(C[N@@H+]2CC[C@@](O)(CO)C2)c2cccnc12	ZINC000214994508	358867849	/nfs/dbraw/zinc/86/78/49/358867849.db2.gz	QOZDFBUXLSCUFK-INIZCTEOSA-N	1	0	272.348	1.472	50	0		CDAARO
NC(=[NH2+])NCCCO[C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000216003673	358915781	/nfs/dbraw/zinc/91/57/81/358915781.db2.gz	OETBCKZVZFNTCU-BDAKNGLRSA-N	1	0	267.295	1.997	50	0		CDAARO
CCNc1ncc(C[N@H+](C)CCc2c(C)n[nH]c2C)cn1	ZINC000215605059	358895260	/nfs/dbraw/zinc/89/52/60/358895260.db2.gz	NFQKUSKUSKGBRU-UHFFFAOYSA-N	1	0	288.399	1.923	50	0		CDAARO
C[C@@H](CNC(=O)c1cnn(C)c1)[NH+]1CCCCCC1	ZINC000032344795	358984397	/nfs/dbraw/zinc/98/43/97/358984397.db2.gz	INIYSBPEEDSAMT-LBPRGKRZSA-N	1	0	264.373	1.414	50	0		CDAARO
O[C@@H](c1cc2n(n1)CCC[N@@H+](C1CCOCC1)C2)C1CC1	ZINC000221428098	359247491	/nfs/dbraw/zinc/24/74/91/359247491.db2.gz	AGWVBALPALAHTR-MRXNPFEDSA-N	1	0	291.395	1.711	50	0		CDAARO
[NH3+]C1CC(c2cc(NCCn3cccn3)nc(C3CC3)n2)C1	ZINC000222348564	359335666	/nfs/dbraw/zinc/33/56/66/359335666.db2.gz	NOYMLNDBZLQETN-UHFFFAOYSA-N	1	0	298.394	1.867	50	0		CDAARO
C[NH+](C)CC(=O)N[C@@H]1CCOC[C@H]1OCc1ccccc1	ZINC000223174258	359404760	/nfs/dbraw/zinc/40/47/60/359404760.db2.gz	POHWOIZIHURGRI-HUUCEWRRSA-N	1	0	292.379	1.039	50	0		CDAARO
COCC1(CNC(=O)C2CC(F)(F)C2)CC[NH2+]CC1	ZINC000262145970	359653479	/nfs/dbraw/zinc/65/34/79/359653479.db2.gz	ZMWLWVVDLYZVLK-UHFFFAOYSA-N	1	0	276.327	1.164	50	0		CDAARO
Cc1ncc(C[n+]2cccc3ccccc32)c(N)n1	ZINC000000381364	359656030	/nfs/dbraw/zinc/65/60/30/359656030.db2.gz	SMLKWYSDCXVDHE-UHFFFAOYSA-N	1	0	251.313	1.856	50	0		CDAARO
COc1ccccc1C[NH2+]C[C@@H]1CCCS1(=O)=O	ZINC000089473748	359928722	/nfs/dbraw/zinc/92/87/22/359928722.db2.gz	MMZUGNXGENTVDC-LBPRGKRZSA-N	1	0	269.366	1.362	50	0		CDAARO
Cc1cccc(C(=O)N2C[C@@H](CO)C3(C2)CC[NH2+]CC3)c1	ZINC000409420843	360224175	/nfs/dbraw/zinc/22/41/75/360224175.db2.gz	OULSRZVNYDRVAF-HNNXBMFYSA-N	1	0	288.391	1.429	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@@H]1CCCN(C(=O)c2ccnn2C)C1	ZINC000409421165	360230521	/nfs/dbraw/zinc/23/05/21/360230521.db2.gz	TYXYGKIEDWHNLB-CYBMUJFWSA-N	1	0	287.367	1.711	50	0		CDAARO
[NH3+]CCCC(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1	ZINC000178085914	189090064	/nfs/dbraw/zinc/09/00/64/189090064.db2.gz	CHKCZTKGIWQVIF-ZFWWWQNUSA-N	1	0	262.353	1.762	50	0		CDAARO
COc1cccc(CNC(=O)N2CC[C@H](C[NH3+])C2)c1	ZINC000426517675	360678596	/nfs/dbraw/zinc/67/85/96/360678596.db2.gz	VBEDWGGJPZKASV-GFCCVEGCSA-N	1	0	263.341	1.185	50	0		CDAARO
CC[N@@H+]1CCC[C@@](C)(C(=O)NCCc2ncc[nH]2)C1	ZINC000426599774	360687703	/nfs/dbraw/zinc/68/77/03/360687703.db2.gz	RJKNWRHSDAEVAP-CQSZACIVSA-N	1	0	264.373	1.190	50	0		CDAARO
CC(C)c1nc(CCN(C)C(=O)[C@H](C)[NH+](C)C)no1	ZINC000426361083	360659765	/nfs/dbraw/zinc/65/97/65/360659765.db2.gz	AKMFVWJQTAAQSP-JTQLQIEISA-N	1	0	268.361	1.144	50	0		CDAARO
Cc1c[nH]c(CNC(=O)[C@@H](C)N2CCCCC2)c(C)c1=O	ZINC000426370891	360659902	/nfs/dbraw/zinc/65/99/02/360659902.db2.gz	AYNKVVXRIFQTDM-CYBMUJFWSA-N	1	0	291.395	1.482	50	0		CDAARO
Cc1ncn(CCNC(=O)[C@@H](C)[NH+]2CCCCC2)c1C	ZINC000426443314	360670967	/nfs/dbraw/zinc/67/09/67/360670967.db2.gz	MXXRDPWYBIDBBA-CQSZACIVSA-N	1	0	278.400	1.491	50	0		CDAARO
Cc1cc(OCC(=O)N2CC[C@H](C[NH3+])C2)ccc1Cl	ZINC000178555918	189126628	/nfs/dbraw/zinc/12/66/28/189126628.db2.gz	VFWPNLSRXKXZEN-LLVKDONJSA-N	1	0	282.771	1.834	50	0		CDAARO
CC(C)Nc1ncccc1C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179062589	189165979	/nfs/dbraw/zinc/16/59/79/189165979.db2.gz	PPABRBQKSRIZPM-NSHDSACASA-N	1	0	262.357	1.336	50	0		CDAARO
C[NH2+]Cc1nnc(SC[C@@H]2CCCOC2)n1C	ZINC000426506566	360934477	/nfs/dbraw/zinc/93/44/77/360934477.db2.gz	GSZUPBXMBICMGN-SECBINFHSA-N	1	0	256.375	1.053	50	0		CDAARO
C[C@H](O)CSc1nnc(C[NH3+])n1Cc1ccccc1	ZINC000426503211	360932323	/nfs/dbraw/zinc/93/23/23/360932323.db2.gz	CNVGSSZSUSOKFY-JTQLQIEISA-N	1	0	278.381	1.258	50	0		CDAARO
COc1ccc(NC(=O)N2CCC[C@H]([NH3+])C2)c(C)c1	ZINC000299802816	200881882	/nfs/dbraw/zinc/88/18/82/200881882.db2.gz	QKEDCCVWDNGXOD-NSHDSACASA-N	1	0	263.341	1.959	50	0		CDAARO
NC(=O)c1cncc(NC2CC[NH+](C3CCCC3)CC2)n1	ZINC000301522879	201046357	/nfs/dbraw/zinc/04/63/57/201046357.db2.gz	DVWRPKKEAYRASK-UHFFFAOYSA-N	1	0	289.383	1.394	50	0		CDAARO
O=S(=O)(NC1CC[NH2+]CC1)c1cccc(Cl)c1F	ZINC000036286245	361425018	/nfs/dbraw/zinc/42/50/18/361425018.db2.gz	ZFRQUEDKUGXUOY-UHFFFAOYSA-N	1	0	292.763	1.509	50	0		CDAARO
Cc1cc(=O)[nH]c([C@H](C)[N@H+](C)CC2CCOCC2)n1	ZINC000192716372	363973131	/nfs/dbraw/zinc/97/31/31/363973131.db2.gz	WMNMKNLCZPSODI-NSHDSACASA-N	1	0	265.357	1.910	50	0		CDAARO
COc1cccc(C[NH2+]C2CCN(C(C)=O)CC2)c1OC	ZINC000017316990	364026702	/nfs/dbraw/zinc/02/67/02/364026702.db2.gz	SWHYDFJIDXSBTL-UHFFFAOYSA-N	1	0	292.379	1.804	50	0		CDAARO
C[C@H](OCc1ccccc1)C(=O)N1CC[C@H]([NH3+])C[C@H]1C	ZINC000404484269	365255273	/nfs/dbraw/zinc/25/52/73/365255273.db2.gz	VMSUJJNGGKWMTC-IPYPFGDCSA-N	1	0	276.380	1.930	50	0		CDAARO
CC[C@](C)([NH2+]CC(=O)N1CCCCCCC1)C(N)=O	ZINC000089941952	366974512	/nfs/dbraw/zinc/97/45/12/366974512.db2.gz	SEYSIEAXLRIQDQ-AWEZNQCLSA-N	1	0	269.389	1.023	50	0		CDAARO
CC[NH+](CC)C[C@H](O)CN1CCC[C@H](c2ccnn2C)C1	ZINC000089967912	366986988	/nfs/dbraw/zinc/98/69/88/366986988.db2.gz	VHTQDULUWSOZAR-GJZGRUSLSA-N	1	0	294.443	1.302	50	0		CDAARO
Cc1cc(C(=O)Nc2ccc3c(c2)C[NH2+]CC3)n(C)n1	ZINC000090121904	367016736	/nfs/dbraw/zinc/01/67/36/367016736.db2.gz	HXGHXZHLXGACQG-UHFFFAOYSA-N	1	0	270.336	1.627	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]C[C@H]1CC(=O)N(C)[C@H]1c1ccccc1	ZINC000252486736	367574376	/nfs/dbraw/zinc/57/43/76/367574376.db2.gz	MPSXSWRTXIHNIJ-GUSZCTEKSA-N	1	0	288.391	1.973	50	0		CDAARO
CCn1ncc(C(=O)NCCn2c(C)c[nH+]c2C)c1C	ZINC000575556264	369133681	/nfs/dbraw/zinc/13/36/81/369133681.db2.gz	WAHNWUHNKJJFLA-UHFFFAOYSA-N	1	0	275.356	1.455	50	0		CDAARO
COc1ccc(CN(C)C(=O)[C@H]2CSCN2)cc1F	ZINC000037758205	370060106	/nfs/dbraw/zinc/06/01/06/370060106.db2.gz	ICIUKKZQGKSPOM-LLVKDONJSA-N	1	0	284.356	1.455	50	0		CDAARO
O=C(NCC1CC[NH+]([C@@H]2CCOC2)CC1)c1ccccc1	ZINC000575606831	370617463	/nfs/dbraw/zinc/61/74/63/370617463.db2.gz	MLKAAJVOYKVBON-MRXNPFEDSA-N	1	0	288.391	1.917	50	0		CDAARO
COC(=O)[C@H]([N@@H+]1CC[C@]2(CCOC2)C1)C1(OC)CCC1	ZINC000253431591	284281212	/nfs/dbraw/zinc/28/12/12/284281212.db2.gz	WKFBEGMBGKWGJN-JSGCOSHPSA-N	1	0	283.368	1.210	50	0		CDAARO
Cc1ccc2ccccc2c1NC(=O)NC[C@@]1(O)CC[NH2+]C1	ZINC000299768922	372750739	/nfs/dbraw/zinc/75/07/39/372750739.db2.gz	ZYPQZJVXFASKNW-QGZVFWFLSA-N	1	0	299.374	1.994	50	0		CDAARO
CCc1nc(C)sc1C(=O)NC[C@H]1COCC[N@H+](C)C1	ZINC000299781523	372757149	/nfs/dbraw/zinc/75/71/49/372757149.db2.gz	DTBFTDFTPFLEIH-LLVKDONJSA-N	1	0	297.424	1.322	50	0		CDAARO
O=C(NCCC[N@H+]1CCC[C@H](O)C1)c1ccc(F)c(O)c1	ZINC000299785182	372759503	/nfs/dbraw/zinc/75/95/03/372759503.db2.gz	KEOFEBXBNFXABP-LBPRGKRZSA-N	1	0	296.342	1.108	50	0		CDAARO
Cc1cc(C)n(CC[N@H+]2CCC[C@H](c3nnc(C)[nH]3)C2)n1	ZINC000299798816	372768447	/nfs/dbraw/zinc/76/84/47/372768447.db2.gz	SNYKUIPPNAVHIJ-AWEZNQCLSA-N	1	0	288.399	1.806	50	0		CDAARO
CCNC(=O)c1cccc(OC)c1OCCC[NH3+]	ZINC000299795680	372769743	/nfs/dbraw/zinc/76/97/43/372769743.db2.gz	LSQQVXMJRLEYAX-UHFFFAOYSA-N	1	0	252.314	1.173	50	0		CDAARO
O=C(NC[C@]1(O)CC[NH2+]C1)Nc1ccccc1Cl	ZINC000299800342	372771434	/nfs/dbraw/zinc/77/14/34/372771434.db2.gz	WYUMPJUHFYVRGK-LBPRGKRZSA-N	1	0	269.732	1.186	50	0		CDAARO
c1ccc2[nH]c(CN3CC[N@@H+]4CCC[C@H]4C3)nc2c1	ZINC000225328311	373040465	/nfs/dbraw/zinc/04/04/65/373040465.db2.gz	UXYBQSIVLQHLRD-LBPRGKRZSA-N	1	0	256.353	1.843	50	0		CDAARO
CC(C)OC[C@@H](O)C[NH+]1CCN(c2ccccc2)CC1	ZINC000020000042	373226023	/nfs/dbraw/zinc/22/60/23/373226023.db2.gz	DMKUAYGWDNCIOT-INIZCTEOSA-N	1	0	278.396	1.595	50	0		CDAARO
O=C([C@@H]1CCCC[NH2+]1)N1CCN(Cc2cccs2)CC1	ZINC000037800843	373348766	/nfs/dbraw/zinc/34/87/66/373348766.db2.gz	HPFCFYOJQRIXEP-AWEZNQCLSA-N	1	0	293.436	1.534	50	0		CDAARO
C[C@@H](C(=O)NC(C)(C)C)[N@H+](C)CCO[C@H]1CCCCO1	ZINC000253394378	373683789	/nfs/dbraw/zinc/68/37/89/373683789.db2.gz	GKNREJQFUSJDDI-STQMWFEESA-N	1	0	286.416	1.765	50	0		CDAARO
CC[N@@H+]1CC[C@H]2[C@H](C1)OCCN2C(=O)c1cccnc1	ZINC000253416335	373726178	/nfs/dbraw/zinc/72/61/78/373726178.db2.gz	CZBUNVDHKQZPBT-KBPBESRZSA-N	1	0	275.352	1.017	50	0		CDAARO
CCCC[N@H+](C)C[C@@H](C)NC(=O)COCc1nc(C)no1	ZINC000253418929	373728632	/nfs/dbraw/zinc/72/86/32/373728632.db2.gz	FSYQQDJOJWLSKX-LLVKDONJSA-N	1	0	298.387	1.131	50	0		CDAARO
Cc1nc2c(c(N3CCC([NH2+]CCO)CC3)n1)CCCC2	ZINC000253425716	373732432	/nfs/dbraw/zinc/73/24/32/373732432.db2.gz	CFDOSDODIQTOJP-UHFFFAOYSA-N	1	0	290.411	1.215	50	0		CDAARO
COc1cc(CN2C[C@@H](C)O[C@@]3(CCOC3)C2)ccc1O	ZINC000253426130	373734747	/nfs/dbraw/zinc/73/47/47/373734747.db2.gz	FUIGFZQMSNWVRF-WBMJQRKESA-N	1	0	293.363	1.781	50	0		CDAARO
COC(=O)[C@H]1CCN(Cc2cc(F)ncc2F)C[C@@H]1C	ZINC000253430658	373736268	/nfs/dbraw/zinc/73/62/68/373736268.db2.gz	NDIVOQVCHZJAGM-ONGXEEELSA-N	1	0	284.306	1.991	50	0		CDAARO
CC[NH+](CC)CCNS(=O)(=O)Cc1ccccc1	ZINC000072700460	374064309	/nfs/dbraw/zinc/06/43/09/374064309.db2.gz	LFXYTBUKXGHSPW-UHFFFAOYSA-N	1	0	270.398	1.448	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@]1(C)CC[NH2+]C1	ZINC000111668926	374199685	/nfs/dbraw/zinc/19/96/85/374199685.db2.gz	WDFCNYDTRDRQQC-GFCCVEGCSA-N	1	0	253.371	1.410	50	0		CDAARO
CC(C)[NH2+]C1CCN(c2cc(=O)n3ccccc3n2)CC1	ZINC000113247314	374247883	/nfs/dbraw/zinc/24/78/83/374247883.db2.gz	VBKYHESOMVOQPT-UHFFFAOYSA-N	1	0	286.379	1.661	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+][C@H](C)[C@H]2CN(C)CCO2)C1(C)C	ZINC000108329921	412824187	/nfs/dbraw/zinc/82/41/87/412824187.db2.gz	OMBYQXWKUWRLHY-YIYPIFLZSA-N	1	0	270.417	1.499	50	0		CDAARO
OCC[C@@H]1CN(C2CCC2)CC[N@@H+]1C1CCCC1	ZINC000020321737	374875625	/nfs/dbraw/zinc/87/56/25/374875625.db2.gz	LSSNGKNXBRBBHC-OAHLLOKOSA-N	1	0	252.402	1.850	50	0		CDAARO
[NH3+][C@H](CNC(=O)c1cccc2ncccc21)C1CC1	ZINC000095394021	374900341	/nfs/dbraw/zinc/90/03/41/374900341.db2.gz	CTVMLUOMQVZOLL-CYBMUJFWSA-N	1	0	255.321	1.702	50	0		CDAARO
C([NH2+]C(C1CC1)C1CC1)[C@]1(N2CCOCC2)CCSC1	ZINC000095420881	374923370	/nfs/dbraw/zinc/92/33/70/374923370.db2.gz	GGLBDANBKUSCOZ-MRXNPFEDSA-N	1	0	296.480	1.973	50	0		CDAARO
CCCC[C@H]([NH3+])C(=O)N1CCC(n2cccn2)CC1	ZINC000095432842	374934694	/nfs/dbraw/zinc/93/46/94/374934694.db2.gz	FVBCUCPGIQUAOG-ZDUSSCGKSA-N	1	0	264.373	1.564	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1cnc2ccnn2c1C	ZINC000095478664	374970140	/nfs/dbraw/zinc/97/01/40/374970140.db2.gz	MJAVOZDNDNHPFK-GFCCVEGCSA-N	1	0	287.367	1.252	50	0		CDAARO
CC(C)c1nsc(NCC[NH+]2CCC(CO)CC2)n1	ZINC000095408609	374911108	/nfs/dbraw/zinc/91/11/08/374911108.db2.gz	BNVCUDWTAPIONV-UHFFFAOYSA-N	1	0	284.429	1.778	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCn2c(nnc2-c2ccccc2)C1	ZINC000095971706	375044985	/nfs/dbraw/zinc/04/49/85/375044985.db2.gz	PVHAVVVRADVGJU-LBPRGKRZSA-N	1	0	285.351	1.025	50	0		CDAARO
CC[NH+](CC)[C@@H]1CCN(C(=O)c2ccc(O)cc2O)C1	ZINC000097236761	375156963	/nfs/dbraw/zinc/15/69/63/375156963.db2.gz	XUTPSGOJBOWQIN-LLVKDONJSA-N	1	0	278.352	1.654	50	0		CDAARO
CC[NH+]1CCN(c2ccc3nnc(C(C)C)n3n2)CC1	ZINC000031809718	375834385	/nfs/dbraw/zinc/83/43/85/375834385.db2.gz	PHLYPRQRDOLKIZ-UHFFFAOYSA-N	1	0	274.372	1.390	50	0		CDAARO
C[C@@H](C(=O)NC(=O)NC(C)(C)C)[N@@H+]1CCC[C@@H](C)C1	ZINC000008142761	376351150	/nfs/dbraw/zinc/35/11/50/376351150.db2.gz	SAJPJOGBTXJTKG-MNOVXSKESA-N	1	0	269.389	1.731	50	0		CDAARO
CS[C@@H]1CCC[C@H]1[N@H+](C)CC(=O)NC[C@H]1CCCO1	ZINC000245339450	378072170	/nfs/dbraw/zinc/07/21/70/378072170.db2.gz	SXSUQYSCSBPSDK-JHJVBQTASA-N	1	0	286.441	1.498	50	0		CDAARO
Cc1cc(C(=O)Nc2nc3c(s2)C[NH2+]CC3)no1	ZINC000036233027	291783968	/nfs/dbraw/zinc/78/39/68/291783968.db2.gz	WADDEDCVBQJPJA-UHFFFAOYSA-N	1	0	264.310	1.338	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CCC[C@H]2C[NH3+])cc1OC	ZINC000492998437	253344238	/nfs/dbraw/zinc/34/42/38/253344238.db2.gz	YJWWXMNTYOHCTM-WOLRVDTOSA-N	1	0	290.363	1.667	50	0		CDAARO
CC(C)[N@H+](C)C[C@@]1(O)CCCN(CC(C)(C)C)C1=O	ZINC000011878442	390201661	/nfs/dbraw/zinc/20/16/61/390201661.db2.gz	BVTWXEJOSXLOHX-HNNXBMFYSA-N	1	0	270.417	1.726	50	0		CDAARO
CCNC(=O)N[C@H]1CC[N@H+](CCCOCC)C[C@@H]1C	ZINC000096407028	390508159	/nfs/dbraw/zinc/50/81/59/390508159.db2.gz	MIXBMOITUKGJIA-STQMWFEESA-N	1	0	271.405	1.443	50	0		CDAARO
C[C@@H]1CN(C(=O)/C=C/c2ccc3c(c2)CCO3)CC[NH2+]1	ZINC000188419209	390590451	/nfs/dbraw/zinc/59/04/51/390590451.db2.gz	XUXDYUDGHNNSPS-OGOUPESXSA-N	1	0	272.348	1.455	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)c1ccc2nccn2c1	ZINC000178285888	390863139	/nfs/dbraw/zinc/86/31/39/390863139.db2.gz	NWNVRGRXGASSIN-LBPRGKRZSA-N	1	0	258.325	1.158	50	0		CDAARO
[NH3+]C[C@@H]1CCCCN1C(=O)NCCCc1ccc(O)cc1	ZINC000417739838	391001688	/nfs/dbraw/zinc/00/16/88/391001688.db2.gz	GTEXQTXKBRMDSL-AWEZNQCLSA-N	1	0	291.395	1.848	50	0		CDAARO
C[C@@H]1CN(C(=O)C[NH2+][C@@H]2CCCC2(C)C)C[C@@H](C)O1	ZINC000191291479	391472682	/nfs/dbraw/zinc/47/26/82/391472682.db2.gz	GOZRDELVDNYOGS-JHJVBQTASA-N	1	0	268.401	1.791	50	0		CDAARO
CC(C)NC(=O)C[C@H](C)[NH2+][C@H]1CN(C(C)C)C[C@H]1C	ZINC000088735536	391485036	/nfs/dbraw/zinc/48/50/36/391485036.db2.gz	RVLZQKRZMPYGSR-RDBSUJKOSA-N	1	0	269.433	1.608	50	0		CDAARO
CCC(=O)N1CCC[N@H+](C[C@@H](O)c2ccccc2)CC1	ZINC000095953102	393155653	/nfs/dbraw/zinc/15/56/53/393155653.db2.gz	XVNPEIFQPYANTG-OAHLLOKOSA-N	1	0	276.380	1.664	50	0		CDAARO
CC(C)[N@H+](C)CC(=O)NC[C@@H]1COC2(CCCCCC2)O1	ZINC000095992267	393157341	/nfs/dbraw/zinc/15/73/41/393157341.db2.gz	ZBBYFJRPKCXJDK-CQSZACIVSA-N	1	0	298.427	1.909	50	0		CDAARO
Cc1nc(CC2CCN(c3cc(C)[nH+]c(N)n3)CC2)no1	ZINC000092078330	135075324	/nfs/dbraw/zinc/07/53/24/135075324.db2.gz	FJYKQLCRFUUQHT-UHFFFAOYSA-N	1	0	288.355	1.518	50	0		CDAARO
Cc1ccc(-c2ncnc(N3CC[NH+](C)CC3)c2N)cc1	ZINC000096282107	292032629	/nfs/dbraw/zinc/03/26/29/292032629.db2.gz	WKGCVPHNQJGBES-UHFFFAOYSA-N	1	0	283.379	1.786	50	0		CDAARO
CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1[NH2+]Cc1ccco1	ZINC000084736396	483321279	/nfs/dbraw/zinc/32/12/79/483321279.db2.gz	BDUXNQPJVJORBJ-YPMHNXCESA-N	1	0	286.397	1.429	50	0		CDAARO
COCCOc1ccc(C[NH2+]Cc2c[nH]nc2C)cn1	ZINC000097159423	397979348	/nfs/dbraw/zinc/97/93/48/397979348.db2.gz	CHHJKPFKKZDYKB-UHFFFAOYSA-N	1	0	276.340	1.428	50	0		CDAARO
CC[C@@H](O)C[N@H+](C)C[C@H]1CC(c2ccccc2)=NO1	ZINC000104984630	397983906	/nfs/dbraw/zinc/98/39/06/397983906.db2.gz	PGUBUSZXBGFZBV-ZIAGYGMSSA-N	1	0	262.353	1.882	50	0		CDAARO
CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1[NH3+]	ZINC000072187473	285883166	/nfs/dbraw/zinc/88/31/66/285883166.db2.gz	ORRVKLSXTZZGJV-ZJUUUORDSA-N	1	0	272.345	1.134	50	0		CDAARO
Cc1[nH]ccc1C(=O)N1CCC([NH2+]CC2CC2)CC1	ZINC000262577652	149077940	/nfs/dbraw/zinc/07/79/40/149077940.db2.gz	GPUAZWFGPRKGGT-UHFFFAOYSA-N	1	0	261.369	1.927	50	0		CDAARO
CCO[C@H]1C[C@@H]([NH2+]C[C@H](O)COC)C12CCCCC2	ZINC000087301417	286493911	/nfs/dbraw/zinc/49/39/11/286493911.db2.gz	CMLARJRSBFUGMT-MJBXVCDLSA-N	1	0	271.401	1.711	50	0		CDAARO
CC[C@H](Oc1ccccc1)C(=O)NCC[NH+](C)C	ZINC000004811131	170021257	/nfs/dbraw/zinc/02/12/57/170021257.db2.gz	ZOTYRHYLZMBPCQ-ZDUSSCGKSA-N	1	0	250.342	1.522	50	0		CDAARO
C[NH2+]C1(c2nnnn2-c2ccc(C)cc2)CCCC1	ZINC000005363669	170089561	/nfs/dbraw/zinc/08/95/61/170089561.db2.gz	KMDWKLGRPZQJRE-UHFFFAOYSA-N	1	0	257.341	1.959	50	0		CDAARO
CC(C)CNC(=O)[C@H]([NH3+])Cc1c[nH]c2ccccc12	ZINC000005461577	170101776	/nfs/dbraw/zinc/10/17/76/170101776.db2.gz	CAPBNIFVVGTSCX-CYBMUJFWSA-N	1	0	259.353	1.810	50	0		CDAARO
C[NH+](C)CC[C@@H](O)c1ccc2c(c1)OCCCO2	ZINC000005912625	170154651	/nfs/dbraw/zinc/15/46/51/170154651.db2.gz	LXSZCLMWICQPOO-GFCCVEGCSA-N	1	0	251.326	1.833	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1cc(=O)c2ccccc2[nH]1	ZINC000006265492	170186665	/nfs/dbraw/zinc/18/66/65/170186665.db2.gz	HIFXNBSCRWIDCI-UHFFFAOYSA-N	1	0	287.363	1.600	50	0		CDAARO
COc1ccccc1CC(=O)N1CCC[N@H+](C)CC1	ZINC000006700030	170228622	/nfs/dbraw/zinc/22/86/22/170228622.db2.gz	GAQYNNQVKWMGAU-UHFFFAOYSA-N	1	0	262.353	1.402	50	0		CDAARO
CC[C@@H](CO)[NH2+]Cc1cc(OC)c(OC)cc1OC	ZINC000008326300	170331568	/nfs/dbraw/zinc/33/15/68/170331568.db2.gz	HGCNCRLZWOETBZ-NSHDSACASA-N	1	0	269.341	1.573	50	0		CDAARO
OC[C@@H]1CC[N@@H+](C2CCN(Cc3ccccc3)CC2)C1	ZINC000008729987	170350895	/nfs/dbraw/zinc/35/08/95/170350895.db2.gz	HGUHOOSPLSCJEM-MRXNPFEDSA-N	1	0	274.408	1.965	50	0		CDAARO
Cc1ncc(C(C)C)c(NC[C@]2(O)CCC[NH2+]C2)n1	ZINC000534586723	411828400	/nfs/dbraw/zinc/82/84/00/411828400.db2.gz	AUTVZOVSQBPRRF-AWEZNQCLSA-N	1	0	264.373	1.435	50	0		CDAARO
COC(=O)c1c(C)[n+](C)cc2c1COC(C)(C)OC2	ZINC000020069270	170981943	/nfs/dbraw/zinc/98/19/43/170981943.db2.gz	CUHONNFNBNLTDL-UHFFFAOYSA-N	1	0	266.317	1.389	50	0		CDAARO
CC(=O)NCC[NH2+]Cc1ccc(Br)s1	ZINC000020184906	171047953	/nfs/dbraw/zinc/04/79/53/171047953.db2.gz	LOSTZXUCNODLLQ-UHFFFAOYSA-N	1	0	277.187	1.736	50	0		CDAARO
CC(=O)c1cccc(OCCN2CC[NH+](C)CC2)c1	ZINC000020325813	171151041	/nfs/dbraw/zinc/15/10/41/171151041.db2.gz	HGFDKXOAZMRFDN-UHFFFAOYSA-N	1	0	262.353	1.515	50	0		CDAARO
CCC[NH+]1CCN(C[C@@H]2COc3ccccc3O2)CC1	ZINC000020790516	171272648	/nfs/dbraw/zinc/27/26/48/171272648.db2.gz	CWAUDKLVCUJVTK-CQSZACIVSA-N	1	0	276.380	1.854	50	0		CDAARO
CC[C@@H](C)[NH+]1CCC2(CC1)C(=O)N(C)C(=O)N2CC	ZINC000020868962	171277434	/nfs/dbraw/zinc/27/74/34/171277434.db2.gz	KHMKAFBGBAVBEA-LLVKDONJSA-N	1	0	267.373	1.533	50	0		CDAARO
CC(C)CNS(=O)(=O)Cc1ccc(C[NH3+])cc1	ZINC000021500150	171304939	/nfs/dbraw/zinc/30/49/39/171304939.db2.gz	GFKAQHCPNOGEBV-UHFFFAOYSA-N	1	0	256.371	1.221	50	0		CDAARO
COc1ccc(CN(C)C(=O)[C@@H]2CCC[NH2+]C2)cc1F	ZINC000037758209	173682715	/nfs/dbraw/zinc/68/27/15/173682715.db2.gz	NUQGMLTYMZCRST-GFCCVEGCSA-N	1	0	280.343	1.792	50	0		CDAARO
Fc1ccc([C@H]2C[NH2+]CCN2)cc1Br	ZINC000038541270	174146245	/nfs/dbraw/zinc/14/62/45/174146245.db2.gz	OXNHARNZUDPFPY-SNVBAGLBSA-N	1	0	259.122	1.822	50	0		CDAARO
C[C@@H]1CN(CCCOc2ccc(F)cc2)CC[NH2+]1	ZINC000040456415	174267398	/nfs/dbraw/zinc/26/73/98/174267398.db2.gz	CBMYJVACGVUFIQ-GFCCVEGCSA-N	1	0	252.333	1.888	50	0		CDAARO
COCc1ncc(-c2nccn2CC[NH+](C)C)cn1	ZINC000071721356	176253003	/nfs/dbraw/zinc/25/30/03/176253003.db2.gz	YRRHHUHJCPBULE-UHFFFAOYSA-N	1	0	261.329	1.048	50	0		CDAARO
O=C(CO)N1C[C@@H](c2ccccc2)[C@@H]2[C@H]1C1CC[NH+]2CC1	ZINC000071746089	176257906	/nfs/dbraw/zinc/25/79/06/176257906.db2.gz	UFGSEVABLQPKLN-USXIJHARSA-N	1	0	286.375	1.068	50	0		CDAARO
Cc1ccc(C)c(O[C@@H](C)C(=O)NCC[NH+](C)C)c1	ZINC000072117341	176319106	/nfs/dbraw/zinc/31/91/06/176319106.db2.gz	DFULERRZJVFIBU-ZDUSSCGKSA-N	1	0	264.369	1.749	50	0		CDAARO
O=C(NC1c2ccccc2-c2ccccc21)[C@H]1C[NH2+]CCO1	ZINC000072130692	176321866	/nfs/dbraw/zinc/32/18/66/176321866.db2.gz	GOPXEBOHDNFGPU-MRXNPFEDSA-N	1	0	294.354	1.861	50	0		CDAARO
Cc1ccc(OCC(=O)NC2CC[NH+](C)CC2)cc1	ZINC000072137455	176322833	/nfs/dbraw/zinc/32/28/33/176322833.db2.gz	VOTQXGTUMIPUPQ-UHFFFAOYSA-N	1	0	262.353	1.584	50	0		CDAARO
Cc1cncc(-n2ccnc2-c2cc3n(n2)CCC[NH2+]C3)c1	ZINC000072410005	176398622	/nfs/dbraw/zinc/39/86/22/176398622.db2.gz	BTQILOCIHJINGP-UHFFFAOYSA-N	1	0	294.362	1.933	50	0		CDAARO
Cc1ncc2c(c1CNC(=O)C1CCC1)CC[NH2+]C2	ZINC000072411810	176398797	/nfs/dbraw/zinc/39/87/97/176398797.db2.gz	NSMDIDKREKKABF-UHFFFAOYSA-N	1	0	259.353	1.452	50	0		CDAARO
O=c1ccc(-c2ccccc2)nn1C[C@H]1CCC[NH2+]1	ZINC000077010783	177146310	/nfs/dbraw/zinc/14/63/10/177146310.db2.gz	SMUDEZZTQUUBHL-CYBMUJFWSA-N	1	0	255.321	1.662	50	0		CDAARO
C[C@@H](C1CCN(Cc2ncc[nH]2)CC1)[NH+]1CCN(C)CC1	ZINC000077505086	177275958	/nfs/dbraw/zinc/27/59/58/177275958.db2.gz	YKVXXBRCHRPUHM-AWEZNQCLSA-N	1	0	291.443	1.258	50	0		CDAARO
OCc1ccc(OCCCC[NH+]2CCOCC2)cc1	ZINC000016488703	260099305	/nfs/dbraw/zinc/09/93/05/260099305.db2.gz	QCCUBMDQDAGPGW-UHFFFAOYSA-N	1	0	265.353	1.670	50	0		CDAARO
C[NH+](C)Cc1ccccc1-c1nc2c([nH]1)C(=O)NCCC2	ZINC000095520252	273802741	/nfs/dbraw/zinc/80/27/41/273802741.db2.gz	WLZOBHNQJPYPHV-UHFFFAOYSA-N	1	0	284.363	1.814	50	0		CDAARO
CC(C)n1ccc(C(=O)N2CCCC[C@@H]2CC[NH3+])n1	ZINC000286017622	276084874	/nfs/dbraw/zinc/08/48/74/276084874.db2.gz	JPDXMLSATVCVCZ-GFCCVEGCSA-N	1	0	264.373	1.808	50	0		CDAARO
CC(C)n1cnnc1CN(C)C[C@H]1CCC[N@@H+]1C	ZINC000252502610	276087640	/nfs/dbraw/zinc/08/76/40/276087640.db2.gz	UROYRUUVFRFIIX-GFCCVEGCSA-N	1	0	251.378	1.385	50	0		CDAARO
CCN1c2ccc(F)cc2C(=O)NC12CC[NH2+]CC2	ZINC000067172756	276254390	/nfs/dbraw/zinc/25/43/90/276254390.db2.gz	VZVXVDQMSYBJRV-UHFFFAOYSA-N	1	0	263.316	1.475	50	0		CDAARO
C[NH2+]C1(c2nnnn2-c2ccccc2C)CCCC1	ZINC000005509771	277262875	/nfs/dbraw/zinc/26/28/75/277262875.db2.gz	QMZCUGYWNGLLPX-UHFFFAOYSA-N	1	0	257.341	1.959	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)COc1cccc(F)c1	ZINC000299739932	277276770	/nfs/dbraw/zinc/27/67/70/277276770.db2.gz	TVGKOUKDBKYPDF-LBPRGKRZSA-N	1	0	266.316	1.415	50	0		CDAARO
COC(=O)CCC[N@@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1	ZINC000252692360	277316289	/nfs/dbraw/zinc/31/62/89/277316289.db2.gz	BGELRDJIBNTCEL-ZFWWWQNUSA-N	1	0	280.412	1.888	50	0		CDAARO
C[C@H](CCN1CCOC(C)(C)C1)[N@@H+]1CCOC(C)(C)C1	ZINC000089895462	279263844	/nfs/dbraw/zinc/26/38/44/279263844.db2.gz	GBMDIPQUCZPBDT-CQSZACIVSA-N	1	0	284.444	1.987	50	0		CDAARO
C[C@H](CCN1CCOCC1)[NH2+]Cc1cccc2c[nH]nc21	ZINC000089895466	279263882	/nfs/dbraw/zinc/26/38/82/279263882.db2.gz	CNRKHLHTBBDUPR-CYBMUJFWSA-N	1	0	288.395	1.763	50	0		CDAARO
Cc1ccc2[nH]c([C@@H]([NH2+]C(CO)CO)C(C)C)nc2c1	ZINC000067604480	281162739	/nfs/dbraw/zinc/16/27/39/281162739.db2.gz	ZRPXRRIIHNQBIM-AWEZNQCLSA-N	1	0	277.368	1.511	50	0		CDAARO
C[C@@H]1c2ccccc2O[C@H]1C(=O)N1CC[NH2+]C[C@H]1C	ZINC000124910427	289086390	/nfs/dbraw/zinc/08/63/90/289086390.db2.gz	ICOMDHXXJVIDRB-JTNHKYCSSA-N	1	0	260.337	1.371	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](Nc2ncc(F)c(OC)n2)C1	ZINC000534642921	328329197	/nfs/dbraw/zinc/32/91/97/328329197.db2.gz	XAPIIDXPXKVKHT-SECBINFHSA-N	1	0	254.309	1.521	50	0		CDAARO
C[NH+](C)Cc1ccccc1CNC(=O)NCCF	ZINC000534646680	328330492	/nfs/dbraw/zinc/33/04/92/328330492.db2.gz	XFCXAQABRXSUEN-UHFFFAOYSA-N	1	0	253.321	1.517	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N1C[C@H]2CC[C@@H](C1)[C@H]2[NH3+]	ZINC000534633055	328332296	/nfs/dbraw/zinc/33/22/96/328332296.db2.gz	GEZOWOWBBOFHPQ-YABSGUDNSA-N	1	0	298.383	1.492	50	0		CDAARO
CCOCCC(=O)N1CCCC2(CC[NH2+]CC2)CC1	ZINC000534646057	328332855	/nfs/dbraw/zinc/33/28/55/328332855.db2.gz	YNQWKJWRTNRJPD-UHFFFAOYSA-N	1	0	268.401	1.795	50	0		CDAARO
Cc1ccccc1[C@@H](CNC(=O)N1CCOCC1)[NH+](C)C	ZINC000534639244	328335162	/nfs/dbraw/zinc/33/51/62/328335162.db2.gz	GRRFLNZHWSTIKJ-OAHLLOKOSA-N	1	0	291.395	1.640	50	0		CDAARO
CCc1noc(CN(CC)C(=O)NCC(C)(C)[NH+](C)C)n1	ZINC000534661735	328349562	/nfs/dbraw/zinc/34/95/62/328349562.db2.gz	BUVYAACHDFQUPY-UHFFFAOYSA-N	1	0	297.403	1.504	50	0		CDAARO
Cc1nc(-c2ccccc2)[nH]c1C(=O)N1CC[C@H]2C[NH2+]C[C@H]21	ZINC000077421207	327132149	/nfs/dbraw/zinc/13/21/49/327132149.db2.gz	WEYNGAKRMMYMEN-UONOGXRCSA-N	1	0	296.374	1.819	50	0		CDAARO
CCc1nnsc1C(=O)N1CCCC[C@@H]1[C@H](C)[NH3+]	ZINC000087455704	330373042	/nfs/dbraw/zinc/37/30/42/330373042.db2.gz	TXMLJYFMWXJBQI-WCBMZHEXSA-N	1	0	268.386	1.442	50	0		CDAARO
Cc1ccc(NC(=O)N2C[C@@H]3C[NH2+]C[C@]3(CO)C2)cc1	ZINC001772711033	1159445062	/nfs/dbraw/zinc/44/50/62/1159445062.db2.gz	VVYLQHTXASLBOH-SWLSCSKDSA-N	1	0	275.352	1.041	50	0		CDAARO
Cn1cncc1C[N@H+](CCO)CCc1ccccc1	ZINC000674369637	483021993	/nfs/dbraw/zinc/02/19/93/483021993.db2.gz	CYSRZLFVJOSFOC-UHFFFAOYSA-N	1	0	259.353	1.457	50	0		CDAARO
CCCn1nccc1C(=O)NCCNc1cc[nH+]cc1C	ZINC000670453451	483023803	/nfs/dbraw/zinc/02/38/03/483023803.db2.gz	ZIIKZBAJSTUENS-UHFFFAOYSA-N	1	0	287.367	1.260	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](CN(C)c2ncc(Cl)cn2)C1	ZINC000670458298	483039604	/nfs/dbraw/zinc/03/96/04/483039604.db2.gz	IEJNRIGMVNRGIH-GFCCVEGCSA-N	1	0	298.818	1.925	50	0		CDAARO
CO[C@H]1C[N@H+](CCCCOCc2ccccc2)C[C@@H]1O	ZINC000670462636	483050501	/nfs/dbraw/zinc/05/05/01/483050501.db2.gz	LWOHHVIIVYOUHG-HOTGVXAUSA-N	1	0	279.380	1.675	50	0		CDAARO
CCOC(=O)N1CC[C@H]([NH2+]CCn2nc(C)c(C)c2C)C1	ZINC000670462976	483050904	/nfs/dbraw/zinc/05/09/04/483050904.db2.gz	WMOMOIQFPAOPHR-AWEZNQCLSA-N	1	0	294.399	1.629	50	0		CDAARO
[NH3+]CCNC(=O)NCCSCc1cccc(Cl)c1	ZINC000670462588	483050980	/nfs/dbraw/zinc/05/09/80/483050980.db2.gz	ORBWGJSPFWHKNF-UHFFFAOYSA-N	1	0	287.816	1.831	50	0		CDAARO
Cc1c[nH]c(CN(C)C(=O)[C@@](C)([NH3+])Cc2ccccc2)n1	ZINC000220545810	533981230	/nfs/dbraw/zinc/98/12/30/533981230.db2.gz	MPTMVGUTCSMJIP-INIZCTEOSA-N	1	0	286.379	1.637	50	0		CDAARO
CN(CCCNC(=O)[C@H]1CCC[NH2+]C1)c1ccccc1	ZINC000019408854	522766314	/nfs/dbraw/zinc/76/63/14/522766314.db2.gz	BWSCVYRBWZJHTH-AWEZNQCLSA-N	1	0	275.396	1.629	50	0		CDAARO
Cc1cc(C(=O)N2CCC[N@@H+](CC(C)C)CC2)cc(=O)[nH]1	ZINC000364939253	526245704	/nfs/dbraw/zinc/24/57/04/526245704.db2.gz	UXVZJFSFPBEUSE-UHFFFAOYSA-N	1	0	291.395	1.900	50	0		CDAARO
CC(C)[C@H]([NH3+])C(=O)Nc1c[nH]cc(Br)c1=O	ZINC000423756820	535059697	/nfs/dbraw/zinc/05/96/97/535059697.db2.gz	BTKQJEOAPUXUPZ-QMMMGPOBSA-N	1	0	288.145	1.059	50	0		CDAARO
CS(=O)(=O)Nc1ccc(C[NH+]2CCCC2)cc1	ZINC000070242689	538293889	/nfs/dbraw/zinc/29/38/89/538293889.db2.gz	GIJMNBJMXVRWTL-UHFFFAOYSA-N	1	0	254.355	1.654	50	0		CDAARO
Cc1cc(NC(=O)C[N@H+]2C[C@@H]3CC=CC[C@@H]3C2)on1	ZINC000076040412	538435902	/nfs/dbraw/zinc/43/59/02/538435902.db2.gz	LJSACSNAHDRRCG-TXEJJXNPSA-N	1	0	261.325	1.820	50	0		CDAARO
COc1ncccc1C(=O)N1CCC[C@H](c2ncc[nH]2)C1	ZINC000075552117	567904041	/nfs/dbraw/zinc/90/40/41/567904041.db2.gz	GJMGIDYKBLALIU-NSHDSACASA-N	1	0	286.335	1.833	50	0		CDAARO
CCOc1cc(N2CC[C@H](Oc3ccncc3)C2)ncn1	ZINC000097095460	567904157	/nfs/dbraw/zinc/90/41/57/567904157.db2.gz	YSSNQMUWYXYJBK-ZDUSSCGKSA-N	1	0	286.335	1.928	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]Cc1ccnc(-n2cccn2)c1	ZINC000097159183	567904884	/nfs/dbraw/zinc/90/48/84/567904884.db2.gz	DQNSQYRMMDNJIM-UHFFFAOYSA-N	1	0	268.324	1.589	50	0		CDAARO
Cc1ccc2c(ncn([C@@H]3CCC[NH2+]C3)c2=O)c1C	ZINC000757177935	577033787	/nfs/dbraw/zinc/03/37/87/577033787.db2.gz	OSNNSSSHGHGHHW-GFCCVEGCSA-N	1	0	257.337	1.938	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@@](O)([C@H]([NH3+])C2CCC2)C1	ZINC000958528660	613974910	/nfs/dbraw/zinc/97/49/10/613974910.db2.gz	YMVHQUHSTJPBGY-DOMZBBRYSA-N	1	0	284.400	1.876	50	0		CDAARO
CCCN1C[C@@H]([NH2+]Cc2ccc(N(C)C)nc2)CC1=O	ZINC000952991390	614785655	/nfs/dbraw/zinc/78/56/55/614785655.db2.gz	OSJWNCDQKSPASS-ZDUSSCGKSA-N	1	0	276.384	1.248	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](CNc2ncc(Cl)cn2)C1	ZINC000952963759	616340633	/nfs/dbraw/zinc/34/06/33/616340633.db2.gz	KBFYIQDNVAESIP-NSHDSACASA-N	1	0	284.791	1.900	50	0		CDAARO
COC(=O)[C@H](C[NH2+][C@H](C)CCn1cccn1)CC1CC1	ZINC000952963284	616601140	/nfs/dbraw/zinc/60/11/40/616601140.db2.gz	FPHRKFDHDZBHKI-OCCSQVGLSA-N	1	0	279.384	1.841	50	0		CDAARO
COC(C)(C)CC(=O)Nc1c[nH+]ccc1NC1CC1	ZINC000888095706	617756906	/nfs/dbraw/zinc/75/69/06/617756906.db2.gz	TYCAGHGBRGOQFI-UHFFFAOYSA-N	1	0	263.341	1.831	50	0		CDAARO
O=C(NCC[C@H]1CCCCO1)[C@H]1[NH2+]CC12CCCC2	ZINC000888101494	617765640	/nfs/dbraw/zinc/76/56/40/617765640.db2.gz	CSBCTDAKKGAHOK-CHWSQXEVSA-N	1	0	266.385	1.594	50	0		CDAARO
CC(=O)c1cnc(NC[C@H]2CCCC[N@H+]2C)nc1C	ZINC001704315367	1177685863	/nfs/dbraw/zinc/68/58/63/1177685863.db2.gz	AZNCPPUYTOAMSG-GFCCVEGCSA-N	1	0	262.357	1.884	50	0		CDAARO
CC[C@@]1(O)CCC[C@@H]2CN(c3cc(C)[nH+]c(N)n3)C[C@@H]21	ZINC001704338613	1177695017	/nfs/dbraw/zinc/69/50/17/1177695017.db2.gz	WFLKCVBQUYEITL-TYNCELHUSA-N	1	0	276.384	1.745	50	0		CDAARO
O=C1CN(CC[NH+]2CCCCC2)CCN1c1cccs1	ZINC000186107116	780872014	/nfs/dbraw/zinc/87/20/14/780872014.db2.gz	AIQROYXEGOSLDW-UHFFFAOYSA-N	1	0	293.436	1.883	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCCN(Cc2ccccc2F)C1=O	ZINC000011873109	781594585	/nfs/dbraw/zinc/59/45/85/781594585.db2.gz	UEEMUPUBCKVOJG-HNNXBMFYSA-N	1	0	280.343	1.241	50	0		CDAARO
COc1ccccc1C/C(C)=C/C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178542969	901425092	/nfs/dbraw/zinc/42/50/92/901425092.db2.gz	BRVIVNNVNXMSHI-UELRPHRMSA-N	1	0	288.391	1.991	50	0		CDAARO
[NH3+]C[C@H]1Cc2cccc(-c3n[nH]c(=O)c4ccccc43)c2O1	ZINC000067542297	906682538	/nfs/dbraw/zinc/68/25/38/906682538.db2.gz	JQHFYEDOIHQOCF-LLVKDONJSA-N	1	0	293.326	1.852	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2)[nH]n1	ZINC000011935243	921296261	/nfs/dbraw/zinc/29/62/61/921296261.db2.gz	KTJBXTNMAWXALU-AWEZNQCLSA-N	1	0	299.378	1.508	50	0		CDAARO
Cc1nc(N2CC[N@@H+](C)[C@@H](CCO)C2)ccc1Cl	ZINC001506414091	909049637	/nfs/dbraw/zinc/04/96/37/909049637.db2.gz	NRFQQCUCEGJKMC-NSHDSACASA-N	1	0	269.776	1.546	50	0		CDAARO
Cc1nc(C(=O)N2CC[NH+](C3CCOCC3)CC2)cs1	ZINC000081032289	909781211	/nfs/dbraw/zinc/78/12/11/909781211.db2.gz	BNECUDHMYMFRFA-UHFFFAOYSA-N	1	0	295.408	1.388	50	0		CDAARO
Cc1nonc1CN(C)C[C@H]1CC[N@@H+](C(C)C)C1	ZINC000823719829	925722725	/nfs/dbraw/zinc/72/27/25/925722725.db2.gz	KWSPDGIPKOOORS-GFCCVEGCSA-N	1	0	252.362	1.540	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)[C@H]1CC(C(C)C)=NO1	ZINC000827791998	925966919	/nfs/dbraw/zinc/96/69/19/925966919.db2.gz	SOWCCEXGPXACRD-CQSZACIVSA-N	1	0	290.367	1.141	50	0		CDAARO
Cc1cc(C)c(C[NH+]2C[C@@H](CO)[C@H](CO)C2)c(C)c1CO	ZINC000828784517	926184322	/nfs/dbraw/zinc/18/43/22/926184322.db2.gz	GNHZUXYOHIYRPH-GJZGRUSLSA-N	1	0	293.407	1.137	50	0		CDAARO
COc1ccccc1C[NH2+][C@@H](C)[C@H]1CN(C)CCN1C	ZINC000585117530	930985076	/nfs/dbraw/zinc/98/50/76/930985076.db2.gz	JRCYAESXUDYRND-DZGCQCFKSA-N	1	0	277.412	1.419	50	0		CDAARO
Cn1cccc1C(=O)N[C@H]1C[C@@H]([NH+](C)C)C12CCC2	ZINC000585131560	931023997	/nfs/dbraw/zinc/02/39/97/931023997.db2.gz	ZJAMOXIKXNHAAF-QWHCGFSZSA-N	1	0	261.369	1.628	50	0		CDAARO
c1ccc(CC[NH+]2CCC(NN3CCOCC3)CC2)cc1	ZINC000019169908	935710818	/nfs/dbraw/zinc/71/08/18/935710818.db2.gz	NKYQFQYQEVHEMK-UHFFFAOYSA-N	1	0	289.423	1.530	50	0		CDAARO
Cc1ccc(C[N@@H+]2CCCN(c3ncccn3)CC2)c(=O)[nH]1	ZINC000019145846	935710840	/nfs/dbraw/zinc/71/08/40/935710840.db2.gz	SQKDPSAJFVPOFP-UHFFFAOYSA-N	1	0	299.378	1.186	50	0		CDAARO
Cc1ccc(C)c(C[NH+]2CCN(CCOCCO)CC2)c1	ZINC000019607253	935717082	/nfs/dbraw/zinc/71/70/82/935717082.db2.gz	LBAKKDUNKQIACE-UHFFFAOYSA-N	1	0	292.423	1.430	50	0		CDAARO
CC(C)=CC[N@@H+]1CCCN(C(=O)CCn2cnnc2)CC1	ZINC001529114120	968983203	/nfs/dbraw/zinc/98/32/03/968983203.db2.gz	LLCBYVZRRUJDSL-UHFFFAOYSA-N	1	0	291.399	1.169	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3ccc(C)o3)C[C@@H]2O)on1	ZINC001529161187	968999077	/nfs/dbraw/zinc/99/90/77/968999077.db2.gz	BDDVSGMKRDJCJM-DOMZBBRYSA-N	1	0	276.336	1.920	50	0		CDAARO
CC(C)CC[NH2+]CCS(=O)(=O)N1CCSCC1	ZINC000190747870	342455015	/nfs/dbraw/zinc/45/50/15/342455015.db2.gz	NKHTUWFVJZWULW-UHFFFAOYSA-N	1	0	280.459	1.001	50	0		CDAARO
Cc1ccc(C[C@H]([NH2+]CCS(C)(=O)=O)C2CC2)cc1	ZINC000096476766	230379831	/nfs/dbraw/zinc/37/98/31/230379831.db2.gz	LTCWPLSLHGRFAO-HNNXBMFYSA-N	1	0	281.421	1.950	50	0		CDAARO
C[C@@H]1CCC[NH2+][C@@H]1CNC(=O)CC[C@H]1CCOC1	ZINC000401255959	342484308	/nfs/dbraw/zinc/48/43/08/342484308.db2.gz	AOTSVQLDPUHNQO-FRRDWIJNSA-N	1	0	254.374	1.307	50	0		CDAARO
C[N@@H+]1CC[C@](C)(Cn2cnc3cc(F)ccc3c2=O)C1	ZINC000584901320	341986683	/nfs/dbraw/zinc/98/66/83/341986683.db2.gz	GWHZPWOLFHNLNZ-HNNXBMFYSA-N	1	0	275.327	1.877	50	0		CDAARO
[NH3+]C1CC(c2cc(NCCCNc3cccnc3)ncn2)C1	ZINC000222752893	230398554	/nfs/dbraw/zinc/39/85/54/230398554.db2.gz	OGDXEOYXLJKDAI-UHFFFAOYSA-N	1	0	298.394	1.990	50	0		CDAARO
COc1cc(CCC(=O)N2CC[NH2+]C[C@H]2C)cc(OC)c1	ZINC000124671912	187148284	/nfs/dbraw/zinc/14/82/84/187148284.db2.gz	UXEPACJBQMVZEF-GFCCVEGCSA-N	1	0	292.379	1.457	50	0		CDAARO
OCCOCC[N@@H+]1CCC[C@@H]1CN1CCc2ccccc21	ZINC000095960788	185044031	/nfs/dbraw/zinc/04/40/31/185044031.db2.gz	GEMMUGMNTXQWAZ-MRXNPFEDSA-N	1	0	290.407	1.522	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@@H]([NH2+][C@H]1CCOC1)C1CC1	ZINC000095968384	185046220	/nfs/dbraw/zinc/04/62/20/185046220.db2.gz	OPAANOLSBPJTJP-NWDGAFQWSA-N	1	0	270.373	1.668	50	0		CDAARO
CNS(=O)(=O)[C@H]1CC[N@H+](CC(C)(C)c2ccccc2)C1	ZINC000095986833	185056198	/nfs/dbraw/zinc/05/61/98/185056198.db2.gz	MDLXZQAYDWHKRK-AWEZNQCLSA-N	1	0	296.436	1.588	50	0		CDAARO
COC(=O)N1CCC([NH2+][C@@H](C)[C@H]2CCCOC2)CC1	ZINC000096003153	185061967	/nfs/dbraw/zinc/06/19/67/185061967.db2.gz	PKPBMXWLQXWKAL-RYUDHWBXSA-N	1	0	270.373	1.622	50	0		CDAARO
CCOC(=O)[C@H]1C[N@H+](Cc2ccccc2)CC12COC2	ZINC000238850640	361739948	/nfs/dbraw/zinc/73/99/48/361739948.db2.gz	CGBYSXYQRGWJGI-CQSZACIVSA-N	1	0	275.348	1.698	50	0		CDAARO
CCn1ccc(CN(C)C(=O)NC[C@@H]2CCC[N@H+](C)C2)c1	ZINC000241287496	361751858	/nfs/dbraw/zinc/75/18/58/361751858.db2.gz	LLXMGDIFQPZXKL-AWEZNQCLSA-N	1	0	292.427	1.991	50	0		CDAARO
CC(C)[C@H](C[NH2+]Cc1cncnc1)c1ccnn1C	ZINC000241587959	361753749	/nfs/dbraw/zinc/75/37/49/361753749.db2.gz	OYKCQFWCOGUPGR-ZDUSSCGKSA-N	1	0	259.357	1.740	50	0		CDAARO
OCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H](O)COCc1cccs1	ZINC000252519093	361850066	/nfs/dbraw/zinc/85/00/66/361850066.db2.gz	AXKQRLCTBDAOBJ-GUTXKFCHSA-N	1	0	299.436	1.766	50	0		CDAARO
Cc1c[nH+]cc(Br)c1N1CCC[C@H](C(N)=O)C1	ZINC000585141784	342219150	/nfs/dbraw/zinc/21/91/50/342219150.db2.gz	FRYOWTSMKDYSCA-VIFPVBQESA-N	1	0	298.184	1.854	50	0		CDAARO
Cc1c(CCO)sc[n+]1Cc1ccc(C)nc1N	ZINC000013983227	342250438	/nfs/dbraw/zinc/25/04/38/342250438.db2.gz	GPDGHBFOHMKNMQ-UHFFFAOYSA-N	1	0	264.374	1.213	50	0		CDAARO
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1[NH2+]Cc1nccn1C	ZINC000084736437	342268334	/nfs/dbraw/zinc/26/83/34/342268334.db2.gz	ZMDKRWSUUYPQTA-UONOGXRCSA-N	1	0	292.427	1.793	50	0		CDAARO
[NH3+][C@H](Cc1ccccc1)C(=O)Nc1ccc2n[nH]nc2c1	ZINC000490439953	539119353	/nfs/dbraw/zinc/11/93/53/539119353.db2.gz	CZWXHSXCXOXKJI-GFCCVEGCSA-N	1	0	281.319	1.466	50	0		CDAARO
C[NH+](C)[C@@H]1CCN(C(=O)c2nc3ccc(O)cc3s2)C1	ZINC000585118807	362037408	/nfs/dbraw/zinc/03/74/08/362037408.db2.gz	CMFFVBSMRPDNPI-SECBINFHSA-N	1	0	291.376	1.778	50	0		CDAARO
COc1cc(CCC(=O)NC(C)(C)CCC[NH+](C)C)on1	ZINC000585110583	362032146	/nfs/dbraw/zinc/03/21/46/362032146.db2.gz	VHSXUYVNBPEHEV-UHFFFAOYSA-N	1	0	297.399	1.852	50	0		CDAARO
Cc1c(CNC(=O)C[N@H+](C)CC(C)(C)C)cnn1C	ZINC000585131654	362057104	/nfs/dbraw/zinc/05/71/04/362057104.db2.gz	BZCZFGMWHLIWFC-UHFFFAOYSA-N	1	0	266.389	1.323	50	0		CDAARO
C[C@H](NC(=O)[C@H](C)[N@H+]1[C@H](C)CC[C@@H]1C)[C@H]1CN(C)CCO1	ZINC000252487307	342382120	/nfs/dbraw/zinc/38/21/20/342382120.db2.gz	VIWHFHNPZPIKEC-AIEDFZFUSA-N	1	0	297.443	1.083	50	0		CDAARO
Cc1ccc(O[C@H](C)C(=O)N2CC[C@@H](C[NH3+])C2)cc1	ZINC000178556489	362247012	/nfs/dbraw/zinc/24/70/12/362247012.db2.gz	LPVSALNRXDSZAR-OLZOCXBDSA-N	1	0	262.353	1.570	50	0		CDAARO
O=C(C[NH+]1CCCC1)N[C@@H](c1ccccc1)[C@H]1C[C@@H](O)C1	ZINC000252539658	362391614	/nfs/dbraw/zinc/39/16/14/362391614.db2.gz	OGSIZTUPJDVCSW-UXLLHSPISA-N	1	0	288.391	1.711	50	0		CDAARO
C/C=C/CC(=O)N[C@@H]([C@H]1C[C@H](O)C1)C1CC[NH2+]CC1	ZINC000252538926	362392203	/nfs/dbraw/zinc/39/22/03/362392203.db2.gz	NJJZJBUMDUBCHY-FZZSVPTGSA-N	1	0	266.385	1.208	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1C(=O)NCCc1ccc2c(c1)OCO2	ZINC000097805498	530051829	/nfs/dbraw/zinc/05/18/29/530051829.db2.gz	DLBKZXGMKOOGDR-CYBMUJFWSA-N	1	0	290.363	1.558	50	0		CDAARO
Cc1nsc(N2CCC([NH+]3CCCC3)CC2)n1	ZINC000096453543	282429975	/nfs/dbraw/zinc/42/99/75/282429975.db2.gz	BCDSQFCTAUAYGI-UHFFFAOYSA-N	1	0	252.387	1.911	50	0		CDAARO
COCc1c(C)onc1C(=O)NCc1ccc(C[NH3+])cc1	ZINC000097446876	185607577	/nfs/dbraw/zinc/60/75/77/185607577.db2.gz	LWFXOYWLIGSWEN-UHFFFAOYSA-N	1	0	289.335	1.518	50	0		CDAARO
Cc1ccc(-c2noc(-c3cn([C@@H]4CC[NH2+]C4)nn3)n2)cc1	ZINC000582468959	346223696	/nfs/dbraw/zinc/22/36/96/346223696.db2.gz	JIIVKXICCOVXRJ-GFCCVEGCSA-N	1	0	296.334	1.838	50	0		CDAARO
O=C1C[C@@H]([NH2+]CCCl)C(=O)N1Cc1ccccc1	ZINC000034453809	346272867	/nfs/dbraw/zinc/27/28/67/346272867.db2.gz	ABTPOTUWHMQVEX-LLVKDONJSA-N	1	0	266.728	1.143	50	0		CDAARO
CN(Cc1ccc2c(c1)OCO2)C(=O)[C@H]1CCC[C@@H]1[NH3+]	ZINC000085367102	179036895	/nfs/dbraw/zinc/03/68/95/179036895.db2.gz	PJSQJAKAYULGMC-RYUDHWBXSA-N	1	0	276.336	1.501	50	0		CDAARO
CCn1cc([C@H]2OCC[C@H]2C[NH2+]Cc2ncc[nH]2)cn1	ZINC000089305964	346755729	/nfs/dbraw/zinc/75/57/29/346755729.db2.gz	QOHIVJOZJNBKFQ-FZMZJTMJSA-N	1	0	275.356	1.494	50	0		CDAARO
CC[C@H]1CN(C(=O)c2csc(COC)n2)C[C@H]1[NH+](C)C	ZINC000089948584	347628066	/nfs/dbraw/zinc/62/80/66/347628066.db2.gz	WSNWDXHCKACLLQ-CMPLNLGQSA-N	1	0	297.424	1.702	50	0		CDAARO
COCC[NH2+]CCOCCOc1cccc(OC)c1	ZINC000002385131	362848862	/nfs/dbraw/zinc/84/88/62/362848862.db2.gz	AVEGTLQSRAZJEO-UHFFFAOYSA-N	1	0	269.341	1.327	50	0		CDAARO
C[NH+](C)Cc1cccc(CNC(=O)C[C@@H]2CCOC2)c1	ZINC000352153229	362912234	/nfs/dbraw/zinc/91/22/34/362912234.db2.gz	FIZGXZJNHWMHSC-HNNXBMFYSA-N	1	0	276.380	1.791	50	0		CDAARO
C[NH+](C)Cc1cccc(CNC(=O)C[C@H]2CCOC2)c1	ZINC000352153230	362912511	/nfs/dbraw/zinc/91/25/11/362912511.db2.gz	FIZGXZJNHWMHSC-OAHLLOKOSA-N	1	0	276.380	1.791	50	0		CDAARO
O=C(C[C@@H]1CCOC1)N1CC[NH+](CC2CCC2)CC1	ZINC000584888573	349347354	/nfs/dbraw/zinc/34/73/54/349347354.db2.gz	UFMTVUHIFAXDEW-AWEZNQCLSA-N	1	0	266.385	1.357	50	0		CDAARO
c1ccc(Cc2noc(CC[NH2+][C@H]3CCOC3)n2)cc1	ZINC000584894516	349354059	/nfs/dbraw/zinc/35/40/59/349354059.db2.gz	ZGEBCBIUWSIGGX-ZDUSSCGKSA-N	1	0	273.336	1.581	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)C1CCCCCC1	ZINC000584898344	349359981	/nfs/dbraw/zinc/35/99/81/349359981.db2.gz	GPVIXLTTWXYVQX-KBPBESRZSA-N	1	0	268.401	1.792	50	0		CDAARO
CCNc1ccnc(NCCCOC2CCCCC2)n1	ZINC000584898119	349360064	/nfs/dbraw/zinc/36/00/64/349360064.db2.gz	ATDJIKLQNLINKK-UHFFFAOYSA-N	1	0	278.400	1.904	50	0		CDAARO
C[NH+](C)[C@H]1CN(C(=O)c2ccncc2)C[C@@H]1C1CC1	ZINC000091452043	180158661	/nfs/dbraw/zinc/15/86/61/180158661.db2.gz	LHTNNSFOSKTKBS-KGLIPLIRSA-N	1	0	259.353	1.494	50	0		CDAARO
CCC[N@@H+]1CC[C@H](CNc2nccc(N(C)C)n2)C1	ZINC000091457815	180160739	/nfs/dbraw/zinc/16/07/39/180160739.db2.gz	NRFJTLYVDDRDAA-GFCCVEGCSA-N	1	0	263.389	1.686	50	0		CDAARO
[NH3+][C@H]1CCCN(Cc2cc(=O)c3cc(F)ccc3[nH]2)C1	ZINC000091416788	180149536	/nfs/dbraw/zinc/14/95/36/180149536.db2.gz	GCKVRQXCOWLNJU-NSHDSACASA-N	1	0	275.327	1.590	50	0		CDAARO
COC(=O)c1ccc([C@@H](C)[N@@H+]2CC[C@H](CO)C2)o1	ZINC000091580870	180199157	/nfs/dbraw/zinc/19/91/57/180199157.db2.gz	FVHYPWRDZVATQR-ZJUUUORDSA-N	1	0	253.298	1.441	50	0		CDAARO
CC[N@H+](C)C[C@@H]1CN(C(=O)c2sccc2C)C[C@@H]1CO	ZINC000091585648	180199832	/nfs/dbraw/zinc/19/98/32/180199832.db2.gz	ROGSECNYLAWDDO-CHWSQXEVSA-N	1	0	296.436	1.689	50	0		CDAARO
CCCCc1c(C)[nH+]c(N)nc1N1CC[C@@H](OC)C1	ZINC000091707007	180230241	/nfs/dbraw/zinc/23/02/41/180230241.db2.gz	PTJIJMDEGJNMHY-LLVKDONJSA-N	1	0	264.373	1.935	50	0		CDAARO
Cc1cc(F)ccc1CC(=O)N1C[C@H]([NH3+])[C@@H](C2CC2)C1	ZINC000091914848	180285761	/nfs/dbraw/zinc/28/57/61/180285761.db2.gz	MIQZEDVXBYNERS-CABCVRRESA-N	1	0	276.355	1.872	50	0		CDAARO
COc1cccc(CN2CC[N@H+](C)[C@H](CCO)C2)c1OC	ZINC000106721249	186133507	/nfs/dbraw/zinc/13/35/07/186133507.db2.gz	PMHABCCNTFPQQH-CQSZACIVSA-N	1	0	294.395	1.202	50	0		CDAARO
COc1ncccc1NC(=O)NC[C@H]1CCC[N@H+](C)C1	ZINC000108433641	186216775	/nfs/dbraw/zinc/21/67/75/186216775.db2.gz	RQJZEPVHPPFUGF-LLVKDONJSA-N	1	0	278.356	1.554	50	0		CDAARO
CS[C@@H]1CCC[C@H]1[N@H+](C)CCN1C(=O)CCC1=O	ZINC000110642405	186308467	/nfs/dbraw/zinc/30/84/67/186308467.db2.gz	NVAOHARBGMASTR-GHMZBOCLSA-N	1	0	270.398	1.351	50	0		CDAARO
CC[N@@H+]1C[C@@H](C)[C@@H](NS(=O)(=O)c2ccc(F)cc2)C1	ZINC000257366253	350964441	/nfs/dbraw/zinc/96/44/41/350964441.db2.gz	PLUJUVWAZQIWFQ-MFKMUULPSA-N	1	0	286.372	1.444	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)c1ccc(F)cc1F	ZINC000122615985	187041044	/nfs/dbraw/zinc/04/10/44/187041044.db2.gz	UTJYOXNIIFJOEL-JTQLQIEISA-N	1	0	254.280	1.789	50	0		CDAARO
CN1CC[N@H+](CCC2OCCO2)[C@@H](c2ccccc2)C1	ZINC000248641226	363328973	/nfs/dbraw/zinc/32/89/73/363328973.db2.gz	YJQIEYTXVWRKFF-OAHLLOKOSA-N	1	0	276.380	1.738	50	0		CDAARO
CC(=O)Oc1c(C)[n+](C)cc2c1CO[C@@H](C)OC2	ZINC000000187148	538220512	/nfs/dbraw/zinc/22/05/12/538220512.db2.gz	GZXPBHDZTLFAAP-JTQLQIEISA-N	1	0	252.290	1.138	50	0		CDAARO
CC(C)NC(=O)c1ccc(N2CC[NH+](C(C)C)CC2)nc1	ZINC000000480516	355913841	/nfs/dbraw/zinc/91/38/41/355913841.db2.gz	YEUHAYGKHVWKET-UHFFFAOYSA-N	1	0	290.411	1.750	50	0		CDAARO
COc1cc(C(=O)N[C@@H]2CCC[NH2+]C2)cc(OC)c1OC	ZINC000000000817	355879345	/nfs/dbraw/zinc/87/93/45/355879345.db2.gz	YSIITVVESCNIPR-LLVKDONJSA-N	1	0	294.351	1.194	50	0	investigational	CDAARO
C[C@@H](O)C[NH2+]C[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000002639614	355977905	/nfs/dbraw/zinc/97/79/05/355977905.db2.gz	ZYCUQNVZGLYZEI-PSASIEDQSA-N	1	0	294.178	1.704	50	0		CDAARO
CN(C)CC(=O)Nc1cccc(Br)c1	ZINC000002861965	355984276	/nfs/dbraw/zinc/98/42/76/355984276.db2.gz	FWUXRVUIOYHDAK-UHFFFAOYSA-N	1	0	257.131	1.949	50	0		CDAARO
C[NH+](C)CCCNC(=O)COc1ccc(Cl)cc1	ZINC000002899067	355987585	/nfs/dbraw/zinc/98/75/85/355987585.db2.gz	SHOCZPNWEOMZQE-UHFFFAOYSA-N	1	0	270.760	1.787	50	0		CDAARO
COc1ccccc1N1CC[NH+](CCCOCCO)CC1	ZINC000002015729	355957333	/nfs/dbraw/zinc/95/73/33/355957333.db2.gz	CXTBTNLJQDHUKK-UHFFFAOYSA-N	1	0	294.395	1.216	50	0		CDAARO
C[NH+](C)[C@@H]1CCC[C@H]1NC(=O)c1cc(O)ccc1F	ZINC000584901882	355957439	/nfs/dbraw/zinc/95/74/39/355957439.db2.gz	FHKKFYKZZGXARD-CHWSQXEVSA-N	1	0	266.316	1.744	50	0		CDAARO
COc1ccc(NC(=O)CC[N@@H+]2CCCC[C@@H]2CO)cc1	ZINC000097371890	356090399	/nfs/dbraw/zinc/09/03/99/356090399.db2.gz	NJJWOWSLZKKPIP-CQSZACIVSA-N	1	0	292.379	1.871	50	0		CDAARO
COc1cc([C@H](C[NH3+])N(C)C)cc(OC)c1OC	ZINC000019365442	356483043	/nfs/dbraw/zinc/48/30/43/356483043.db2.gz	VNKKIJXJEPUFJP-JTQLQIEISA-N	1	0	254.330	1.274	50	0		CDAARO
CCC[C@@](C)([NH3+])C(=O)Nc1ccc(-n2cncn2)nc1	ZINC000037622101	356513306	/nfs/dbraw/zinc/51/33/06/356513306.db2.gz	HGVMWSHEUQWOGN-CYBMUJFWSA-N	1	0	274.328	1.118	50	0		CDAARO
CCc1ccc(C[NH2+][C@H]2CCS(=O)(=O)C2)cc1	ZINC000019772553	356501207	/nfs/dbraw/zinc/50/12/07/356501207.db2.gz	YFGRULIWGIAXPJ-ZDUSSCGKSA-N	1	0	253.367	1.526	50	0		CDAARO
[NH3+]CCNCCOCCOc1ccc(Cl)c(Cl)c1	ZINC000020118332	356525815	/nfs/dbraw/zinc/52/58/15/356525815.db2.gz	MYMZVSZYLRZWCX-UHFFFAOYSA-N	1	0	293.194	1.937	50	0		CDAARO
O=C(c1cccc(C(F)(F)F)c1)N1CC[NH2+]CC1	ZINC000021951707	356592714	/nfs/dbraw/zinc/59/27/14/356592714.db2.gz	DLUXDOKFRWDPBN-UHFFFAOYSA-N	1	0	258.243	1.751	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COCc2ccccc2F)CC1	ZINC000022030464	356597965	/nfs/dbraw/zinc/59/79/65/356597965.db2.gz	VPPVPPKNHCQVJB-OAHLLOKOSA-N	1	0	296.386	1.341	50	0		CDAARO
CCNc1cc(C)[nH+]c(N2CCN(C(=O)C(C)C)CC2)n1	ZINC000023993751	356650959	/nfs/dbraw/zinc/65/09/59/356650959.db2.gz	JFKJDOLDSDUYOJ-UHFFFAOYSA-N	1	0	291.399	1.521	50	0		CDAARO
COc1ccc(OC)c(C[N@@H+]2CCC[C@H](O)C2)c1	ZINC000002811246	356734908	/nfs/dbraw/zinc/73/49/08/356734908.db2.gz	JAITZLCJEAIXBU-LBPRGKRZSA-N	1	0	251.326	1.661	50	0		CDAARO
CCc1ccccc1C(=O)NCC1(O)CC[NH+](C)CC1	ZINC000269540414	356820844	/nfs/dbraw/zinc/82/08/44/356820844.db2.gz	PSKWZPXMNPHODB-UHFFFAOYSA-N	1	0	276.380	1.436	50	0		CDAARO
COC(=O)c1ccccc1COCC1CC[NH2+]CC1	ZINC000042782947	357080328	/nfs/dbraw/zinc/08/03/28/357080328.db2.gz	LONKGGILFYRJKX-UHFFFAOYSA-N	1	0	263.337	1.989	50	0		CDAARO
CN(CC1CCOCC1)C(=O)[C@H]([NH3+])Cc1ccccc1	ZINC000042783708	357080626	/nfs/dbraw/zinc/08/06/26/357080626.db2.gz	ZNYJZDOGZXANPS-OAHLLOKOSA-N	1	0	276.380	1.441	50	0		CDAARO
O=C(COc1ccc(Cl)cc1)N[C@@H]1C[NH+]2CCC1CC2	ZINC000000537719	357210195	/nfs/dbraw/zinc/21/01/95/357210195.db2.gz	IYTACMQBGIPOIJ-CQSZACIVSA-N	1	0	294.782	1.929	50	0		CDAARO
CCCCC[N@@H+]1CCC[C@H](Cn2cc(CCO)nn2)C1	ZINC000048234121	357175328	/nfs/dbraw/zinc/17/53/28/357175328.db2.gz	ZRRJPOJHLUYCBG-AWEZNQCLSA-N	1	0	280.416	1.715	50	0		CDAARO
Cc1ccccc1CCNC(=O)[C@H](C)[N@@H+]1CC[C@H](CO)C1	ZINC000095430702	357445290	/nfs/dbraw/zinc/44/52/90/357445290.db2.gz	YNWBSXYNXQEFLQ-GJZGRUSLSA-N	1	0	290.407	1.356	50	0		CDAARO
Cc1nc(C(=O)N[C@H]2COC[C@@H]2[NH+]2CCCCC2)cs1	ZINC000065397035	357536635	/nfs/dbraw/zinc/53/66/35/357536635.db2.gz	BENDUOGGGFFFBJ-AAEUAGOBSA-N	1	0	295.408	1.435	50	0		CDAARO
CC(=O)N1CCC([N@H+](C)Cc2c(C)noc2C)CC1	ZINC000065492005	357544501	/nfs/dbraw/zinc/54/45/01/357544501.db2.gz	YVUFMBKJZJWCNV-UHFFFAOYSA-N	1	0	265.357	1.734	50	0		CDAARO
Clc1ccc(N2CC[NH+](C3CCOCC3)CC2)nn1	ZINC000065506389	357545911	/nfs/dbraw/zinc/54/59/11/357545911.db2.gz	CVBCHUXWTGIVIE-UHFFFAOYSA-N	1	0	282.775	1.431	50	0		CDAARO
O=C(Cn1cc(Cl)cn1)N1CC[C@]2(C1)CCC[NH2+]C2	ZINC000067784347	357626239	/nfs/dbraw/zinc/62/62/39/357626239.db2.gz	NCUSLLUQMOPUQK-CYBMUJFWSA-N	1	0	282.775	1.139	50	0		CDAARO
C[NH+]1CCC(CNC(=O)C(=O)Nc2ccccc2)CC1	ZINC000022999058	357581871	/nfs/dbraw/zinc/58/18/71/357581871.db2.gz	OLHCEZSYZLUXDZ-UHFFFAOYSA-N	1	0	275.352	1.083	50	0		CDAARO
C[NH+](C)CC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000067800767	357628836	/nfs/dbraw/zinc/62/88/36/357628836.db2.gz	FRQZLRYVQWAWKD-UHFFFAOYSA-N	1	0	285.388	1.064	50	0		CDAARO
CC(C)C[N@@H+]1CCC[C@H](CNC(=O)c2ccc[nH]c2=O)C1	ZINC000067649644	357616960	/nfs/dbraw/zinc/61/69/60/357616960.db2.gz	SPBWUIRTXSOPAI-CYBMUJFWSA-N	1	0	291.395	1.473	50	0		CDAARO
CNC(=O)[C@H](C)N(C)Cc1cccc(C(=O)OC)c1	ZINC000067695039	357618733	/nfs/dbraw/zinc/61/87/33/357618733.db2.gz	WFDKSWJIMSMCNP-JTQLQIEISA-N	1	0	264.325	1.040	50	0		CDAARO
CCc1nc(C)sc1C[NH2+][C@H](C)Cn1cncn1	ZINC000067851853	357632246	/nfs/dbraw/zinc/63/22/46/357632246.db2.gz	VJJJZWMEFJYSSH-SECBINFHSA-N	1	0	265.386	1.784	50	0		CDAARO
COCCOC[C@H]1CCN(c2cccc(C)n2)C1	ZINC000097096508	357953577	/nfs/dbraw/zinc/95/35/77/357953577.db2.gz	QQXSZRMOJWALHR-ZDUSSCGKSA-N	1	0	250.342	1.879	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@@H]2CCCC[C@H]2O)s1	ZINC000097102609	357972211	/nfs/dbraw/zinc/97/22/11/357972211.db2.gz	QWRCKNHABXQISK-GHMZBOCLSA-N	1	0	269.366	1.928	50	0		CDAARO
C[C@@H]1OCC[C@H]1[NH2+]C[C@@H](Cc1ccc(F)cc1)C(N)=O	ZINC000097113575	357982998	/nfs/dbraw/zinc/98/29/98/357982998.db2.gz	ZNBZYMSYQCWOQK-ZKYQVNSYSA-N	1	0	280.343	1.237	50	0		CDAARO
OCc1ccc(C[NH+]2CCC(OC[C@H]3CCOC3)CC2)o1	ZINC000097108595	357983719	/nfs/dbraw/zinc/98/37/19/357983719.db2.gz	JKXJKEPNBVSUHU-ZDUSSCGKSA-N	1	0	295.379	1.789	50	0		CDAARO
O[C@@H]1COCC[N@@H+](C2CCN(c3ccccc3F)CC2)C1	ZINC000077517547	358020737	/nfs/dbraw/zinc/02/07/37/358020737.db2.gz	FFIYDZSTWYIQGN-AWEZNQCLSA-N	1	0	294.370	1.488	50	0		CDAARO
C[C@@H](CCn1cccn1)[NH2+][C@@H](C)C(=O)N1CCCCC1	ZINC000097234795	358050530	/nfs/dbraw/zinc/05/05/30/358050530.db2.gz	IYPAOHMNQHGRSZ-KBPBESRZSA-N	1	0	278.400	1.652	50	0		CDAARO
CN(C(=O)c1cc[nH]n1)C1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000000054378	358075414	/nfs/dbraw/zinc/07/54/14/358075414.db2.gz	HQFIPRGGQKDGFG-UHFFFAOYSA-N	1	0	264.373	1.791	50	0		CDAARO
C[NH+]1CCN(C[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000019772770	358138889	/nfs/dbraw/zinc/13/88/89/358138889.db2.gz	JIFNRGXVPACIKK-CYBMUJFWSA-N	1	0	284.787	1.327	50	0		CDAARO
Cc1cn2cc(C(=O)N3CC[NH2+][C@H](C)C3)ccc2n1	ZINC000082160840	358149494	/nfs/dbraw/zinc/14/94/94/358149494.db2.gz	BKGFNFGPOYCIKD-SNVBAGLBSA-N	1	0	258.325	1.077	50	0		CDAARO
Cc1nc(/C=C\C(=O)N2CC[N@@H+](C)C[C@@H]2C)cs1	ZINC000098055833	358342544	/nfs/dbraw/zinc/34/25/44/358342544.db2.gz	XDNVBXBGADLSAH-LWTINBJPSA-N	1	0	265.382	1.627	50	0		CDAARO
CC(C)NC(=O)C[C@H](C)[NH2+][C@H]1CN(C(C)C)C[C@@H]1C	ZINC000088735539	366430800	/nfs/dbraw/zinc/43/08/00/366430800.db2.gz	RVLZQKRZMPYGSR-IHRRRGAJSA-N	1	0	269.433	1.608	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCC(=O)NCCn2ccnc2)C1	ZINC000095372974	358688806	/nfs/dbraw/zinc/68/88/06/358688806.db2.gz	NUSUDRGRICSZIL-CYBMUJFWSA-N	1	0	264.373	1.121	50	0		CDAARO
O[C@H]1CN(Cc2ccc3ccccc3n2)C[C@@H]1[NH+]1CCCC1	ZINC000097288868	358765223	/nfs/dbraw/zinc/76/52/23/358765223.db2.gz	UVJVBOHQHORCLI-ROUUACIJSA-N	1	0	297.402	1.876	50	0		CDAARO
O[C@@H](c1ccccn1)C1CCN(Cc2ncc[nH]2)CC1	ZINC000097568910	358784894	/nfs/dbraw/zinc/78/48/94/358784894.db2.gz	YSKSYCQTMXPYLF-OAHLLOKOSA-N	1	0	272.352	1.750	50	0		CDAARO
CC(C)c1ncc(CN2CCN([C@H]3CC[NH2+]C3)CC2)cn1	ZINC000097618863	358788193	/nfs/dbraw/zinc/78/81/93/358788193.db2.gz	KVWALNMOGSHDEY-HNNXBMFYSA-N	1	0	289.427	1.080	50	0		CDAARO
Cc1cc(C(N)=O)ccc1NC(=O)NCC1CC[NH2+]CC1	ZINC000097772974	358797749	/nfs/dbraw/zinc/79/77/49/358797749.db2.gz	OTPHPTUARVPSEB-UHFFFAOYSA-N	1	0	290.367	1.215	50	0		CDAARO
Cc1nc(C(=O)N2CCCC[C@H]2C[NH3+])c(C)s1	ZINC000097784820	358798495	/nfs/dbraw/zinc/79/84/95/358798495.db2.gz	HEWJWKMHNUPWQI-JTQLQIEISA-N	1	0	253.371	1.713	50	0		CDAARO
CC(C)c1nc(CN(C)C[C@@H]2COCCO2)co1	ZINC000097823069	358801683	/nfs/dbraw/zinc/80/16/83/358801683.db2.gz	YCIZRJCTRAGUIS-GFCCVEGCSA-N	1	0	254.330	1.645	50	0		CDAARO
C[C@H](c1ccccc1)N1C(=[NH2+])S[C@@H]2CS(=O)(=O)C[C@H]21	ZINC000251577512	366511838	/nfs/dbraw/zinc/51/18/38/366511838.db2.gz	VPTURGDGEBLVCX-YUSALJHKSA-N	1	0	296.417	1.897	50	0		CDAARO
Cc1n[nH]c(C)c1C[N@@H+](C)[C@H](C)Cc1cnccn1	ZINC000215992629	358913626	/nfs/dbraw/zinc/91/36/26/358913626.db2.gz	ZQAZZEUKICDJDN-SNVBAGLBSA-N	1	0	259.357	1.880	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1nc(-c2ccc(F)cc2)no1	ZINC000012321982	358982245	/nfs/dbraw/zinc/98/22/45/358982245.db2.gz	XQIRNJQTOZYDPN-UHFFFAOYSA-N	1	0	292.314	1.557	50	0		CDAARO
COc1cc(OC)c(NC(=O)[C@@H]2CCC[NH2+]2)cc1F	ZINC000087393323	359097257	/nfs/dbraw/zinc/09/72/57/359097257.db2.gz	DZGHGJXPSUNUAV-VIFPVBQESA-N	1	0	268.288	1.533	50	0		CDAARO
C[C@@H]1CCC[C@H](C)N1C(=O)C[N@H+](C)CC(C)(C)O	ZINC000087408551	359127141	/nfs/dbraw/zinc/12/71/41/359127141.db2.gz	FSPUGWSBXBHRPT-TXEJJXNPSA-N	1	0	256.390	1.479	50	0		CDAARO
CC(C)(C)NC(=O)N1CCC([C@H]2CC[NH2+]C2)CC1	ZINC000257186576	359523144	/nfs/dbraw/zinc/52/31/44/359523144.db2.gz	ZICIECOBTWNBGO-LBPRGKRZSA-N	1	0	253.390	1.816	50	0		CDAARO
OCC[NH2+]CCCOc1cccc(Br)c1	ZINC000003000625	359551064	/nfs/dbraw/zinc/55/10/64/359551064.db2.gz	RGQBWUSJCWLWLD-UHFFFAOYSA-N	1	0	274.158	1.800	50	0		CDAARO
COCCC1([NH+](C)C)CCN(C(=O)C2CC2)CC1	ZINC000257195240	359610746	/nfs/dbraw/zinc/61/07/46/359610746.db2.gz	VRDVLWZBYOPOLJ-UHFFFAOYSA-N	1	0	254.374	1.356	50	0		CDAARO
COc1ccccc1C[NH2+]C[C@@H](OC)[C@@H]1CCOC1	ZINC000585093632	482828481	/nfs/dbraw/zinc/82/84/81/482828481.db2.gz	PZNCWJCCKHDIAI-UKRRQHHQSA-N	1	0	265.353	1.836	50	0		CDAARO
C[NH2+][C@@H](CO)c1cc(OC)ccc1Br	ZINC000229296726	360070046	/nfs/dbraw/zinc/07/00/46/360070046.db2.gz	FBVIFOVPPRDLJE-JTQLQIEISA-N	1	0	260.131	1.711	50	0		CDAARO
CN1C(=O)N(C)[C@@]2(CC[N@H+](Cc3ccccc3F)C2)C1=O	ZINC000409420329	360224481	/nfs/dbraw/zinc/22/44/81/360224481.db2.gz	KDBCSKXFZDUVKX-OAHLLOKOSA-N	1	0	291.326	1.294	50	0		CDAARO
Cc1c[nH+]c(C)n1C1CCN(C(=O)c2cnccn2)CC1	ZINC000409420981	360230054	/nfs/dbraw/zinc/23/00/54/360230054.db2.gz	RLLHTGXRCYZENP-UHFFFAOYSA-N	1	0	285.351	1.767	50	0		CDAARO
Cc1n[nH]c([C@H]2CCN(Cc3ccoc3)C[C@H]2[NH+](C)C)n1	ZINC000409421262	360230289	/nfs/dbraw/zinc/23/02/89/360230289.db2.gz	XXZLYQUFNQYADT-UONOGXRCSA-N	1	0	289.383	1.626	50	0		CDAARO
O=S(=O)([C@@H]1CC[N@H+](C[C@H]2CC=CCC2)C1)N1CCCC1	ZINC000092044710	360261659	/nfs/dbraw/zinc/26/16/59/360261659.db2.gz	APUHFHMEHYJPQZ-LSDHHAIUSA-N	1	0	298.452	1.843	50	0		CDAARO
[NH3+]CCOc1cccc(C(=O)NCC[C@@H]2CCCOC2)c1	ZINC000426677396	360695424	/nfs/dbraw/zinc/69/54/24/360695424.db2.gz	FZEVFYJLZCUQSC-ZDUSSCGKSA-N	1	0	292.379	1.571	50	0		CDAARO
Cc1nc([C@H]2CCOC2)cc(N(C)C2CC[NH+](C)CC2)n1	ZINC000426419961	360668353	/nfs/dbraw/zinc/66/83/53/360668353.db2.gz	IGBJXGHNVMLNFB-ZDUSSCGKSA-N	1	0	290.411	1.819	50	0		CDAARO
Cc1c(C(=O)N(C)[C@H]2CC[NH2+]C2)cnn1Cc1ccccc1	ZINC000179111747	189170788	/nfs/dbraw/zinc/17/07/88/189170788.db2.gz	GSOBUOZONHXTCJ-HNNXBMFYSA-N	1	0	298.390	1.674	50	0		CDAARO
C[C@H]1CN(C(=O)c2ccc3ncsc3c2)CC[NH2+]1	ZINC000179182191	189176079	/nfs/dbraw/zinc/17/60/79/189176079.db2.gz	ZUGDRPYPEQSFFX-VIFPVBQESA-N	1	0	261.350	1.730	50	0		CDAARO
CC(C)N(C)C[C@H](C)[NH2+]Cc1ccc(CO)cc1	ZINC000311124097	361263271	/nfs/dbraw/zinc/26/32/71/361263271.db2.gz	YHTGAORVNGLFGW-ZDUSSCGKSA-N	1	0	250.386	1.997	50	0		CDAARO
[NH3+][C@@H]1CCCN(S(=O)(=O)c2cccc(Cl)c2F)C1	ZINC000036297265	361462327	/nfs/dbraw/zinc/46/23/27/361462327.db2.gz	KNUXIYACHFPDIH-MRVPVSSYSA-N	1	0	292.763	1.591	50	0		CDAARO
COc1ccnc(NC[C@H]2CC[N@H+](CC(C)C)C2)n1	ZINC000268226439	364010742	/nfs/dbraw/zinc/01/07/42/364010742.db2.gz	KYOHLSROEDFEJU-GFCCVEGCSA-N	1	0	264.373	1.875	50	0		CDAARO
COC[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCC2)C1CC1	ZINC000248701676	364268565	/nfs/dbraw/zinc/26/85/65/364268565.db2.gz	GHLLPYBTIIODOB-IGQOVBAYSA-N	1	0	251.370	1.959	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCC[NH2+]C2)c(F)c1	ZINC000193350025	189641560	/nfs/dbraw/zinc/64/15/60/189641560.db2.gz	LYLFHKKGGSQREX-JTQLQIEISA-N	1	0	272.345	1.164	50	0		CDAARO
CC[N@@H+]1CC[C@@H](N(C)S(=O)(=O)c2cccnc2)[C@@H](C)C1	ZINC000195530978	189677183	/nfs/dbraw/zinc/67/71/83/189677183.db2.gz	GVTGNSHPRCJXKX-GXTWGEPZSA-N	1	0	297.424	1.432	50	0		CDAARO
CC(C)[N@H+](CCNC(=O)NC1(CO)CCCC1)C1CC1	ZINC000089869573	366951381	/nfs/dbraw/zinc/95/13/81/366951381.db2.gz	ABBPEDWIXRXGKS-UHFFFAOYSA-N	1	0	283.416	1.464	50	0		CDAARO
CCCn1nnnc1CN1CCC[C@@H]([NH+]2CCCC2)CC1	ZINC000089960686	366985049	/nfs/dbraw/zinc/98/50/49/366985049.db2.gz	ZUEQOWYCWAZSCT-CQSZACIVSA-N	1	0	292.431	1.533	50	0		CDAARO
CC[N@H+](CCC(=O)NCC(=O)OC)CCc1ccccc1	ZINC000089969226	366990107	/nfs/dbraw/zinc/99/01/07/366990107.db2.gz	OMXLUPFTTGBJFU-UHFFFAOYSA-N	1	0	292.379	1.230	50	0		CDAARO
C[C@H](CCc1ccco1)[NH2+][C@@H]1CC(=O)N(C2CC2)C1	ZINC000090180782	367023556	/nfs/dbraw/zinc/02/35/56/367023556.db2.gz	KYVIERBJCYEFTC-VXGBXAGGSA-N	1	0	262.353	1.954	50	0		CDAARO
c1[nH]nc2ncnc(N3CCN(Cc4cccnc4)CC3)c12	ZINC000012556519	369422262	/nfs/dbraw/zinc/42/22/62/369422262.db2.gz	DDOLMDNSMLTIGS-UHFFFAOYSA-N	1	0	295.350	1.070	50	0		CDAARO
CCn1ncnc1C[NH2+]CCc1cnn(-c2ccccc2)c1	ZINC000638346436	369491632	/nfs/dbraw/zinc/49/16/32/369491632.db2.gz	CADUDXZULCEXPP-UHFFFAOYSA-N	1	0	296.378	1.816	50	0		CDAARO
CCN(C)C(=O)[C@@H](C)[N@H+](C)CCCc1nccn1C	ZINC000299777447	372754248	/nfs/dbraw/zinc/75/42/48/372754248.db2.gz	NJBQKHHDQGWJQX-GFCCVEGCSA-N	1	0	266.389	1.151	50	0		CDAARO
CC(C)N(C)C(=O)CN(C)[C@H](C)Cc1cnccn1	ZINC000299780747	372757395	/nfs/dbraw/zinc/75/73/95/372757395.db2.gz	BRRQRRBCWGXZGI-GFCCVEGCSA-N	1	0	264.373	1.206	50	0		CDAARO
[NH3+][C@H](CC(=O)NCc1ccccn1)c1ccc(F)cc1	ZINC000299803847	372772626	/nfs/dbraw/zinc/77/26/26/372772626.db2.gz	HEWCNLMOBFXOCD-CQSZACIVSA-N	1	0	273.311	1.927	50	0		CDAARO
CC(C)N1CC[C@H]([NH2+][C@@H]2[C@@H]3CCO[C@H]3C2(C)C)C1=O	ZINC000253370691	373680233	/nfs/dbraw/zinc/68/02/33/373680233.db2.gz	UYKYTYGNRCVPIW-WUHRBBMRSA-N	1	0	266.385	1.399	50	0		CDAARO
C[NH2+]CC(=O)N[C@@H](Cc1cccc(OC)c1)C1CC1	ZINC000253426931	373733917	/nfs/dbraw/zinc/73/39/17/373733917.db2.gz	JFJTULJHIKUWPO-AWEZNQCLSA-N	1	0	262.353	1.352	50	0		CDAARO
C[NH+](C)[C@@H]1Cc2ccccc2N(C(=O)c2cnsn2)C1	ZINC000109112527	374049850	/nfs/dbraw/zinc/04/98/50/374049850.db2.gz	FNWVHRVOEANVMS-LLVKDONJSA-N	1	0	288.376	1.671	50	0		CDAARO
CO[C@H](C(=O)N1CCC[C@@H]([C@H](C)[NH3+])C1)c1ccccc1	ZINC000251498829	189970030	/nfs/dbraw/zinc/97/00/30/189970030.db2.gz	HHOWOBJOTQLWAW-CFVMTHIKSA-N	1	0	276.380	1.960	50	0		CDAARO
COc1ccc(OC)c(CCCNC2=[NH+]CCCN2)c1	ZINC000252497509	189977827	/nfs/dbraw/zinc/97/78/27/189977827.db2.gz	QJRKWQGZUBSPAQ-UHFFFAOYSA-N	1	0	277.368	1.575	50	0		CDAARO
COC(=O)[C@@]12CCC[C@H]1C[N@H+](Cc1cnn(C)c1C)C2	ZINC000108466435	412829528	/nfs/dbraw/zinc/82/95/28/412829528.db2.gz	HBNPJZPSOGOKLI-DZGCQCFKSA-N	1	0	277.368	1.504	50	0		CDAARO
CCCc1nnc(N2CCC([N@@H+]3CCC[C@@H](O)C3)CC2)o1	ZINC000095384208	374897782	/nfs/dbraw/zinc/89/77/82/374897782.db2.gz	OYVOHQCXEAZSKX-CYBMUJFWSA-N	1	0	294.399	1.448	50	0		CDAARO
CS(=O)(=O)[C@@H]1CCCC[C@H]1[NH2+]Cc1cccnc1	ZINC000095427024	374927735	/nfs/dbraw/zinc/92/77/35/374927735.db2.gz	LNJMPFOYXYKXKJ-CHWSQXEVSA-N	1	0	268.382	1.527	50	0		CDAARO
CC(C)[C@@H]1C[C@@H](C[NH2+]C2(CCO)CCOCC2)CCO1	ZINC000095466063	374961970	/nfs/dbraw/zinc/96/19/70/374961970.db2.gz	BSEYEURYJSZODZ-GJZGRUSLSA-N	1	0	285.428	1.959	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N(C)[C@H]1CCC[C@H]1SC	ZINC000095971186	375045653	/nfs/dbraw/zinc/04/56/53/375045653.db2.gz	UWBOVYWDRFBPHV-GARJFASQSA-N	1	0	276.471	1.809	50	0		CDAARO
CC(C)(C)c1n[nH]cc1C[NH2+]CCNc1ncccn1	ZINC000097160042	375150676	/nfs/dbraw/zinc/15/06/76/375150676.db2.gz	HNRZWLUTOWZPCV-UHFFFAOYSA-N	1	0	274.372	1.699	50	0		CDAARO
Cn1cc(C2CC[NH+]([C@H](C(N)=O)c3ccccc3)CC2)cn1	ZINC000097203157	375156760	/nfs/dbraw/zinc/15/67/60/375156760.db2.gz	LOTRIMWLBSHQPD-INIZCTEOSA-N	1	0	298.390	1.826	50	0		CDAARO
CCCC(=O)NCc1ccccc1C[N@@H+]1CC[C@@H](O)C1	ZINC000097237868	375159221	/nfs/dbraw/zinc/15/92/21/375159221.db2.gz	BMAMDNDTGCUBGK-OAHLLOKOSA-N	1	0	276.380	1.670	50	0		CDAARO
C[C@@H](COCC(F)(F)F)NC(=O)CC1CC[NH2+]CC1	ZINC000253433421	189992691	/nfs/dbraw/zinc/99/26/91/189992691.db2.gz	WQSVFWMGIZATLJ-VIFPVBQESA-N	1	0	282.306	1.460	50	0		CDAARO
C[C@H]1CCC[N@H+](CC(=O)Nc2ccc(C(N)=O)cc2)C1	ZINC000003564661	375749927	/nfs/dbraw/zinc/74/99/27/375749927.db2.gz	YXPAIYNRSPTRGS-NSHDSACASA-N	1	0	275.352	1.456	50	0		CDAARO
Cc1ccc(-n2cc(C(=O)NCC[NH+](C)C)nn2)cc1C	ZINC000067261927	376956832	/nfs/dbraw/zinc/95/68/32/376956832.db2.gz	AVUZAYKLOPGUSX-UHFFFAOYSA-N	1	0	287.367	1.176	50	0		CDAARO
c1ccc2c(c1)CN(c1ncnc3c1CC[NH2+]C3)CCO2	ZINC000067675549	377200429	/nfs/dbraw/zinc/20/04/29/377200429.db2.gz	AZZOCYFPVIFKEB-UHFFFAOYSA-N	1	0	282.347	1.521	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)NCc1cc[nH]n1)c1ccsc1	ZINC000089312271	377823084	/nfs/dbraw/zinc/82/30/84/377823084.db2.gz	NCOCXUOCXYMBEZ-GFCCVEGCSA-N	1	0	293.396	1.573	50	0		CDAARO
C[C@H]1C[NH+](CCCNC(=O)c2cccc(=O)[nH]2)C[C@H](C)O1	ZINC000278632849	194076366	/nfs/dbraw/zinc/07/63/66/194076366.db2.gz	NHDAFKSFAMYBNQ-RYUDHWBXSA-N	1	0	293.367	1.016	50	0		CDAARO
CC[C@H](CO)[NH2+]C[C@@H](O)Cn1c(C)c(C)c2ccccc21	ZINC000000106243	169538124	/nfs/dbraw/zinc/53/81/24/169538124.db2.gz	CSEDJBHBLGSNMW-HUUCEWRRSA-N	1	0	290.407	1.980	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCCN1C(=O)/C=C\C1CCOCC1	ZINC000493167776	253387767	/nfs/dbraw/zinc/38/77/67/253387767.db2.gz	AWYLSRWNIGNMSS-HPQNNBMJSA-N	1	0	266.385	1.698	50	0		CDAARO
COC[C@H]([NH2+][C@H]1CCN(CC(F)(F)F)C1)C1CC1	ZINC000096476824	533099709	/nfs/dbraw/zinc/09/97/09/533099709.db2.gz	CPRZCLYNHPUKMN-QWRGUYRKSA-N	1	0	266.307	1.638	50	0		CDAARO
Cc1ccc(-n2cc3c(n2)ncnc3N2CC[NH2+]CC2)cc1	ZINC000045795884	390438921	/nfs/dbraw/zinc/43/89/21/390438921.db2.gz	POQFTAORXAWUOR-UHFFFAOYSA-N	1	0	294.362	1.534	50	0		CDAARO
Cn1nc(-c2nc(-c3ccccc3F)no2)c2c1CC[NH2+]C2	ZINC000074934358	390662326	/nfs/dbraw/zinc/66/23/26/390662326.db2.gz	YWNDWLVSHZYMCG-UHFFFAOYSA-N	1	0	299.309	1.922	50	0		CDAARO
CC[C@@H]1CN(c2ncc(OC)cn2)CC[N@@H+]1C(C)C	ZINC000077356211	390810031	/nfs/dbraw/zinc/81/00/31/390810031.db2.gz	VEYCYXDCXPEAJK-GFCCVEGCSA-N	1	0	264.373	1.794	50	0		CDAARO
CC(C)Cc1cc(CNC(=O)[C@H]2CC[C@@H]([NH3+])C2)no1	ZINC000072448088	390815208	/nfs/dbraw/zinc/81/52/08/390815208.db2.gz	JOWKYKKANJSWFU-WDEREUQCSA-N	1	0	265.357	1.617	50	0		CDAARO
CC(C)NC(=O)NC(=O)[C@@H](C)[NH+]1CCCCCC1	ZINC000008119235	391056279	/nfs/dbraw/zinc/05/62/79/391056279.db2.gz	UUJALNIKRYOYSB-LLVKDONJSA-N	1	0	255.362	1.485	50	0		CDAARO
O=C1N(Cc2cccnc2)CCCN1C1CC[NH2+]CC1	ZINC000526056016	391172277	/nfs/dbraw/zinc/17/22/77/391172277.db2.gz	AEWTVDBMSRNRPD-UHFFFAOYSA-N	1	0	274.368	1.461	50	0		CDAARO
CCc1ccc(S(=O)(=O)N[C@H]2CCC[C@H]2C[NH3+])cc1	ZINC000089092065	391692811	/nfs/dbraw/zinc/69/28/11/391692811.db2.gz	MEFXCPYLYLUFTH-JSGCOSHPSA-N	1	0	282.409	1.655	50	0		CDAARO
CCC[C@@]1(COC)CCC[N@@H+]1Cc1nc(COC)no1	ZINC000194922578	392006294	/nfs/dbraw/zinc/00/62/94/392006294.db2.gz	UWEZSAHEPNIPNT-AWEZNQCLSA-N	1	0	283.372	1.997	50	0		CDAARO
Cc1cc(CN2CCN(S(C)(=O)=O)CC2)c(C)s1	ZINC000194367424	392173965	/nfs/dbraw/zinc/17/39/65/392173965.db2.gz	SKKZBTQQZZQOER-UHFFFAOYSA-N	1	0	288.438	1.442	50	0		CDAARO
c1ccc2[nH]c(C3C[NH+](C[C@H]4COCCO4)C3)nc2c1	ZINC000243892330	131083016	/nfs/dbraw/zinc/08/30/16/131083016.db2.gz	AGDDPMDXVZCRAN-LBPRGKRZSA-N	1	0	273.336	1.378	50	0		CDAARO
C[C@@H]([NH3+])C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000261891969	131176286	/nfs/dbraw/zinc/17/62/86/131176286.db2.gz	WQYINDSPEMMTEK-KWCYVHTRSA-N	1	0	262.353	1.448	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)C1	ZINC000269152580	132121456	/nfs/dbraw/zinc/12/14/56/132121456.db2.gz	CCFXRXNBDGFPNN-GDLCADMTSA-N	1	0	262.328	1.736	50	0		CDAARO
CC(C)[C@H](NC(=O)C[N@H+](C)C1CC1)c1ccccn1	ZINC000096437059	393186541	/nfs/dbraw/zinc/18/65/41/393186541.db2.gz	SKWQCCKTHUIYBU-HNNXBMFYSA-N	1	0	261.369	1.989	50	0		CDAARO
O=C(NCC(F)(F)C(F)F)[C@@H]1C[C@@H]2CCCC[C@H]2[NH2+]1	ZINC000261568280	140350477	/nfs/dbraw/zinc/35/04/77/140350477.db2.gz	JSPHZCDMEXFAMT-YIZRAAEISA-N	1	0	282.281	1.924	50	0		CDAARO
Clc1ccc(CN2CCN([C@H]3CC[NH2+]C3)CC2)s1	ZINC000261572940	140352016	/nfs/dbraw/zinc/35/20/16/140352016.db2.gz	MCJDCWRUDHDDNS-NSHDSACASA-N	1	0	285.844	1.881	50	0		CDAARO
COC(C)(C)C[C@@H](C)[NH2+]C1CCN(S(C)(=O)=O)CC1	ZINC000036828123	292066163	/nfs/dbraw/zinc/06/61/63/292066163.db2.gz	ZWBUJBAQOGMWAM-LLVKDONJSA-N	1	0	292.445	1.204	50	0		CDAARO
Cc1ccc(CNC(=O)[C@H](C)[NH+]2CCC(O)CC2)cc1	ZINC000027536913	397792144	/nfs/dbraw/zinc/79/21/44/397792144.db2.gz	LXWIGADJUUFRJF-ZDUSSCGKSA-N	1	0	276.380	1.456	50	0		CDAARO
C[C@@H](C[NH2+]C(C1CC1)C1CC1)N1CCOC[C@H]1C	ZINC000095967929	286875511	/nfs/dbraw/zinc/87/55/11/286875511.db2.gz	QABMJDGBHGTZNB-NWDGAFQWSA-N	1	0	252.402	1.874	50	0		CDAARO
Nc1ncnc2c1ncn2CC[NH2+]CCc1ccccc1	ZINC000003999871	169928262	/nfs/dbraw/zinc/92/82/62/169928262.db2.gz	OSYGQVBMAWMOPA-UHFFFAOYSA-N	1	0	282.351	1.241	50	0	biogenic	CDAARO
CCOc1cc(C[NH2+]C)ccc1O[C@H](C)C(=O)NC	ZINC000004851152	170030456	/nfs/dbraw/zinc/03/04/56/170030456.db2.gz	LGRDJVAIQHXGGF-SNVBAGLBSA-N	1	0	266.341	1.318	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)Nc1ccc2[nH]c(=O)[nH]c2c1	ZINC000009497775	170378518	/nfs/dbraw/zinc/37/85/18/170378518.db2.gz	XSODGKJZGSGPGM-UHFFFAOYSA-N	1	0	288.351	1.671	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](n2cc(C(=O)NC(C)C)nn2)C1	ZINC000014988865	170652701	/nfs/dbraw/zinc/65/27/01/170652701.db2.gz	MJTWUURVUAVADU-GFCCVEGCSA-N	1	0	279.388	1.463	50	0		CDAARO
Cc1cc(Cl)ccc1OCCN1CC[NH2+]CC1	ZINC000019728633	170845838	/nfs/dbraw/zinc/84/58/38/170845838.db2.gz	KEYOOUFLZVCDPX-UHFFFAOYSA-N	1	0	254.761	1.932	50	0		CDAARO
CO[C@@H]1C[C@@H](c2nc[nH]n2)N(c2cc[nH+]c(C)c2)C1	ZINC000284544567	196081160	/nfs/dbraw/zinc/08/11/60/196081160.db2.gz	LZMNEMNAQJXSJF-NEPJUHHUSA-N	1	0	259.313	1.475	50	0		CDAARO
[NH3+]C[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000020182651	171045979	/nfs/dbraw/zinc/04/59/79/171045979.db2.gz	IERAQGDJNCAARE-JTQLQIEISA-N	1	0	274.773	1.452	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)N[C@@H](C)c2ccccc2)CC1	ZINC000020595108	171263901	/nfs/dbraw/zinc/26/39/01/171263901.db2.gz	SHMPXRSYAAWEMI-HNNXBMFYSA-N	1	0	289.423	1.891	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2cc(C)ccc2C)CC1	ZINC000020608820	171267549	/nfs/dbraw/zinc/26/75/49/171267549.db2.gz	FCXNUDVJQUXSTK-UHFFFAOYSA-N	1	0	275.396	1.879	50	0		CDAARO
C[NH+]1CCN([C@@H](CNC(=O)C2CC2)c2ccsc2)CC1	ZINC000022794229	171399579	/nfs/dbraw/zinc/39/95/79/171399579.db2.gz	XKMVDWQJLFDPKL-AWEZNQCLSA-N	1	0	293.436	1.563	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)c2c[nH]c3ccccc23)CC1	ZINC000035134657	172001416	/nfs/dbraw/zinc/00/14/16/172001416.db2.gz	DQILBZIHXOCGKH-UHFFFAOYSA-N	1	0	257.337	1.946	50	0		CDAARO
C[C@@H]1CSC[C@H]1[NH2+][C@@H]1CCCN(c2ccn(C)n2)C1=O	ZINC000285118292	196199825	/nfs/dbraw/zinc/19/98/25/196199825.db2.gz	NBAXENSERLTGBO-IJLUTSLNSA-N	1	0	294.424	1.257	50	0		CDAARO
CC(C)(C)n1cc(C[NH2+][C@@H]2CCCCNC2=O)cn1	ZINC000037282874	173090389	/nfs/dbraw/zinc/09/03/89/173090389.db2.gz	XZPPODDMXGDIPO-GFCCVEGCSA-N	1	0	264.373	1.396	50	0		CDAARO
C[NH2+]C1CCN(Cc2ncc(C)c(OC)c2C)CC1	ZINC000037536884	173255870	/nfs/dbraw/zinc/25/58/70/173255870.db2.gz	PMMDMECGQPSSJK-UHFFFAOYSA-N	1	0	263.385	1.891	50	0		CDAARO
CCCn1cc(CN2CC[N@H+](C)[C@H](CCO)C2)c(C)n1	ZINC000039532130	174169523	/nfs/dbraw/zinc/16/95/23/174169523.db2.gz	LTHBMKLZKVYEIC-OAHLLOKOSA-N	1	0	280.416	1.100	50	0		CDAARO
CC(C)SCC(=O)NCC[C@@H]1CCC[N@H+](C)C1	ZINC000067743104	175788460	/nfs/dbraw/zinc/78/84/60/175788460.db2.gz	GQORYJLATHQZQL-LBPRGKRZSA-N	1	0	258.431	1.976	50	0		CDAARO
[NH3+]C1(C(=O)N2CCC([C@H](O)Cc3ccccc3)CC2)CC1	ZINC000071575595	176202860	/nfs/dbraw/zinc/20/28/60/176202860.db2.gz	PVSBTWNANGKYMP-OAHLLOKOSA-N	1	0	288.391	1.320	50	0		CDAARO
[NH3+]CC(=O)N1CCC[C@H](CCc2ccc(F)cc2)C1	ZINC000071751000	176259889	/nfs/dbraw/zinc/25/98/89/176259889.db2.gz	JHWQRWIWEIUTPK-CYBMUJFWSA-N	1	0	264.344	1.956	50	0		CDAARO
O=C(Cc1cccc(Cl)c1)NC[C@@]1(O)CCC[NH2+]CC1	ZINC000072174177	176333538	/nfs/dbraw/zinc/33/35/38/176333538.db2.gz	NQOFDJUMAQYEPP-OAHLLOKOSA-N	1	0	296.798	1.503	50	0		CDAARO
[NH3+]CCn1cc(-c2nc(-c3ccsc3)no2)nn1	ZINC000072264974	176352150	/nfs/dbraw/zinc/35/21/50/176352150.db2.gz	IQYDZTSVPQNVBN-UHFFFAOYSA-N	1	0	262.298	1.015	50	0		CDAARO
CC[N@H+](C)C[C@H](C)CNC(=O)[C@H]1CC[C@@H](O)CC1	ZINC000247967515	276307305	/nfs/dbraw/zinc/30/73/05/276307305.db2.gz	BZJNLPRYYFPLBH-UPJWGTAASA-N	1	0	256.390	1.242	50	0		CDAARO
CC(C)(C)OC(=O)N1CC2(C1)OCC[C@H]2CC[NH3+]	ZINC000306136785	277179792	/nfs/dbraw/zinc/17/97/92/277179792.db2.gz	QDFYBBOCEAHFOU-SNVBAGLBSA-N	1	0	256.346	1.361	50	0		CDAARO
CN1c2cc(Cl)ccc2C(=O)NC12CC[NH2+]CC2	ZINC000067172758	277215892	/nfs/dbraw/zinc/21/58/92/277215892.db2.gz	XMSXENOJBZUJCQ-UHFFFAOYSA-N	1	0	265.744	1.599	50	0		CDAARO
COCC[NH2+]CC(=O)N[C@@H]1CCCC[C@@H]1C(C)(C)C	ZINC000092495313	277229531	/nfs/dbraw/zinc/22/95/31/277229531.db2.gz	GTUAQPFNRUCIQJ-QWHCGFSZSA-N	1	0	270.417	1.944	50	0		CDAARO
CNC(=O)N1c2ccc(C)cc2[C@@H]2C[N@@H+](C)CC[C@@H]21	ZINC000002490524	277234683	/nfs/dbraw/zinc/23/46/83/277234683.db2.gz	ZLLYQMRMDBRZGG-JSGCOSHPSA-N	1	0	259.353	1.942	50	0	biogenic	CDAARO
CNc1nc(N2CC[NH+](C)CC2)nc2ccccc21	ZINC000041146716	277305232	/nfs/dbraw/zinc/30/52/32/277305232.db2.gz	VMMHKLBVXJNMEM-UHFFFAOYSA-N	1	0	257.341	1.423	50	0		CDAARO
Cc1ccc([C@@H]([NH2+]CC(=O)NC(N)=O)c2ccccc2)cc1	ZINC000096714511	278845106	/nfs/dbraw/zinc/84/51/06/278845106.db2.gz	LAVCCBLQNRHSQR-INIZCTEOSA-N	1	0	297.358	1.869	50	0		CDAARO
C[C@@H]1OC(=O)[C@H]2[C@@H]1[N@@H+]1CCc3ccccc3[C@@H]1C[C@H]2O	ZINC000020111859	279039016	/nfs/dbraw/zinc/03/90/16/279039016.db2.gz	MPEJFJFZVUSBET-NJEAUENSSA-N	1	0	273.332	1.281	50	0	biogenic	CDAARO
[NH3+][C@@H]1[C@@H]2CC[C@H]1CN(C(=O)C1Cc3ccccc3C1)C2	ZINC000426402114	279681769	/nfs/dbraw/zinc/68/17/69/279681769.db2.gz	VMGDIGAJNSAWFN-MIFYACCESA-N	1	0	270.376	1.597	50	0		CDAARO
O=C1[C@@H]2CC(Cl)=CC[C@@H]2C(=O)N1CC[NH+]1CCCC1	ZINC000100081124	280315913	/nfs/dbraw/zinc/31/59/13/280315913.db2.gz	UHZVARWABQKUTG-NWDGAFQWSA-N	1	0	282.771	1.600	50	0		CDAARO
O=c1c(Br)ccc2n1C[C@@H]1C[NH2+]C[C@H]2C1	ZINC000013519529	280389419	/nfs/dbraw/zinc/38/94/19/280389419.db2.gz	DWDCLEHDNICBMI-JGVFFNPUSA-N	1	0	269.142	1.318	50	0	in-vitro	CDAARO
C[C@H](O)C[N@@H+]1CCN(CCO[C@@H]2CCCC[C@H]2C)C[C@@H]1C	ZINC000252474545	290114041	/nfs/dbraw/zinc/11/40/41/290114041.db2.gz	HJKMFYUHPTUJKZ-LTIDMASMSA-N	1	0	298.471	1.969	50	0		CDAARO
COP(=O)(OC)[C@]1(O)C[C@@H](C)[N@H+](C)C[C@@H]1C	ZINC000031812353	293376618	/nfs/dbraw/zinc/37/66/18/293376618.db2.gz	ANRNCSUBAGMGGV-IVZWLZJFSA-N	1	0	251.263	1.521	50	0		CDAARO
Clc1ccc(-c2nnc(N3CC[NH2+]CC3)o2)cc1	ZINC000020270633	294103169	/nfs/dbraw/zinc/10/31/69/294103169.db2.gz	NWDGGAPPESJYDZ-UHFFFAOYSA-N	1	0	264.716	1.800	50	0		CDAARO
O=C1CC[C@@H]([NH2+]CCCOC2CCCCC2)CCN1	ZINC000534587731	328316263	/nfs/dbraw/zinc/31/62/63/328316263.db2.gz	OACKRXNOVSXZNU-CYBMUJFWSA-N	1	0	268.401	1.984	50	0		CDAARO
CCC[C@@H](CNC(=O)c1n[nH]c(C)c1Cl)[NH+](C)C	ZINC000534590789	328318106	/nfs/dbraw/zinc/31/81/06/328318106.db2.gz	XMZVMAROZRJUBA-VIFPVBQESA-N	1	0	272.780	1.832	50	0		CDAARO
O=C(NC[C@@H]1CC[N@@H+](C2CCCC2)C1)C1(CO)CC1	ZINC000534640024	328335817	/nfs/dbraw/zinc/33/58/17/328335817.db2.gz	BWURPRBQIOQFAH-LBPRGKRZSA-N	1	0	266.385	1.140	50	0		CDAARO
C[C@H](CN1CCCCCC1)[NH2+]CCn1ccnn1	ZINC000534652371	328337814	/nfs/dbraw/zinc/33/78/14/328337814.db2.gz	VHYSUQBWCZETPI-CYBMUJFWSA-N	1	0	251.378	1.132	50	0		CDAARO
C[C@H](CCC(=O)NCC1(CO)CC1)[NH+]1CCCC1	ZINC000534657461	328340784	/nfs/dbraw/zinc/34/07/84/328340784.db2.gz	JGSPZCSEIUSFMP-GFCCVEGCSA-N	1	0	254.374	1.140	50	0		CDAARO
COc1nccnc1NCCCOC1CC[NH+](C)CC1	ZINC000534657526	328340972	/nfs/dbraw/zinc/34/09/72/328340972.db2.gz	XMNWQHPCAMJSMR-UHFFFAOYSA-N	1	0	280.372	1.398	50	0		CDAARO
CN(Cc1[nH]nc2c1CCCCC2)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000534662704	328350245	/nfs/dbraw/zinc/35/02/45/328350245.db2.gz	DQHAHERATSWMHN-ZDUSSCGKSA-N	1	0	274.368	1.165	50	0		CDAARO
COC[C@@H](O)C[NH2+][C@@H](C)[C@H]1COc2ccccc21	ZINC000185576311	323392520	/nfs/dbraw/zinc/39/25/20/323392520.db2.gz	FEMHEBPCTAKINK-GMXVVIOVSA-N	1	0	251.326	1.148	50	0		CDAARO
CCS(=O)(=O)N1CC(C[NH2+][C@H]2CC(C)(C)C[C@H]2C)C1	ZINC000193149905	323527386	/nfs/dbraw/zinc/52/73/86/323527386.db2.gz	IWEPSYGBGODEHS-YPMHNXCESA-N	1	0	288.457	1.682	50	0		CDAARO
C[C@H]1OCC[C@H]1[NH2+]Cc1ccnc(OCC(F)F)c1	ZINC000091411385	482564757	/nfs/dbraw/zinc/56/47/57/482564757.db2.gz	UABMYZZZDSPKFA-MWLCHTKSSA-N	1	0	272.295	1.993	50	0		CDAARO
C[N@H+](CCc1nc2ccccc2[nH]1)Cc1cc(=O)[nH]c(=O)[nH]1	ZINC000670438596	482981541	/nfs/dbraw/zinc/98/15/41/482981541.db2.gz	YCCQIUGUCQIVGG-UHFFFAOYSA-N	1	0	299.334	1.439	50	0		CDAARO
COCC[C@H]1C[N@@H+](C2Cc3ccccc3C2)CCO1	ZINC000670439690	482984758	/nfs/dbraw/zinc/98/47/58/482984758.db2.gz	AXGIXCNFJJXGQK-INIZCTEOSA-N	1	0	261.365	1.891	50	0		CDAARO
Cc1cnc(C[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)cn1	ZINC000670440786	482985584	/nfs/dbraw/zinc/98/55/84/482985584.db2.gz	APPHXCVVJSQUER-LBPRGKRZSA-N	1	0	257.341	1.888	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CCc2nncn2C(C)C)n1	ZINC000670455792	483033937	/nfs/dbraw/zinc/03/39/37/483033937.db2.gz	ZZYHKKXMLOKGDC-ZDUSSCGKSA-N	1	0	290.415	1.893	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1ncc(F)c(OC)n1	ZINC000670458649	483040599	/nfs/dbraw/zinc/04/05/99/483040599.db2.gz	BINTVEGGDNPIMG-SNVBAGLBSA-N	1	0	268.336	1.911	50	0		CDAARO
Cc1[nH]nc2c1C[N@@H+](C1CSCCSC1)CC2	ZINC000670461391	483044774	/nfs/dbraw/zinc/04/47/74/483044774.db2.gz	AQWUOFDDHNCHAY-UHFFFAOYSA-N	1	0	269.439	1.925	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN(Cc2cnccc2Cl)C1	ZINC000670466616	483057085	/nfs/dbraw/zinc/05/70/85/483057085.db2.gz	HQJDIKGIVRCMIQ-GFCCVEGCSA-N	1	0	283.803	1.745	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](c2ncnn2-c2cccnc2)C1	ZINC000670468366	483059595	/nfs/dbraw/zinc/05/95/95/483059595.db2.gz	JHGMCSWCFZMOLA-GFCCVEGCSA-N	1	0	273.340	1.098	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCN(C(=O)Cc2cccs2)C1	ZINC000070172265	524857288	/nfs/dbraw/zinc/85/72/88/524857288.db2.gz	CRYPLHDLLGYSBZ-QWRGUYRKSA-N	1	0	252.383	1.876	50	0		CDAARO
CCO[C@H]1C[N@H+](CCc2cccc(C)n2)C[C@@H]1O	ZINC000220576049	528064314	/nfs/dbraw/zinc/06/43/14/528064314.db2.gz	TZHCFMSOPDSDAS-KBPBESRZSA-N	1	0	250.342	1.014	50	0		CDAARO
CCCO[C@@H]1CCCN(C(=O)[C@@H]2CC[C@H](C[NH3+])O2)CC1	ZINC000261910007	528604381	/nfs/dbraw/zinc/60/43/81/528604381.db2.gz	XLODXKCOCUXVRW-MCIONIFRSA-N	1	0	284.400	1.300	50	0		CDAARO
COc1cc(CC(=O)N2CC[NH2+][C@H]3C[C@H]32)ccc1C	ZINC000952992430	617180299	/nfs/dbraw/zinc/18/02/99/617180299.db2.gz	DNNKSPCAUSNDBR-QWHCGFSZSA-N	1	0	260.337	1.119	50	0		CDAARO
CC[C@@H](C(=O)N(C)Cc1cc(C)on1)[N@H+](C)CC	ZINC000952979247	615366941	/nfs/dbraw/zinc/36/69/41/615366941.db2.gz	ZPOUSNGFBUOMAX-LBPRGKRZSA-N	1	0	253.346	1.672	50	0		CDAARO
O=C(N[C@@H]1C[NH+]2CCC1CC2)c1cccc(CO)c1	ZINC000888095711	617756846	/nfs/dbraw/zinc/75/68/46/617756846.db2.gz	DEMWXYAXGKDAKH-CQSZACIVSA-N	1	0	260.337	1.003	50	0		CDAARO
C[C@H]([NH2+]CCCNc1ccccc1)[C@H]1CN(C)CCN1C	ZINC000888098454	617761256	/nfs/dbraw/zinc/76/12/56/617761256.db2.gz	IZRWISSKDWSCMR-DOTOQJQBSA-N	1	0	290.455	1.713	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1nnc(CN(C)C)o1	ZINC001772701562	1159437356	/nfs/dbraw/zinc/43/73/56/1159437356.db2.gz	NZEGGCHULKIWFH-LLVKDONJSA-N	1	0	267.377	1.418	50	0		CDAARO
CN(C[C@H]1Cc2ccccc2C[N@@H+]1C)c1nnc(CN)o1	ZINC001772704025	1159439703	/nfs/dbraw/zinc/43/97/03/1159439703.db2.gz	BFWXLYALUXCVHE-CYBMUJFWSA-N	1	0	287.367	1.021	50	0		CDAARO
CCCc1cnc(C)nc1NC[C@@H](O)C[NH+](C)C	ZINC001704316153	1177686662	/nfs/dbraw/zinc/68/66/62/1177686662.db2.gz	XUIVQKMBZWWCTC-GFCCVEGCSA-N	1	0	252.362	1.072	50	0		CDAARO
[NH3+]CCN(C(=O)NC1CCCC1)C1CCOCC1	ZINC000675020617	899875472	/nfs/dbraw/zinc/87/54/72/899875472.db2.gz	ZVWINDJERIIVCD-UHFFFAOYSA-N	1	0	255.362	1.078	50	0		CDAARO
Cc1csc2c1ncn(CCCCC[NH3+])c2=O	ZINC000032553557	901189667	/nfs/dbraw/zinc/18/96/67/901189667.db2.gz	NSAFOQDNSXLQLI-UHFFFAOYSA-N	1	0	251.355	1.895	50	0		CDAARO
O=C([O-])c1ccccc1C[N@H+]1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000426712576	902909048	/nfs/dbraw/zinc/90/90/48/902909048.db2.gz	FAYFFYVZYKGOTR-NMWPEEMBSA-N	1	0	272.348	1.567	50	0		CDAARO
C[C@H]([NH2+]CCN1CCc2ccccc2C1=O)c1ncc[nH]1	ZINC000952845592	910405620	/nfs/dbraw/zinc/40/56/20/910405620.db2.gz	YVSOSSVGZCQVND-LBPRGKRZSA-N	1	0	284.363	1.759	50	0		CDAARO
COCC[N@H+](C)CCC(=O)N(C)Cc1sccc1C	ZINC000952873059	910429635	/nfs/dbraw/zinc/42/96/35/910429635.db2.gz	FNVIIUNMMZKCCS-UHFFFAOYSA-N	1	0	284.425	1.983	50	0		CDAARO
C[C@H](CCn1cccn1)[NH2+]C1CC(O)(C(F)(F)F)C1	ZINC000952883062	910452897	/nfs/dbraw/zinc/45/28/97/910452897.db2.gz	MJKJLZNCDYGIGF-KPPDAEKUSA-N	1	0	277.290	1.707	50	0		CDAARO
OC[C@H]1CCCCN1CC[NH2+]Cc1cccc(O)c1	ZINC000952971857	910510874	/nfs/dbraw/zinc/51/08/74/910510874.db2.gz	GMRNYCABTXYOEJ-CQSZACIVSA-N	1	0	264.369	1.329	50	0		CDAARO
COc1ncccc1CN(CC[NH+](C)C)C[C@H]1CCCO1	ZINC000952975824	910521950	/nfs/dbraw/zinc/52/19/50/910521950.db2.gz	XOZZVHBLZMOOBZ-OAHLLOKOSA-N	1	0	293.411	1.633	50	0		CDAARO
Cc1nc(CNCCC[N@@H+]2CCC[C@@H](CO)C2)n(C)c1C	ZINC000952986810	910553183	/nfs/dbraw/zinc/55/31/83/910553183.db2.gz	BEDZKOFGEKGPRX-OAHLLOKOSA-N	1	0	294.443	1.221	50	0		CDAARO
C[NH+](C)CC1(CO)CCN(C(=O)[C@@H]2CC2(C)C)CC1	ZINC000952989322	910557760	/nfs/dbraw/zinc/55/77/60/910557760.db2.gz	UQARXOPVZXHXIE-LBPRGKRZSA-N	1	0	268.401	1.195	50	0		CDAARO
Cn1cncc1C[NH+]1CCC(CNC(=O)C2CCC2)CC1	ZINC000827716921	925958233	/nfs/dbraw/zinc/95/82/33/925958233.db2.gz	DAEQWCYRFZTGKB-UHFFFAOYSA-N	1	0	290.411	1.548	50	0		CDAARO
O[C@@H]1CCC[N@H+](CCCNc2nccc3cccnc32)C1	ZINC000828627375	926151135	/nfs/dbraw/zinc/15/11/35/926151135.db2.gz	IVAMXKDZZJXPBM-CQSZACIVSA-N	1	0	286.379	1.889	50	0		CDAARO
Cc1cnn(CC(=O)NCCn2c(C)c[nH+]c2C2CC2)c1	ZINC000581813091	927204089	/nfs/dbraw/zinc/20/40/89/927204089.db2.gz	YXDQYECYNOUMKF-UHFFFAOYSA-N	1	0	287.367	1.390	50	0		CDAARO
Cc1nccn1CCC[N@@H+](C)[C@H](C)Cc1cnccn1	ZINC000243957106	937588549	/nfs/dbraw/zinc/58/85/49/937588549.db2.gz	CFUJSFQODVUYIW-CYBMUJFWSA-N	1	0	273.384	1.935	50	0		CDAARO
CC(C)[C@@H](CCO)NC(=O)C(C)(C)[NH+]1CCCCC1	ZINC000863948073	934309525	/nfs/dbraw/zinc/30/95/25/934309525.db2.gz	ALDIARZLFBPACJ-CYBMUJFWSA-N	1	0	270.417	1.774	50	0		CDAARO
CC(C)Cn1cncc1CN1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC001529178069	969004222	/nfs/dbraw/zinc/00/42/22/969004222.db2.gz	HDKGEAOCUMYCHT-GEEKYZPCSA-N	1	0	274.412	1.721	50	0		CDAARO
Cc1c[nH+]ccc1NCCNc1ncc(F)c(N(C)C)n1	ZINC001529186302	969006143	/nfs/dbraw/zinc/00/61/43/969006143.db2.gz	BLVSNNITJIUJEU-UHFFFAOYSA-N	1	0	290.346	1.331	50	0		CDAARO
Cc1ccnn1CCN1CC[NH+](CC2CCCC2)CC1	ZINC001506397852	975147883	/nfs/dbraw/zinc/14/78/83/975147883.db2.gz	XUPYECXESPJOFE-UHFFFAOYSA-N	1	0	276.428	1.999	50	0		CDAARO
Cc1ccc(NC(C)(C)C(=O)NC[C@]2(O)CC[NH2+]C2)cc1	ZINC001506399400	975148877	/nfs/dbraw/zinc/14/88/77/975148877.db2.gz	NBKKTLDRVDVFQZ-INIZCTEOSA-N	1	0	291.395	1.026	50	0		CDAARO
C[C@H](Cn1cncn1)[NH2+]C1CCN(Cc2ccco2)CC1	ZINC001506401674	975150362	/nfs/dbraw/zinc/15/03/62/975150362.db2.gz	NMWMEUNOJLHSLJ-CYBMUJFWSA-N	1	0	289.383	1.514	50	0		CDAARO
COCc1cc(C[NH2+][C@@H]2CCN(c3ccccc3)C2)[nH]n1	ZINC001506427048	975160798	/nfs/dbraw/zinc/16/07/98/975160798.db2.gz	JZLFTJCVNKGWKF-CYBMUJFWSA-N	1	0	286.379	1.925	50	0		CDAARO
C[NH+](C)CCN1C(=O)c2cccc3cccc(c32)C1=O	ZINC000004071506	230368556	/nfs/dbraw/zinc/36/85/56/230368556.db2.gz	AZFCDSPUTDVZDH-UHFFFAOYSA-N	1	0	268.316	1.997	50	0		CDAARO
NC(=O)[C@H]1CCCC[C@@H]1[NH2+]Cc1nc2c(s1)CCC2	ZINC000097375105	342002799	/nfs/dbraw/zinc/00/27/99/342002799.db2.gz	UCNUUPGJDPIZHZ-UWVGGRQHSA-N	1	0	279.409	1.766	50	0		CDAARO
Cc1cc([C@@H]2CCC[N@@H+]([C@@H]3CCN(C)C3=O)C2)[nH]n1	ZINC000084110860	539086199	/nfs/dbraw/zinc/08/61/99/539086199.db2.gz	WOQNZAFQRHURBK-DGCLKSJQSA-N	1	0	262.357	1.128	50	0		CDAARO
CN(C)c1nccc(N(C)C[C@H]2CCC[N@H+](C)C2)n1	ZINC000095960970	185043920	/nfs/dbraw/zinc/04/39/20/185043920.db2.gz	CCVUINKXRBNBAB-LBPRGKRZSA-N	1	0	263.389	1.321	50	0		CDAARO
COCCN1CCC[C@@H]1C[NH2+][C@H](C)c1cncc(F)c1	ZINC000095967647	185047223	/nfs/dbraw/zinc/04/72/23/185047223.db2.gz	UREMEBPFEBQKGD-IUODEOHRSA-N	1	0	281.375	1.982	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N(C)[C@H]1CCC[C@@H]1SC	ZINC000095971184	185048420	/nfs/dbraw/zinc/04/84/20/185048420.db2.gz	UWBOVYWDRFBPHV-DCAQKATOSA-N	1	0	276.471	1.809	50	0		CDAARO
C[N@@H+]1CC[C@H]2CCN(C(=O)c3cc(C4CC4)on3)[C@@H]2C1	ZINC000240333282	361746183	/nfs/dbraw/zinc/74/61/83/361746183.db2.gz	FCSOOITZNUIIQC-GXFFZTMASA-N	1	0	275.352	1.718	50	0		CDAARO
C[N@@H+]1CC[C@H]2CCN(C(=O)c3cc(C4CC4)on3)[C@H]2C1	ZINC000240333281	361746301	/nfs/dbraw/zinc/74/63/01/361746301.db2.gz	FCSOOITZNUIIQC-GWCFXTLKSA-N	1	0	275.352	1.718	50	0		CDAARO
C[C@]1(O)CC[N@H+](Cc2ccc(-n3ccnc3)cc2)C[C@@H]1O	ZINC000096147916	185106917	/nfs/dbraw/zinc/10/69/17/185106917.db2.gz	QLLPCBHIHKCULB-HOTGVXAUSA-N	1	0	287.363	1.190	50	0		CDAARO
C[C@H](CNC(=O)[C@H]1C[C@H]1c1ccccc1F)[NH+](C)C	ZINC000252517135	361848597	/nfs/dbraw/zinc/84/85/97/361848597.db2.gz	AQMPYSMONIEUKG-WXHSDQCUSA-N	1	0	264.344	1.996	50	0		CDAARO
Nc1nc(NCCCc2ccco2)cc([C@H]2C[C@@H](O)C2)[nH+]1	ZINC000244574810	361853815	/nfs/dbraw/zinc/85/38/15/361853815.db2.gz	CRWATUGDCQZERY-PHIMTYICSA-N	1	0	288.351	1.935	50	0		CDAARO
CSCc1noc(CN2CCC[C@H]([NH+](C)C)CC2)n1	ZINC000244659662	361854924	/nfs/dbraw/zinc/85/49/24/361854924.db2.gz	HGQHZABKEVLMCG-NSHDSACASA-N	1	0	284.429	1.849	50	0		CDAARO
Oc1cccc([C@H]2CN(C[C@H]3CCCO3)CCO2)c1	ZINC000252487527	361844995	/nfs/dbraw/zinc/84/49/95/361844995.db2.gz	YTOYCBPIHGCJMF-HUUCEWRRSA-N	1	0	263.337	1.945	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CN(CCO)Cc1nccs1	ZINC000244763991	361861508	/nfs/dbraw/zinc/86/15/08/361861508.db2.gz	OZGANXDOUYJDLH-LBPRGKRZSA-N	1	0	269.414	1.422	50	0		CDAARO
C[C@H](Cc1cnccn1)[N@H+](C)CCC(=O)Nc1cccnc1	ZINC000244787685	361863757	/nfs/dbraw/zinc/86/37/57/361863757.db2.gz	QBPVXGSAGFYYKF-CYBMUJFWSA-N	1	0	299.378	1.763	50	0		CDAARO
C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)C[C@H]1CSCCS1	ZINC000245339213	539041490	/nfs/dbraw/zinc/04/14/90/539041490.db2.gz	RFGFFKOVVZHFNM-TUAOUCFPSA-N	1	0	288.482	1.776	50	0		CDAARO
C[C@H](NC(=O)[C@@H]1C[C@H](O)C[NH2+]1)c1ccc(C(C)(C)C)cc1	ZINC000037007482	539082955	/nfs/dbraw/zinc/08/29/55/539082955.db2.gz	WEGAQGJCAJBCGM-CQDKDKBSSA-N	1	0	290.407	1.884	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@H]1C[N@@H+](C)C[C@H]1C	ZINC000257366050	539096219	/nfs/dbraw/zinc/09/62/19/539096219.db2.gz	HNXHOIFUTIJZKW-PWSUYJOCSA-N	1	0	286.372	1.363	50	0		CDAARO
CN1C[C@]2(CC[N@H+](Cc3ccsc3)C2)OCC1=O	ZINC000670441526	539114254	/nfs/dbraw/zinc/11/42/54/539114254.db2.gz	OCXYODHPPRIKMR-ZDUSSCGKSA-N	1	0	266.366	1.181	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1cccc(Oc2cnccn2)c1	ZINC000125708209	187197101	/nfs/dbraw/zinc/19/71/01/187197101.db2.gz	OOFPOYDZPZHEAA-LBPRGKRZSA-N	1	0	298.346	1.703	50	0		CDAARO
Cn1cccc1C(=O)N1CCCN(c2cc[nH+]cc2)CC1	ZINC000585129876	362061165	/nfs/dbraw/zinc/06/11/65/362061165.db2.gz	ANCNCAWOKPFPAT-UHFFFAOYSA-N	1	0	284.363	1.773	50	0		CDAARO
COCC(=O)N[C@@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000036396637	362064217	/nfs/dbraw/zinc/06/42/17/362064217.db2.gz	USKIETSXNSZZAU-CQSZACIVSA-N	1	0	262.353	1.414	50	0		CDAARO
COc1cccc([C@H](C)[NH2+][C@@H](C)C(=O)N[C@H]2CCOC2)c1	ZINC000252585607	342385803	/nfs/dbraw/zinc/38/58/03/342385803.db2.gz	JUKDHODNBFBQFD-OBJOEFQTSA-N	1	0	292.379	1.639	50	0		CDAARO
COC(C)(C)C[C@H](C)[NH2+][C@H]1CCCC[C@H]1C(N)=O	ZINC000253370948	342416388	/nfs/dbraw/zinc/41/63/88/342416388.db2.gz	YQECQZLYZUSYRN-TUAOUCFPSA-N	1	0	256.390	1.824	50	0		CDAARO
C[NH2+]C1CCN(C(=O)[C@@H](C)n2nc(C)cc2C)CC1	ZINC000179144963	362252324	/nfs/dbraw/zinc/25/23/24/362252324.db2.gz	MMCRAYUQQYPYLN-GFCCVEGCSA-N	1	0	264.373	1.271	50	0		CDAARO
Cc1ccc(OCCC(=O)N(C)[C@H]2CC[NH2+]C2)c(C)c1	ZINC000179089197	362253884	/nfs/dbraw/zinc/25/38/84/362253884.db2.gz	FUVLQRGQNCDCGU-AWEZNQCLSA-N	1	0	276.380	1.893	50	0		CDAARO
C[C@H](CC[NH+](C)C)NC(=O)Nc1ccc(N(C)C)nc1	ZINC000084637212	362269089	/nfs/dbraw/zinc/26/90/89/362269089.db2.gz	ODVZZWJABCAMPS-LLVKDONJSA-N	1	0	279.388	1.609	50	0		CDAARO
CC[C@@H](C)[N@H+](C)CCNC(=O)N(C)CC(F)F	ZINC000084721822	362270983	/nfs/dbraw/zinc/27/09/83/362270983.db2.gz	MEGNKMCHELTBEF-SECBINFHSA-N	1	0	251.321	1.623	50	0		CDAARO
[NH3+][C@H]1C[C@@H](c2cc(NCCc3cc[nH]n3)ncn2)C1	ZINC000252540334	362391515	/nfs/dbraw/zinc/39/15/15/362391515.db2.gz	PDOWXHOSKLFKIQ-AOOOYVTPSA-N	1	0	258.329	1.059	50	0		CDAARO
CC1(CNC(=O)[C@@H]2OCCc3ccccc32)CC[NH2+]CC1	ZINC000129103460	362515037	/nfs/dbraw/zinc/51/50/37/362515037.db2.gz	ZGABSHMZPWRVFE-OAHLLOKOSA-N	1	0	288.391	1.806	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CCNC(=O)c1[nH]nc(N)c1Cl	ZINC000230590637	345084655	/nfs/dbraw/zinc/08/46/55/345084655.db2.gz	GEUJXEMFLKKZLK-QMMMGPOBSA-N	1	0	285.779	1.250	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(C(=O)NCC[C@H]2CCCO2)C1	ZINC000129430319	345576778	/nfs/dbraw/zinc/57/67/78/345576778.db2.gz	DFOWEIOKSNEEQC-QWHCGFSZSA-N	1	0	269.389	1.149	50	0		CDAARO
CC1CC[NH+](Cc2ccccc2CNC(=O)CO)CC1	ZINC000192099659	362611507	/nfs/dbraw/zinc/61/15/07/362611507.db2.gz	SUCAMGTYXFHYTQ-UHFFFAOYSA-N	1	0	276.380	1.527	50	0		CDAARO
COc1cc(C)sc1C(=O)N[C@@H]1CCC[NH2+]C1	ZINC000097570956	185628677	/nfs/dbraw/zinc/62/86/77/185628677.db2.gz	ABOJBDMWSLDGDH-SECBINFHSA-N	1	0	254.355	1.547	50	0		CDAARO
C[C@H](NC(=O)N1CCC[C@@H]1CO)C(C)(C)C[NH+](C)C	ZINC000085424371	179059723	/nfs/dbraw/zinc/05/97/23/179059723.db2.gz	NQDTUKJJCJOACV-NWDGAFQWSA-N	1	0	271.405	1.129	50	0		CDAARO
O[C@H](C[NH+]1CCN(Cc2ccccc2F)CC1)C1CC1	ZINC000085436864	179063156	/nfs/dbraw/zinc/06/31/56/179063156.db2.gz	KIKYIBRIWGBIET-MRXNPFEDSA-N	1	0	278.371	1.714	50	0		CDAARO
COc1cc(CN2CC[NH+](C[C@@H](C)O)CC2)cc(OC)c1	ZINC000085436924	179063810	/nfs/dbraw/zinc/06/38/10/179063810.db2.gz	DGDSTLFFWIZXNP-CYBMUJFWSA-N	1	0	294.395	1.202	50	0		CDAARO
CS(=O)(=O)CCOCC[NH2+][C@H]1CCCc2occc21	ZINC000193008082	362753036	/nfs/dbraw/zinc/75/30/36/362753036.db2.gz	FXFSOKMNKNVCKJ-LBPRGKRZSA-N	1	0	287.381	1.308	50	0		CDAARO
CCn1cc([C@H]2OCC[C@@H]2C[NH2+]C2CCOCC2)cn1	ZINC000089305951	346755794	/nfs/dbraw/zinc/75/57/94/346755794.db2.gz	CKMDKBBQNOVWAU-DOMZBBRYSA-N	1	0	279.384	1.749	50	0		CDAARO
CCNC(=O)CC[N@@H+]1CCc2c(nc(C3CC3)n2C)C1	ZINC000089977399	347630439	/nfs/dbraw/zinc/63/04/39/347630439.db2.gz	WAIMUVVZBPJMGK-UHFFFAOYSA-N	1	0	276.384	1.182	50	0		CDAARO
O=S1(=O)CC[C@@H]([NH2+]C2CCN(Cc3ccco3)CC2)C1	ZINC000584896267	349357286	/nfs/dbraw/zinc/35/72/86/349357286.db2.gz	XUPOWCYOBFXBJO-CYBMUJFWSA-N	1	0	298.408	1.021	50	0		CDAARO
Cc1[nH]ccc1C(=O)N1CC[N@@H+](CC(C)C)[C@H](CCO)C1	ZINC000584886663	349344758	/nfs/dbraw/zinc/34/47/58/349344758.db2.gz	KTPWCUGHDOEFRS-CQSZACIVSA-N	1	0	293.411	1.488	50	0		CDAARO
Cn1ccnc1SCC(=O)N[C@@H]1CC[N@@H+](C(C)(C)C)C1	ZINC000584889012	349347968	/nfs/dbraw/zinc/34/79/68/349347968.db2.gz	ZCEMHLUTYBBCCY-LLVKDONJSA-N	1	0	296.440	1.501	50	0		CDAARO
CCC[N@@H+]1CC[C@H](Cn2cnc3cccnc3c2=O)C1	ZINC000584891241	349350268	/nfs/dbraw/zinc/35/02/68/349350268.db2.gz	YIXILDHKUQNRAM-LBPRGKRZSA-N	1	0	272.352	1.523	50	0		CDAARO
CC[N@@H+]1CC[C@@H](C(=O)N2CCC(CCCOC)CC2)C1	ZINC000584897539	349358730	/nfs/dbraw/zinc/35/87/30/349358730.db2.gz	YDORDUVRSVBKNH-OAHLLOKOSA-N	1	0	282.428	1.993	50	0		CDAARO
C[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cnc(N)s1)C2	ZINC000584897556	349358778	/nfs/dbraw/zinc/35/87/78/349358778.db2.gz	JRUOPQLLDLNLCX-CYBMUJFWSA-N	1	0	280.397	1.114	50	0		CDAARO
Cc1cc(=O)c(C(=O)N(C)C[C@@H]2CCC[N@H+](C)C2)cn1C	ZINC000584899082	349360322	/nfs/dbraw/zinc/36/03/22/349360322.db2.gz	UNZYWYXUKPHZKJ-CYBMUJFWSA-N	1	0	291.395	1.108	50	0		CDAARO
O=C(NCc1ccc2[nH]cnc2c1)[C@H]1CC12CC[NH2+]CC2	ZINC000584900260	349362097	/nfs/dbraw/zinc/36/20/97/349362097.db2.gz	WOUIYUUMYKAUEI-GFCCVEGCSA-N	1	0	284.363	1.569	50	0		CDAARO
Cc1cccc(S(=O)(=O)N[C@H]2CCC[NH2+][C@H]2C)c1	ZINC000091496963	180172696	/nfs/dbraw/zinc/17/26/96/180172696.db2.gz	OYPFHDCQEYMPRI-AAEUAGOBSA-N	1	0	268.382	1.414	50	0		CDAARO
Cc1[nH+]c(N)nc(NCCCN2CCCC2=O)c1C	ZINC000091416820	180149601	/nfs/dbraw/zinc/14/96/01/180149601.db2.gz	NPLYYRBVXGNTDN-UHFFFAOYSA-N	1	0	263.345	1.100	50	0		CDAARO
COCCC[N@@H+]1CC[C@H](CNc2ncccn2)C1	ZINC000091562710	180192802	/nfs/dbraw/zinc/19/28/02/180192802.db2.gz	RWZQEKBRBTVRKE-GFCCVEGCSA-N	1	0	250.346	1.247	50	0		CDAARO
CCC[C@H]1CN(c2ccc(CS(C)(=O)=O)cn2)C[C@@H]1[NH3+]	ZINC000091691737	180227165	/nfs/dbraw/zinc/22/71/65/180227165.db2.gz	PSFJWCWBUTUKOP-STQMWFEESA-N	1	0	297.424	1.190	50	0		CDAARO
CC[C@H](O)Cn1ncnc1CC1CC[NH+](C(C)C)CC1	ZINC000091847449	180271107	/nfs/dbraw/zinc/27/11/07/180271107.db2.gz	VTPUAOMQNSCTLE-AWEZNQCLSA-N	1	0	280.416	1.712	50	0		CDAARO
COc1ccccc1C[N@H+](C)C[C@@H]1CCN(C(C)=O)C1	ZINC000092101493	180325930	/nfs/dbraw/zinc/32/59/30/180325930.db2.gz	XYYVIHHIPWABBG-AWEZNQCLSA-N	1	0	276.380	1.995	50	0		CDAARO
CC[C@H]1CN(CCOCC(F)(F)F)CC[N@@H+]1C[C@H](C)O	ZINC000106906895	186149852	/nfs/dbraw/zinc/14/98/52/186149852.db2.gz	RFJVCGJXFWMMMM-RYUDHWBXSA-N	1	0	298.349	1.342	50	0		CDAARO
CC[C@@H]1CN(Cc2nnc(C3CC3)o2)CC[N@@H+]1C[C@H](C)O	ZINC000106929219	186152756	/nfs/dbraw/zinc/15/27/56/186152756.db2.gz	XKVJJDMXIJLJPA-WCQYABFASA-N	1	0	294.399	1.224	50	0		CDAARO
c1ccn2c(c1)nnc2C[NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCC2	ZINC000108176375	186208080	/nfs/dbraw/zinc/20/80/80/186208080.db2.gz	HAJSXVJANHZYEY-NILFDRSVSA-N	1	0	284.363	1.777	50	0		CDAARO
O=C(c1ncccc1O)N1CC[C@H]([NH+]2CCCCC2)C1	ZINC000110325616	186292018	/nfs/dbraw/zinc/29/20/18/186292018.db2.gz	IUCPGPQRJUBBGT-LBPRGKRZSA-N	1	0	275.352	1.488	50	0		CDAARO
CC(=O)N1CCN([C@@H]2C[N@@H+](CC3CCC3)C[C@@H]2C)CC1	ZINC000257365970	350963296	/nfs/dbraw/zinc/96/32/96/350963296.db2.gz	DLZPENQESHEACN-XJKSGUPXSA-N	1	0	279.428	1.271	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1nnc(C2(C)CC2)o1	ZINC000583652092	366020113	/nfs/dbraw/zinc/02/01/13/366020113.db2.gz	ZLKSPLGJLQVYRN-UHFFFAOYSA-N	1	0	266.345	1.193	50	0		CDAARO
Cc1onc(-c2ccccc2)c1C(=O)N1CC[NH2+]CC1	ZINC000000158506	355892870	/nfs/dbraw/zinc/89/28/70/355892870.db2.gz	NBGCHQLIKVQRSF-UHFFFAOYSA-N	1	0	271.320	1.695	50	0		CDAARO
C[N@@H+]1CCC[C@@H](OC(=O)COc2ccc(F)cc2)C1	ZINC000000249839	355899411	/nfs/dbraw/zinc/89/94/11/355899411.db2.gz	JJVMNOUACCFPSQ-CYBMUJFWSA-N	1	0	267.300	1.842	50	0		CDAARO
CC[NH2+][C@@H](C)c1nc2ccccc2c(=O)n1CCOC	ZINC000005091540	356049499	/nfs/dbraw/zinc/04/94/99/356049499.db2.gz	VKHOEPKMLBSPHI-NSHDSACASA-N	1	0	275.352	1.713	50	0		CDAARO
O=C1c2ccccc2C(=O)N1OCC[n+]1ccccc1	ZINC000002699752	356097520	/nfs/dbraw/zinc/09/75/20/356097520.db2.gz	WHFIIDNGQDTUGP-UHFFFAOYSA-N	1	0	269.280	1.202	50	0		CDAARO
Cn1ccnc1CN1CCC[C@@H]([NH+]2CCC(CO)CC2)C1	ZINC000022851150	356227124	/nfs/dbraw/zinc/22/71/24/356227124.db2.gz	CIEDEPJPUAWNRQ-OAHLLOKOSA-N	1	0	292.427	1.089	50	0		CDAARO
Cn1nnnc1SCC[NH2+]CC1CCCCC1	ZINC000010475066	356259075	/nfs/dbraw/zinc/25/90/75/356259075.db2.gz	OJRPBNSRLKGINS-UHFFFAOYSA-N	1	0	255.391	1.472	50	0		CDAARO
C[NH+](C)CC[C@@H]1CN(C(=O)c2ccsc2)CCO1	ZINC000012207580	356291367	/nfs/dbraw/zinc/29/13/67/356291367.db2.gz	CBWSOINBVYXJSS-GFCCVEGCSA-N	1	0	268.382	1.541	50	0		CDAARO
C[NH+](C)CC[C@H]1CN(C(=O)c2ccsc2)CCO1	ZINC000012207587	356291399	/nfs/dbraw/zinc/29/13/99/356291399.db2.gz	CBWSOINBVYXJSS-LBPRGKRZSA-N	1	0	268.382	1.541	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@H]([NH3+])c1ccc2c(c1)OCO2	ZINC000012357114	356294854	/nfs/dbraw/zinc/29/48/54/356294854.db2.gz	SPSZUBZMVYTJJF-JTQLQIEISA-N	1	0	280.324	1.940	50	0		CDAARO
CC[NH+](CC)CCNC(=O)C(=O)Nc1cccc(F)c1	ZINC000004583706	356432785	/nfs/dbraw/zinc/43/27/85/356432785.db2.gz	CZNKIDOYVZWZNX-UHFFFAOYSA-N	1	0	281.331	1.222	50	0		CDAARO
OCC[NH+]1CCN(Cc2ccccc2Br)CC1	ZINC000019607174	356493228	/nfs/dbraw/zinc/49/32/28/356493228.db2.gz	ILEMZYNLJOTXSH-UHFFFAOYSA-N	1	0	299.212	1.559	50	0		CDAARO
COc1ccccc1/C=C/CN1CC[NH+](CCO)CC1	ZINC000019634672	356494190	/nfs/dbraw/zinc/49/41/90/356494190.db2.gz	WCQSWRRSLAZTJM-GQCTYLIASA-N	1	0	276.380	1.318	50	0		CDAARO
CN(C)C(=O)Oc1ccccc1CN1CC[NH+](C)CC1	ZINC000019799263	356505633	/nfs/dbraw/zinc/50/56/33/356505633.db2.gz	UVORYNRMPAXPTO-UHFFFAOYSA-N	1	0	277.368	1.494	50	0		CDAARO
Cc1cc(C)c(OC[C@H](O)CN2CC[NH+](C)CC2)c(C)c1	ZINC000022027223	356598074	/nfs/dbraw/zinc/59/80/74/356598074.db2.gz	GFPXUMPZAWMVKJ-MRXNPFEDSA-N	1	0	292.423	1.599	50	0		CDAARO
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C[NH3+])cc1	ZINC000022161900	356603785	/nfs/dbraw/zinc/60/37/85/356603785.db2.gz	LLJIOVQMEOKVCQ-NSHDSACASA-N	1	0	268.382	1.708	50	0		CDAARO
CC(C)(C)OC(=O)NCCC[C@@H]([NH3+])[C@H](O)C(F)(F)F	ZINC000034537887	363531181	/nfs/dbraw/zinc/53/11/81/363531181.db2.gz	UHEFDJGMLCIEND-SFYZADRCSA-N	1	0	286.294	1.542	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@@H](CO)C2)c(OC)c1OC	ZINC000023114941	356628553	/nfs/dbraw/zinc/62/85/53/356628553.db2.gz	GXDUQGITFQVULU-GFCCVEGCSA-N	1	0	295.379	1.917	50	0		CDAARO
CC[N@H+](CCN1C(=O)NC(C)(C)C1=O)Cc1ccccc1	ZINC000024747700	356661251	/nfs/dbraw/zinc/66/12/51/356661251.db2.gz	DZGWVAQGICIWRI-UHFFFAOYSA-N	1	0	289.379	1.839	50	0		CDAARO
C[C@H](NC(=O)c1ccc(-n2ccnc2)nc1)C1CC1	ZINC000025595403	356678997	/nfs/dbraw/zinc/67/89/97/356678997.db2.gz	RRYJMFSTNLBAHR-JTQLQIEISA-N	1	0	256.309	1.796	50	0		CDAARO
NC(=O)[C@H]([NH2+]C[C@H]1Cc2ccccc2O1)c1ccccc1	ZINC000027032837	356703287	/nfs/dbraw/zinc/70/32/87/356703287.db2.gz	OGHGNCJYECCLBI-GDBMZVCRSA-N	1	0	282.343	1.806	50	0		CDAARO
Cc1cc(NC(=O)NC[C@H]2C[N@H+](CC(C)C)CCO2)no1	ZINC000029077250	356729870	/nfs/dbraw/zinc/72/98/70/356729870.db2.gz	VCOBUPNLGBVRQG-LBPRGKRZSA-N	1	0	296.371	1.461	50	0		CDAARO
COc1cc(N)c(Cl)cc1C(=O)NCC1CC[NH2+]CC1	ZINC000033967579	356810036	/nfs/dbraw/zinc/81/00/36/356810036.db2.gz	YBUGDJUVZUNIRB-UHFFFAOYSA-N	1	0	297.786	1.660	50	0		CDAARO
O=S(=O)(c1cc(Cl)ccc1Cl)N1CCNCC1	ZINC000034781224	356820558	/nfs/dbraw/zinc/82/05/58/356820558.db2.gz	OZYYUZYHDXJSPP-UHFFFAOYSA-N	1	0	295.191	1.587	50	0		CDAARO
[NH3+]CC(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000037822422	356935603	/nfs/dbraw/zinc/93/56/03/356935603.db2.gz	VOIYSFDFEDLQOL-LLVKDONJSA-N	1	0	254.717	1.199	50	0		CDAARO
CC(C)=CC[N@@H+]1CCN(Cc2cc(C)n[nH]2)C[C@H]1CCO	ZINC000039466366	356973362	/nfs/dbraw/zinc/97/33/62/356973362.db2.gz	YFHIGPYGFPHRQM-MRXNPFEDSA-N	1	0	292.427	1.553	50	0		CDAARO
COc1cc(COC[C@H]2CC[NH2+]C2)cc(OC)c1	ZINC000042774056	357079516	/nfs/dbraw/zinc/07/95/16/357079516.db2.gz	OTOZBNAEAYZJFO-NSHDSACASA-N	1	0	251.326	1.830	50	0		CDAARO
C[NH+]1CCC(NC(=O)COc2cccc(Cl)c2)CC1	ZINC000061031493	357448784	/nfs/dbraw/zinc/44/87/84/357448784.db2.gz	WAUWMRWMDWDWSW-UHFFFAOYSA-N	1	0	282.771	1.929	50	0		CDAARO
Cc1c[nH+]ccc1-n1nc(C2CC2)nc1CN1CCOC1=O	ZINC000065423925	357540520	/nfs/dbraw/zinc/54/05/20/357540520.db2.gz	DGHSVDRDIVSMDJ-UHFFFAOYSA-N	1	0	299.334	1.800	50	0		CDAARO
C[N@@H+](Cc1ccccc1)C[C@H]1CCCN(CCO)C1	ZINC000065460517	357543481	/nfs/dbraw/zinc/54/34/81/357543481.db2.gz	XOQZAUJMTLVLIL-MRXNPFEDSA-N	1	0	262.397	1.823	50	0		CDAARO
O=C1C[C@H]2CC[C@@H](CN1)[N@@H+]2Cc1cccc2nsnc21	ZINC000065508295	357547155	/nfs/dbraw/zinc/54/71/55/357547155.db2.gz	GBZBKUPOQHTFIC-MNOVXSKESA-N	1	0	288.376	1.544	50	0		CDAARO
O=C(NC1CC1)c1ccc(OC[C@H]2CCC[NH2+]2)cc1	ZINC000066323515	357562022	/nfs/dbraw/zinc/56/20/22/357562022.db2.gz	OASWAUFWLHENJR-CYBMUJFWSA-N	1	0	260.337	1.710	50	0		CDAARO
COc1cccc(OCC(=O)NC[C@H]2CCC[N@H+](C)C2)c1	ZINC000067604972	357614047	/nfs/dbraw/zinc/61/40/47/357614047.db2.gz	SXNXFKZHDJABQB-CYBMUJFWSA-N	1	0	292.379	1.532	50	0		CDAARO
C[C@H]([NH3+])C(=O)NCc1cccnc1N(C)Cc1ccccc1	ZINC000067967033	357641029	/nfs/dbraw/zinc/64/10/29/357641029.db2.gz	YPJRMXOVRBZFLQ-ZDUSSCGKSA-N	1	0	298.390	1.681	50	0		CDAARO
[NH3+][C@@H]1CCC[C@@H]1C(=O)N1CCO[C@H](c2cccc(F)c2)C1	ZINC000299740216	357700157	/nfs/dbraw/zinc/70/01/57/357700157.db2.gz	XCAGIQKYGQNJNR-ZNMIVQPWSA-N	1	0	292.354	1.853	50	0		CDAARO
CCc1cc(N2CC[N@@H+]3CCCC[C@@H]3C2)n2nccc2n1	ZINC000072421303	357749885	/nfs/dbraw/zinc/74/98/85/357749885.db2.gz	GNMJPRQHZGGWDA-CQSZACIVSA-N	1	0	285.395	1.966	50	0		CDAARO
Fc1ccccc1CCNc1ncnc2c1CC[NH2+]CC2	ZINC000072425996	357834861	/nfs/dbraw/zinc/83/48/61/357834861.db2.gz	YWBQEEHIWDRLIH-UHFFFAOYSA-N	1	0	286.354	1.959	50	0		CDAARO
COCc1cc(NCC[NH+]2CCCCC2)n2nccc2n1	ZINC000072432832	357835269	/nfs/dbraw/zinc/83/52/69/357835269.db2.gz	KTLYRKFQJSZERR-UHFFFAOYSA-N	1	0	289.383	1.774	50	0		CDAARO
OCC[C@H]1C[NH2+]CCN1Cc1ccc(Cl)c(F)c1	ZINC000085207963	358255341	/nfs/dbraw/zinc/25/53/41/358255341.db2.gz	CGFUXCFWUHUPBB-NSHDSACASA-N	1	0	272.751	1.635	50	0		CDAARO
CS(=O)(=O)N1C[C@@H]2CC[C@H](C1)[N@H+](Cc1ccccc1)C2	ZINC000091620628	358520137	/nfs/dbraw/zinc/52/01/37/358520137.db2.gz	GSLAGDHMSMDZNE-HUUCEWRRSA-N	1	0	294.420	1.542	50	0		CDAARO
CC(C)[C@H]([NH3+])C(=O)N(C)Cc1cn(C)nc1C(F)(F)F	ZINC000195554696	358557919	/nfs/dbraw/zinc/55/79/19/358557919.db2.gz	SHAZIGMDSSYXBY-VIFPVBQESA-N	1	0	292.305	1.381	50	0		CDAARO
CC[N@@H+]1CCC[C@](C)(C(=O)NCCn2nc(C)nc2C)C1	ZINC000095364448	358686297	/nfs/dbraw/zinc/68/62/97/358686297.db2.gz	YEENDYWFQCROME-HNNXBMFYSA-N	1	0	293.415	1.133	50	0		CDAARO
CC(C)c1cc(N2CC[C@H](N3CC[NH+](C)CC3)C2)ncn1	ZINC000095386160	358691510	/nfs/dbraw/zinc/69/15/10/358691510.db2.gz	HLJPGPUDOPEHCO-AWEZNQCLSA-N	1	0	289.427	1.426	50	0		CDAARO
Cc1cc(C(=O)NCC[C@@H]2CCC[N@H+]2C)cc(C)n1	ZINC000097117014	358751839	/nfs/dbraw/zinc/75/18/39/358751839.db2.gz	QOYAUZQXGGHZMZ-AWEZNQCLSA-N	1	0	261.369	1.913	50	0		CDAARO
O=C(NCCCSCc1ccco1)[C@H]1C[NH2+]CCO1	ZINC000097307077	358765985	/nfs/dbraw/zinc/76/59/85/358765985.db2.gz	BGJWZCFEBIQANV-GFCCVEGCSA-N	1	0	284.381	1.008	50	0		CDAARO
C[NH+]1CCN(Cc2ccc(-c3ccccc3CO)nc2)CC1	ZINC000097527323	358782315	/nfs/dbraw/zinc/78/23/15/358782315.db2.gz	DCPMSIFUORBVFU-UHFFFAOYSA-N	1	0	297.402	1.988	50	0		CDAARO
CCc1cc(Cl)ccc1NC(=O)NC[C@H](O)C[NH+](C)C	ZINC000097632166	358788590	/nfs/dbraw/zinc/78/85/90/358788590.db2.gz	CWJIFCRYMUVQBW-LBPRGKRZSA-N	1	0	299.802	1.946	50	0		CDAARO
Cc1ccc(F)cc1CNC(=O)C1(O)CC[NH+](C)CC1	ZINC000097713579	358794913	/nfs/dbraw/zinc/79/49/13/358794913.db2.gz	CIXMNRBMZRGKQS-UHFFFAOYSA-N	1	0	280.343	1.207	50	0		CDAARO
OCC[NH+]1CCN(Cc2cccc(Cl)c2)CC1	ZINC000084367734	358846474	/nfs/dbraw/zinc/84/64/74/358846474.db2.gz	RGWXJPZWLWCKRR-UHFFFAOYSA-N	1	0	254.761	1.450	50	0		CDAARO
Cc1cc(C)cc(N2CCN(C[C@H]3[C@@H]4C[NH2+]C[C@H]34)CC2=O)c1	ZINC000102419498	358877799	/nfs/dbraw/zinc/87/77/99/358877799.db2.gz	OZAAQWMZNAUWOG-FVQHAEBGSA-N	1	0	299.418	1.417	50	0		CDAARO
C[C@H]1C[N@H+](Cc2ccccc2)CCN1Cc1nccc(N)n1	ZINC000269705822	358892978	/nfs/dbraw/zinc/89/29/78/358892978.db2.gz	NTLLYAGFNHDQJX-AWEZNQCLSA-N	1	0	297.406	1.765	50	0		CDAARO
CCc1nccc(C[N@H+](C)[C@@H](C)Cc2cnccn2)n1	ZINC000215624631	358896295	/nfs/dbraw/zinc/89/62/95/358896295.db2.gz	QGQVEUXRWUTYTD-LBPRGKRZSA-N	1	0	271.368	1.892	50	0		CDAARO
COC[C@@H]1CCC[N@@H+]1CCn1c2ccccc2oc1=O	ZINC000216375385	358942131	/nfs/dbraw/zinc/94/21/31/358942131.db2.gz	IMAJAVNHZAGIRS-LBPRGKRZSA-N	1	0	276.336	1.705	50	0		CDAARO
Cc1nc(NCC[NH+]2CCCC2)cc(C2CC(O)C2)n1	ZINC000218874912	359069457	/nfs/dbraw/zinc/06/94/57/359069457.db2.gz	UVCTUKBSCZAJAF-UHFFFAOYSA-N	1	0	276.384	1.531	50	0		CDAARO
[NH3+]C1CC(c2cc(NCCn3cc(Cl)cn3)ncn2)C1	ZINC000219284887	359086403	/nfs/dbraw/zinc/08/64/03/359086403.db2.gz	VYSHKRACKCEEDF-UHFFFAOYSA-N	1	0	292.774	1.643	50	0		CDAARO
Cn1cc(-c2ccnc(NCC[C@@H]3CCC[N@@H+]3C)n2)cn1	ZINC000023478179	359144556	/nfs/dbraw/zinc/14/45/56/359144556.db2.gz	DDVWZGJVAXGBKP-ZDUSSCGKSA-N	1	0	286.383	1.773	50	0		CDAARO
Cc1nc(CNC(=O)CN2CCC[N@@H+](C)CC2)sc1C	ZINC000221261126	359223280	/nfs/dbraw/zinc/22/32/80/359223280.db2.gz	WUCXEPKLMRMKBN-UHFFFAOYSA-N	1	0	296.440	1.014	50	0		CDAARO
Cc1nnc([C@@H](C)Nc2cc(C3CC([NH3+])C3)ncn2)[nH]1	ZINC000223757813	359453087	/nfs/dbraw/zinc/45/30/87/359453087.db2.gz	YPVPQNDZUVQFSZ-CUUXFQNZSA-N	1	0	273.344	1.281	50	0		CDAARO
C[C@@H]1COC[C@H](C)N1C(=O)[C@H]1CC12CC[NH2+]CC2	ZINC000261961851	359591182	/nfs/dbraw/zinc/59/11/82/359591182.db2.gz	RXZJOOPGCXNIQM-GRYCIOLGSA-N	1	0	252.358	1.012	50	0		CDAARO
COC(=O)[C@]1(C)CCN(C(=O)[C@H](C)[NH+]2CCCCCC2)C1	ZINC000089420052	359904376	/nfs/dbraw/zinc/90/43/76/359904376.db2.gz	JGBGDARDYKHYAG-XJKSGUPXSA-N	1	0	296.411	1.663	50	0		CDAARO
CCn1cnc2c1ncnc2N1CC[C@@H]([NH+](C)C)[C@H]1C	ZINC000408518609	359909465	/nfs/dbraw/zinc/90/94/65/359909465.db2.gz	PWMDKAWYBNWBHF-GHMZBOCLSA-N	1	0	274.372	1.375	50	0		CDAARO
Cc1nsc(N2CCC(CO)([NH2+]CC(C)C)CC2)n1	ZINC000408523458	359930935	/nfs/dbraw/zinc/93/09/35/359930935.db2.gz	RRRJAYLRCFVUQI-UHFFFAOYSA-N	1	0	284.429	1.423	50	0		CDAARO
C[C@H]([NH2+]C[C@H](O)CN1CCCC1=O)c1ccc(F)cc1F	ZINC000089515112	360095122	/nfs/dbraw/zinc/09/51/22/360095122.db2.gz	SGBIGUQYMHCUNR-JQWIXIFHSA-N	1	0	298.333	1.599	50	0		CDAARO
O=C(NCC1CC1)N1CCC([NH+]2CCCC2)CC1	ZINC000084544082	360105500	/nfs/dbraw/zinc/10/55/00/360105500.db2.gz	VYKSUIGHYGLZOZ-UHFFFAOYSA-N	1	0	251.374	1.666	50	0		CDAARO
CCc1cc(=O)[nH]c(N2CC[NH+](Cc3ccccc3)CC2)n1	ZINC000054268754	360108746	/nfs/dbraw/zinc/10/87/46/360108746.db2.gz	ANAKRZCQHOXHOH-UHFFFAOYSA-N	1	0	298.390	1.655	50	0		CDAARO
COC[C@@H]1[C@H](C(=O)N2CCCCCC2)CCC[N@@H+]1C	ZINC000409420272	360223210	/nfs/dbraw/zinc/22/32/10/360223210.db2.gz	WYADUKMZAXBVIK-ZIAGYGMSSA-N	1	0	268.401	1.746	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@H]1CCN(C(=O)c2nccn2C)C1	ZINC000409421173	360229960	/nfs/dbraw/zinc/22/99/60/360229960.db2.gz	URAYYZWNLIHCKB-LBPRGKRZSA-N	1	0	273.340	1.321	50	0		CDAARO
Cc1n[nH]c(C)c1CCCNC(=O)C(C)(C)[NH+]1CCCC1	ZINC000426533714	360681228	/nfs/dbraw/zinc/68/12/28/360681228.db2.gz	DFHKRNKVYNWDNR-UHFFFAOYSA-N	1	0	292.427	1.950	50	0		CDAARO
CCCn1nccc1C(=O)NCC1([NH+](C)C)CCOCC1	ZINC000426545396	360681904	/nfs/dbraw/zinc/68/19/04/360681904.db2.gz	VUDGVNGOXPVAMZ-UHFFFAOYSA-N	1	0	294.399	1.134	50	0		CDAARO
Cn1c(C[NH3+])nnc1SCc1cc(C2CC2)on1	ZINC000426618596	360690219	/nfs/dbraw/zinc/69/02/19/360690219.db2.gz	YTQWRRWTOBAGHV-UHFFFAOYSA-N	1	0	265.342	1.432	50	0		CDAARO
Cn1c(CC[NH3+])nnc1SCc1cscn1	ZINC000426668323	360694710	/nfs/dbraw/zinc/69/47/10/360694710.db2.gz	LTEHBCIBMASCHV-UHFFFAOYSA-N	1	0	255.372	1.065	50	0		CDAARO
COCCN(Cc1ccc(C)cc1)C(=O)NCC[NH+](C)C	ZINC000426479135	360674536	/nfs/dbraw/zinc/67/45/36/360674536.db2.gz	TVXGACNPOYVBCC-UHFFFAOYSA-N	1	0	293.411	1.715	50	0		CDAARO
CC(C)(C(=O)N1CC[C@H](C[NH3+])C1)c1ccccc1F	ZINC000178552547	189126126	/nfs/dbraw/zinc/12/61/26/189126126.db2.gz	JCDSAUUDVRNVGW-LLVKDONJSA-N	1	0	264.344	1.911	50	0		CDAARO
COc1cccc(OC)c1CC(=O)N1CC[C@H](C[NH3+])C1	ZINC000178564789	189127201	/nfs/dbraw/zinc/12/72/01/189127201.db2.gz	LCQQKOKRVNBGBU-LLVKDONJSA-N	1	0	278.352	1.054	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)c2ccccc2OCC2CC2)C1	ZINC000178560537	189127248	/nfs/dbraw/zinc/12/72/48/189127248.db2.gz	SDRDLXQGCRECQY-ZDUSSCGKSA-N	1	0	274.364	1.896	50	0		CDAARO
Cc1ccccc1[C@@H]1C[C@@H]1C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178573136	189128053	/nfs/dbraw/zinc/12/80/53/189128053.db2.gz	BHEQMCGDGXCKAM-SNPRPXQTSA-N	1	0	258.365	1.906	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2c[nH]nc2-c2ccccc2)C1	ZINC000178971422	189158364	/nfs/dbraw/zinc/15/83/64/189158364.db2.gz	XGEGXRBRMHSJRU-GFCCVEGCSA-N	1	0	284.363	1.758	50	0		CDAARO
C[C@H](OCC1CC1)C(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1C	ZINC000248164607	361284596	/nfs/dbraw/zinc/28/45/96/361284596.db2.gz	ZGVPQPCMJARCGI-NWANDNLSSA-N	1	0	280.412	1.887	50	0		CDAARO
Nc1cc[nH+]cc1C(=O)N1CCO[C@@H]2CCCC[C@H]21	ZINC000127555583	283681767	/nfs/dbraw/zinc/68/17/67/283681767.db2.gz	SXXKBZWDRFXKDD-CHWSQXEVSA-N	1	0	261.325	1.447	50	0		CDAARO
C[C@H](C(=O)NC(N)=O)[N@H+](C)Cc1ccc2ccccc2c1	ZINC000007500514	364177826	/nfs/dbraw/zinc/17/78/26/364177826.db2.gz	PJCWMVUQCHIXFG-LLVKDONJSA-N	1	0	285.347	1.855	50	0		CDAARO
O=C(CSC1=[NH+]CCN1)Nc1cccc(Cl)c1	ZINC000001994569	364508066	/nfs/dbraw/zinc/50/80/66/364508066.db2.gz	MICJGHOYLMGGDT-UHFFFAOYSA-N	1	0	269.757	1.971	50	0		CDAARO
CC[N@H+](C)C[C@H]1CCN(C(=O)N[C@H](C)c2cn[nH]c2)C1	ZINC000270377595	364571719	/nfs/dbraw/zinc/57/17/19/364571719.db2.gz	VDQXQGUMPCRGIG-VXGBXAGGSA-N	1	0	279.388	1.454	50	0		CDAARO
Cc1ccc(CN2CC[NH+](CCC(N)=O)CC2)c(F)c1F	ZINC000215772426	189697183	/nfs/dbraw/zinc/69/71/83/189697183.db2.gz	IWEUOJNPSZTNHX-UHFFFAOYSA-N	1	0	297.349	1.266	50	0		CDAARO
c1ccc(CN2CCO[C@@H]3C[N@@H+](CC4CC4)C[C@@H]32)cc1	ZINC000089835003	366941953	/nfs/dbraw/zinc/94/19/53/366941953.db2.gz	TZNJOKPYGZMSLG-DLBZAZTESA-N	1	0	272.392	1.982	50	0		CDAARO
CC(C)(C[NH2+]CCCNc1ccccc1)S(C)(=O)=O	ZINC000089761795	366929539	/nfs/dbraw/zinc/92/95/39/366929539.db2.gz	RAOLHIIYOPRUOA-UHFFFAOYSA-N	1	0	284.425	1.901	50	0		CDAARO
O=C1C[C@H]([NH2+]C[C@H](c2ccco2)N2CCCC2)CCCN1	ZINC000630060070	366974765	/nfs/dbraw/zinc/97/47/65/366974765.db2.gz	GZHQSVKNUQZXHR-ZIAGYGMSSA-N	1	0	291.395	1.675	50	0		CDAARO
C[C@@H]1CN(C)[C@@H](C)CN1C(=O)c1cc(C(F)F)n[nH]1	ZINC000630076993	367311857	/nfs/dbraw/zinc/31/18/57/367311857.db2.gz	MENKYRKQXDRTIL-JGVFFNPUSA-N	1	0	272.299	1.512	50	0		CDAARO
COC(C)(C)[C@H](C)[NH2+]CC(=O)N(C)CC(F)(F)F	ZINC000252492291	367637909	/nfs/dbraw/zinc/63/79/09/367637909.db2.gz	MHKKHRPBANGVQR-QMMMGPOBSA-N	1	0	270.295	1.410	50	0		CDAARO
Cc1ccc([C@@H](C)NC(=O)[C@H]2CSCN2)cc1F	ZINC000094956637	367747975	/nfs/dbraw/zinc/74/79/75/367747975.db2.gz	JNTSLYWHEQXDMN-BXKDBHETSA-N	1	0	268.357	1.974	50	0		CDAARO
CCc1ccc(CN2CC[N@H+](C[C@@H](C)O)C[C@@H]2C)o1	ZINC000252537674	367802249	/nfs/dbraw/zinc/80/22/49/367802249.db2.gz	MAIUAAOVLDGJSY-QWHCGFSZSA-N	1	0	266.385	1.729	50	0		CDAARO
C[NH2+]CCCC(=O)Nc1cccc(-n2ccnc2)c1	ZINC000037610950	369347759	/nfs/dbraw/zinc/34/77/59/369347759.db2.gz	CGFZPAAOHVRTKJ-UHFFFAOYSA-N	1	0	258.325	1.810	50	0		CDAARO
FC(F)(F)CN1CC[C@H](C[NH2+]Cc2cc[nH]n2)C1	ZINC000037648516	369521774	/nfs/dbraw/zinc/52/17/74/369521774.db2.gz	BTPHRYCSQVBPOW-SECBINFHSA-N	1	0	262.279	1.384	50	0		CDAARO
Cc1nnc(NC(=O)N2CC[N@@H+](C(C)C)[C@@H](C)C2)s1	ZINC000055370236	369973177	/nfs/dbraw/zinc/97/31/77/369973177.db2.gz	QOCOAEHEEXZBDP-VIFPVBQESA-N	1	0	283.401	1.793	50	0		CDAARO
c1cnc(N2CCN(CCC[NH+]3CCCCC3)CC2)nc1	ZINC000020999137	370121869	/nfs/dbraw/zinc/12/18/69/370121869.db2.gz	CARGYNRUDZCOFN-UHFFFAOYSA-N	1	0	289.427	1.475	50	0		CDAARO
CC[N@H+](C)C[C@@H](C)CNC(=O)CCC(=O)NC1CCCC1	ZINC000055227547	284340592	/nfs/dbraw/zinc/34/05/92/284340592.db2.gz	RSYDKMLLUTZAHP-ZDUSSCGKSA-N	1	0	297.443	1.529	50	0		CDAARO
CCN(CC[NH+](CC)CC)C(=O)Nc1ccc[nH]c1=O	ZINC000299777999	372754114	/nfs/dbraw/zinc/75/41/14/372754114.db2.gz	OGEVXFOYFRGUTL-UHFFFAOYSA-N	1	0	280.372	1.983	50	0		CDAARO
COc1ccccc1CCN1C(=O)CC[C@@H]2C[NH2+]CC[C@@H]21	ZINC000299788431	372761482	/nfs/dbraw/zinc/76/14/82/372761482.db2.gz	PFNMLDSKNRFSEM-CABCVRRESA-N	1	0	288.391	1.838	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)Cn1cc(C)cn1	ZINC000253601378	373937529	/nfs/dbraw/zinc/93/75/29/373937529.db2.gz	QVVFUQDRWQXYRW-HUUCEWRRSA-N	1	0	290.411	1.667	50	0		CDAARO
OC1CC[NH+](CCN2CCc3ccccc3C2)CC1	ZINC000019228932	374706413	/nfs/dbraw/zinc/70/64/13/374706413.db2.gz	WSJLOMUCPNSABF-UHFFFAOYSA-N	1	0	260.381	1.501	50	0		CDAARO
CCCS(=O)(=O)CCN(C)[C@H]1CC[N@H+](CC)C[C@@H]1C	ZINC000095432187	374932701	/nfs/dbraw/zinc/93/27/01/374932701.db2.gz	GHMCJYAQJCAXNM-KBPBESRZSA-N	1	0	290.473	1.473	50	0		CDAARO
CC[C@H](O)C[N@H+](C)CCN1CCN(c2ccccc2)CC1	ZINC000096415733	375098663	/nfs/dbraw/zinc/09/86/63/375098663.db2.gz	KHLDFHFFDNYEIX-KRWDZBQOSA-N	1	0	291.439	1.511	50	0		CDAARO
O=C(c1ccc(C[NH+]2CCCC2)o1)N1CCOCC1	ZINC000027984082	375168081	/nfs/dbraw/zinc/16/80/81/375168081.db2.gz	HAZWAAIBINWCOW-UHFFFAOYSA-N	1	0	264.325	1.348	50	0		CDAARO
Cc1cc(C#N)ccc1S(=O)(=O)N1CC[C@H]([NH3+])C[C@H]1C	ZINC000299741242	375201513	/nfs/dbraw/zinc/20/15/13/375201513.db2.gz	FAZFPQGOZSKRCP-YPMHNXCESA-N	1	0	293.392	1.367	50	0		CDAARO
CCOC(C)(C)C(=O)NCCNc1cc[nH+]cc1C	ZINC000670441116	542011251	/nfs/dbraw/zinc/01/12/51/542011251.db2.gz	GBBHVOIFUSTJQB-UHFFFAOYSA-N	1	0	265.357	1.155	50	0		CDAARO
CC1CCN(CC(=O)Nc2ccc(C(N)=O)cc2)CC1	ZINC000003538702	375739005	/nfs/dbraw/zinc/73/90/05/375739005.db2.gz	DOISHRAORHYPRQ-UHFFFAOYSA-N	1	0	275.352	1.456	50	0		CDAARO
C[NH+](C)C[C@H]1CCN(C(=O)NCc2cccc(CO)c2)C1	ZINC000187804946	375828152	/nfs/dbraw/zinc/82/81/52/375828152.db2.gz	GPZCMDGSYPLDFT-OAHLLOKOSA-N	1	0	291.395	1.272	50	0		CDAARO
COC[C@@H](C)NC(=S)NC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000007983762	375970695	/nfs/dbraw/zinc/97/06/95/375970695.db2.gz	YOEXRPLVYGZEQQ-SNVBAGLBSA-N	1	0	287.473	1.795	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]C[C@](C)(O)CN2CCOCC2)[C@@H](C)C1	ZINC000241316705	376019336	/nfs/dbraw/zinc/01/93/36/376019336.db2.gz	LUGRNEHMSOUNKL-UGUYLWEFSA-N	1	0	284.444	1.484	50	0		CDAARO
Cc1nn(C)c(N(C)C)c1CN[C@H]1CC[N@@H+]2CCCC[C@H]12	ZINC000069444261	376731767	/nfs/dbraw/zinc/73/17/67/376731767.db2.gz	JXDYRIPWIBUNIM-LSDHHAIUSA-N	1	0	291.443	1.511	50	0		CDAARO
OCCNc1ncnc2c1cnn2-c1ccc(Cl)cc1	ZINC000001901968	376929715	/nfs/dbraw/zinc/92/97/15/376929715.db2.gz	ZCCLLOXZNCTFJU-UHFFFAOYSA-N	1	0	289.726	1.873	50	0		CDAARO
Cn1cncc1-c1nccn1CCC[NH+]1CCOCC1	ZINC000067954435	377330788	/nfs/dbraw/zinc/33/07/88/377330788.db2.gz	UZUNCHKTWMPFQU-UHFFFAOYSA-N	1	0	275.356	1.006	50	0		CDAARO
O=C(c1ccccc1C(F)(F)F)N1CC[NH2+]CC1	ZINC000020283237	296260911	/nfs/dbraw/zinc/26/09/11/296260911.db2.gz	VDWDAGOWIJYIGH-UHFFFAOYSA-N	1	0	258.243	1.751	50	0		CDAARO
Cc1ccc(C[NH2+]C[C@@H](O)CN2CCCC2=O)cc1	ZINC000001391348	377592352	/nfs/dbraw/zinc/59/23/52/377592352.db2.gz	MKIRWDZDSJKHBB-CQSZACIVSA-N	1	0	262.353	1.068	50	0		CDAARO
O[C@H]([C@@H]1CCC[N@@H+]1CCOC[C@H]1CCCO1)C(F)(F)F	ZINC000245281200	378035946	/nfs/dbraw/zinc/03/59/46/378035946.db2.gz	AEMRESOZUGYQLY-GRYCIOLGSA-N	1	0	297.317	1.570	50	0		CDAARO
O=C1CC[C@@H]2C[NH2+]CC[C@@H]2N1Cc1ccc2c(c1)OCO2	ZINC000299783386	296327514	/nfs/dbraw/zinc/32/75/14/296327514.db2.gz	YVQCKXWFXVXEEH-OLZOCXBDSA-N	1	0	288.347	1.516	50	0		CDAARO
COCC[C@H]1CCCC[N@H+](CCN2CCO[C@@H](C)C2)C1	ZINC000253397136	285176334	/nfs/dbraw/zinc/17/63/34/285176334.db2.gz	IHHVZVKZMZKQBQ-JKSUJKDBSA-N	1	0	284.444	1.846	50	0		CDAARO
COCCn1ccnc1[C@H]1CCC[N@H+](CCOC)C1	ZINC000091486376	285194267	/nfs/dbraw/zinc/19/42/67/285194267.db2.gz	SFTOKYKMXWQANN-ZDUSSCGKSA-N	1	0	267.373	1.355	50	0		CDAARO
COC[C@@H]1[C@@H]([NH2+]C2CSCCSC2)[C@@H]2CCO[C@H]12	ZINC000219037184	285313464	/nfs/dbraw/zinc/31/34/64/285313464.db2.gz	YVXKFYDCFKNPNP-RNJOBUHISA-N	1	0	289.466	1.475	50	0		CDAARO
C[C@@H](C(=O)NC1CC1)[NH+]1CCC(OC2CCOCC2)CC1	ZINC000096417441	256763473	/nfs/dbraw/zinc/76/34/73/256763473.db2.gz	CCBOCPRRXVMZOF-LBPRGKRZSA-N	1	0	296.411	1.314	50	0		CDAARO
[NH2+]=C1Nc2nc3ccccc3n2[C@@H](c2ccccn2)N1	ZINC000001408217	390138441	/nfs/dbraw/zinc/13/84/41/390138441.db2.gz	XDRRPGXVSUVWGM-LBPRGKRZSA-N	1	0	264.292	1.528	50	0		CDAARO
O=C(C[C@@H]1CCCO1)NC[C@H]1[NH2+]CCc2ccccc21	ZINC000261843347	390547144	/nfs/dbraw/zinc/54/71/44/390547144.db2.gz	WASIZIWUEGNBFT-DZGCQCFKSA-N	1	0	274.364	1.559	50	0		CDAARO
Cc1cc(C[NH2+][C@H](C2CC2)[C@@]2(CO)CCCO2)ccn1	ZINC000527539127	391035324	/nfs/dbraw/zinc/03/53/24/391035324.db2.gz	JFVBYYMACZUXCD-CVEARBPZSA-N	1	0	276.380	1.800	50	0		CDAARO
O=C(NCCCOC1CCCC1)[C@@H]1CC12CC[NH2+]CC2	ZINC000238059126	391364936	/nfs/dbraw/zinc/36/49/36/391364936.db2.gz	ZGQQJYXFZMWFKK-AWEZNQCLSA-N	1	0	280.412	1.842	50	0		CDAARO
CC[C@H]1CN(C)c2ccccc2C[N@@H+]1CCOCCO	ZINC000088562626	391422686	/nfs/dbraw/zinc/42/26/86/391422686.db2.gz	HUWVZCFQEYCYTO-HNNXBMFYSA-N	1	0	278.396	1.726	50	0		CDAARO
COCCN1CCC[C@@H]1C[NH2+][C@@H]1[C@@H]2CCCO[C@H]2C1(C)C	ZINC000242284652	391681381	/nfs/dbraw/zinc/68/13/81/391681381.db2.gz	YIOJOBYLYDHOJH-QKPAOTATSA-N	1	0	296.455	1.890	50	0		CDAARO
O=C(NC1CC1)[C@@H]1CCC[N@H+](C[C@H]2CCCCO2)C1	ZINC000242167666	391681522	/nfs/dbraw/zinc/68/15/22/391681522.db2.gz	WYMVRWQDRNDPBI-TZMCWYRMSA-N	1	0	266.385	1.546	50	0		CDAARO
CN(C)C(=O)C[N@H+](Cc1ccccc1)CC1(O)CCCC1	ZINC000089311958	392000539	/nfs/dbraw/zinc/00/05/39/392000539.db2.gz	HBQHWPGNAXAGNL-UHFFFAOYSA-N	1	0	290.407	1.882	50	0		CDAARO
C[C@@H](C(=O)NC(=O)NC(C)(C)C)[N@@H+]1CCC[C@H](C)C1	ZINC000008142764	391948178	/nfs/dbraw/zinc/94/81/78/391948178.db2.gz	SAJPJOGBTXJTKG-QWRGUYRKSA-N	1	0	269.389	1.731	50	0		CDAARO
Cn1cc([C@@H]([NH2+]C2Cc3ccccc3C2)[C@H]2C[C@@H](O)C2)cn1	ZINC000243885669	131082957	/nfs/dbraw/zinc/08/29/57/131082957.db2.gz	ABGRBHCGGYNHDF-QGTPRVQTSA-N	1	0	297.402	1.989	50	0		CDAARO
C[NH2+][C@H](C)CNC(=O)c1cc(F)cc2nccnc21	ZINC000261831697	131171839	/nfs/dbraw/zinc/17/18/39/131171839.db2.gz	VLIUIQJKDCGVEU-MRVPVSSYSA-N	1	0	262.288	1.107	50	0		CDAARO
Cc1cc(N2CCC[C@@H]2C[NH+]2C[C@@H](C)O[C@H](C)C2)ncn1	ZINC000253370649	392715255	/nfs/dbraw/zinc/71/52/55/392715255.db2.gz	UGOIEYRKZQPEMU-RBSFLKMASA-N	1	0	290.411	1.863	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)[C@@H](C)c1cccnc1	ZINC000269192452	132128592	/nfs/dbraw/zinc/12/85/92/132128592.db2.gz	ROFSZWJCEUPLSW-OUCADQQQSA-N	1	0	261.369	1.913	50	0		CDAARO
C[C@H]([NH3+])C(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000195143317	393070082	/nfs/dbraw/zinc/07/00/82/393070082.db2.gz	AXMVFKBNZSTKRV-LBPRGKRZSA-N	1	0	279.359	1.207	50	0		CDAARO
Cc1ccc(CN2CC[NH2+]CC2)c(-c2cnn(C)c2)c1	ZINC000261652238	140370282	/nfs/dbraw/zinc/37/02/82/140370282.db2.gz	BCJWQWJAUCSRHY-UHFFFAOYSA-N	1	0	270.380	1.801	50	0		CDAARO
COC[C@@H]([NH3+])C(=O)N1CCc2c(F)cc(F)cc2[C@H]1C	ZINC000262319340	140423807	/nfs/dbraw/zinc/42/38/07/140423807.db2.gz	QDJMGYITGZKQRO-AMIZOPFISA-N	1	0	284.306	1.384	50	0		CDAARO
O=C(Nc1ccccc1N1CCCC1)[C@H]1CCC[NH2+]1	ZINC000037016646	398055499	/nfs/dbraw/zinc/05/54/99/398055499.db2.gz	KSXLJCJEUXFULV-CYBMUJFWSA-N	1	0	259.353	1.977	50	0		CDAARO
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178530054	148064613	/nfs/dbraw/zinc/06/46/13/148064613.db2.gz	IBCFTXKFLAADGC-ZJUUUORDSA-N	1	0	284.306	1.539	50	0		CDAARO
Cc1ccc([C@@H]2C[N@@H+](CCCO)C[C@H]2N(C)C)cc1	ZINC000077471183	292219786	/nfs/dbraw/zinc/21/97/86/292219786.db2.gz	PKIZAOASAAXPBA-JKSUJKDBSA-N	1	0	262.397	1.707	50	0		CDAARO
Cc1ccc([C@H](C(=O)NCCCCC[NH3+])N(C)C)cc1	ZINC000091270620	292239002	/nfs/dbraw/zinc/23/90/02/292239002.db2.gz	RDIOWRWGJYQFRB-OAHLLOKOSA-N	1	0	277.412	1.843	50	0		CDAARO
COc1ccc(CCC(=O)N2CCC[C@@H]2C[NH3+])cc1F	ZINC000262591660	286299328	/nfs/dbraw/zinc/29/93/28/286299328.db2.gz	FKHDETXBQUPJFZ-GFCCVEGCSA-N	1	0	280.343	1.717	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@@H]1[NH2+][C@H](C)C(=O)N(CC)CC	ZINC000107504627	287179743	/nfs/dbraw/zinc/17/97/43/287179743.db2.gz	DCMODUOHPKERKF-YUELXQCFSA-N	1	0	297.443	1.480	50	0		CDAARO
CC[C@@H]1CN([C@H](C)C(=O)N2CCCC2)CC[N@@H+]1CCOC	ZINC000252474773	287209956	/nfs/dbraw/zinc/20/99/56/287209956.db2.gz	LYWRJEMIWXJXTC-HUUCEWRRSA-N	1	0	297.443	1.040	50	0		CDAARO
C[NH+](C)CCNC(=O)c1ccc(Br)s1	ZINC000004805275	170020053	/nfs/dbraw/zinc/02/00/53/170020053.db2.gz	DRINQSOIXCNISE-UHFFFAOYSA-N	1	0	277.187	1.802	50	0		CDAARO
CCOc1ccccc1C(=O)N1CCC[N@H+](C)CC1	ZINC000006699115	170228285	/nfs/dbraw/zinc/22/82/85/170228285.db2.gz	JFUOUNYILIJQCM-UHFFFAOYSA-N	1	0	262.353	1.863	50	0		CDAARO
COc1ccccc1CCNC(=O)C[NH+]1CCCCC1	ZINC000007339071	170277781	/nfs/dbraw/zinc/27/77/81/170277781.db2.gz	OEJMOHILVHWGNN-UHFFFAOYSA-N	1	0	276.380	1.840	50	0		CDAARO
COc1ccc(CNC(=S)NCC[NH+](C)C)cc1OC	ZINC000007572389	170290958	/nfs/dbraw/zinc/29/09/58/170290958.db2.gz	UPZYRANFEVPGMR-UHFFFAOYSA-N	1	0	297.424	1.230	50	0		CDAARO
Cc1ccccc1OCC[NH+]1CCC(C(N)=O)CC1	ZINC000008317232	170330547	/nfs/dbraw/zinc/33/05/47/170330547.db2.gz	SWTFQZKQXXXBPI-UHFFFAOYSA-N	1	0	262.353	1.571	50	0		CDAARO
CC[C@@H](C)[NH2+]C[C@H](O)COc1ccccc1OC	ZINC000008844746	170357504	/nfs/dbraw/zinc/35/75/04/170357504.db2.gz	VXJQVAMMFVYRJF-NEPJUHHUSA-N	1	0	253.342	1.823	50	0		CDAARO
C[NH+](C)CC[C@@H]1CN(C(=O)CCc2cccs2)CCO1	ZINC000011817469	170443446	/nfs/dbraw/zinc/44/34/46/170443446.db2.gz	ARDYYLUWNWIDGC-CYBMUJFWSA-N	1	0	296.436	1.860	50	0		CDAARO
[NH3+]C[C@H]1CN(C(=O)c2ccc(Cl)cc2)CCO1	ZINC000011887365	170452645	/nfs/dbraw/zinc/45/26/45/170452645.db2.gz	SIEVAVUIDHVZNI-NSHDSACASA-N	1	0	254.717	1.140	50	0		CDAARO
CC[NH+]1CCN(C[C@@H]2COc3ccccc3O2)CC1	ZINC000020791698	171272781	/nfs/dbraw/zinc/27/27/81/171272781.db2.gz	YSMURWKPMWDUGL-CYBMUJFWSA-N	1	0	262.353	1.464	50	0		CDAARO
CC[NH+](CC)CCCNCC(=O)N[C@@H]1CCOC(C)(C)C1	ZINC000021149438	171298729	/nfs/dbraw/zinc/29/87/29/171298729.db2.gz	BKDYMPBZNFRLRW-CQSZACIVSA-N	1	0	299.459	1.382	50	0		CDAARO
Nc1nnc(N2CC[NH+](C3CCCCC3)CC2)s1	ZINC000021531687	171316652	/nfs/dbraw/zinc/31/66/52/171316652.db2.gz	RPYJEAHQWAHERC-UHFFFAOYSA-N	1	0	267.402	1.575	50	0		CDAARO
COCCC[NH2+]CCOCCOc1ccccc1	ZINC000022079147	171352472	/nfs/dbraw/zinc/35/24/72/171352472.db2.gz	XDUDNESNIFQKCG-UHFFFAOYSA-N	1	0	253.342	1.708	50	0		CDAARO
C[C@@H](Cc1ccccc1F)N1CC[NH+](CCO)CC1	ZINC000022455193	171388444	/nfs/dbraw/zinc/38/84/44/171388444.db2.gz	RCZWETNQVRYAGE-ZDUSSCGKSA-N	1	0	266.360	1.367	50	0		CDAARO
O=C(NC[C@@H](O)c1ccccc1)[C@@H]1Cc2ccccc2C[NH2+]1	ZINC000035349332	172143800	/nfs/dbraw/zinc/14/38/00/172143800.db2.gz	ABYODZCNDMDCOU-DLBZAZTESA-N	1	0	296.370	1.551	50	0		CDAARO
C[NH+]1CCN(Cc2ccc(N)cc2Br)CC1	ZINC000037460439	173224327	/nfs/dbraw/zinc/22/43/27/173224327.db2.gz	IXYWNRNRQJPZDO-UHFFFAOYSA-N	1	0	284.201	1.779	50	0		CDAARO
O=S1(=O)CC[C@@H]([NH2+]C2CC(c3ccccc3F)C2)C1	ZINC000037506688	173241194	/nfs/dbraw/zinc/24/11/94/173241194.db2.gz	OSPFNVVNRDPBGF-MOENNCHZSA-N	1	0	283.368	1.848	50	0		CDAARO
C[NH2+]C1CCN(S(=O)(=O)c2cc(F)ccc2C)CC1	ZINC000037536764	173255795	/nfs/dbraw/zinc/25/57/95/173255795.db2.gz	SSBZOJMCVGWXLB-UHFFFAOYSA-N	1	0	286.372	1.507	50	0		CDAARO
OC[C@@H](c1ccc(Br)cc1)N1CC[NH2+]CC1	ZINC000038120816	174128442	/nfs/dbraw/zinc/12/84/42/174128442.db2.gz	QUJIMOZKQNYZDZ-LBPRGKRZSA-N	1	0	285.185	1.388	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)c1csc2ccccc12	ZINC000042891901	174902409	/nfs/dbraw/zinc/90/24/09/174902409.db2.gz	HNERTCCNGQUBET-RYUDHWBXSA-N	1	0	276.361	1.618	50	0		CDAARO
CN(Cc1cc2cc(F)ccc2[nH]1)C(=O)[C@H]1C[NH2+]CCO1	ZINC000071419298	176160361	/nfs/dbraw/zinc/16/03/61/176160361.db2.gz	XTIFASPNOJUFJG-CQSZACIVSA-N	1	0	291.326	1.254	50	0		CDAARO
[NH3+]CC1(O)CCN(C(=O)OCc2ccccc2)CC1	ZINC000071476912	176187523	/nfs/dbraw/zinc/18/75/23/176187523.db2.gz	LWIUVSBTWBNGLT-UHFFFAOYSA-N	1	0	264.325	1.109	50	0		CDAARO
O=C(OCc1ccccc1)N1CCC([NH2+]C2COC2)CC1	ZINC000071792077	176263609	/nfs/dbraw/zinc/26/36/09/176263609.db2.gz	AUUYUAXEDBUQED-UHFFFAOYSA-N	1	0	290.363	1.776	50	0		CDAARO
COc1c(C)cnc(C[N@@H+]2CCC[C@](O)(CO)C2)c1C	ZINC000072152607	176327597	/nfs/dbraw/zinc/32/75/97/176327597.db2.gz	IDSBDDQJMQEIPG-OAHLLOKOSA-N	1	0	280.368	1.026	50	0		CDAARO
O[C@H](CC[N@H+]1C[C@@H]2C[C@H](O)[C@@H](O)C[C@@H]2C1)c1ccccc1	ZINC000072157521	176329353	/nfs/dbraw/zinc/32/93/53/176329353.db2.gz	CTPNBONZRPQBNG-ALYAQQCSSA-N	1	0	291.391	1.174	50	0		CDAARO
Cn1ncc(C[N@@H+]2CCC[C@@](O)(CO)CC2)c1C1CC1	ZINC000072162744	176330315	/nfs/dbraw/zinc/33/03/15/176330315.db2.gz	SVTNMUKUXNSWLM-HNNXBMFYSA-N	1	0	279.384	1.007	50	0		CDAARO
O=C(NCCc1c[nH]cn1)c1ccccc1[C@@H]1CC[NH2+]C1	ZINC000072163438	176330655	/nfs/dbraw/zinc/33/06/55/176330655.db2.gz	SGGBLYCMLGGADP-GFCCVEGCSA-N	1	0	284.363	1.459	50	0		CDAARO
CC(=O)NCC1CC[NH+](Cc2cccnc2N)CC1	ZINC000077407720	177264171	/nfs/dbraw/zinc/26/41/71/177264171.db2.gz	JQHFMKKSHFNZDF-UHFFFAOYSA-N	1	0	262.357	1.012	50	0		CDAARO
CC(C)c1ncc(S(C)(=O)=O)c([C@@H]2CCC[NH2+]C2)n1	ZINC000077425229	177266033	/nfs/dbraw/zinc/26/60/33/177266033.db2.gz	RMZOYUHWXQRAKJ-SNVBAGLBSA-N	1	0	283.397	1.471	50	0		CDAARO
Cc1cnc(C[NH2+][C@@H]2CCOC3(CCOCC3)C2)cn1	ZINC000077488570	177274356	/nfs/dbraw/zinc/27/43/56/177274356.db2.gz	QSHIRVQFWWZZMD-CYBMUJFWSA-N	1	0	277.368	1.603	50	0		CDAARO
CC(=O)c1ccccc1OCCCN1CC[NH+](C)CC1	ZINC000019815144	260114857	/nfs/dbraw/zinc/11/48/57/260114857.db2.gz	MRFZHPSDEBJSSM-UHFFFAOYSA-N	1	0	276.380	1.906	50	0		CDAARO
CCN1C(=O)C[C@@H]([NH+]2CCC(c3ccncc3)CC2)C1=O	ZINC000004707963	273649119	/nfs/dbraw/zinc/64/91/19/273649119.db2.gz	ATCFRWLXYNXCBB-CQSZACIVSA-N	1	0	287.363	1.408	50	0		CDAARO
C[N@@H+]1CCN(Cc2c(F)cccc2F)C[C@@H]1CCO	ZINC000020601140	277109052	/nfs/dbraw/zinc/10/90/52/277109052.db2.gz	ZRSAAQRJXWEKCK-NSHDSACASA-N	1	0	270.323	1.463	50	0		CDAARO
CC(C)c1nn(C)c(Cl)c1C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178573071	278090180	/nfs/dbraw/zinc/09/01/80/278090180.db2.gz	IEQFQLDVHALIPQ-SECBINFHSA-N	1	0	284.791	1.618	50	0		CDAARO
CC1(C)C[N@H+](CCNC(N)=O)C[C@H]1c1ccccc1	ZINC000426423133	278332600	/nfs/dbraw/zinc/33/26/00/278332600.db2.gz	VLLLFWXJBOQPSR-ZDUSSCGKSA-N	1	0	261.369	1.780	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@H](N2CCC([NH3+])CC2)C1	ZINC000026896585	278404863	/nfs/dbraw/zinc/40/48/63/278404863.db2.gz	UMWHGGWSANLOKM-GFCCVEGCSA-N	1	0	269.389	1.419	50	0		CDAARO
Cc1cc2cc(C(=O)N[C@H]3[C@@H]4OCC[C@@H]4[C@@H]3[NH3+])ccc2o1	ZINC000222316573	278760557	/nfs/dbraw/zinc/76/05/57/278760557.db2.gz	CMJQCWFOCPBMQC-FAAHXZRKSA-N	1	0	286.331	1.586	50	0		CDAARO
CCn1nc(C(=O)NC)c2c1CC[C@@H]([NH+](CC)CC)C2	ZINC000020208924	279152741	/nfs/dbraw/zinc/15/27/41/279152741.db2.gz	KCBMWLSAUPEVMD-LLVKDONJSA-N	1	0	278.400	1.462	50	0		CDAARO
C[C@H](CCO)[NH+]1CCC2(CC1)Nc1ccccc1NC2=O	ZINC000082133571	279269446	/nfs/dbraw/zinc/26/94/46/279269446.db2.gz	OGZZBEKQQOHULD-GFCCVEGCSA-N	1	0	289.379	1.656	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@@H](C[NH3+])c2ccccc2)C[C@H](C)O1	ZINC000269263568	280365637	/nfs/dbraw/zinc/36/56/37/280365637.db2.gz	SOAQWOOXMRAHPK-CFVMTHIKSA-N	1	0	276.380	1.755	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)/C=C\c1ccc2c(c1)CCO2	ZINC000255115287	289357044	/nfs/dbraw/zinc/35/70/44/289357044.db2.gz	ORMDJUHGLYAKOR-FHMRSRPSSA-N	1	0	272.348	1.455	50	0		CDAARO
Cc1c(F)cccc1S(=O)(=O)N[C@@H]1CCC[C@H]1C[NH3+]	ZINC000095432107	300970941	/nfs/dbraw/zinc/97/09/41/300970941.db2.gz	DEDJRXGHXFHHGX-CMPLNLGQSA-N	1	0	286.372	1.540	50	0		CDAARO
CSCC(=O)N1CCCC2(CC[NH2+]CC2)CC1	ZINC000534574546	328309446	/nfs/dbraw/zinc/30/94/46/328309446.db2.gz	QLFJINXKVQKHHL-UHFFFAOYSA-N	1	0	256.415	1.732	50	0		CDAARO
Cc1nccn1C[C@H](C)[NH2+]CC1(CN2CCOCC2)CC1	ZINC000534658726	328341229	/nfs/dbraw/zinc/34/12/29/328341229.db2.gz	JEEMYSNGHQWMQF-AWEZNQCLSA-N	1	0	292.427	1.282	50	0		CDAARO
Cc1csc(S(=O)(=O)NC[C@H](C(C)C)[NH+](C)C)c1	ZINC000534665546	328345003	/nfs/dbraw/zinc/34/50/03/328345003.db2.gz	DKNPGJFBNUGRNM-LLVKDONJSA-N	1	0	290.454	1.921	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@H]1CCC(C)(C)C[C@@H]1C	ZINC000097099854	323207429	/nfs/dbraw/zinc/20/74/29/323207429.db2.gz	YRBLQUQCMWXHCS-RYUDHWBXSA-N	1	0	276.446	1.730	50	0		CDAARO
CC(C)n1nnnc1C[NH2+][C@H]1CC(C)(C)OC1(C)C	ZINC000097100325	323207483	/nfs/dbraw/zinc/20/74/83/323207483.db2.gz	RFBNQTUXXHCXDM-JTQLQIEISA-N	1	0	267.377	1.690	50	0		CDAARO
O=C(C[N@@H+]1C[C@@H]2[C@H](O)C[C@@H]2C1)NC1CCCCCC1	ZINC001772706844	1159441992	/nfs/dbraw/zinc/44/19/92/1159441992.db2.gz	WBIWZAPMVBHOMP-KWCYVHTRSA-N	1	0	266.385	1.138	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@@H]([NH2+]C2COC2)C1	ZINC000071792050	482450716	/nfs/dbraw/zinc/45/07/16/482450716.db2.gz	MVRZYWPCHJFVKP-SNVBAGLBSA-N	1	0	256.346	1.374	50	0		CDAARO
c1cnn(CCC[NH+]2CCC(c3cc[nH]n3)CC2)c1	ZINC000670446596	482998152	/nfs/dbraw/zinc/99/81/52/482998152.db2.gz	CIDAUFQBXXRFMU-UHFFFAOYSA-N	1	0	259.357	1.876	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H]1CN(C(=O)C1CCOCC1)C2	ZINC000670459287	483042179	/nfs/dbraw/zinc/04/21/79/483042179.db2.gz	QLUZVMWFISXVJI-JSGCOSHPSA-N	1	0	266.385	1.356	50	0		CDAARO
Cc1[nH]nc2c1CN(Cc1nncn1C(C)C)CC2	ZINC000670460072	483042587	/nfs/dbraw/zinc/04/25/87/483042587.db2.gz	BANFTCSBNDLQEG-UHFFFAOYSA-N	1	0	260.345	1.449	50	0		CDAARO
Nc1ncc(C[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)s1	ZINC000670462604	483050760	/nfs/dbraw/zinc/05/07/60/483050760.db2.gz	BEPHRERMIJPLCD-SECBINFHSA-N	1	0	263.370	1.828	50	0		CDAARO
O=C(C1CCC1)N1CCC[N@H+](C[C@H]2CCC(=O)O2)CC1	ZINC000670467596	483059497	/nfs/dbraw/zinc/05/94/97/483059497.db2.gz	NUTRWENJSMOPMK-CYBMUJFWSA-N	1	0	280.368	1.026	50	0		CDAARO
Cc1ncc(CO)c(C[N@@H+]2CC[C@@H](O)CC(C)(C)C2)c1O	ZINC000670472797	483081910	/nfs/dbraw/zinc/08/19/10/483081910.db2.gz	GTLJQIHQAIACIZ-CYBMUJFWSA-N	1	0	294.395	1.571	50	0		CDAARO
COCCn1cnnc1[C@H](C)[NH2+]C1Cc2ccccc2C1	ZINC000670474338	483085291	/nfs/dbraw/zinc/08/52/91/483085291.db2.gz	YBCTULPGRFFGDJ-LBPRGKRZSA-N	1	0	286.379	1.743	50	0		CDAARO
Cc1ccsc1[C@H](C)[NH2+]C[C@@H]1CN2CCN1CC2	ZINC000090648930	483281901	/nfs/dbraw/zinc/28/19/01/483281901.db2.gz	PUANHGYPGMECAR-QWHCGFSZSA-N	1	0	265.426	1.707	50	0		CDAARO
C[C@@H]1CNC(=O)CC[N@@H+]1Cc1ccc(-n2ccnc2)cc1	ZINC000067982849	525089834	/nfs/dbraw/zinc/08/98/34/525089834.db2.gz	YKHMIWPLEWYBHE-CYBMUJFWSA-N	1	0	284.363	1.583	50	0		CDAARO
CCC[C@H]1CN(C(=O)C2CC2)CC[N@@H+]1CCOC	ZINC000096487594	528391352	/nfs/dbraw/zinc/39/13/52/528391352.db2.gz	QHTYUQOHYOPLHZ-ZDUSSCGKSA-N	1	0	254.374	1.356	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CCN1CCN(c2cccnn2)CC1	ZINC000268515785	536354648	/nfs/dbraw/zinc/35/46/48/536354648.db2.gz	DNHSGRFKWXJVEX-OAHLLOKOSA-N	1	0	289.427	1.473	50	0		CDAARO
CC[C@](C)(O)C[NH+]1CCN(c2nccs2)CC1	ZINC000119394021	538169562	/nfs/dbraw/zinc/16/95/62/538169562.db2.gz	PWBDEMNTSKLBHK-LBPRGKRZSA-N	1	0	255.387	1.426	50	0		CDAARO
CC(C)(O)CC[N@@H+]1CCC[C@@H](CNC(=O)C2CCC2)C1	ZINC000952976999	614184603	/nfs/dbraw/zinc/18/46/03/614184603.db2.gz	RLOPCPOWNJAARH-ZDUSSCGKSA-N	1	0	282.428	1.776	50	0		CDAARO
CCCOCCNC(=O)C1CC[NH+](C(C)C)CC1	ZINC000952981809	614937162	/nfs/dbraw/zinc/93/71/62/614937162.db2.gz	WLRVZTCJYIJTFZ-UHFFFAOYSA-N	1	0	256.390	1.650	50	0		CDAARO
C[N@@H+]1CCC[C@H]1C(=O)NCc1cc(-c2ccco2)on1	ZINC000952973096	616211643	/nfs/dbraw/zinc/21/16/43/616211643.db2.gz	KEGMKGSAEMYKGX-NSHDSACASA-N	1	0	275.308	1.645	50	0		CDAARO
CC[C@](C)([NH2+]Cc1cccc2c1OC(F)(F)O2)C(N)=O	ZINC000888093981	617753383	/nfs/dbraw/zinc/75/33/83/617753383.db2.gz	RDKRXESXMALQAN-LBPRGKRZSA-N	1	0	286.278	1.752	50	0		CDAARO
O=C(NCC[C@@H]1CCCCO1)[C@@H]1[NH2+]CC12CCCC2	ZINC000888101497	617765330	/nfs/dbraw/zinc/76/53/30/617765330.db2.gz	CSBCTDAKKGAHOK-STQMWFEESA-N	1	0	266.385	1.594	50	0		CDAARO
C[C@H](C[C@H]1CCC(=O)N1)[NH2+]C[C@@H]1CCOC(C)(C)C1	ZINC000926557018	618067322	/nfs/dbraw/zinc/06/73/22/618067322.db2.gz	FKBHZDYYWXTCIJ-JHJVBQTASA-N	1	0	268.401	1.838	50	0		CDAARO
[NH3+][C@H]1CCN(c2ccc(Br)cc2)C1=O	ZINC000049648556	1158652024	/nfs/dbraw/zinc/65/20/24/1158652024.db2.gz	VYBOJUGFCIEGAW-VIFPVBQESA-N	1	0	255.115	1.513	50	0		CDAARO
CC(=O)c1cnc(NC[C@@H]2CCCC[N@H+]2C)nc1C	ZINC001704315368	1177686249	/nfs/dbraw/zinc/68/62/49/1177686249.db2.gz	AZNCPPUYTOAMSG-LBPRGKRZSA-N	1	0	262.357	1.884	50	0		CDAARO
C[C@H](COC[C@H](O)C[NH+]1CCN(C)CC1)c1ccccc1	ZINC000020638943	784762157	/nfs/dbraw/zinc/76/21/57/784762157.db2.gz	NOFWBZNOYUENPG-NVXWUHKLSA-N	1	0	292.423	1.415	50	0		CDAARO
CC(C)CN1CC[N@H+](C2CCCC2)[C@H](CCO)C1	ZINC000039466969	784929321	/nfs/dbraw/zinc/92/93/21/784929321.db2.gz	RGSCLQYAIVYKSQ-OAHLLOKOSA-N	1	0	254.418	1.954	50	0		CDAARO
COc1ccc(CN(CCO)Cc2cncn2C)cc1	ZINC000880571223	785011361	/nfs/dbraw/zinc/01/13/61/785011361.db2.gz	OBHSTHOVGOWRIW-UHFFFAOYSA-N	1	0	275.352	1.423	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CN(C)CC1(CO)CCCC1	ZINC000092672536	786356108	/nfs/dbraw/zinc/35/61/08/786356108.db2.gz	XYLPKQVYOPPDKW-CQSZACIVSA-N	1	0	254.418	1.955	50	0		CDAARO
COc1ccnc(CSc2nnc(CC[NH3+])n2C)c1	ZINC000426434579	787812642	/nfs/dbraw/zinc/81/26/42/787812642.db2.gz	WMQZIKVGJFUMNF-UHFFFAOYSA-N	1	0	279.369	1.012	50	0		CDAARO
Cc1nc(CN2CCC[C@](CO)(C[NH+](C)C)C2)n(C)c1C	ZINC000952978602	789810010	/nfs/dbraw/zinc/81/00/10/789810010.db2.gz	BHYDPZUOYGFHJQ-INIZCTEOSA-N	1	0	294.443	1.173	50	0		CDAARO
COCc1csc(C[NH2+]C(C)(C)C(=O)N(C)C)c1	ZINC000698009257	910253619	/nfs/dbraw/zinc/25/36/19/910253619.db2.gz	LLGCRBJRUSAQQN-UHFFFAOYSA-N	1	0	270.398	1.851	50	0		CDAARO
CCO[C@@H](C)CNC(=O)CCC[NH+]1CCCCC1	ZINC000952872382	910428036	/nfs/dbraw/zinc/42/80/36/910428036.db2.gz	NHTOCYRFLRNRCV-ZDUSSCGKSA-N	1	0	256.390	1.794	50	0		CDAARO
C[C@@H](Cc1ccno1)[NH2+]C[C@@](C)(O)C(=O)OC(C)(C)C	ZINC000952995708	910582935	/nfs/dbraw/zinc/58/29/35/910582935.db2.gz	WDPDXUXBWCUKNO-IINYFYTJSA-N	1	0	284.356	1.288	50	0		CDAARO
CN(Cc1ccnn1C)C[C@H]1CC[N@H+](C)C1(C)C	ZINC000823715242	925722978	/nfs/dbraw/zinc/72/29/78/925722978.db2.gz	ZFJADAWNPVYYBZ-GFCCVEGCSA-N	1	0	250.390	1.582	50	0		CDAARO
COC[C@H](C)NC(=O)c1ccc(C[NH+]2CCCC2)o1	ZINC000824468382	925823001	/nfs/dbraw/zinc/82/30/01/925823001.db2.gz	SJVOYJZPHAOGMZ-NSHDSACASA-N	1	0	266.341	1.640	50	0		CDAARO
C[NH+](C)CC(C)(C)NS(=O)(=O)/C=C/c1ccccc1	ZINC000585087309	930900167	/nfs/dbraw/zinc/90/01/67/930900167.db2.gz	KXKKHRJXFPUYQI-ZHACJKMWSA-N	1	0	282.409	1.917	50	0		CDAARO
CCC[C@@H](C)NC(=O)[C@H]1CCC[N@H+](CC2COCOC2)C1	ZINC000585116868	930968843	/nfs/dbraw/zinc/96/88/43/930968843.db2.gz	KWXCZIXDOYALKN-HIFRSBDPSA-N	1	0	298.427	1.624	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@H]1CNc1cc(C(N)=O)ccn1	ZINC001506396940	975147740	/nfs/dbraw/zinc/14/77/40/975147740.db2.gz	PPMQRPUOVFTGDI-LBPRGKRZSA-N	1	0	262.357	1.465	50	0		CDAARO
CCc1noc(NC(=O)[C@@H]2CC[N@H+](CCOC)C2)c1C	ZINC001506406930	975151857	/nfs/dbraw/zinc/15/18/57/975151857.db2.gz	SFTXLMQNNZDLSU-LLVKDONJSA-N	1	0	281.356	1.452	50	0		CDAARO
C[N@@H+]1CCC[C@H](Nc2ncc(F)c(N3CCCC3)n2)C1	ZINC001506406994	975152032	/nfs/dbraw/zinc/15/20/32/975152032.db2.gz	NBSJPPAPXUGYAP-NSHDSACASA-N	1	0	279.363	1.722	50	0		CDAARO
CO[C@H]1CN(c2cc(C)[nH+]c3ccccc32)C[C@@H]1O	ZINC001506421691	975158015	/nfs/dbraw/zinc/15/80/15/975158015.db2.gz	KTWOWOKQEVQTDI-GJZGRUSLSA-N	1	0	258.321	1.739	50	0		CDAARO
c1cn(CCC[NH2+][C@@H]2CCN(c3ccccc3)C2)nn1	ZINC001506421393	975158029	/nfs/dbraw/zinc/15/80/29/975158029.db2.gz	PEQFMAIGEJFUBY-CQSZACIVSA-N	1	0	271.368	1.537	50	0		CDAARO
CC(C)Sc1nnc(NC(=O)[C@@H]2CCC[NH2+]C2)s1	ZINC001506421443	975158513	/nfs/dbraw/zinc/15/85/13/975158513.db2.gz	PQZCATVBZPCDMT-MRVPVSSYSA-N	1	0	286.426	1.977	50	0		CDAARO
OC[C@@]1(O)CCC[N@@H+](C2CSCCSC2)CC1	ZINC001506428089	975160686	/nfs/dbraw/zinc/16/06/86/975160686.db2.gz	LZOWAQZTIWAOTK-GFCCVEGCSA-N	1	0	277.455	1.044	50	0		CDAARO
Cc1c(C(=O)C(=O)NCC[NH+](C)C)c2ccccc2n1C	ZINC000004062493	230368099	/nfs/dbraw/zinc/36/80/99/230368099.db2.gz	FBJVPXRODFHJGW-UHFFFAOYSA-N	1	0	287.363	1.347	50	0		CDAARO
C[C@H](CCNc1nncc2ccccc21)[NH+]1CCN(C)CC1	ZINC000584903702	341987089	/nfs/dbraw/zinc/98/70/89/341987089.db2.gz	KLJRWSLDFIYSPG-CQSZACIVSA-N	1	0	299.422	1.490	50	0		CDAARO
C[C@@H](CCC(=O)NCCc1cn[nH]c1)[NH+]1CCCC1	ZINC000426689965	230426697	/nfs/dbraw/zinc/42/66/97/230426697.db2.gz	VFIJNLZKUDFQJR-LBPRGKRZSA-N	1	0	264.373	1.333	50	0		CDAARO
C(c1nnc(C2CCC2)o1)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000107498291	398149283	/nfs/dbraw/zinc/14/92/83/398149283.db2.gz	PNQXGLIKTKDDHI-LBPRGKRZSA-N	1	0	262.357	1.617	50	0		CDAARO
O=C1CCC(=O)N1C1CCC([NH2+][C@@H]2CCCSC2)CC1	ZINC000097370905	342002259	/nfs/dbraw/zinc/00/22/59/342002259.db2.gz	XDSZMRARQXKXKB-OTTFEQOBSA-N	1	0	296.436	1.932	50	0		CDAARO
CNc1cc(C(=O)N2CCC[C@@H](C[NH3+])C2)cc(Cl)n1	ZINC000095971557	185048796	/nfs/dbraw/zinc/04/87/96/185048796.db2.gz	DXTBXXAVJSFSIT-VIFPVBQESA-N	1	0	282.775	1.588	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H](C[NH3+])C2CC2)c(F)c1	ZINC000095972647	185049303	/nfs/dbraw/zinc/04/93/03/185049303.db2.gz	RMQDIQLFFVMVII-NSHDSACASA-N	1	0	272.345	1.150	50	0		CDAARO
O=C1[C@@H]([NH2+][C@@H]2CCOC2)CCN1CCCc1ccccc1	ZINC000095983710	185053754	/nfs/dbraw/zinc/05/37/54/185053754.db2.gz	RPSWKEMQYYHKNI-CVEARBPZSA-N	1	0	288.391	1.599	50	0		CDAARO
CC(C)OCCCNC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@@H]21	ZINC000095996138	185060532	/nfs/dbraw/zinc/06/05/32/185060532.db2.gz	QHTCHXFIBBHPMS-GJZGRUSLSA-N	1	0	297.443	1.927	50	0		CDAARO
COC(=O)N1CCC([NH2+]C2Cc3ccccc3C2)CC1	ZINC000089401052	539087467	/nfs/dbraw/zinc/08/74/67/539087467.db2.gz	SCUMDXVGXWXPBG-UHFFFAOYSA-N	1	0	274.364	1.974	50	0		CDAARO
COCCc1noc(CCC[NH+]2CCCCC2)n1	ZINC000096132441	185104450	/nfs/dbraw/zinc/10/44/50/185104450.db2.gz	LJZAJTXRXNSKJI-UHFFFAOYSA-N	1	0	253.346	1.677	50	0		CDAARO
C[C@@H](Cc1ccc(F)cc1)NC(=O)[C@]1(F)CC[NH2+]C1	ZINC000195543194	342626638	/nfs/dbraw/zinc/62/66/38/342626638.db2.gz	URGUCRVKWWWDBN-HZMBPMFUSA-N	1	0	268.307	1.575	50	0		CDAARO
CCOc1ccc(NC(=O)C[NH2+]CCOC)cc1C	ZINC000195543344	342626724	/nfs/dbraw/zinc/62/67/24/342626724.db2.gz	SHGVGFABRUNNBK-UHFFFAOYSA-N	1	0	266.341	1.568	50	0		CDAARO
C[C@@H](C(=O)NC(N)=O)[N@@H+]1CCC[C@H]1c1ccsc1	ZINC000252517929	361849870	/nfs/dbraw/zinc/84/98/70/361849870.db2.gz	VHDAOFYZGHRVBA-WPRPVWTQSA-N	1	0	267.354	1.468	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1csc(C2CC2)n1	ZINC000125411768	187183797	/nfs/dbraw/zinc/18/37/97/187183797.db2.gz	WOYOQIWVAMKFJE-QMMMGPOBSA-N	1	0	251.355	1.454	50	0		CDAARO
Cc1cccc(NC(=O)CC[N@@H+]2CC[C@@](O)(CO)C2)c1C	ZINC000244884244	361869183	/nfs/dbraw/zinc/86/91/83/361869183.db2.gz	YIHPIQQCBGZUHE-INIZCTEOSA-N	1	0	292.379	1.061	50	0		CDAARO
Cc1cc[nH+]c(NC[C@H]2CCN([C@@H]3CCOC3=O)C2)c1	ZINC000065463571	361907123	/nfs/dbraw/zinc/90/71/23/361907123.db2.gz	ODBBIHYUFPAAHP-CHWSQXEVSA-N	1	0	275.352	1.439	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1cc(C)cc(F)c1	ZINC000097229411	342204799	/nfs/dbraw/zinc/20/47/99/342204799.db2.gz	KYGAATWFZWMXTK-LLVKDONJSA-N	1	0	274.361	1.540	50	0		CDAARO
C[C@H](CC(=O)N1CCCCCC1)[NH2+][C@@]1(C)CCOC1	ZINC000097231654	342205366	/nfs/dbraw/zinc/20/53/66/342205366.db2.gz	YLXOPQJUXHMDTF-HIFRSBDPSA-N	1	0	268.401	1.936	50	0		CDAARO
CC1(c2ccccc2)CC[NH+](CCNS(C)(=O)=O)CC1	ZINC000097021019	185153457	/nfs/dbraw/zinc/15/34/57/185153457.db2.gz	DPMMSYFXQCVHBE-UHFFFAOYSA-N	1	0	296.436	1.589	50	0		CDAARO
Cc1ccc(NC(=O)C(=O)N2CCC[N@@H+](C)CC2)cc1C	ZINC000096997145	185148941	/nfs/dbraw/zinc/14/89/41/185148941.db2.gz	ODLGIFZQNUWIBN-UHFFFAOYSA-N	1	0	289.379	1.406	50	0		CDAARO
COCCCC1(C[N@@H+]2CCCN(C=O)CC2)CCC1	ZINC000585136733	342216077	/nfs/dbraw/zinc/21/60/77/342216077.db2.gz	QXJGFIDPUKXWAZ-UHFFFAOYSA-N	1	0	268.401	1.747	50	0		CDAARO
O=C(Nc1ccc(-c2cc[nH]n2)cc1)[C@H]1CCC[NH2+]1	ZINC000037045321	539082958	/nfs/dbraw/zinc/08/29/58/539082958.db2.gz	YQLXKOCPSYCFKJ-CYBMUJFWSA-N	1	0	256.309	1.767	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@@H]1C[N@@H+](C)C[C@H]1C	ZINC000257365990	539096172	/nfs/dbraw/zinc/09/61/72/539096172.db2.gz	FKGJHZJSEDWKHW-ZYHUDNBSSA-N	1	0	286.372	1.363	50	0		CDAARO
CCCCOc1ncccc1CNC(=O)[C@H](C)[NH+](C)C	ZINC000584907742	539102383	/nfs/dbraw/zinc/10/23/83/539102383.db2.gz	FMQXKQJHQPELDA-LBPRGKRZSA-N	1	0	279.384	1.827	50	0		CDAARO
COc1cccc(CN2C[C@H](C)[NH2+]C[C@@H]2[C@H](C)O)c1	ZINC000072233534	342273277	/nfs/dbraw/zinc/27/32/77/342273277.db2.gz	SBXUEXTUQONRQQ-SLEUVZQESA-N	1	0	264.369	1.238	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)CCc1nncn1-c1ccccc1	ZINC000125739034	187198553	/nfs/dbraw/zinc/19/85/53/187198553.db2.gz	RNWJGQBSAAYEBS-ZDUSSCGKSA-N	1	0	299.378	1.020	50	0		CDAARO
Cc1cc(C(=O)NCC23CCC[NH+]2CCC3)ns1	ZINC000585108327	362031791	/nfs/dbraw/zinc/03/17/91/362031791.db2.gz	LOKZXHUPZXVISG-UHFFFAOYSA-N	1	0	265.382	1.810	50	0		CDAARO
CC[C@H]1C(=O)NCCN1Cc1c(C)cccc1OC	ZINC000585117047	362044636	/nfs/dbraw/zinc/04/46/36/362044636.db2.gz	PVZJSMSRPQVTSA-ZDUSSCGKSA-N	1	0	262.353	1.714	50	0		CDAARO
C[C@@H](CCCO)NC(=O)NC[C@]1([NH+](C)C)CCC[C@@H](C)C1	ZINC000088505834	342386389	/nfs/dbraw/zinc/38/63/89/342386389.db2.gz	LALSGSIABHABLH-YCPHGPKFSA-N	1	0	299.459	1.957	50	0		CDAARO
Cn1ccc(CN2CC[NH+](C3CCCC3)CC2)cc1=O	ZINC000051685215	344834172	/nfs/dbraw/zinc/83/41/72/344834172.db2.gz	HMRWKBRXHLFLPR-UHFFFAOYSA-N	1	0	275.396	1.446	50	0		CDAARO
Cc1noc2ncc(C(=O)NC[C@H](C3CC3)[NH+](C)C)cc12	ZINC000084067910	178783518	/nfs/dbraw/zinc/78/35/18/178783518.db2.gz	IFAJSHQKMRGKPO-CYBMUJFWSA-N	1	0	288.351	1.601	50	0		CDAARO
Cc1cnn([C@@H](C)CNC(=O)Cn2ccnc2C)c1	ZINC000534661253	345510329	/nfs/dbraw/zinc/51/03/29/345510329.db2.gz	OHAOQGBKNUBYMB-NSHDSACASA-N	1	0	261.329	1.074	50	0		CDAARO
CC(C)[N@@H+]1CCO[C@H](CC(=O)NCCc2ccco2)C1	ZINC000097553393	185626797	/nfs/dbraw/zinc/62/67/97/185626797.db2.gz	QZERARKDLQPYCR-CQSZACIVSA-N	1	0	280.368	1.438	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)C2CCCC2)CC1	ZINC000085467892	179072982	/nfs/dbraw/zinc/07/29/82/179072982.db2.gz	CLRUEKBJBMDXII-UHFFFAOYSA-N	1	0	254.374	1.404	50	0		CDAARO
CCn1cc(C[NH2+]C[C@@H]2CCO[C@H]2c2cnn(C)c2)cn1	ZINC000089306036	346755994	/nfs/dbraw/zinc/75/59/94/346755994.db2.gz	AYWCLUAOFFXEQM-DZGCQCFKSA-N	1	0	289.383	1.504	50	0		CDAARO
Cc1c[nH]c(C(=O)N(C)CC[N@H+](C)C2CCCC2)n1	ZINC000584888026	349346337	/nfs/dbraw/zinc/34/63/37/349346337.db2.gz	HSOKFJZQGIHMQB-UHFFFAOYSA-N	1	0	264.373	1.665	50	0		CDAARO
C[N@@H+]1CC[C@]2(C1)CCCN(C(=O)c1cnc(N)s1)C2	ZINC000584897557	349359171	/nfs/dbraw/zinc/35/91/71/349359171.db2.gz	JRUOPQLLDLNLCX-ZDUSSCGKSA-N	1	0	280.397	1.114	50	0		CDAARO
CC1(CCC(=O)NCCC[N@@H+]2CCC[C@@H](O)C2)CC1	ZINC000584897870	349359810	/nfs/dbraw/zinc/35/98/10/349359810.db2.gz	VZLPQSILXSLQCQ-CYBMUJFWSA-N	1	0	268.401	1.530	50	0		CDAARO
Nc1ncc(C(=O)N2CCC[C@H](C[NH+]3CCCC3)C2)s1	ZINC000584897971	349359867	/nfs/dbraw/zinc/35/98/67/349359867.db2.gz	AZJSNARXVXXCFP-LLVKDONJSA-N	1	0	294.424	1.504	50	0		CDAARO
Cc1nc[nH]c1C(=O)N1CC[NH+](CC2CCCC2)CC1	ZINC000584900562	349362388	/nfs/dbraw/zinc/36/23/88/349362388.db2.gz	NVSODVJMWXBTMS-UHFFFAOYSA-N	1	0	276.384	1.666	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)CCCc1cccs1	ZINC000584900776	349363107	/nfs/dbraw/zinc/36/31/07/349363107.db2.gz	DEMCDEGIWOCYSR-KBPBESRZSA-N	1	0	296.436	1.906	50	0		CDAARO
COc1ccc2c(c1)CCC[C@@H]2[NH2+]C[C@@]1(O)CCOC1	ZINC000090848583	180045101	/nfs/dbraw/zinc/04/51/01/180045101.db2.gz	RKGWXDASLRSJAW-HOTGVXAUSA-N	1	0	277.364	1.814	50	0		CDAARO
C[C@@H]1CN(C(=O)c2csc(CC[NH3+])n2)CC(C)(C)O1	ZINC000090953367	180074155	/nfs/dbraw/zinc/07/41/55/180074155.db2.gz	KWTITTCDJRJXGX-SECBINFHSA-N	1	0	283.397	1.284	50	0		CDAARO
CCCN(C(=O)c1ccncc1Cl)[C@@H]1CC[NH2+]C1	ZINC000091456947	180160442	/nfs/dbraw/zinc/16/04/42/180160442.db2.gz	CEGSYUSEYXLSKL-SNVBAGLBSA-N	1	0	267.760	1.949	50	0		CDAARO
C[C@@H]1C[N@H+](CC(=O)N2CCCCCC2)C[C@@]1(O)C1CC1	ZINC000091381011	180143892	/nfs/dbraw/zinc/14/38/92/180143892.db2.gz	MTTKRJKQVMRWDM-CJNGLKHVSA-N	1	0	280.412	1.482	50	0		CDAARO
CN(C)c1ccccc1C(=O)N1C[C@H]2CC[C@@H]1C[N@H+](C)C2	ZINC000091416978	180149757	/nfs/dbraw/zinc/14/97/57/180149757.db2.gz	GFVOJXJVNZUCOK-UONOGXRCSA-N	1	0	287.407	1.919	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1NCCc1csc(N)n1	ZINC000091694533	180228539	/nfs/dbraw/zinc/22/85/39/180228539.db2.gz	GJWGIWDOVLEOEM-UHFFFAOYSA-N	1	0	278.385	1.623	50	0		CDAARO
O=c1cc(C[NH2+]C[C@@H]2CCOC2)[nH]c2c(F)cccc12	ZINC000091769892	180249153	/nfs/dbraw/zinc/24/91/53/180249153.db2.gz	YFAAPKMRVXJMFA-JTQLQIEISA-N	1	0	276.311	1.793	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2csc(NC)n2)C[C@@H]1[NH3+]	ZINC000091819571	180264037	/nfs/dbraw/zinc/26/40/37/180264037.db2.gz	LJQRGKSCIANHLA-IUCAKERBSA-N	1	0	268.386	1.384	50	0		CDAARO
COC[C@]1(O)CC[N@H+](Cc2cc(C)no2)CC1(C)C	ZINC000091893604	180281697	/nfs/dbraw/zinc/28/16/97/180281697.db2.gz	VCZJEBVYVQYKTH-CQSZACIVSA-N	1	0	268.357	1.592	50	0		CDAARO
Cc1cc(C(=O)NC[C@@H](C)[N@@H+]2CCC[C@@H](C)C2)on1	ZINC000106078735	186102076	/nfs/dbraw/zinc/10/20/76/186102076.db2.gz	KYYLVJDSPNMFLV-ZYHUDNBSSA-N	1	0	265.357	1.833	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(C[C@H](O)c2cccc(F)c2)C[C@@H]1C	ZINC000106840968	186140028	/nfs/dbraw/zinc/14/00/28/186140028.db2.gz	OIERGGADFLJKQW-XEZPLFJOSA-N	1	0	296.386	1.246	50	0		CDAARO
Cc1cc(NC(=O)[C@H](C)[NH2+][C@H](C)[C@H](C)n2cccn2)on1	ZINC000106845450	186140750	/nfs/dbraw/zinc/14/07/50/186140750.db2.gz	FMENYFCGJOUBQL-WOPDTQHZSA-N	1	0	291.355	1.746	50	0		CDAARO
COc1cccc(CN2CC[N@H+](C[C@H](C)O)[C@H](C)C2)c1	ZINC000106929728	186152894	/nfs/dbraw/zinc/15/28/94/186152894.db2.gz	QLGQAIIUCDWDJE-KGLIPLIRSA-N	1	0	278.396	1.582	50	0		CDAARO
O[C@H]1CN(Cc2ccccc2)CC[N@H+](CC2CCC2)C1	ZINC000108268260	186210296	/nfs/dbraw/zinc/21/02/96/186210296.db2.gz	RTVONXGJSISGIY-KRWDZBQOSA-N	1	0	274.408	1.965	50	0		CDAARO
Cc1noc([C@@H]2C[N@@H+](C[C@@]3(C)CCCS3)CCN2C)n1	ZINC000583651487	366012543	/nfs/dbraw/zinc/01/25/43/366012543.db2.gz	NQTHMCMBEXTWSL-GXTWGEPZSA-N	1	0	296.440	1.952	50	0		CDAARO
O=C1N=NC(CC2CC[NH2+]CC2)N1c1cccs1	ZINC000390827208	351372979	/nfs/dbraw/zinc/37/29/79/351372979.db2.gz	FQNIZALEELLLNQ-UHFFFAOYSA-N	1	0	264.354	1.577	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)c1sccc1OC	ZINC000122582720	187039411	/nfs/dbraw/zinc/03/94/11/187039411.db2.gz	MXKJTHCGZRSMCQ-SECBINFHSA-N	1	0	254.355	1.581	50	0		CDAARO
CN(Cc1cnccn1)C(=O)[C@H](Cc1ccccc1)[NH+](C)C	ZINC000172161732	188785285	/nfs/dbraw/zinc/78/52/85/188785285.db2.gz	INMTZQZONKTMBJ-INIZCTEOSA-N	1	0	298.390	1.608	50	0		CDAARO
COc1cccc([C@@]2(O)CC[S@@](=O)C[C@H]2C[NH+](C)C)c1	ZINC000000347491	355906264	/nfs/dbraw/zinc/90/62/64/355906264.db2.gz	SMRSCUYCLLYTCF-AFBRZQFHSA-N	1	0	297.420	1.213	50	0		CDAARO
Cc1ccccc1OCC(=O)NCC[NH+]1CCCC1	ZINC000000802599	355921799	/nfs/dbraw/zinc/92/17/99/355921799.db2.gz	XCKIOPKMXKLHLF-UHFFFAOYSA-N	1	0	262.353	1.586	50	0		CDAARO
OCCC[NH+]1CCN(c2cccc(Cl)c2)CC1	ZINC000001760340	355951317	/nfs/dbraw/zinc/95/13/17/355951317.db2.gz	MHOVZUZZHTZBSV-UHFFFAOYSA-N	1	0	254.761	1.844	50	0		CDAARO
COc1cc(CNCCC[NH+](C)C)cc(OC)c1OC	ZINC000002518426	355972689	/nfs/dbraw/zinc/97/26/89/355972689.db2.gz	UEQSXXIWIFDWFA-UHFFFAOYSA-N	1	0	282.384	1.754	50	0		CDAARO
OC[C@@H](Cc1ccccc1)[NH2+]C[C@@H](O)C(F)(F)F	ZINC000004092337	356017717	/nfs/dbraw/zinc/01/77/17/356017717.db2.gz	SJSOKMKUAWKDDB-GHMZBOCLSA-N	1	0	263.259	1.103	50	0		CDAARO
COc1ccccc1C/C(C)=C\C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000255387389	356076502	/nfs/dbraw/zinc/07/65/02/356076502.db2.gz	BRVIVNNVNXMSHI-ZVHGMHCTSA-N	1	0	288.391	1.991	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1Cn1cnc2ccncc2c1=O	ZINC000032547797	356229458	/nfs/dbraw/zinc/22/94/58/356229458.db2.gz	GUZTVLIQQLTXAN-LBPRGKRZSA-N	1	0	272.352	1.666	50	0		CDAARO
O=S(=O)(NCCC[NH+]1CCCC1)c1ccccc1	ZINC000010450149	356258645	/nfs/dbraw/zinc/25/86/45/356258645.db2.gz	RVBTTZXRZCJEJB-UHFFFAOYSA-N	1	0	268.382	1.451	50	0		CDAARO
CC[N@H+](CCO)Cc1cc(=O)oc2ccc(C)cc12	ZINC000004340557	356304195	/nfs/dbraw/zinc/30/41/95/356304195.db2.gz	XCCUBVUBLRROHC-UHFFFAOYSA-N	1	0	261.321	1.916	50	0		CDAARO
COc1cccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c1OC	ZINC000016662907	356444603	/nfs/dbraw/zinc/44/46/03/356444603.db2.gz	GFIMNBNCNRKENT-GFCCVEGCSA-N	1	0	278.352	1.401	50	0		CDAARO
OCC[C@H]1C[NH2+]CCN1Cc1cccc(F)c1F	ZINC000019368002	356483362	/nfs/dbraw/zinc/48/33/62/356483362.db2.gz	DIGXPLSBVULGPI-NSHDSACASA-N	1	0	256.296	1.121	50	0		CDAARO
O=C(c1ccc(Cl)cc1F)N1CCC[NH2+]CC1	ZINC000019397316	356483864	/nfs/dbraw/zinc/48/38/64/356483864.db2.gz	AQJHIMLEFVDDAY-UHFFFAOYSA-N	1	0	256.708	1.915	50	0		CDAARO
COc1cc(CN2CC[NH2+]CC2)cc(OC)c1OC	ZINC000019781718	356502758	/nfs/dbraw/zinc/50/27/58/356502758.db2.gz	OVEVYSWOILUFMF-UHFFFAOYSA-N	1	0	266.341	1.118	50	0	in-vitro	CDAARO
CC[NH+]1CCN(CC(=O)N2c3ccccc3C[C@H]2C)CC1	ZINC000019899634	356514927	/nfs/dbraw/zinc/51/49/27/356514927.db2.gz	JMNXWFGBYXLBAQ-CQSZACIVSA-N	1	0	287.407	1.602	50	0		CDAARO
[NH3+][C@H](CCN1CCOCC1)c1ccc2c(c1)OCCO2	ZINC000020274124	356534939	/nfs/dbraw/zinc/53/49/39/356534939.db2.gz	QRSDCQDDHYLZGL-CYBMUJFWSA-N	1	0	278.352	1.180	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(c2cnc3ccccc3n2)C[C@H]1C	ZINC000247130748	356668929	/nfs/dbraw/zinc/66/89/29/356668929.db2.gz	KJQDZROGKDMIOC-OLZOCXBDSA-N	1	0	286.379	1.521	50	0		CDAARO
Cc1cccn2c(=O)cc(CN3CCOC[C@H]3C)nc12	ZINC000026451528	356693537	/nfs/dbraw/zinc/69/35/37/356693537.db2.gz	XRRRQNGTTVHFKO-GFCCVEGCSA-N	1	0	273.336	1.224	50	0		CDAARO
C[C@@H](C(=O)NC1CCCCCC1)[NH+]1CCC(C(N)=O)CC1	ZINC000026467642	356693746	/nfs/dbraw/zinc/69/37/46/356693746.db2.gz	VCDDRHXYNGKESJ-LBPRGKRZSA-N	1	0	295.427	1.411	50	0		CDAARO
CCn1nc(C)c(CN2CC[N@H+](C)[C@H](CCO)C2)c1C	ZINC000039380757	356972156	/nfs/dbraw/zinc/97/21/56/356972156.db2.gz	JEQIMUDBQHGGEB-CQSZACIVSA-N	1	0	280.416	1.018	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)c2ccc(Cl)cc2O)C1	ZINC000050246025	357233704	/nfs/dbraw/zinc/23/37/04/357233704.db2.gz	JCFBYPOFCXWISP-QMMMGPOBSA-N	1	0	254.717	1.466	50	0		CDAARO
[NH3+]CCCN1CCN(c2ccccc2Cl)CC1	ZINC000054009812	357305744	/nfs/dbraw/zinc/30/57/44/357305744.db2.gz	UOJJKDOJCHDJQF-UHFFFAOYSA-N	1	0	253.777	1.811	50	0		CDAARO
Cc1ccc(C)c(NC(=O)N2C[C@H]([NH+](C)C)C[C@H]2CO)c1	ZINC000065381094	357533486	/nfs/dbraw/zinc/53/34/86/357533486.db2.gz	RRNZDGTYTFSNDU-KGLIPLIRSA-N	1	0	291.395	1.832	50	0		CDAARO
COC[C@@H](C)[NH2+]CC(=O)Nc1ccc(F)cc1C	ZINC000065506313	357545881	/nfs/dbraw/zinc/54/58/81/357545881.db2.gz	OZEDYTYPFFTZHR-SNVBAGLBSA-N	1	0	254.305	1.697	50	0		CDAARO
Nc1nc(CCNC(=O)C[NH+]2CCCCCC2)cs1	ZINC000065505942	357546048	/nfs/dbraw/zinc/54/60/48/357546048.db2.gz	OGYGTIJGRMDYHF-UHFFFAOYSA-N	1	0	282.413	1.260	50	0		CDAARO
O=c1c2c(ncn1C[C@@H]1CCCO1)sc1c2CC[NH2+]C1	ZINC000065534024	357547828	/nfs/dbraw/zinc/54/78/28/357547828.db2.gz	HSFJISIYORYDNL-VIFPVBQESA-N	1	0	291.376	1.283	50	0		CDAARO
O=C(CCc1ccccc1O)N1CCC[C@]2(CC[NH2+]C2)C1	ZINC000067726263	357621584	/nfs/dbraw/zinc/62/15/84/357621584.db2.gz	BQAMHCDPSVFJTP-QGZVFWFLSA-N	1	0	288.391	1.927	50	0		CDAARO
O[C@H]1CC[N@H+](Cc2cnc3c(-c4ccccc4)cnn3c2)C1	ZINC000067842018	357630978	/nfs/dbraw/zinc/63/09/78/357630978.db2.gz	UXORTRCOZHHLHD-HNNXBMFYSA-N	1	0	294.358	1.963	50	0		CDAARO
c1cncc(NCCNc2ncnc3c2CC[NH2+]CC3)c1	ZINC000072421196	357834098	/nfs/dbraw/zinc/83/40/98/357834098.db2.gz	PSHPJLHLGYESAB-UHFFFAOYSA-N	1	0	284.367	1.084	50	0		CDAARO
CC(C)CN1C(=O)CC[C@H]2CN(Cc3ncc[nH]3)CC[C@H]21	ZINC000072462569	357837117	/nfs/dbraw/zinc/83/71/17/357837117.db2.gz	RBBHMYZXOHJBSZ-UONOGXRCSA-N	1	0	290.411	1.879	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)Nc2ccc3c(c2)OCC(=O)N3)C1	ZINC000072476028	357837974	/nfs/dbraw/zinc/83/79/74/357837974.db2.gz	KLFNPQZNNOUWRX-DTWKUNHWSA-N	1	0	275.308	1.083	50	0		CDAARO
C(c1nc2c(c(N3CCC3)n1)CC[NH2+]CC2)C1CC1	ZINC000072476093	357838144	/nfs/dbraw/zinc/83/81/44/357838144.db2.gz	NZXHIFMFJWPBDV-UHFFFAOYSA-N	1	0	258.369	1.327	50	0		CDAARO
CC(C)(C[NH3+])NS(=O)(=O)c1cc(F)ccc1Cl	ZINC000097229261	358043577	/nfs/dbraw/zinc/04/35/77/358043577.db2.gz	OVQZSILEKGQVDQ-UHFFFAOYSA-N	1	0	280.752	1.495	50	0		CDAARO
CCCc1cc(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@@H+]3C)n(C)n1	ZINC000082086933	358145965	/nfs/dbraw/zinc/14/59/65/358145965.db2.gz	GEZXUFUARLZBGU-UONOGXRCSA-N	1	0	290.411	1.681	50	0		CDAARO
O=C(NC[C@H]1C[N@H+](Cc2ccccc2)CCCO1)C(F)F	ZINC000194900602	358544282	/nfs/dbraw/zinc/54/42/82/358544282.db2.gz	GEGFYIVAHIEDKV-ZDUSSCGKSA-N	1	0	298.333	1.659	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)COc2ccc(F)cc2F)C1	ZINC000195117832	358551353	/nfs/dbraw/zinc/55/13/53/358551353.db2.gz	MCBSOICJZBTWET-JTQLQIEISA-N	1	0	270.279	1.293	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CC(=O)N1CC(c2ccncc2)C1	ZINC000426399019	358528951	/nfs/dbraw/zinc/52/89/51/358528951.db2.gz	KQKAPHKPNKWFIW-OAHLLOKOSA-N	1	0	273.380	1.882	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNc1ncc(F)c(N(C)C)n1	ZINC000095365584	358686226	/nfs/dbraw/zinc/68/62/26/358686226.db2.gz	UCDWVUZKRYHKFS-SNVBAGLBSA-N	1	0	267.352	1.578	50	0		CDAARO
O=C(NC[C@@H]1C[C@H](F)C[NH2+]1)Nc1ccc2c(c1)OCO2	ZINC000097619707	358788533	/nfs/dbraw/zinc/78/85/33/358788533.db2.gz	GFLCFJDKILJTGK-WPRPVWTQSA-N	1	0	281.287	1.237	50	0		CDAARO
CCn1nc(C)c(C[N@@H+]2CCC[C@H]2CCO)c1C	ZINC000097772852	358797162	/nfs/dbraw/zinc/79/71/62/358797162.db2.gz	MRWLWLQEVQBVPZ-ZDUSSCGKSA-N	1	0	251.374	1.867	50	0		CDAARO
COC[C@@H]1CC[N@H+](Cc2ccc3c(c2)OCCO3)C1	ZINC000215472981	358889965	/nfs/dbraw/zinc/88/99/65/358889965.db2.gz	CKTUCHUTVOVUDT-CYBMUJFWSA-N	1	0	263.337	1.926	50	0		CDAARO
COCc1cc(CNc2cc(C3CC([NH3+])C3)ncn2)[nH]n1	ZINC000219105843	359078360	/nfs/dbraw/zinc/07/83/60/359078360.db2.gz	BMVXHMPVVASUKJ-UHFFFAOYSA-N	1	0	288.355	1.163	50	0		CDAARO
O=C(CC[N@@H+]1C[C@@H]2CC[C@H]1C2)NCCc1cscn1	ZINC000219597971	359106994	/nfs/dbraw/zinc/10/69/94/359106994.db2.gz	YIHCPDYPYICLPG-YPMHNXCESA-N	1	0	279.409	1.676	50	0		CDAARO
Cc1ccc(F)cc1CC(=O)N1C[C@H]([NH+](C)C)C[C@H]1CO	ZINC000222514871	359350607	/nfs/dbraw/zinc/35/06/07/359350607.db2.gz	PPFZUXCOICSDKS-CABCVRRESA-N	1	0	294.370	1.200	50	0		CDAARO
Cc1noc(C)c1C(=O)NCCNc1cc[nH+]cc1C	ZINC000223598934	359437527	/nfs/dbraw/zinc/43/75/27/359437527.db2.gz	JEDWDFMNSWNTEY-UHFFFAOYSA-N	1	0	274.324	1.837	50	0		CDAARO
Cc1ccc(C(=O)N2CCC(OCCC[NH3+])CC2)o1	ZINC000094071181	359667181	/nfs/dbraw/zinc/66/71/81/359667181.db2.gz	JFGNTLSHCJFLCH-UHFFFAOYSA-N	1	0	266.341	1.558	50	0		CDAARO
CC(C)[N@@H+](CC(N)=O)C[C@@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC000408518894	359910258	/nfs/dbraw/zinc/91/02/58/359910258.db2.gz	IUJJTNJLQRMREL-CYBMUJFWSA-N	1	0	297.443	1.467	50	0		CDAARO
Cc1ccsc1[C@H](C)[NH2+]CCN1CCCS1(=O)=O	ZINC000089519977	360137665	/nfs/dbraw/zinc/13/76/65/360137665.db2.gz	BJTAZSQTJHMPCF-NSHDSACASA-N	1	0	288.438	1.743	50	0		CDAARO
COc1ccc2cc(CN3C[C@@H]([NH3+])[C@H](O)C3)ccc2c1	ZINC000426434140	360529901	/nfs/dbraw/zinc/52/99/01/360529901.db2.gz	QWJLYXDDYQDVHW-HZPDHXFCSA-N	1	0	272.348	1.352	50	0		CDAARO
COc1ccccc1CN(C)C(=O)C1(OC)CC[NH2+]CC1	ZINC000178326038	189107472	/nfs/dbraw/zinc/10/74/72/189107472.db2.gz	JHBLJEPCSFYPNJ-UHFFFAOYSA-N	1	0	292.379	1.422	50	0		CDAARO
[NH3+]CC[C@@H]1CN(Cc2ccc3nsnc3c2)CCO1	ZINC000426498632	360677501	/nfs/dbraw/zinc/67/75/01/360677501.db2.gz	PSPFBEXEDDJJOD-LLVKDONJSA-N	1	0	278.381	1.241	50	0		CDAARO
[NH3+][C@H]1CCN(Cc2ccccc2Cn2cccn2)C1	ZINC000426511833	360678653	/nfs/dbraw/zinc/67/86/53/360678653.db2.gz	WIEPQGLZTNGIRD-HNNXBMFYSA-N	1	0	256.353	1.464	50	0		CDAARO
C[C@@H](C(=O)NCC1(Cn2cccn2)CC1)n1ccnc1	ZINC000426534054	360681423	/nfs/dbraw/zinc/68/14/23/360681423.db2.gz	LNLLRXQOEXTWMH-LBPRGKRZSA-N	1	0	273.340	1.237	50	0		CDAARO
Cc1[nH]nc(C(=O)NCCNc2cc[nH+]cc2C)c1Cl	ZINC000426606833	360688507	/nfs/dbraw/zinc/68/85/07/360688507.db2.gz	YVEJNNZKRVXZQY-UHFFFAOYSA-N	1	0	293.758	1.339	50	0		CDAARO
CC1(CNC(=O)c2cc(F)ccc2OCCC[NH3+])COC1	ZINC000426633711	360692453	/nfs/dbraw/zinc/69/24/53/360692453.db2.gz	AQFCZMTYKDOQBK-UHFFFAOYSA-N	1	0	296.342	1.320	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2ccccc2COC)C1	ZINC000178981419	189158790	/nfs/dbraw/zinc/15/87/90/189158790.db2.gz	QNZXYDIMUIYKIX-LBPRGKRZSA-N	1	0	262.353	1.515	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2ccc(-n3ccnc3)cc2)C1	ZINC000178990718	189160125	/nfs/dbraw/zinc/16/01/25/189160125.db2.gz	MVXVLMXEUVIULR-CYBMUJFWSA-N	1	0	284.363	1.554	50	0		CDAARO
C(=C/c1ccccc1)\CN1CCN([C@H]2CC[NH2+]C2)CC1	ZINC000097425408	360959874	/nfs/dbraw/zinc/95/98/74/360959874.db2.gz	ZQSVRSZNVMQQQU-PFWMLDTASA-N	1	0	271.408	1.679	50	0		CDAARO
CSc1ccccc1NC(=O)NC[C@]1(O)CC[NH2+]C1	ZINC000299777899	200868495	/nfs/dbraw/zinc/86/84/95/200868495.db2.gz	LJARHWYZHBZBHV-ZDUSSCGKSA-N	1	0	281.381	1.254	50	0		CDAARO
Cc1nncn1-c1cccc(NC(=O)[C@H]2CCC[NH2+]2)c1	ZINC000182851702	189337231	/nfs/dbraw/zinc/33/72/31/189337231.db2.gz	SDRAOELPIKHSFG-CYBMUJFWSA-N	1	0	271.324	1.266	50	0		CDAARO
C[C@H](c1cccnc1)N1CC[NH+](CCCCCO)CC1	ZINC000089910022	366966094	/nfs/dbraw/zinc/96/60/94/366966094.db2.gz	XWLWMRYWRVAXRW-OAHLLOKOSA-N	1	0	277.412	1.923	50	0		CDAARO
C[C@@H](CCc1ccco1)[NH2+][C@H]1CC(=O)N(C2CC2)C1	ZINC000090180783	367024499	/nfs/dbraw/zinc/02/44/99/367024499.db2.gz	KYVIERBJCYEFTC-RYUDHWBXSA-N	1	0	262.353	1.954	50	0		CDAARO
C[C@@H]1C[C@H]([NH3+])CCN1C(=O)[C@H]1CCOc2ccccc21	ZINC000252209117	367371794	/nfs/dbraw/zinc/37/17/94/367371794.db2.gz	XSEXYPWORYSNMO-BZPMIXESSA-N	1	0	274.364	1.891	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@H]1CC[NH2+]C[C@@H]1C	ZINC000094345632	367490564	/nfs/dbraw/zinc/49/05/64/367490564.db2.gz	ROVYWRQYKMMRLT-JQWIXIFHSA-N	1	0	286.372	1.410	50	0		CDAARO
CCOCC[N@@H+]1CCN(C[C@@H](O)c2ccccc2)[C@H](C)C1	ZINC000252474774	367535901	/nfs/dbraw/zinc/53/59/01/367535901.db2.gz	MACWBFHZFSCYFM-NVXWUHKLSA-N	1	0	292.423	1.763	50	0		CDAARO
CN(C[C@H]1CCC[N@@H+]1C)C(=O)Cc1ccsc1	ZINC000421705291	244784321	/nfs/dbraw/zinc/78/43/21/244784321.db2.gz	QZABCFARVJMFSA-GFCCVEGCSA-N	1	0	252.383	1.843	50	0		CDAARO
COC(=O)c1c[nH]c(SC[C@@H]2CC[N@H+](C)C2)n1	ZINC000193549790	372041451	/nfs/dbraw/zinc/04/14/51/372041451.db2.gz	HCYPGQKJDMMZAB-MRVPVSSYSA-N	1	0	255.343	1.240	50	0		CDAARO
Cc1cccc2[nH]c(CNC(=O)[C@@H](C)[NH+]3CCCC3)nc21	ZINC000299763676	372748884	/nfs/dbraw/zinc/74/88/84/372748884.db2.gz	ZHYWWQWHLXIMEY-GFCCVEGCSA-N	1	0	286.379	1.972	50	0		CDAARO
Cc1nn[nH]c1C(=O)N[C@H]1CCC[N@@H+](C2CCCCC2)C1	ZINC000299774909	372752752	/nfs/dbraw/zinc/75/27/52/372752752.db2.gz	JARKANOKOJBXAI-LBPRGKRZSA-N	1	0	291.399	1.640	50	0		CDAARO
O=C(NCC[C@@H]1CCC[NH2+]1)Nc1cccc2c[nH]nc21	ZINC000299783485	372758652	/nfs/dbraw/zinc/75/86/52/372758652.db2.gz	VFACNHHORKYACV-NSHDSACASA-N	1	0	273.340	1.827	50	0		CDAARO
COc1ccccc1CC(=O)N1CC[C@H]2[NH2+]CCC[C@@H]2C1	ZINC000299794439	372765909	/nfs/dbraw/zinc/76/59/09/372765909.db2.gz	KFPGFWGFSNCRNC-HUUCEWRRSA-N	1	0	288.391	1.838	50	0		CDAARO
COCCN1CC[N@H+](CCCc2ccccc2)CCC1=O	ZINC000299794861	372766228	/nfs/dbraw/zinc/76/62/28/372766228.db2.gz	KKSLTEGTNFURJA-UHFFFAOYSA-N	1	0	290.407	1.800	50	0		CDAARO
Nc1cc(C(=O)N2CCC[N@@H+](C3CCCC3)CC2)[nH]n1	ZINC000299801503	372771409	/nfs/dbraw/zinc/77/14/09/372771409.db2.gz	ZLTMHFPSVPOFDQ-UHFFFAOYSA-N	1	0	277.372	1.082	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)Nc2snnc2-c2ccccc2)C1	ZINC000299801084	372771553	/nfs/dbraw/zinc/77/15/53/372771553.db2.gz	VRQRXQJXPDEWDL-JTQLQIEISA-N	1	0	289.364	1.770	50	0		CDAARO
CC(C)N1CC[C@H]([NH2+][C@@H]2[C@H]3CCO[C@@H]3C2(C)C)C1=O	ZINC000253370692	373679492	/nfs/dbraw/zinc/67/94/92/373679492.db2.gz	UYKYTYGNRCVPIW-XQHKEYJVSA-N	1	0	266.385	1.399	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)CCc2ccccc2)C[C@H]1CO	ZINC000253402837	373690226	/nfs/dbraw/zinc/69/02/26/373690226.db2.gz	GRILBUNUGYOEFU-LSDHHAIUSA-N	1	0	276.380	1.000	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)Cc2ccc(F)cc2F)C1	ZINC000095067584	373706920	/nfs/dbraw/zinc/70/69/20/373706920.db2.gz	AYSDDTGJFGXUFS-LLVKDONJSA-N	1	0	282.334	1.965	50	0		CDAARO
Cc1nc([C@H]2CN(c3cc[nH+]c(C)c3)CCO2)no1	ZINC000253419376	373728098	/nfs/dbraw/zinc/72/80/98/373728098.db2.gz	RCWSMYHBXHWRLC-GFCCVEGCSA-N	1	0	260.297	1.659	50	0		CDAARO
CCC[C@H]1C[C@@H](C(=O)NCC[N@H+]2CC=CCC2)CCO1	ZINC000253431735	373745548	/nfs/dbraw/zinc/74/55/48/373745548.db2.gz	SZEJOWWYBCMIGM-GJZGRUSLSA-N	1	0	280.412	1.960	50	0		CDAARO
C[C@@H](C(=O)N1CCO[C@@H](C)[C@H]1C)[C@H]([NH3+])c1ccccc1	ZINC000248921661	374206003	/nfs/dbraw/zinc/20/60/03/374206003.db2.gz	FFHNTCYWCXUHCO-CXTNEJHOSA-N	1	0	276.380	1.958	50	0		CDAARO
CCOC(=O)C1(C[C@@H]2CCCCO2)CC[NH2+]CC1	ZINC000067723197	374425792	/nfs/dbraw/zinc/42/57/92/374425792.db2.gz	BUBVWNUKKWLMNE-LBPRGKRZSA-N	1	0	255.358	1.879	50	0		CDAARO
COC(=O)[C@@]12CCC[C@@H]1C[N@H+](Cc1cnn(C)c1C)C2	ZINC000108466430	412829230	/nfs/dbraw/zinc/82/92/30/412829230.db2.gz	HBNPJZPSOGOKLI-UKRRQHHQSA-N	1	0	277.368	1.504	50	0		CDAARO
C[NH+]1CCC(N[C@@H](Cn2cncn2)c2ccccc2)CC1	ZINC000095421764	374923618	/nfs/dbraw/zinc/92/36/18/374923618.db2.gz	DTWWFMXQQBIZKU-INIZCTEOSA-N	1	0	285.395	1.703	50	0		CDAARO
COCc1nc2n(n1)CCC[C@@H]2N[C@H]1CC[N@@H+](C2CC2)C1	ZINC000095423840	374923906	/nfs/dbraw/zinc/92/39/06/374923906.db2.gz	IQFPQVSJNAGNIU-AAEUAGOBSA-N	1	0	291.399	1.086	50	0		CDAARO
CC[C@@H](O)C[NH+]1CCN(Cc2ccc(O)c(OC)c2)CC1	ZINC000095467802	374963430	/nfs/dbraw/zinc/96/34/30/374963430.db2.gz	WVIZXYTVJZJFCI-CQSZACIVSA-N	1	0	294.395	1.289	50	0		CDAARO
O=C(NCC1=COCCO1)[C@H]1CC[N@@H+](C2CCCCC2)C1	ZINC000095407365	374909899	/nfs/dbraw/zinc/90/98/99/374909899.db2.gz	NJOBEGMCXVMKFT-ZDUSSCGKSA-N	1	0	294.395	1.645	50	0		CDAARO
CC(C)[C@H]1C[N@H+](C)CCN1C(=O)Nc1cccnn1	ZINC000096000053	375050278	/nfs/dbraw/zinc/05/02/78/375050278.db2.gz	QWEORKBROPCFFS-LLVKDONJSA-N	1	0	263.345	1.281	50	0		CDAARO
CC(C)COC[C@@H](O)C[NH2+]Cc1c[nH]nc1C(C)(C)C	ZINC000097160041	375150969	/nfs/dbraw/zinc/15/09/69/375150969.db2.gz	MGYPUCZFZFHJIH-ZDUSSCGKSA-N	1	0	283.416	1.830	50	0		CDAARO
C[NH+](C)CCNC(=O)COc1cccc(Cl)c1	ZINC000001781565	375228373	/nfs/dbraw/zinc/22/83/73/375228373.db2.gz	MFBQYWMDGUZVDD-UHFFFAOYSA-N	1	0	256.733	1.397	50	0		CDAARO
COc1nccnc1CN1CC[N@H+](C)C[C@@H]1C(C)C	ZINC000253426366	189991501	/nfs/dbraw/zinc/99/15/01/189991501.db2.gz	ZOPQVQFNVRBLTD-CYBMUJFWSA-N	1	0	264.373	1.257	50	0		CDAARO
Cc1nc(/C=C\C(=O)N2CCCC[C@@H]2C[NH3+])cs1	ZINC000606441720	375823136	/nfs/dbraw/zinc/82/31/36/375823136.db2.gz	SBQGVNRNHUVVFL-FOQNGQEVSA-N	1	0	265.382	1.805	50	0		CDAARO
COCC(=O)N[C@@H]1CCC[N@H+](CCc2ccccc2)C1	ZINC000012715690	377012749	/nfs/dbraw/zinc/01/27/49/377012749.db2.gz	XLPMMNJSSGLKTH-OAHLLOKOSA-N	1	0	276.380	1.456	50	0		CDAARO
COC(=O)[C@H](NC(=O)C[NH+](C)C)c1cc(C)cc(C)c1	ZINC000188880397	377099299	/nfs/dbraw/zinc/09/92/99/377099299.db2.gz	QCXZBEUFHTZGGE-CQSZACIVSA-N	1	0	278.352	1.195	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N(C)[C@H]1CCN(c2ccccc2F)C1=O	ZINC000129854317	377494658	/nfs/dbraw/zinc/49/46/58/377494658.db2.gz	KQOHZPRZBBBVNI-YPMHNXCESA-N	1	0	293.342	1.127	50	0		CDAARO
FC(F)(F)CN1CCN(C[C@H]2CCC[NH2+]C2)CC1	ZINC000061941404	378187719	/nfs/dbraw/zinc/18/77/19/378187719.db2.gz	QWEKGBRGCQTIPA-NSHDSACASA-N	1	0	265.323	1.166	50	0		CDAARO
CN(C)C(=O)c1ccc(C[NH2+]C[C@H]2COc3ccccc32)[nH]1	ZINC000288535202	197105071	/nfs/dbraw/zinc/10/50/71/197105071.db2.gz	KLHBUQIUCFMCES-LBPRGKRZSA-N	1	0	299.374	1.982	50	0		CDAARO
CC[C@H]([NH2+][C@@H](C)C(=O)NC(N)=O)c1ccc(C)cc1	ZINC000012798225	390205641	/nfs/dbraw/zinc/20/56/41/390205641.db2.gz	VBUXGDAJPNQTCS-JQWIXIFHSA-N	1	0	263.341	1.619	50	0		CDAARO
CC(C)(C)CCS(=O)(=O)NC[C@H]1CC[N@@H+](C2CC2)C1	ZINC000096427711	390517357	/nfs/dbraw/zinc/51/73/57/390517357.db2.gz	JLBBFLUANLSGPK-GFCCVEGCSA-N	1	0	288.457	1.826	50	0		CDAARO
CCCCCNC(=O)C[N@@H+]1CC[C@H](CSC)C1	ZINC000096417918	390513137	/nfs/dbraw/zinc/51/31/37/390513137.db2.gz	OPUNODYEASIYGR-LBPRGKRZSA-N	1	0	258.431	1.978	50	0		CDAARO
Cc1cc(N2CCO[C@H](C(F)(F)F)C2)nc(N)[nH+]1	ZINC000072478114	390629058	/nfs/dbraw/zinc/62/90/58/390629058.db2.gz	PYWVZTKPCXUONH-ZETCQYMHSA-N	1	0	262.235	1.135	50	0		CDAARO
CC(C)[N@@H+]1CC[C@H](CN(C)C(=O)c2csnc2N)C1	ZINC000299773193	391721478	/nfs/dbraw/zinc/72/14/78/391721478.db2.gz	CZXAKCWAMURHHB-SNVBAGLBSA-N	1	0	282.413	1.528	50	0		CDAARO
CC(C)(C)OC(=O)[C@@](C)(O)C[NH2+][C@H]1CCC[C@H]2C[C@H]21	ZINC000549376098	391934100	/nfs/dbraw/zinc/93/41/00/391934100.db2.gz	FVDLTYUJOZHBPQ-OXIQGZBJSA-N	1	0	269.385	1.857	50	0		CDAARO
CCCCC[NH2+][C@@H]1CS(=O)(=O)C[C@H]1N1CCCC1	ZINC000089953459	392531340	/nfs/dbraw/zinc/53/13/40/392531340.db2.gz	BMVSEMLBNHMGAH-CHWSQXEVSA-N	1	0	274.430	1.028	50	0		CDAARO
[NH3+][C@H](CO)c1nc2cc(Br)ccc2[nH]1	ZINC000037441215	392809469	/nfs/dbraw/zinc/80/94/69/392809469.db2.gz	MFSOZANVKBGVPQ-ZCFIWIBFSA-N	1	0	256.103	1.318	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[N@H+](CCO)Cc1cnn(C(C)(C)C)c1	ZINC000449675540	392854820	/nfs/dbraw/zinc/85/48/20/392854820.db2.gz	AKTLJBAADQPGJA-JSGCOSHPSA-N	1	0	281.400	1.610	50	0		CDAARO
COC[C@@H](O)C[N@@H+]1CCC[C@H](C(=O)c2ccc(F)cc2)C1	ZINC000096415730	393183854	/nfs/dbraw/zinc/18/38/54/393183854.db2.gz	IHYGCNDBKHHEPY-ZFWWWQNUSA-N	1	0	295.354	1.728	50	0		CDAARO
CC[N@H+](C[C@H](O)COC)[C@@H]1CCN(c2ccccc2)C1=O	ZINC000096409695	393181381	/nfs/dbraw/zinc/18/13/81/393181381.db2.gz	ZMDFTMCWVHVLQY-LSDHHAIUSA-N	1	0	292.379	1.121	50	0		CDAARO
CC[C@@](C)(CC(=O)OC)[NH2+]Cc1cnc(C)cn1	ZINC000084721134	483318235	/nfs/dbraw/zinc/31/82/35/483318235.db2.gz	IRMCAXKXICJHST-ZDUSSCGKSA-N	1	0	251.330	1.606	50	0		CDAARO
CCN(CC)c1ncnc(N2CCC([NH+](C)C)CC2)c1N	ZINC000104799723	397961148	/nfs/dbraw/zinc/96/11/48/397961148.db2.gz	FEONAYJVJCUCIW-UHFFFAOYSA-N	1	0	292.431	1.435	50	0		CDAARO
C[NH2+]CCC(=O)N1CCOC[C@@H]1Cc1ccccc1	ZINC000262223749	149035958	/nfs/dbraw/zinc/03/59/58/149035958.db2.gz	PKFHHNWRZZVUIL-AWEZNQCLSA-N	1	0	262.353	1.066	50	0		CDAARO
c1cnn([C@@H]2CCCC[C@@H]2[NH2+]CC2OCCO2)c1	ZINC000128391251	296637061	/nfs/dbraw/zinc/63/70/61/296637061.db2.gz	JCNUJXUYCKURJX-NWDGAFQWSA-N	1	0	251.330	1.329	50	0		CDAARO
C[C@@H]([NH2+][C@@H](C)Cn1cncn1)c1ccc2c(c1)OCCO2	ZINC000095421183	287049950	/nfs/dbraw/zinc/04/99/50/287049950.db2.gz	JHBWOEMLFHMZSK-NWDGAFQWSA-N	1	0	288.351	1.789	50	0		CDAARO
COc1cccc(OC[C@@H](O)C[NH+]2CCCC2)c1	ZINC000005092328	170065928	/nfs/dbraw/zinc/06/59/28/170065928.db2.gz	PWXXQKICNMWMQW-LBPRGKRZSA-N	1	0	251.326	1.531	50	0		CDAARO
Cc1cc(C)cc(OCC(=O)NCC[NH+](C)C)c1	ZINC000005539421	170110618	/nfs/dbraw/zinc/11/06/18/170110618.db2.gz	HHZLWALYNKDTTL-UHFFFAOYSA-N	1	0	250.342	1.360	50	0		CDAARO
COC(=O)c1ccccc1NC(=O)C[NH2+]CC(C)C	ZINC000006587279	170216177	/nfs/dbraw/zinc/21/61/77/170216177.db2.gz	RQWJOWOGIOUOSO-UHFFFAOYSA-N	1	0	264.325	1.657	50	0		CDAARO
O=C(CSC1=[NH+]CCN1)Nc1ccc(F)cc1	ZINC000006937714	170256952	/nfs/dbraw/zinc/25/69/52/170256952.db2.gz	ZIUDYHZFBURWDC-UHFFFAOYSA-N	1	0	253.302	1.457	50	0		CDAARO
CCNC(=O)C[C@H]1CCCC[N@@H+]1Cc1ncc(C)o1	ZINC000284362791	196039201	/nfs/dbraw/zinc/03/92/01/196039201.db2.gz	DNVSSAJTHOWKNX-GFCCVEGCSA-N	1	0	265.357	1.864	50	0		CDAARO
Cn1c2ccc(C[NH2+]CCCCCO)cc2n(C)c1=O	ZINC000013727117	170582800	/nfs/dbraw/zinc/58/28/00/170582800.db2.gz	CLPVKGRPJRWSKH-UHFFFAOYSA-N	1	0	277.368	1.129	50	0		CDAARO
C[NH+]1CCC(OCCCNc2ncc(F)cn2)CC1	ZINC000534659332	411828488	/nfs/dbraw/zinc/82/84/88/411828488.db2.gz	VXDJLWGWSUZRFF-UHFFFAOYSA-N	1	0	268.336	1.529	50	0		CDAARO
C[NH+]1CCN(C[C@@H](O)c2ccccc2Cl)CC1	ZINC000019785051	170864761	/nfs/dbraw/zinc/86/47/61/170864761.db2.gz	MVWQUQFWZWEKDC-CYBMUJFWSA-N	1	0	254.761	1.621	50	0		CDAARO
Cn1cc(C[NH2+]CCN2CCOCC2)c2ccccc21	ZINC000022440835	171387371	/nfs/dbraw/zinc/38/73/71/171387371.db2.gz	QYLWPTZTJWQQIO-UHFFFAOYSA-N	1	0	273.380	1.600	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]CCN2CCCCC2)CC1	ZINC000022455532	171388209	/nfs/dbraw/zinc/38/82/09/171388209.db2.gz	REJICKZINJKPSV-UHFFFAOYSA-N	1	0	283.416	1.683	50	0		CDAARO
CC(=O)NCC[NH2+]C1CCN(c2ccccc2)CC1	ZINC000119599088	412107071	/nfs/dbraw/zinc/10/70/71/412107071.db2.gz	PMHLAWBVDAJZFW-UHFFFAOYSA-N	1	0	261.369	1.381	50	0		CDAARO
[NH3+]C1(C(=O)Nc2cnc3c(F)cccc3c2)CCOCC1	ZINC000659342983	413733903	/nfs/dbraw/zinc/73/39/03/413733903.db2.gz	ORTFMBAYPPECLD-UHFFFAOYSA-N	1	0	289.310	1.820	50	0		CDAARO
NC(=O)N1CCC([NH2+][C@@H]2CCC[C@H]2n2ccnc2)CC1	ZINC000037314057	173115884	/nfs/dbraw/zinc/11/58/84/173115884.db2.gz	XCYRZWGSEXYOKU-CHWSQXEVSA-N	1	0	277.372	1.109	50	0		CDAARO
Brc1ccc(OC2CC[NH2+]CC2)nc1	ZINC000038303108	174139047	/nfs/dbraw/zinc/13/90/47/174139047.db2.gz	KJUHOECMLFFCCB-UHFFFAOYSA-N	1	0	257.131	1.975	50	0		CDAARO
COc1ccccc1/C=C/CN1CC[NH2+]C[C@H]1CCO	ZINC000038534545	174144974	/nfs/dbraw/zinc/14/49/74/174144974.db2.gz	YAISVYPTRHXCFH-CSPWOOARSA-N	1	0	276.380	1.365	50	0		CDAARO
O=C(NCCc1ccccn1)[C@H]1CC12CC[NH2+]CC2	ZINC000070252124	175884235	/nfs/dbraw/zinc/88/42/35/175884235.db2.gz	DUWUHQVACUNAEP-CYBMUJFWSA-N	1	0	259.353	1.130	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(C(=O)c2cnn3cccnc23)CC1	ZINC000072127201	176320553	/nfs/dbraw/zinc/32/05/53/176320553.db2.gz	WITMQBPRSQMKRI-LBPRGKRZSA-N	1	0	287.367	1.286	50	0		CDAARO
Cc1cnc(CNC(=O)c2cccc([C@H]3CC[NH2+]C3)c2)cn1	ZINC000072165881	176330930	/nfs/dbraw/zinc/33/09/30/176330930.db2.gz	QHLUXLJRDVEHRL-HNNXBMFYSA-N	1	0	296.374	1.792	50	0		CDAARO
COC[C@@H](C)Nc1nc(-c2ccccn2)nc2c1CC[NH2+]C2	ZINC000072166214	176331544	/nfs/dbraw/zinc/33/15/44/176331544.db2.gz	SHLCQNKLUXZCGQ-LLVKDONJSA-N	1	0	299.378	1.631	50	0		CDAARO
CN(C)C(=O)C1(CCCc2ccccn2)CC[NH2+]CC1	ZINC000072343786	176372136	/nfs/dbraw/zinc/37/21/36/176372136.db2.gz	HKTVKFWHYKNCNN-UHFFFAOYSA-N	1	0	275.396	1.862	50	0		CDAARO
O[C@H]1COCC[N@H+](CCCOCc2ccccc2)C1	ZINC000077505619	177276120	/nfs/dbraw/zinc/27/61/20/177276120.db2.gz	YXOYLBVUQPQDPQ-OAHLLOKOSA-N	1	0	265.353	1.286	50	0		CDAARO
CC[C@@H]1CN(C(=O)c2cc(C)n[nH]2)CC[N@@H+]1C(C)C	ZINC000077564329	177281304	/nfs/dbraw/zinc/28/13/04/177281304.db2.gz	AYOUAAXPJWYJOS-GFCCVEGCSA-N	1	0	264.373	1.663	50	0		CDAARO
COc1ccc(Cl)cc1N1C(=O)[C@@H]2C[C@H]1C[NH2+]2	ZINC000299765926	274111895	/nfs/dbraw/zinc/11/18/95/274111895.db2.gz	ZXEKYXQPSGRJFC-IUCAKERBSA-N	1	0	252.701	1.426	50	0		CDAARO
c1ccc2c(c1)CC[N@@H+](C1CCN(c3ncncn3)CC1)C2	ZINC000223281587	275069395	/nfs/dbraw/zinc/06/93/95/275069395.db2.gz	IBZFXIPHOIXKSA-UHFFFAOYSA-N	1	0	295.390	1.899	50	0		CDAARO
c1nc2ncnc(N3CC[NH+](Cc4ccccc4)CC3)c2[nH]1	ZINC000006530542	275076776	/nfs/dbraw/zinc/07/67/76/275076776.db2.gz	FVIDDZWAAFMKKE-UHFFFAOYSA-N	1	0	294.362	1.675	50	0		CDAARO
CC[C@H]([NH3+])C(=O)Nc1nc2c(s1)C(=O)CCC2	ZINC000095996127	276578366	/nfs/dbraw/zinc/57/83/66/276578366.db2.gz	BQQLNAWIIXKYRQ-LURJTMIESA-N	1	0	253.327	1.338	50	0		CDAARO
CCn1nc(C(=O)NC)c2c1CC[C@H]([NH2+]CC(C)C)C2	ZINC000014538978	276721236	/nfs/dbraw/zinc/72/12/36/276721236.db2.gz	VODKPHKQNVTKPF-NSHDSACASA-N	1	0	278.400	1.366	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CC(=O)N1CCC(c2cc[nH]n2)CC1	ZINC000426698455	277045413	/nfs/dbraw/zinc/04/54/13/277045413.db2.gz	PQJKVQPYDYBPQJ-AWEZNQCLSA-N	1	0	290.411	1.990	50	0		CDAARO
CC(C)(C)OC(=O)N1C[C@H](C[NH3+])CC(F)(F)C1	ZINC000091692688	277196019	/nfs/dbraw/zinc/19/60/19/277196019.db2.gz	PZRLKSYZJHAEEK-QMMMGPOBSA-N	1	0	250.289	1.837	50	0		CDAARO
Cc1ccccc1[C@H](CN1CCOCC1)[NH2+][C@@H](C)CO	ZINC000183687012	302184772	/nfs/dbraw/zinc/18/47/72/302184772.db2.gz	XIRSHNFBPJCKQA-HOCLYGCPSA-N	1	0	278.396	1.339	50	0		CDAARO
[NH3+]C[C@H]1CCN(CC(=O)NC2CCCCCCC2)C1	ZINC000534587808	328316317	/nfs/dbraw/zinc/31/63/17/328316317.db2.gz	PEIHNSMIUIUNMM-CYBMUJFWSA-N	1	0	267.417	1.496	50	0		CDAARO
CNC(=O)CCC(=O)N[C@@H](CC[NH+](C)C)c1ccccc1	ZINC000534647955	328343042	/nfs/dbraw/zinc/34/30/42/328343042.db2.gz	BEKUGAAGCFFFRT-AWEZNQCLSA-N	1	0	291.395	1.322	50	0		CDAARO
Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2[NH2+]CCO)cc1	ZINC000184889994	323376916	/nfs/dbraw/zinc/37/69/16/323376916.db2.gz	ZCOCACMOFVUOKA-LSDHHAIUSA-N	1	0	297.420	1.662	50	0		CDAARO
c1c(C2CC2)[nH]nc1N1CC[NH+](CC2CCOCC2)CC1	ZINC000189638174	323470868	/nfs/dbraw/zinc/47/08/68/323470868.db2.gz	CEKGFTFVZXUBTC-UHFFFAOYSA-N	1	0	290.411	1.836	50	0		CDAARO
Cc1nc(C(=O)N2CCCC[C@H]2[C@H](C)[NH3+])cs1	ZINC000087428995	330373031	/nfs/dbraw/zinc/37/30/31/330373031.db2.gz	ARQJCOWHKDSIHB-KWQFWETISA-N	1	0	253.371	1.793	50	0		CDAARO
CCOc1c(F)cccc1C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188428591	482446380	/nfs/dbraw/zinc/44/63/80/482446380.db2.gz	SLFSQTFMLFXEAR-SNVBAGLBSA-N	1	0	266.316	1.658	50	0		CDAARO
CC1(C)C[N@H+](CCC(=O)NC2CCCC2)C[C@]1(C)O	ZINC000091304771	482556973	/nfs/dbraw/zinc/55/69/73/482556973.db2.gz	OJNMVVDUWGGWTC-HNNXBMFYSA-N	1	0	268.401	1.528	50	0		CDAARO
Cc1nnc([C@@H](C)Nc2cc(C(C)C)[nH+]c(N)n2)[nH]1	ZINC000091871312	482588399	/nfs/dbraw/zinc/58/83/99/482588399.db2.gz	ASKUIHLLPXBSSF-SSDOTTSWSA-N	1	0	261.333	1.782	50	0		CDAARO
O=C(NC[C@H]1CCC[NH2+]1)[C@H]1CSc2ccccc21	ZINC000092239282	482610910	/nfs/dbraw/zinc/61/09/10/482610910.db2.gz	YNHMBSBXVYSPSK-PWSUYJOCSA-N	1	0	262.378	1.744	50	0		CDAARO
CC(C)[N@@H+]1CCCN(CC[C@H]2CCS(=O)(=O)C2)CC1	ZINC000677681784	482748885	/nfs/dbraw/zinc/74/88/85/482748885.db2.gz	MAMSONUXKDXOCV-AWEZNQCLSA-N	1	0	288.457	1.227	50	0		CDAARO
CCc1nccn1CCC(=O)N[C@H]1CCc2c[nH]nc2C1	ZINC000670434572	482970754	/nfs/dbraw/zinc/97/07/54/482970754.db2.gz	XMLHMPYHBNTQEH-LBPRGKRZSA-N	1	0	287.367	1.232	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNC(=O)c2ccncc2Cl)C1	ZINC000670439119	482983296	/nfs/dbraw/zinc/98/32/96/482983296.db2.gz	IURXEYGAYJJMMT-NSHDSACASA-N	1	0	297.786	1.433	50	0		CDAARO
Cn1ccnc1CC[N@@H+]1CC[C@](O)(c2ccccc2)C1	ZINC000670440805	482985368	/nfs/dbraw/zinc/98/53/68/482985368.db2.gz	KIQDCZIDMPWMBT-MRXNPFEDSA-N	1	0	271.364	1.556	50	0		CDAARO
C[NH+](C)C[C@]1(CO)CCCN(C(=O)CCC2CCC2)C1	ZINC000670448894	483004270	/nfs/dbraw/zinc/00/42/70/483004270.db2.gz	ILMJZUJBEQOWPC-MRXNPFEDSA-N	1	0	282.428	1.729	50	0		CDAARO
CCC1=NO[C@@H](CN2CC[N@@H+](CC)C(C)(C)C2)C1	ZINC000670449565	483005372	/nfs/dbraw/zinc/00/53/72/483005372.db2.gz	FTUGXPMAXXPVQL-CYBMUJFWSA-N	1	0	253.390	1.957	50	0		CDAARO
Cc1cccc(N2CCC(NC(=O)[C@@H]3C=CC[NH2+]3)CC2)c1	ZINC000670452443	483021147	/nfs/dbraw/zinc/02/11/47/483021147.db2.gz	ZLHIIWGOPCQKCT-INIZCTEOSA-N	1	0	285.391	1.608	50	0		CDAARO
CC(C)(C(=O)NCCC[N@@H+]1CCC[C@H](O)C1)n1cccc1	ZINC000670467086	483057497	/nfs/dbraw/zinc/05/74/97/483057497.db2.gz	NIGOFMMDXGJMJU-AWEZNQCLSA-N	1	0	293.411	1.186	50	0		CDAARO
COC[C@@H](C)NC(=O)C1CC[NH+](CC=C(C)C)CC1	ZINC000670468173	483059634	/nfs/dbraw/zinc/05/96/34/483059634.db2.gz	IPSJWIDXTLFUGD-CYBMUJFWSA-N	1	0	268.401	1.816	50	0		CDAARO
Cc1cc([C@@H]2CCC[N@H+](CCN3CCOCC3)C2)[nH]n1	ZINC000084111203	483247085	/nfs/dbraw/zinc/24/70/85/483247085.db2.gz	SRJHJBJVCVEPSH-CQSZACIVSA-N	1	0	278.400	1.230	50	0		CDAARO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)COC[C@@H]1CCCO1	ZINC000084544266	483286526	/nfs/dbraw/zinc/28/65/26/483286526.db2.gz	DENPXIZWLDUSPJ-CABCVRRESA-N	1	0	298.427	1.419	50	0		CDAARO
CCNC(=O)N1CCC([NH2+]C[C@](C)(O)[C@@H](C)CC)CC1	ZINC000096492713	528126247	/nfs/dbraw/zinc/12/62/47/528126247.db2.gz	NRCVVNFRXIFIPG-WFASDCNBSA-N	1	0	285.432	1.567	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@](O)([C@H]([NH3+])C2CC2)C1	ZINC000958528545	613980806	/nfs/dbraw/zinc/98/08/06/613980806.db2.gz	QEBFZINDPCOVGI-ZWNOBZJWSA-N	1	0	256.346	1.096	50	0		CDAARO
CC(C)C(=O)N1CCC[C@@H]([NH2+]Cc2ncc[nH]2)C1	ZINC000952991040	614360046	/nfs/dbraw/zinc/36/00/46/614360046.db2.gz	LDSJRUBOANQOOB-LLVKDONJSA-N	1	0	250.346	1.146	50	0		CDAARO
CC[NH+]1CCN(CC(=O)NC2(C3CCCC3)CC2)CC1	ZINC000952985676	615155106	/nfs/dbraw/zinc/15/51/06/615155106.db2.gz	CQGVATWJDOEEIY-UHFFFAOYSA-N	1	0	279.428	1.463	50	0		CDAARO
C=CC(=O)N1C[C@@H]2C[N@@H+](C)[C@@H](c3ccccc3)[C@H]2C1	ZINC000888102167	617768129	/nfs/dbraw/zinc/76/81/29/617768129.db2.gz	KZDDFIXKIUXDSX-DZKIICNBSA-N	1	0	256.349	1.934	50	0		CDAARO
CC1(C)C(c2ccccn2)[N+](=O)[C@H](c2cccnc2)N1O	ZINC000000437403	790319009	/nfs/dbraw/zinc/31/90/09/790319009.db2.gz	HERLXZLGBGRHMD-AWEZNQCLSA-N	1	0	284.319	1.958	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1CCNc1ncnc2[nH]ccc21	ZINC000952963273	789917235	/nfs/dbraw/zinc/91/72/35/789917235.db2.gz	IOKKTOJNFCNRPM-LLVKDONJSA-N	1	0	275.356	1.217	50	0		CDAARO
Cc1ncn(C)c1C(=O)N1CCC[C@@H](c2nccn2C)C1	ZINC000299773259	791243383	/nfs/dbraw/zinc/24/33/83/791243383.db2.gz	BXUPLYAERQOLQC-GFCCVEGCSA-N	1	0	287.367	1.482	50	0		CDAARO
OCC[C@@H]1CN(Cc2ccccn2)CC[N@@H+]1C1CCCC1	ZINC000020537449	791896124	/nfs/dbraw/zinc/89/61/24/791896124.db2.gz	MFVBAWRAVLFEAD-QGZVFWFLSA-N	1	0	289.423	1.893	50	0		CDAARO
Cc1nnc(CN2CC[N@H+](C3CCCC3)[C@@H](C)C2)o1	ZINC000952994634	792664169	/nfs/dbraw/zinc/66/41/69/792664169.db2.gz	SFUWEELMKKUFJK-NSHDSACASA-N	1	0	264.373	1.827	50	0		CDAARO
CC[NH+](CC)[C@@H]1CCN(C(=O)c2c(C)[nH]c(C)cc2=O)C1	ZINC000426746113	793398067	/nfs/dbraw/zinc/39/80/67/793398067.db2.gz	OMDYFYSBAGKYOS-CYBMUJFWSA-N	1	0	291.395	1.548	50	0		CDAARO
O=C(C[NH2+]CCC1=CCCCC1)Nc1cnccn1	ZINC000065396159	794344739	/nfs/dbraw/zinc/34/47/39/794344739.db2.gz	OGONCINQCPHYOX-UHFFFAOYSA-N	1	0	260.341	1.895	50	0		CDAARO
COc1ccc(CNC(=O)[C@H]2CCC[NH2+][C@@H]2C)cc1OC	ZINC000094647262	794358156	/nfs/dbraw/zinc/35/81/56/794358156.db2.gz	SYRJYKFHUWOFCK-YPMHNXCESA-N	1	0	292.379	1.708	50	0		CDAARO
Fc1ccc(-n2cccn2)c([C@@H]2[NH2+]CCc3nc[nH]c32)c1	ZINC000065380460	794756033	/nfs/dbraw/zinc/75/60/33/794756033.db2.gz	ZCCCGBSNRXILJZ-AWEZNQCLSA-N	1	0	283.310	1.970	50	0		CDAARO
CC(C)Nc1cc(N2CC[C@]3(C2)CCC[NH2+]C3)ncn1	ZINC000067885142	794878947	/nfs/dbraw/zinc/87/89/47/794878947.db2.gz	WPDRMEDVEGLHMG-OAHLLOKOSA-N	1	0	275.400	1.877	50	0		CDAARO
CCn1nc(C)c(C[N@H+]2C[C@@H]3[C@H](O)CC[C@@H]3C2)c1C	ZINC000675011871	899867035	/nfs/dbraw/zinc/86/70/35/899867035.db2.gz	ULIRDYLRQSYZIH-VHDGCEQUSA-N	1	0	263.385	1.723	50	0		CDAARO
O=C(N[C@@H]1CC[NH2+]C1)c1ncccc1OCc1ccncc1	ZINC000178459470	900617462	/nfs/dbraw/zinc/61/74/62/900617462.db2.gz	RLCJEUKXCQSLEM-CYBMUJFWSA-N	1	0	298.346	1.147	50	0		CDAARO
CC(C)C[N@@H+]1CCC[C@H]1C(=O)N1CCO[C@@H]2CCC[C@@H]21	ZINC000952848920	910405750	/nfs/dbraw/zinc/40/57/50/910405750.db2.gz	LDXIIKWEEDYBOK-SOUVJXGZSA-N	1	0	280.412	1.887	50	0		CDAARO
Cc1nc(CNCc2c(C)nn(CCO)c2C)cs1	ZINC000067215140	936616917	/nfs/dbraw/zinc/61/69/17/936616917.db2.gz	VACVAQTVMMTQEX-UHFFFAOYSA-N	1	0	280.397	1.547	50	0		CDAARO
CC(C)C[C@H](NC(=O)C1CC[NH+](C(C)C)CC1)C(N)=O	ZINC000821396969	925580606	/nfs/dbraw/zinc/58/06/06/925580606.db2.gz	ZSNKXCMPEXZASM-ZDUSSCGKSA-N	1	0	283.416	1.123	50	0		CDAARO
Cc1cccc2[nH]c(CNC(=O)NC3CC[NH2+]CC3)nc21	ZINC000828015621	926018122	/nfs/dbraw/zinc/01/81/22/926018122.db2.gz	YPBBBXDHURZNSH-UHFFFAOYSA-N	1	0	287.367	1.423	50	0		CDAARO
Cc1c(NC(=O)[C@@H](C)[NH3+])cccc1-c1nncn1C	ZINC000828120975	926037404	/nfs/dbraw/zinc/03/74/04/926037404.db2.gz	ZIOVLYIDFHZPEF-SECBINFHSA-N	1	0	259.313	1.076	50	0		CDAARO
O[C@H]1CN(CCC(F)(F)F)C[C@@H]1[NH+]1CCCC1	ZINC000828896798	926208016	/nfs/dbraw/zinc/20/80/16/926208016.db2.gz	RUFMLFNWPAEBOS-UWVGGRQHSA-N	1	0	252.280	1.080	50	0		CDAARO
c1cn(CC2(C[NH2+][C@@H]3CN4CCC3CC4)CC2)cn1	ZINC000829078377	926232446	/nfs/dbraw/zinc/23/24/46/926232446.db2.gz	IBQNVPQTOOJUIS-CQSZACIVSA-N	1	0	260.385	1.347	50	0		CDAARO
CCNC(=O)N1CC([N@@H+](Cc2ccncc2)CC(C)C)C1	ZINC000581776075	927194173	/nfs/dbraw/zinc/19/41/73/927194173.db2.gz	HKLNWHKMENAIKQ-UHFFFAOYSA-N	1	0	290.411	1.953	50	0		CDAARO
CCCCCOCC(=O)NCC[C@@H]1CCC[N@@H+]1C	ZINC000585113808	930953070	/nfs/dbraw/zinc/95/30/70/930953070.db2.gz	RISBRHCQLYJXIL-ZDUSSCGKSA-N	1	0	256.390	1.794	50	0		CDAARO
Cc1nn(C)cc1NC(=O)C[C@@H]1CCCC[N@@H+]1C	ZINC001529100113	968980890	/nfs/dbraw/zinc/98/08/90/968980890.db2.gz	NPTKTGGHHFGJJS-NSHDSACASA-N	1	0	250.346	1.541	50	0		CDAARO
CC[C@@H]1CCCC[N@@H+]1CC(=O)Nc1nccn1C	ZINC001529099131	968981312	/nfs/dbraw/zinc/98/13/12/968981312.db2.gz	RDJILTWPAOUUBQ-LLVKDONJSA-N	1	0	250.346	1.623	50	0		CDAARO
Cc1ncsc1C(=O)Nc1nnc(CC[NH+](C)C)s1	ZINC001529112448	968984010	/nfs/dbraw/zinc/98/40/10/968984010.db2.gz	LLXVOXVJTZDKBT-UHFFFAOYSA-N	1	0	297.409	1.659	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1C1CN(c2nccnc2N(C)C)C1	ZINC001529167453	969000041	/nfs/dbraw/zinc/00/00/41/969000041.db2.gz	JWUOWYOUWRAFAP-GFCCVEGCSA-N	1	0	275.400	1.606	50	0		CDAARO
C[C@@H](NCC(C)(C)C[NH+]1CCCC1)c1nncn1C	ZINC001506400238	975148949	/nfs/dbraw/zinc/14/89/49/975148949.db2.gz	JOJHMIIDTSAGHL-GFCCVEGCSA-N	1	0	265.405	1.588	50	0		CDAARO
CSc1nccc(NCC[N@@H+]2CCC[C@H](CO)C2)n1	ZINC001506407151	975152071	/nfs/dbraw/zinc/15/20/71/975152071.db2.gz	UKQHVWCWTKBAOL-NSHDSACASA-N	1	0	282.413	1.315	50	0		CDAARO
COc1cc(N(C)CC[N@H+](C)C2CCCC2)nc(N)n1	ZINC001506409635	975153405	/nfs/dbraw/zinc/15/34/05/975153405.db2.gz	RWCMGGREXDGFMA-UHFFFAOYSA-N	1	0	279.388	1.378	50	0		CDAARO
O=C1CCCN1CCN1CCC[N@@H+](C2CCCCC2)CC1	ZINC001506422954	975159863	/nfs/dbraw/zinc/15/98/63/975159863.db2.gz	SVLZSMFKQIZBCO-UHFFFAOYSA-N	1	0	293.455	1.949	50	0		CDAARO
CC(C)c1ccc(N(C)CC2CC[NH+](CCO)CC2)nn1	ZINC001506430924	975161733	/nfs/dbraw/zinc/16/17/33/975161733.db2.gz	ZLPRDUXTHQUZOX-UHFFFAOYSA-N	1	0	292.427	1.741	50	0		CDAARO
Cc1nncn1CCN1CCC[N@@H+](C2CCCCC2)CC1	ZINC001506428177	975161895	/nfs/dbraw/zinc/16/18/95/975161895.db2.gz	XXRRFRSFWRSKSU-UHFFFAOYSA-N	1	0	291.443	1.927	50	0		CDAARO
Cn1cc(C[NH2+][C@H](CC(N)=O)C2CCCCC2)cn1	ZINC000096494760	230383726	/nfs/dbraw/zinc/38/37/26/230383726.db2.gz	ZOYKHHZWCXHTLJ-CYBMUJFWSA-N	1	0	264.373	1.334	50	0		CDAARO
C[N@@H+]1CC[C@@](C)(Cn2cnc3cc(F)ccc3c2=O)C1	ZINC000584901321	341986640	/nfs/dbraw/zinc/98/66/40/341986640.db2.gz	GWHZPWOLFHNLNZ-OAHLLOKOSA-N	1	0	275.327	1.877	50	0		CDAARO
O[C@@H]1CN(Cc2ccccc2)CC[N@H+](CC2CCC2)C1	ZINC000095519024	185002849	/nfs/dbraw/zinc/00/28/49/185002849.db2.gz	RTVONXGJSISGIY-QGZVFWFLSA-N	1	0	274.408	1.965	50	0		CDAARO
C[C@@]1(c2ccccc2)CCC[N@H+](Cc2cc(=O)[nH]c(=O)[nH]2)C1	ZINC000095524618	185003850	/nfs/dbraw/zinc/00/38/50/185003850.db2.gz	BLSXBIMRRHZJPI-QGZVFWFLSA-N	1	0	299.374	1.617	50	0		CDAARO
CN(C)C(=O)OCC[N@H+](C)[C@H]1CCCc2c1cnn2C	ZINC000097373633	342002628	/nfs/dbraw/zinc/00/26/28/342002628.db2.gz	YVAOFWRYEZWLNF-LBPRGKRZSA-N	1	0	280.372	1.428	50	0		CDAARO
NC(=O)[C@@H](C[NH2+][C@H]1CCSC1)Cc1ccc(F)cc1	ZINC000097375222	342002847	/nfs/dbraw/zinc/00/28/47/342002847.db2.gz	MBIVMDAVBWVICO-YPMHNXCESA-N	1	0	282.384	1.565	50	0		CDAARO
COCCOc1ccc(C[NH2+][C@H](C)[C@@H](C)COC)cn1	ZINC000095995514	185060192	/nfs/dbraw/zinc/06/01/92/185060192.db2.gz	GISCFEXRJDXMER-QWHCGFSZSA-N	1	0	282.384	1.867	50	0		CDAARO
OCC1CC[NH+](CCNc2ncccc2F)CC1	ZINC000084486368	342089563	/nfs/dbraw/zinc/08/95/63/342089563.db2.gz	SAESBXBXEPFTNK-UHFFFAOYSA-N	1	0	253.321	1.337	50	0		CDAARO
Cc1ccccc1NC(=O)NCCCN1CC[NH+](C)CC1	ZINC000020153993	342088893	/nfs/dbraw/zinc/08/88/93/342088893.db2.gz	PHSLBPHMNXZPMI-UHFFFAOYSA-N	1	0	290.411	1.754	50	0		CDAARO
COc1cc(C)c(CN2CC[NH+](CCO)CC2)cc1C	ZINC000022454735	342089123	/nfs/dbraw/zinc/08/91/23/342089123.db2.gz	CPJXNWDSFUVVGG-UHFFFAOYSA-N	1	0	278.396	1.422	50	0		CDAARO
COc1cc(CCNC(=O)[C@H]2CCC[NH2+]2)ccc1F	ZINC000195555078	342626161	/nfs/dbraw/zinc/62/61/61/342626161.db2.gz	OTECRNNYXMDYHA-GFCCVEGCSA-N	1	0	266.316	1.245	50	0		CDAARO
C[C@H]1CCCN(C(=O)c2cccc(Cl)n2)[C@@H]1C[NH3+]	ZINC000195542970	342626659	/nfs/dbraw/zinc/62/66/59/342626659.db2.gz	AHUBNEOOOWNICW-GXSJLCMTSA-N	1	0	267.760	1.934	50	0		CDAARO
COC(C[N@@H+]1CCCN(c2nc(C)cs2)CC1)OC	ZINC000195572033	342628817	/nfs/dbraw/zinc/62/88/17/342628817.db2.gz	NIWOSRASLHUJNR-UHFFFAOYSA-N	1	0	285.413	1.583	50	0		CDAARO
Cc1ccnn1CCN1CC[NH+](C2CCSCC2)CC1	ZINC000244595027	361853084	/nfs/dbraw/zinc/85/30/84/361853084.db2.gz	DNDUUSYYRJEREH-UHFFFAOYSA-N	1	0	294.468	1.705	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CCN(C)CCc1cn[nH]c1	ZINC000244659521	361854855	/nfs/dbraw/zinc/85/48/55/361854855.db2.gz	HEDIPLGJQCILGV-ZDUSSCGKSA-N	1	0	250.390	1.758	50	0		CDAARO
CC(C)Cn1cncc1C[N@H+](C)CC1(CO)CC1	ZINC000244691666	361856674	/nfs/dbraw/zinc/85/66/74/361856674.db2.gz	JGWWMZYXKVNOJW-UHFFFAOYSA-N	1	0	251.374	1.743	50	0		CDAARO
CN1C[C@]2(CCC[N@H+](CCCc3cccnc3)C2)OC1=O	ZINC000244715841	361858124	/nfs/dbraw/zinc/85/81/24/361858124.db2.gz	LDJMOHBDPOYYGX-INIZCTEOSA-N	1	0	289.379	1.931	50	0		CDAARO
C[NH+](C)Cc1ccc(-c2nc3c([nH]2)C(=O)NCCC3)cc1	ZINC000216375957	282145798	/nfs/dbraw/zinc/14/57/98/282145798.db2.gz	HDBXNAFEWGYLFB-UHFFFAOYSA-N	1	0	284.363	1.814	50	0		CDAARO
CC(C)[C@H]([NH3+])C(=O)N1CC[C@H](Oc2cccnc2)C1	ZINC000097234163	342205433	/nfs/dbraw/zinc/20/54/33/342205433.db2.gz	AHDSUBVIBYULCZ-STQMWFEESA-N	1	0	263.341	1.045	50	0		CDAARO
CC(C)n1ncc(C(=O)N2CC[C@@H]([NH3+])C2)c1C(F)(F)F	ZINC000097019389	185153151	/nfs/dbraw/zinc/15/31/51/185153151.db2.gz	LHWUWZRRPVSFIO-MRVPVSSYSA-N	1	0	290.289	1.656	50	0		CDAARO
O=C(OCCN1CCSCC1)c1ccn2c[nH+]cc2c1	ZINC000097034344	185157423	/nfs/dbraw/zinc/15/74/23/185157423.db2.gz	WDKJFFJWDNOFDZ-UHFFFAOYSA-N	1	0	291.376	1.540	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1ccc2c(c1)OCO2	ZINC000002772990	361994746	/nfs/dbraw/zinc/99/47/46/361994746.db2.gz	CGKHJCUEQWBUAS-UHFFFAOYSA-N	1	0	250.298	1.097	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@@H]1NC(=O)CCc1ccon1	ZINC000585136701	342215991	/nfs/dbraw/zinc/21/59/91/342215991.db2.gz	PXCILHJJNGFJOY-GIPNMCIBSA-N	1	0	251.330	1.110	50	0		CDAARO
CON1CCC(CC(=O)N[C@@H]2[C@H](C)CC[NH2+][C@H]2C)CC1	ZINC000585136382	342216081	/nfs/dbraw/zinc/21/60/81/342216081.db2.gz	CXXPKADGVQXVNS-TYNCELHUSA-N	1	0	283.416	1.153	50	0		CDAARO
Cc1cc(CNC(=O)N2CCC[C@@]3(CC[NH2+]C3)C2)ccn1	ZINC000333638247	539053510	/nfs/dbraw/zinc/05/35/10/539053510.db2.gz	UDDYHQGCUBQKIM-INIZCTEOSA-N	1	0	288.395	1.675	50	0		CDAARO
CC[C@H]([NH2+]CC(=O)NC(=O)NC)C(C)(C)c1ccccc1	ZINC000096493175	529587552	/nfs/dbraw/zinc/58/75/52/529587552.db2.gz	LJDQSCPEGBXEPP-ZDUSSCGKSA-N	1	0	291.395	1.788	50	0		CDAARO
CCCCNC(=O)[C@@H](C)[NH2+][C@@H]1C[C@@H](OCC)[C@H]1SC	ZINC000585089105	362015627	/nfs/dbraw/zinc/01/56/27/362015627.db2.gz	MTDTVBDDGHUQEQ-LPWJVIDDSA-N	1	0	288.457	1.790	50	0		CDAARO
O=C1C[C@@H](C[N@H+]2CCC[C@@H](C(F)(F)F)C2)CN1	ZINC000585094225	362021328	/nfs/dbraw/zinc/02/13/28/362021328.db2.gz	RYKWCKUWFKNANI-RKDXNWHRSA-N	1	0	250.264	1.397	50	0		CDAARO
CC(C)O[C@H](C[N@@H+]1CC[C@H](C(N)=O)C1)c1ccccc1	ZINC000585085636	362013310	/nfs/dbraw/zinc/01/33/10/362013310.db2.gz	AYRKUGJELCTNCV-LSDHHAIUSA-N	1	0	276.380	1.960	50	0		CDAARO
CCCCNC(=O)[C@H](C)N1CC[N@H+](C)[C@H](C(C)(C)C)C1	ZINC000585116448	362045637	/nfs/dbraw/zinc/04/56/37/362045637.db2.gz	WMWCWEWXKATMGF-KBPBESRZSA-N	1	0	283.460	1.953	50	0		CDAARO
COC(=O)CN(C(=O)c1ccc(-n2ccnc2)cc1)C1CC1	ZINC000083891259	362255478	/nfs/dbraw/zinc/25/54/78/362255478.db2.gz	UMIQJJBLTQOWBL-UHFFFAOYSA-N	1	0	299.330	1.650	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)COc2ccccc2Cl)C1	ZINC000191339527	362419856	/nfs/dbraw/zinc/41/98/56/362419856.db2.gz	VLHSFHDUHIXTMC-SNVBAGLBSA-N	1	0	268.744	1.669	50	0		CDAARO
Nc1nc(N[C@H]2C[C@@H](c3cc(=O)[nH]cn3)C2)c2c([nH+]1)CCC2	ZINC000253534951	362435035	/nfs/dbraw/zinc/43/50/35/362435035.db2.gz	ZGQNCZFCLWWJHZ-DTORHVGOSA-N	1	0	298.350	1.401	50	0		CDAARO
CCN1CCc2ccc(NC(=O)N3CC([NH+](C)C)C3)cc21	ZINC000097113230	185537728	/nfs/dbraw/zinc/53/77/28/185537728.db2.gz	HJCKJOXSDJIWKI-UHFFFAOYSA-N	1	0	288.395	1.847	50	0		CDAARO
COCCCC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@@H+]1C	ZINC000106842342	345812987	/nfs/dbraw/zinc/81/29/87/345812987.db2.gz	MIALZHWAHRXJRF-QWHCGFSZSA-N	1	0	254.374	1.498	50	0		CDAARO
O[C@H](C[NH+]1CCN(Cc2cccc(F)c2)CC1)C1CC1	ZINC000085436858	179062786	/nfs/dbraw/zinc/06/27/86/179062786.db2.gz	SZZRDQFESYCAMM-MRXNPFEDSA-N	1	0	278.371	1.714	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCCNC(=O)C2=CCCCO2)C[C@H](C)O1	ZINC000085457337	179068271	/nfs/dbraw/zinc/06/82/71/179068271.db2.gz	HRCALQVMOAWVJK-OKILXGFUSA-N	1	0	296.411	1.686	50	0		CDAARO
CN(CC[N@@H+]1CCC[C@H](OCCO)C1)c1ccccc1	ZINC000085819857	179183036	/nfs/dbraw/zinc/18/30/36/179183036.db2.gz	GBSMMIYMNFCHLC-INIZCTEOSA-N	1	0	278.396	1.596	50	0		CDAARO
C[NH+](C)CC1(O)CCN(C(=O)[C@H]2CC23CCCC3)CC1	ZINC000584886644	349345069	/nfs/dbraw/zinc/34/50/69/349345069.db2.gz	BLDKWYAQNXTVAH-CYBMUJFWSA-N	1	0	280.412	1.482	50	0		CDAARO
Cn1ccnc1SCC(=O)N[C@H]1CC[N@@H+](C(C)(C)C)C1	ZINC000584889013	349347959	/nfs/dbraw/zinc/34/79/59/349347959.db2.gz	ZCEMHLUTYBBCCY-NSHDSACASA-N	1	0	296.440	1.501	50	0		CDAARO
C[N@@H+]1CCC=C(CCNC(=O)COc2ccccc2)C1	ZINC000065375822	362948860	/nfs/dbraw/zinc/94/88/60/362948860.db2.gz	LTACQSGLNPDXAT-UHFFFAOYSA-N	1	0	274.364	1.834	50	0		CDAARO
CCc1ccccc1C[NH+]1CCC2(CC1)[C@H](O)C[C@@H]2O	ZINC000091319814	180134050	/nfs/dbraw/zinc/13/40/50/180134050.db2.gz	ARUDUIDQFJILLW-IYBDPMFKSA-N	1	0	275.392	1.957	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2ccc3c(c2)CCCO3)C[C@@H]1C1CC1	ZINC000091381769	180144189	/nfs/dbraw/zinc/14/41/89/180144189.db2.gz	WFWNSEIEPFERAF-CABCVRRESA-N	1	0	286.375	1.821	50	0		CDAARO
COC[C@@H](Nc1nc(N)[nH+]c(C)c1C)c1ccnn1C	ZINC000091390976	180145021	/nfs/dbraw/zinc/14/50/21/180145021.db2.gz	SRRMJLJIOLXCLJ-SNVBAGLBSA-N	1	0	276.344	1.209	50	0		CDAARO
COCCC[N@@H+]1CC[C@@H](CNc2ncccn2)C1	ZINC000091562711	180192967	/nfs/dbraw/zinc/19/29/67/180192967.db2.gz	RWZQEKBRBTVRKE-LBPRGKRZSA-N	1	0	250.346	1.247	50	0		CDAARO
Cc1cnn(CCNC(=O)CC[C@@H]2CCC[N@@H+](C)C2)c1	ZINC000091713323	180231307	/nfs/dbraw/zinc/23/13/07/180231307.db2.gz	SZQZPJLUNPGSAT-AWEZNQCLSA-N	1	0	278.400	1.430	50	0		CDAARO
C[N@@H+]1C[C@H]2CC[C@@H]1CN(C(=O)Cc1cccc(F)c1)C2	ZINC000091756426	180247043	/nfs/dbraw/zinc/24/70/43/180247043.db2.gz	MPGCZZJROUCSLD-UKRRQHHQSA-N	1	0	276.355	1.921	50	0		CDAARO
COCC[C@]1(O)CC[N@H+](CCCSC)C[C@H]1C	ZINC000091770298	180249406	/nfs/dbraw/zinc/24/94/06/180249406.db2.gz	QDBVHMNFENVISH-CHWSQXEVSA-N	1	0	261.431	1.849	50	0		CDAARO
CCCc1nc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)cs1	ZINC000091724847	180241998	/nfs/dbraw/zinc/24/19/98/180241998.db2.gz	DLWBVSBLDCBBDS-MNOVXSKESA-N	1	0	279.409	1.905	50	0		CDAARO
Cn1ccnc1SCCNC(=O)[C@@H]1CCCCC[N@@H+]1C	ZINC000091745812	180245105	/nfs/dbraw/zinc/24/51/05/180245105.db2.gz	DSUHTTHYCITFIA-LBPRGKRZSA-N	1	0	296.440	1.503	50	0		CDAARO
CC(C)[C@H]1CN(C(=O)c2ccc(=O)[nH]c2)C[C@@H]1[NH+](C)C	ZINC000091965847	180293669	/nfs/dbraw/zinc/29/36/69/180293669.db2.gz	LIDMJACKHDQCGK-OLZOCXBDSA-N	1	0	277.368	1.033	50	0		CDAARO
COc1ccc([C@H]2CN(C(=O)C(C)(C)OC)C[C@@H]2[NH3+])cc1	ZINC000091966146	180294060	/nfs/dbraw/zinc/29/40/60/180294060.db2.gz	REZGNJJTYWATNR-KGLIPLIRSA-N	1	0	292.379	1.373	50	0		CDAARO
CC[C@@H]1CN(Cc2cscn2)CC[N@@H+]1C[C@H](C)O	ZINC000106906731	186149611	/nfs/dbraw/zinc/14/96/11/186149611.db2.gz	UWMUJMANAFNQGK-WCQYABFASA-N	1	0	269.414	1.420	50	0		CDAARO
COc1cccc(C(=O)NC[C@H]2C[N@@H+]3CCC[C@H]3CO2)c1	ZINC000106517091	186123331	/nfs/dbraw/zinc/12/33/31/186123331.db2.gz	YHKLBQIVNWZGIC-ZFWWWQNUSA-N	1	0	290.363	1.288	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+][C@H](CO)c2cnn(C)c2)C1(C)C	ZINC000108329961	186212924	/nfs/dbraw/zinc/21/29/24/186212924.db2.gz	BOAASZMUNPXNTL-FRRDWIJNSA-N	1	0	267.373	1.247	50	0		CDAARO
O=C(NCc1ccccc1)[C@@]1(C(F)(F)F)CC[NH2+]C1	ZINC000111242881	186374389	/nfs/dbraw/zinc/37/43/89/186374389.db2.gz	GQBYOMATPDFAEX-GFCCVEGCSA-N	1	0	272.270	1.845	50	0		CDAARO
CCOC1CC(C[NH2+]Cc2cc[nH]c2)(N2CCOCC2)C1	ZINC000195460544	363435458	/nfs/dbraw/zinc/43/54/58/363435458.db2.gz	HUIVEXLMFXLBEW-UHFFFAOYSA-N	1	0	293.411	1.374	50	0		CDAARO
CC(=O)O[C@@H]1CSc2n(C)c3ccccc3[n+]2C1	ZINC000000432643	355910831	/nfs/dbraw/zinc/91/08/31/355910831.db2.gz	YTQDXMMOEXRDMZ-JTQLQIEISA-N	1	0	263.342	1.503	50	0		CDAARO
Cn1ncc(N2CCC[N@@H+]3CCC[C@@H]3C2)c(Cl)c1=O	ZINC000095349714	355886048	/nfs/dbraw/zinc/88/60/48/355886048.db2.gz	QVUILQNTZZYOBE-SNVBAGLBSA-N	1	0	282.775	1.108	50	0		CDAARO
COCCN(Cc1ccc(C)c(Cl)c1)[C@H](C)C(N)=O	ZINC000193889024	358500161	/nfs/dbraw/zinc/50/01/61/358500161.db2.gz	YAOXMBFWRQCRID-LLVKDONJSA-N	1	0	284.787	1.971	50	0		CDAARO
CC(=O)NC(=S)NC1CC[NH+](Cc2ccccc2)CC1	ZINC000010451195	356258414	/nfs/dbraw/zinc/25/84/14/356258414.db2.gz	NLNJCAFGOJYWQU-UHFFFAOYSA-N	1	0	291.420	1.662	50	0		CDAARO
CN(CCOc1ccccc1F)C(=O)[C@@]1(F)CC[NH2+]C1	ZINC000299738636	356263543	/nfs/dbraw/zinc/26/35/43/356263543.db2.gz	DJLWVEUCSJJBMK-CQSZACIVSA-N	1	0	284.306	1.365	50	0		CDAARO
C[C@H](OC[C@@H]1CCCO1)C(=O)N1CCC[C@@H](C)[C@H]1C[NH3+]	ZINC000299739091	356267023	/nfs/dbraw/zinc/26/70/23/356267023.db2.gz	KKNJONFFNZGZQI-ZOBORPQBSA-N	1	0	284.400	1.156	50	0		CDAARO
Cc1nc2ccccc2n1CC[NH2+]Cc1cc[nH]n1	ZINC000036900238	356276267	/nfs/dbraw/zinc/27/62/67/356276267.db2.gz	YVVXPJPASVRPNF-UHFFFAOYSA-N	1	0	255.325	1.858	50	0		CDAARO
CCOC(=O)c1cc(C[NH2+]CC2CCOCC2)on1	ZINC000012410835	356298710	/nfs/dbraw/zinc/29/87/10/356298710.db2.gz	UHKSITGUWRJJGC-UHFFFAOYSA-N	1	0	268.313	1.368	50	0		CDAARO
COc1ccc(C(=O)[C@@H]2CCC[N@H+](CCO)C2)cc1OC	ZINC000012704097	356319117	/nfs/dbraw/zinc/31/91/17/356319117.db2.gz	AIMDWBJNXDMWAF-CYBMUJFWSA-N	1	0	293.363	1.591	50	0		CDAARO
Cc1noc(C)c1S(=O)(=O)NC1CC[NH+](C2CC2)CC1	ZINC000012982434	356334814	/nfs/dbraw/zinc/33/48/14/356334814.db2.gz	SWWOBUMLPGUYFA-UHFFFAOYSA-N	1	0	299.396	1.197	50	0		CDAARO
COC(=O)c1cc(CSC(N)=[NH2+])ccc1OC	ZINC000004507105	356374790	/nfs/dbraw/zinc/37/47/90/356374790.db2.gz	BKWPLLASLPEQAW-UHFFFAOYSA-N	1	0	254.311	1.608	50	0		CDAARO
C[C@@H](CNC(=O)[C@@]1(C)CC1(Cl)Cl)N1CCOCC1	ZINC000032817367	356379861	/nfs/dbraw/zinc/37/98/61/356379861.db2.gz	ROXJJFQFSOFHPH-GXSJLCMTSA-N	1	0	295.210	1.407	50	0		CDAARO
C[N@H+](CCC(N)=O)Cc1cnn(Cc2ccccc2)c1	ZINC000014200956	356380025	/nfs/dbraw/zinc/38/00/25/356380025.db2.gz	XFDLUMWJWFKKTQ-UHFFFAOYSA-N	1	0	272.352	1.239	50	0		CDAARO
COC(=O)Cc1ccc(OC[C@@H]2CCC[NH2+]C2)cc1	ZINC000014631277	356392609	/nfs/dbraw/zinc/39/26/09/356392609.db2.gz	MNHZADWRPWBFLV-CYBMUJFWSA-N	1	0	263.337	1.781	50	0		CDAARO
CCCc1noc(CN2CCCC[C@H]2CCO)n1	ZINC000015075059	356405028	/nfs/dbraw/zinc/40/50/28/356405028.db2.gz	VEECALCOEVGJLW-NSHDSACASA-N	1	0	253.346	1.759	50	0		CDAARO
Cc1ccc(C)c(NC(=O)C(=O)NCCC[NH+](C)C)c1	ZINC000004583807	356433226	/nfs/dbraw/zinc/43/32/26/356433226.db2.gz	WBKWDUUFPHDWPH-UHFFFAOYSA-N	1	0	277.368	1.310	50	0		CDAARO
C[N@H+](CCC(N)=O)Cc1ccccc1N1CCCCC1	ZINC000016385363	356438438	/nfs/dbraw/zinc/43/84/38/356438438.db2.gz	RPWKFACCPMABMU-UHFFFAOYSA-N	1	0	275.396	1.984	50	0		CDAARO
C[C@@H]1C(=O)OC[C@@H]1C(=O)N1CCC[C@H](C[NH+]2CCCC2)C1	ZINC000043144596	356472517	/nfs/dbraw/zinc/47/25/17/356472517.db2.gz	RADYVFJDGDWEBN-MJBXVCDLSA-N	1	0	294.395	1.130	50	0		CDAARO
Fc1ccc(CN2CC[NH2+]CC2)c(Br)c1	ZINC000019279639	356478583	/nfs/dbraw/zinc/47/85/83/356478583.db2.gz	YXTYIHVLFQRLDJ-UHFFFAOYSA-N	1	0	273.149	1.993	50	0		CDAARO
COc1cccc(C[NH2+]CCN2CCOCC2)c1OC	ZINC000019702469	356496105	/nfs/dbraw/zinc/49/61/05/356496105.db2.gz	PWDBRIPQWHRONA-UHFFFAOYSA-N	1	0	280.368	1.126	50	0		CDAARO
C[NH+]1CCN(Cn2nc(-c3ccccc3)ccc2=O)CC1	ZINC000019833793	356508629	/nfs/dbraw/zinc/50/86/29/356508629.db2.gz	FYTMHOLUHCVFNU-UHFFFAOYSA-N	1	0	284.363	1.115	50	0		CDAARO
O=C(Nc1nccnn1)c1ccc([C@@H]2CCC[NH2+]2)s1	ZINC000023339255	356640783	/nfs/dbraw/zinc/64/07/83/356640783.db2.gz	WJCRHODYFPOGHP-QMMMGPOBSA-N	1	0	275.337	1.610	50	0		CDAARO
C[C@H](C(=O)NC1CCCCCC1)[NH+]1CCC(C(N)=O)CC1	ZINC000026467636	356694358	/nfs/dbraw/zinc/69/43/58/356694358.db2.gz	VCDDRHXYNGKESJ-GFCCVEGCSA-N	1	0	295.427	1.411	50	0		CDAARO
C[C@H]1C[C@@H]1C(=O)NCC[N@@H+]1CCc2ccccc2C1	ZINC000030363241	356749242	/nfs/dbraw/zinc/74/92/42/356749242.db2.gz	HRWDPCVTBZSRBY-WFASDCNBSA-N	1	0	258.365	1.817	50	0		CDAARO
CCC[N@@H+]1CCCN(C(=O)C[C@H]2CCOC2)CC1	ZINC000365470264	356824623	/nfs/dbraw/zinc/82/46/23/356824623.db2.gz	RAPRVWAJMRKPOB-CYBMUJFWSA-N	1	0	254.374	1.357	50	0		CDAARO
C[NH+](C)Cc1ccc(C(=O)NCC2(C)COC2)cc1	ZINC000083519696	357101550	/nfs/dbraw/zinc/10/15/50/357101550.db2.gz	BXYXNBUROKECQP-UHFFFAOYSA-N	1	0	262.353	1.515	50	0		CDAARO
Cc1cnn(Cc2cccc(F)c2)c1NC(=O)[C@@H](C)[NH3+]	ZINC000055227298	357331150	/nfs/dbraw/zinc/33/11/50/357331150.db2.gz	JWTRCYCEQUKQEG-SNVBAGLBSA-N	1	0	276.315	1.665	50	0		CDAARO
[NH3+][C@H](C(=O)N1CCC(n2cncn2)CC1)c1ccccc1	ZINC000095426476	357355973	/nfs/dbraw/zinc/35/59/73/357355973.db2.gz	MKXCNXNDHINPMI-AWEZNQCLSA-N	1	0	285.351	1.142	50	0		CDAARO
Cc1ccsc1[C@@H](C)[NH2+]CCN1CCCS1(=O)=O	ZINC000089519976	357496475	/nfs/dbraw/zinc/49/64/75/357496475.db2.gz	BJTAZSQTJHMPCF-LLVKDONJSA-N	1	0	288.438	1.743	50	0		CDAARO
CC[NH+](CC)CCNc1nccc(N2CCC[C@H](O)C2)n1	ZINC000065383782	357534604	/nfs/dbraw/zinc/53/46/04/357534604.db2.gz	KIKCGZRCZSKXIK-ZDUSSCGKSA-N	1	0	293.415	1.191	50	0		CDAARO
CCN1CCC[C@H]([NH2+]Cc2ccccc2-n2cncn2)C1	ZINC000065393921	357535317	/nfs/dbraw/zinc/53/53/17/357535317.db2.gz	YLRUECLBCKQFFL-HNNXBMFYSA-N	1	0	285.395	1.841	50	0		CDAARO
Cn1nccc1C(=O)NCC[N@H+](C)Cc1ccccc1	ZINC000065403762	357538092	/nfs/dbraw/zinc/53/80/92/357538092.db2.gz	GCVSPGOULIZCSA-UHFFFAOYSA-N	1	0	272.352	1.282	50	0		CDAARO
COC[C@@H]([NH2+]C1CCSCC1)c1ccnn1C	ZINC000065410996	357539253	/nfs/dbraw/zinc/53/92/53/357539253.db2.gz	GCIQWNLSTGFVOA-LLVKDONJSA-N	1	0	255.387	1.593	50	0		CDAARO
CC(C)[NH+]1CCC(C[N@@H+]2CC[C@H](O)C[C@@H]2C(=O)[O-])CC1	ZINC000065417482	357540329	/nfs/dbraw/zinc/54/03/29/357540329.db2.gz	DJGBDVIWEKVPLP-UONOGXRCSA-N	1	0	284.400	1.017	50	0		CDAARO
Cc1nc(CC[NH2+][C@@H](C)Cn2cncn2)sc1C	ZINC000065420999	357540545	/nfs/dbraw/zinc/54/05/45/357540545.db2.gz	RVQAZHAZPAQURY-VIFPVBQESA-N	1	0	265.386	1.572	50	0		CDAARO
C[C@H](CCn1cccn1)[NH2+]Cc1ccc2nonc2c1	ZINC000065461950	357543382	/nfs/dbraw/zinc/54/33/82/357543382.db2.gz	AVOQAWZRUUBTRM-LLVKDONJSA-N	1	0	271.324	1.988	50	0		CDAARO
CC(=O)NCCc1cn(-c2cccc([C@H](C)O)c2)cn1	ZINC000065491334	357544874	/nfs/dbraw/zinc/54/48/74/357544874.db2.gz	GPWGCOWJHFIGGL-NSHDSACASA-N	1	0	273.336	1.604	50	0		CDAARO
NCC[NH2+]C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000066323402	357562421	/nfs/dbraw/zinc/56/24/21/357562421.db2.gz	AVMRQZDZKIQWAL-UHFFFAOYSA-N	1	0	277.368	1.336	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC([N@@H+]2CCC[C@H](O)C2)CC1	ZINC000067796541	357628060	/nfs/dbraw/zinc/62/80/60/357628060.db2.gz	UZONPELMGKAXTA-ZDUSSCGKSA-N	1	0	284.400	1.843	50	0		CDAARO
Cc1cc2nc(C[NH2+][C@@H](C)Cn3cncn3)[nH]c2cc1C	ZINC000067785655	357628079	/nfs/dbraw/zinc/62/80/79/357628079.db2.gz	VLQXAMOEFNUJPI-LBPRGKRZSA-N	1	0	284.367	1.950	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccncc2Cl)C[C@@H](C)[NH2+]1	ZINC000091456984	357602016	/nfs/dbraw/zinc/60/20/16/357602016.db2.gz	JCODPPZLVDVXQM-RKDXNWHRSA-N	1	0	253.733	1.557	50	0		CDAARO
C[C@@H](CCn1cccn1)[NH+]1CCC2(CN(C)C(=O)O2)CC1	ZINC000072477243	357838224	/nfs/dbraw/zinc/83/82/24/357838224.db2.gz	IFLHBQYUOGELKS-ZDUSSCGKSA-N	1	0	292.383	1.578	50	0		CDAARO
Cc1nc(C)c(C(=O)N2CCC[N@@H+](C(C)C)CC2)o1	ZINC000073334135	357877261	/nfs/dbraw/zinc/87/72/61/357877261.db2.gz	SBWWSQUDPIVNER-UHFFFAOYSA-N	1	0	265.357	1.848	50	0		CDAARO
COC(C)(C)C[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C(N)=O	ZINC000097095718	357953574	/nfs/dbraw/zinc/95/35/74/357953574.db2.gz	YQECQZLYZUSYRN-SRVKXCTJSA-N	1	0	256.390	1.824	50	0		CDAARO
COCC[NH+]1[C@H](C)CN(c2cncc(SC)n2)C[C@H]1C	ZINC000097162963	358004687	/nfs/dbraw/zinc/00/46/87/358004687.db2.gz	BJJCZQXECRHJDN-VXGBXAGGSA-N	1	0	296.440	1.744	50	0		CDAARO
CC(C)NC(=O)C(=O)NCC1CC[NH+](C2CCCC2)CC1	ZINC000023127403	358062491	/nfs/dbraw/zinc/06/24/91/358062491.db2.gz	GAUWXPARFARECC-UHFFFAOYSA-N	1	0	295.427	1.282	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1C1CN(C(=O)c2ccncc2)C1	ZINC000082161115	358149530	/nfs/dbraw/zinc/14/95/30/358149530.db2.gz	IBDJUHPPUMYNAW-LBPRGKRZSA-N	1	0	259.353	1.780	50	0		CDAARO
CCOc1ccc(N2C[C@@H](C)[N@@H+](CCOC)[C@@H](C)C2)nn1	ZINC000097082676	358183544	/nfs/dbraw/zinc/18/35/44/358183544.db2.gz	FBPVBCOZQWZWRL-BETUJISGSA-N	1	0	294.399	1.421	50	0		CDAARO
O=C(C[C@@H]1CC[NH2+]C1)NCCOCc1ccccc1	ZINC000129052859	358275836	/nfs/dbraw/zinc/27/58/36/358275836.db2.gz	DMAONXYHKNAZMD-AWEZNQCLSA-N	1	0	262.353	1.319	50	0		CDAARO
c1csc(N2CCC([NH2+]CCN3CCOCC3)CC2)n1	ZINC000195579105	358567921	/nfs/dbraw/zinc/56/79/21/358567921.db2.gz	CDQHNIIKYYEWFP-UHFFFAOYSA-N	1	0	296.440	1.034	50	0		CDAARO
CCC[N@@H+]1C[C@H]2CC[C@@H]1CN(C(=O)Cc1ccccn1)C2	ZINC000095354195	358683556	/nfs/dbraw/zinc/68/35/56/358683556.db2.gz	HZJPYCWWOFIFJT-GDBMZVCRSA-N	1	0	287.407	1.957	50	0		CDAARO
CN(C)[C@H](C(=O)NCC[NH+]1CCCC1)c1ccc(F)cc1	ZINC000095389046	358692063	/nfs/dbraw/zinc/69/20/63/358692063.db2.gz	RRHJGZUDBTVBEP-HNNXBMFYSA-N	1	0	293.386	1.640	50	0		CDAARO
CC[NH+]1CCC(CC(=O)N[C@@H](C)c2nnc(N)s2)CC1	ZINC000095500703	358696391	/nfs/dbraw/zinc/69/63/91/358696391.db2.gz	WDWXRBNWJJQJML-VIFPVBQESA-N	1	0	297.428	1.420	50	0		CDAARO
CC[N@H+](Cc1nc2ccccc2nc1C)[C@H]1COC[C@@H]1O	ZINC000097675569	358793031	/nfs/dbraw/zinc/79/30/31/358793031.db2.gz	LEJPDIREFZVFIW-HOTGVXAUSA-N	1	0	287.363	1.520	50	0		CDAARO
Cc1ncncc1C(=O)NCC(C)(C)C[NH+](C)C	ZINC000097757812	358796777	/nfs/dbraw/zinc/79/67/77/358796777.db2.gz	ZNRYFEOKZCUYRU-UHFFFAOYSA-N	1	0	250.346	1.103	50	0		CDAARO
Cc1ncnc(N2C[C@H]3CC[C@@H](C2)[C@H]3[NH+](C)C)c1C	ZINC000102776870	358891088	/nfs/dbraw/zinc/89/10/88/358891088.db2.gz	USSXYNUDHSOUES-WDNDVIMCSA-N	1	0	260.385	1.870	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@@H](CO)N(C(=O)c2ccc(Cl)cc2O)C1	ZINC000215819125	358904632	/nfs/dbraw/zinc/90/46/32/358904632.db2.gz	XXQSCLYEOCATNJ-MNOVXSKESA-N	1	0	298.770	1.183	50	0		CDAARO
Cc1cnn(C)c1C[N@H+](C)C[C@@H](O)c1ccccc1	ZINC000216045775	358920339	/nfs/dbraw/zinc/92/03/39/358920339.db2.gz	WKNRQMSNVJGXAU-OAHLLOKOSA-N	1	0	259.353	1.894	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@@H](CO)N(C/C=C/c2ccc(F)cc2)C1	ZINC000216103715	358925537	/nfs/dbraw/zinc/92/55/37/358925537.db2.gz	NSWITFAWRLVIHF-WNEUIUNWSA-N	1	0	278.371	1.836	50	0		CDAARO
CC[C@@H](NC(=O)Cn1nc(C)cc1N)c1nc(C)c[nH]1	ZINC000216349651	358939337	/nfs/dbraw/zinc/93/93/37/358939337.db2.gz	HVEBRZZGARITSS-SNVBAGLBSA-N	1	0	276.344	1.073	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@@H](CO)N(C(=O)c2ccc3ncccc3c2)C1	ZINC000219535696	359102633	/nfs/dbraw/zinc/10/26/33/359102633.db2.gz	GDAXFCZVBPPCRU-CABCVRRESA-N	1	0	299.374	1.372	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNC(=O)Cc1cc(C)no1	ZINC000219626456	359108716	/nfs/dbraw/zinc/10/87/16/359108716.db2.gz	SNKAMSCVSVRNNG-GFCCVEGCSA-N	1	0	265.357	1.516	50	0		CDAARO
COc1ccccc1CCC(=O)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000220459260	359174834	/nfs/dbraw/zinc/17/48/34/359174834.db2.gz	OQYKIKFKLDFZSC-CABCVRRESA-N	1	0	288.391	1.981	50	0		CDAARO
CCCOCCNc1cc(C2CC([NH3+])C2)nc(N)n1	ZINC000222917872	359382603	/nfs/dbraw/zinc/38/26/03/359382603.db2.gz	QJBUZSOYYPJNSX-UHFFFAOYSA-N	1	0	265.361	1.102	50	0		CDAARO
Cc1nc(N)ncc1C(=O)N[C@H](c1nccn1C)C(C)C	ZINC000223512409	359430963	/nfs/dbraw/zinc/43/09/63/359430963.db2.gz	JDICHDXXHWIGNG-NSHDSACASA-N	1	0	288.355	1.228	50	0		CDAARO
CCOC(=O)[C@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000000248224	359399840	/nfs/dbraw/zinc/39/98/40/359399840.db2.gz	DHNVWVJYVSKEOI-LBPRGKRZSA-N	1	0	254.374	1.356	50	0		CDAARO
O=C(NCCc1csc2ccccc12)[C@H]1C[C@H](O)C[NH2+]1	ZINC000277556186	359566337	/nfs/dbraw/zinc/56/63/37/359566337.db2.gz	MXBMYVXKGHDIIU-WCQYABFASA-N	1	0	290.388	1.283	50	0		CDAARO
CN1CCO[C@H](C(=O)Nc2nc3ccsc3s2)C1	ZINC000266916939	359918869	/nfs/dbraw/zinc/91/88/69/359918869.db2.gz	VAHMTGDYGZYHGA-QMMMGPOBSA-N	1	0	283.378	1.627	50	0		CDAARO
O=C(CC[N@@H+]1CC[C@H](c2nnc[nH]2)C1)Nc1ccccc1	ZINC000408524901	359934269	/nfs/dbraw/zinc/93/42/69/359934269.db2.gz	PDJOPKWAXMMEMR-LBPRGKRZSA-N	1	0	285.351	1.623	50	0		CDAARO
COC(=O)[C@@H]1CN(CCc2ccccc2)C[C@@H](C)O1	ZINC000089496909	359941466	/nfs/dbraw/zinc/94/14/66/359941466.db2.gz	UBZPCEORFNIRHJ-OCCSQVGLSA-N	1	0	263.337	1.491	50	0		CDAARO
Cc1ccc(N2CCC[C@H]([NH2+]C[C@H]3CCCCO3)C2)nn1	ZINC000247911184	360135851	/nfs/dbraw/zinc/13/58/51/360135851.db2.gz	LGSDQGFUDBHNLA-LSDHHAIUSA-N	1	0	290.411	1.913	50	0		CDAARO
CC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@H+]1[C@H](C)C(=O)NC1CC1	ZINC000247933722	360252100	/nfs/dbraw/zinc/25/21/00/360252100.db2.gz	KPSFOGHTYCJJJL-BYCMXARLSA-N	1	0	293.411	1.129	50	0		CDAARO
Cc1nnc2n1CC[C@@H]([N@H+](C)Cc1ccccn1)CC2	ZINC000409421243	360229940	/nfs/dbraw/zinc/22/99/40/360229940.db2.gz	HALPEDAVZVBFFH-AWEZNQCLSA-N	1	0	271.368	1.818	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@@H]1CCN(C(=O)c2ccnn2C)C1	ZINC000409421062	360230182	/nfs/dbraw/zinc/23/01/82/360230182.db2.gz	BPVPTFNDMPGALG-GFCCVEGCSA-N	1	0	273.340	1.321	50	0		CDAARO
O=C(Cn1ccc([C@@H]2CCC[NH2+]C2)n1)NCc1ccccn1	ZINC000426379703	360661041	/nfs/dbraw/zinc/66/10/41/360661041.db2.gz	KNNOWCCMWCRDGL-CYBMUJFWSA-N	1	0	299.378	1.062	50	0		CDAARO
CC1(C)C[N@H+](CCc2nn[nH]n2)C[C@@H]1c1ccccc1	ZINC000426719845	360698799	/nfs/dbraw/zinc/69/87/99/360698799.db2.gz	KHGJEWYNEMHKLQ-CYBMUJFWSA-N	1	0	271.368	1.868	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2c(Cl)n(C)nc2C(C)C)C1	ZINC000179009902	189161561	/nfs/dbraw/zinc/16/15/61/189161561.db2.gz	SVAAQZHIWHZYBH-JTQLQIEISA-N	1	0	298.818	1.878	50	0		CDAARO
CN(C(=O)CCOc1ccccc1Cl)[C@H]1CC[NH2+]C1	ZINC000179068452	189166635	/nfs/dbraw/zinc/16/66/35/189166635.db2.gz	FVGIILVHAVUAHY-NSHDSACASA-N	1	0	282.771	1.929	50	0		CDAARO
NC(=O)NC(=O)CCC[N@@H+]1CCc2ccc(F)cc2C1	ZINC000179077091	189166677	/nfs/dbraw/zinc/16/66/77/189166677.db2.gz	ZYGSKHSEPGAXIQ-UHFFFAOYSA-N	1	0	279.315	1.159	50	0		CDAARO
COCCC[N@@H+]1CC[C@H](CNC(=O)c2cc[nH]c2C)C1	ZINC000426571851	361018677	/nfs/dbraw/zinc/01/86/77/361018677.db2.gz	WWSKROFWWLLKMB-CYBMUJFWSA-N	1	0	279.384	1.411	50	0		CDAARO
COc1ccc(CC(=O)N2CC[C@H](C[NH3+])C2)c(Cl)c1	ZINC000299739978	200852210	/nfs/dbraw/zinc/85/22/10/200852210.db2.gz	UJDWQKMABMGFJI-SNVBAGLBSA-N	1	0	282.771	1.698	50	0		CDAARO
CC(C)(C)OC(=O)NCc1cn([C@@H]2CCC[NH2+]C2)nn1	ZINC000299805453	200882329	/nfs/dbraw/zinc/88/23/29/200882329.db2.gz	OWIKJTPGPPMAEM-LLVKDONJSA-N	1	0	281.360	1.227	50	0		CDAARO
CCOc1cc2c(cc1C[NH2+]C[C@@H](C)O)O[C@@H](C)C2	ZINC000035111534	361258199	/nfs/dbraw/zinc/25/81/99/361258199.db2.gz	DAOZUFSMWUNKFJ-MNOVXSKESA-N	1	0	265.353	1.879	50	0		CDAARO
Cc1nc(C(F)(F)F)ncc1CN1CC[NH2+]CC1	ZINC000426641365	361330488	/nfs/dbraw/zinc/33/04/88/361330488.db2.gz	LKXQPHITSXCYAB-UHFFFAOYSA-N	1	0	260.263	1.209	50	0		CDAARO
CO[C@@H]1CCN(C(=O)c2cccc(C[NH+](C)C)c2)C1	ZINC000360979008	361615554	/nfs/dbraw/zinc/61/55/54/361615554.db2.gz	JBEHEHDSBNOYLL-CQSZACIVSA-N	1	0	262.353	1.609	50	0		CDAARO
COc1cc(NC(=O)N(C)CC[NH+](C)C)ccc1F	ZINC000275479888	193053643	/nfs/dbraw/zinc/05/36/43/193053643.db2.gz	PIYHONFFVZLPKV-UHFFFAOYSA-N	1	0	269.320	1.860	50	0		CDAARO
COCc1cc(C(=O)N[C@H](C)C2=CC[N@H+](C)CC2)no1	ZINC000272679961	365348355	/nfs/dbraw/zinc/34/83/55/365348355.db2.gz	KPLOEUDHVUSXQS-SNVBAGLBSA-N	1	0	279.340	1.201	50	0		CDAARO
CS[C@H]1CN(C(=O)Nc2cc(C)no2)C[C@@H]1[NH+](C)C	ZINC000089608789	366884067	/nfs/dbraw/zinc/88/40/67/366884067.db2.gz	OLGOISRCAPGDOP-UWVGGRQHSA-N	1	0	284.385	1.492	50	0		CDAARO
CCC[C@H](C(=O)NCCc1nc(C)cs1)[NH+](C)C	ZINC000089949418	366979147	/nfs/dbraw/zinc/97/91/47/366979147.db2.gz	FEQYEBSCUVWNIE-LLVKDONJSA-N	1	0	269.414	1.841	50	0		CDAARO
C[C@@H]1CN(C(=O)c2cc(C(F)F)n[nH]2)[C@@H](C)CN1C	ZINC000630076996	367311986	/nfs/dbraw/zinc/31/19/86/367311986.db2.gz	MENKYRKQXDRTIL-SFYZADRCSA-N	1	0	272.299	1.512	50	0		CDAARO
Cc1ccc(F)c(C(=O)N[C@H]2CC[NH2+]C[C@H]2C)c1	ZINC000094345082	367414941	/nfs/dbraw/zinc/41/49/41/367414941.db2.gz	OMDOBBGSSMZZIT-MFKMUULPSA-N	1	0	250.317	1.862	50	0		CDAARO
Cc1ccc(C(=O)N[C@@H]2CC[NH2+]C[C@@H]2C)cc1F	ZINC000094345419	367471919	/nfs/dbraw/zinc/47/19/19/367471919.db2.gz	MCUGJJNOCHPIBJ-GXFFZTMASA-N	1	0	250.317	1.862	50	0		CDAARO
CN(C[C@H]1CCC[N@@H+]1C)S(=O)(=O)CC1CCCC1	ZINC000420769793	244370905	/nfs/dbraw/zinc/37/09/05/244370905.db2.gz	PSCLLVHSVNXSSN-CYBMUJFWSA-N	1	0	274.430	1.532	50	0		CDAARO
C[C@@H](C1CCN(C(=O)c2cn[nH]n2)CC1)[NH+]1CCCC1	ZINC000299757431	372745010	/nfs/dbraw/zinc/74/50/10/372745010.db2.gz	JMQANEZCMXDKPU-NSHDSACASA-N	1	0	277.372	1.141	50	0		CDAARO
O=C(NC[C@@H]1CCC2(CC[NH2+]CC2)O1)C1CCCCC1	ZINC000299768401	372750777	/nfs/dbraw/zinc/75/07/77/372750777.db2.gz	JFTMDEWSWUDWQY-AWEZNQCLSA-N	1	0	280.412	1.984	50	0		CDAARO
CC(=O)Nc1cc(C[NH3+])cc(C(=O)N2CCCC2)c1	ZINC000299803171	372773523	/nfs/dbraw/zinc/77/35/23/372773523.db2.gz	ZDGDQNQQHUYKCP-UHFFFAOYSA-N	1	0	261.325	1.340	50	0		CDAARO
Cc1c(Cl)cncc1NC(=O)NC[C@@H]1C[NH2+]CCCO1	ZINC000333279498	205181155	/nfs/dbraw/zinc/18/11/55/205181155.db2.gz	HIRNINACFRUQER-JTQLQIEISA-N	1	0	298.774	1.543	50	0		CDAARO
CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1C[C@@H](O)C[NH2+]1	ZINC000037800014	373340759	/nfs/dbraw/zinc/34/07/59/373340759.db2.gz	FDYUEXSHPWNZFT-SCZZXKLOSA-N	1	0	288.800	1.473	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1C(=O)N[C@H]1C[C@@H](CO)c2ccccc21	ZINC000253370973	373678724	/nfs/dbraw/zinc/67/87/24/373678724.db2.gz	YXNNMLJUGQECKL-TUKIKUTGSA-N	1	0	274.364	1.418	50	0		CDAARO
O[C@H](Cc1ccccc1)C[N@@H+]1CCC12CCOCC2	ZINC000253393976	373683970	/nfs/dbraw/zinc/68/39/70/373683970.db2.gz	XWEMKWHKTHGNDZ-OAHLLOKOSA-N	1	0	261.365	1.845	50	0		CDAARO
COc1ccc(C)cc1NC(=O)CN1CCC[N@H+](C)CC1	ZINC000298687461	373784057	/nfs/dbraw/zinc/78/40/57/373784057.db2.gz	XHEZCWSIUQMYOH-UHFFFAOYSA-N	1	0	291.395	1.580	50	0		CDAARO
CN(C)C(=O)[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1	ZINC000012997964	374005076	/nfs/dbraw/zinc/00/50/76/374005076.db2.gz	HHUHKGUFUAPVKE-AWEZNQCLSA-N	1	0	289.379	1.568	50	0		CDAARO
C[C@@H](C(=O)N1CCO[C@@H](C)[C@H]1C)[C@@H]([NH3+])c1ccccc1	ZINC000248921664	374205884	/nfs/dbraw/zinc/20/58/84/374205884.db2.gz	FFHNTCYWCXUHCO-GUIRCDHDSA-N	1	0	276.380	1.958	50	0		CDAARO
Cc1ccc([C@@H]2CCC[N@@H+]2CC(=O)N2CCNC2=O)cc1	ZINC000036392927	374559978	/nfs/dbraw/zinc/55/99/78/374559978.db2.gz	NZNVQZGOPMEYLS-AWEZNQCLSA-N	1	0	287.363	1.684	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@H](CC(N)=O)C2)cc1	ZINC000093809127	374785911	/nfs/dbraw/zinc/78/59/11/374785911.db2.gz	NOXCQFMCIHCWCE-CYBMUJFWSA-N	1	0	262.353	1.783	50	0		CDAARO
COc1cccc(CN2CC[N@H+](C)[C@@H](C)C2)c1OC	ZINC000019794836	374791720	/nfs/dbraw/zinc/79/17/20/374791720.db2.gz	BSKLUCGUPGRDHQ-LBPRGKRZSA-N	1	0	264.369	1.840	50	0		CDAARO
CCCN(CC[NH+](C)C)C(=O)Cc1cn2ccsc2n1	ZINC000095351232	374888531	/nfs/dbraw/zinc/88/85/31/374888531.db2.gz	VDHRLLISMKBICP-UHFFFAOYSA-N	1	0	294.424	1.739	50	0		CDAARO
C([NH2+]C(C1CC1)C1CC1)[C@H]([C@H]1CCOC1)N1CCOCC1	ZINC000095420025	374921018	/nfs/dbraw/zinc/92/10/18/374921018.db2.gz	JTLKXOXAKRTJTO-JKSUJKDBSA-N	1	0	294.439	1.502	50	0		CDAARO
C[C@@H](COc1cccc(F)c1)NC(=O)[C@H]1CCCC[NH2+]1	ZINC000095426460	374927519	/nfs/dbraw/zinc/92/75/19/374927519.db2.gz	ZLSLKIDFLODKIK-SMDDNHRTSA-N	1	0	280.343	1.851	50	0		CDAARO
CCCC[C@H]([NH3+])C(=O)N1CCC(N2CCCCC2=O)CC1	ZINC000095466814	374961353	/nfs/dbraw/zinc/96/13/53/374961353.db2.gz	YWDOZQSUMOIHEJ-AWEZNQCLSA-N	1	0	295.427	1.507	50	0		CDAARO
CCc1cc(C)nc(N2CC[N@H+](CCOC)[C@H](CC)C2)n1	ZINC000096011569	375050784	/nfs/dbraw/zinc/05/07/84/375050784.db2.gz	LWDADUFETCNMSC-OAHLLOKOSA-N	1	0	292.427	1.894	50	0		CDAARO
O=C(NC[C@H](O)c1ccccc1Cl)[C@]1(F)CC[NH2+]C1	ZINC000299739183	375200436	/nfs/dbraw/zinc/20/04/36/375200436.db2.gz	LQMIKYNNNXMUTA-AAEUAGOBSA-N	1	0	286.734	1.191	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=S)NCc1ccco1	ZINC000003286855	375623694	/nfs/dbraw/zinc/62/36/94/375623694.db2.gz	HGKPNPGBQODYCZ-LLVKDONJSA-N	1	0	267.398	1.728	50	0		CDAARO
Cc1ccc([C@H](CNC(=O)C2(C)COC2)[NH+](C)C)cc1	ZINC000360315202	375824705	/nfs/dbraw/zinc/82/47/05/375824705.db2.gz	COENGIALCNSWOR-AWEZNQCLSA-N	1	0	276.380	1.750	50	0		CDAARO
Nc1nc(Cl)cc(N2CCC[N@@H+]3CCC[C@H]3C2)n1	ZINC000239352485	376015219	/nfs/dbraw/zinc/01/52/19/376015219.db2.gz	ACJHOACUEGAFAW-VIFPVBQESA-N	1	0	267.764	1.387	50	0		CDAARO
C[C@H](C[NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)[S@@](C)=O	ZINC000242100106	376021334	/nfs/dbraw/zinc/02/13/34/376021334.db2.gz	WEIYYPXDJDGTLF-APPZKNGHSA-N	1	0	271.426	1.691	50	0		CDAARO
C[NH+](C)CCC(=O)c1ccc(NS(C)(=O)=O)cc1	ZINC000049947106	376055934	/nfs/dbraw/zinc/05/59/34/376055934.db2.gz	JKHVQIXMUNOFBP-UHFFFAOYSA-N	1	0	270.354	1.193	50	0		CDAARO
OCCC[N@@H+]1CCc2[nH]nc(-c3ccccc3F)c2C1	ZINC000067433892	377074029	/nfs/dbraw/zinc/07/40/29/377074029.db2.gz	XOICWIUVFXUSQO-UHFFFAOYSA-N	1	0	275.327	1.956	50	0		CDAARO
C[N@@H+]1CCC[C@H](NC(=O)NCCc2ccncc2)C1	ZINC000089375316	377847884	/nfs/dbraw/zinc/84/78/84/377847884.db2.gz	IILNQRVECTVGMC-ZDUSSCGKSA-N	1	0	262.357	1.018	50	0		CDAARO
CC[NH+]1CCN(c2nc(-c3ccccc3)cc(=O)[nH]2)CC1	ZINC000009764263	379527110	/nfs/dbraw/zinc/52/71/10/379527110.db2.gz	CZZUMGMZLHFOHG-UHFFFAOYSA-N	1	0	284.363	1.579	50	0		CDAARO
COCC[NH2+][C@@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000001529142	285081960	/nfs/dbraw/zinc/08/19/60/285081960.db2.gz	PXCLVBLJRPLSEC-JTQLQIEISA-N	1	0	257.355	1.387	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCCN1C(=O)/C=C\C1CCOCC1	ZINC000493167777	253387853	/nfs/dbraw/zinc/38/78/53/253387853.db2.gz	AWYLSRWNIGNMSS-KIZSPLDGSA-N	1	0	266.385	1.698	50	0		CDAARO
C[C@@H]1CCC[C@@H](OCC(=O)N2CCCC[C@H]2C[NH3+])C1	ZINC000521394598	256854308	/nfs/dbraw/zinc/85/43/08/256854308.db2.gz	ZWAFPDOFBODFFX-HZSPNIEDSA-N	1	0	268.401	1.922	50	0		CDAARO
CC(C)[NH2+]C[C@H](O)c1ccc(NS(C)(=O)=O)cc1	ZINC000000896819	169682309	/nfs/dbraw/zinc/68/23/09/169682309.db2.gz	ZBMZVLHSJCTVON-LBPRGKRZSA-N	1	0	272.370	1.090	50	0	fda	CDAARO
NC(=[NH2+])NCc1cccc(I)c1	ZINC000001538318	169712131	/nfs/dbraw/zinc/71/21/31/169712131.db2.gz	PDWUPXJEEYOOTR-UHFFFAOYSA-N	1	0	275.093	1.274	50	0	world	CDAARO
COC(=O)CCCN1CCc2ccccc2[C@@H]1C(N)=O	ZINC000096409564	390508043	/nfs/dbraw/zinc/50/80/43/390508043.db2.gz	BSJBZARCDVLPDX-CQSZACIVSA-N	1	0	276.336	1.024	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](NC(=O)NCc2ccccc2C)C1	ZINC000096413337	390510168	/nfs/dbraw/zinc/51/01/68/390510168.db2.gz	SDGSGDXLKCYARP-OAHLLOKOSA-N	1	0	291.395	1.515	50	0		CDAARO
CC(C)C[C@](C)([NH2+]CC(=O)N1CCC(C)CC1)C(N)=O	ZINC000096419584	390512941	/nfs/dbraw/zinc/51/29/41/390512941.db2.gz	CUKAPPHTTQEUKN-HNNXBMFYSA-N	1	0	283.416	1.125	50	0		CDAARO
COC[C@@H](O)C[N@H+](C)Cc1cccc(NC(C)=O)c1	ZINC000096424651	390515688	/nfs/dbraw/zinc/51/56/88/390515688.db2.gz	RBLVADOZIVVZMI-AWEZNQCLSA-N	1	0	266.341	1.084	50	0		CDAARO
COc1ccc([C@@H](O)C[NH2+]Cc2c[nH]nc2C)cc1	ZINC000097159545	390801118	/nfs/dbraw/zinc/80/11/18/390801118.db2.gz	HJSWSFAECULWKY-AWEZNQCLSA-N	1	0	261.325	1.550	50	0		CDAARO
c1ccc(N2CCN(C[C@H]3CCC[NH2+]C3)CC2)nc1	ZINC000020072927	285482213	/nfs/dbraw/zinc/48/22/13/285482213.db2.gz	YBHAJIYLLVWXBK-AWEZNQCLSA-N	1	0	260.385	1.203	50	0		CDAARO
FC(F)(F)CN1CC[NH+](CC[C@@H]2CCOC2)CC1	ZINC000437574249	392462203	/nfs/dbraw/zinc/46/22/03/392462203.db2.gz	AXBUOMBAAUQPFM-LLVKDONJSA-N	1	0	266.307	1.593	50	0		CDAARO
C[NH+]1CCC(CNC(=O)COc2cccc(F)c2)CC1	ZINC000074861031	139645783	/nfs/dbraw/zinc/64/57/83/139645783.db2.gz	QHZNQQGUBWSAHQ-UHFFFAOYSA-N	1	0	280.343	1.663	50	0		CDAARO
C[C@H](CNC(=O)N1CCCC1)[N@@H+]1CCC[C@H](C)C1	ZINC000245266596	140263738	/nfs/dbraw/zinc/26/37/38/140263738.db2.gz	KFQPFGNDVRAERH-QWHCGFSZSA-N	1	0	253.390	1.912	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[N@@H+]1CC[C@H]2CCCC[C@@H]2C1	ZINC000103511411	397907344	/nfs/dbraw/zinc/90/73/44/397907344.db2.gz	YOVRCEQNLOHWNK-QJPTWQEYSA-N	1	0	267.373	1.343	50	0		CDAARO
CCOC(=O)[C@H]1CC[C@@H]([NH3+])[C@H](NC(=O)OC(C)(C)C)C1	ZINC000095743377	285940897	/nfs/dbraw/zinc/94/08/97/285940897.db2.gz	STWAQGKVYHZJCJ-HBNTYKKESA-N	1	0	286.372	1.570	50	0		CDAARO
COCCC1(C[NH3+])CCN(C(=O)OC(C)(C)C)CC1	ZINC000096029443	292300014	/nfs/dbraw/zinc/30/00/14/292300014.db2.gz	IBLSTEKEDIPNJW-UHFFFAOYSA-N	1	0	272.389	1.999	50	0		CDAARO
O=C1C[C@@H]([NH2+]C2CCCC2)C(=O)N1c1ccccc1	ZINC000004954087	170045355	/nfs/dbraw/zinc/04/53/55/170045355.db2.gz	BOECZKNDQUNYMW-CYBMUJFWSA-N	1	0	258.321	1.851	50	0		CDAARO
CCOc1ccccc1C[NH2+]CCSc1nnnn1C	ZINC000004998023	170052171	/nfs/dbraw/zinc/05/21/71/170052171.db2.gz	YHULQVQKUIFYFI-UHFFFAOYSA-N	1	0	293.396	1.491	50	0		CDAARO
CCc1ccc(OCCOCC[NH2+]CCOC)cc1	ZINC000005042600	170059837	/nfs/dbraw/zinc/05/98/37/170059837.db2.gz	YQHVLFHKCZQWFV-UHFFFAOYSA-N	1	0	267.369	1.880	50	0		CDAARO
C=Cn1nccc1[C@](O)(CCC[NH+](C)C)c1ccncc1	ZINC000005140121	170070518	/nfs/dbraw/zinc/07/05/18/170070518.db2.gz	WECVTOHVPCTMAT-INIZCTEOSA-N	1	0	286.379	1.956	50	0		CDAARO
COc1ccc2cc(C(=O)NCC[NH+](C)C)[nH]c2c1	ZINC000005302419	170084613	/nfs/dbraw/zinc/08/46/13/170084613.db2.gz	QJYHOECAZOTIHW-UHFFFAOYSA-N	1	0	261.325	1.468	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)COc2ccc(Cl)cc2)CC1	ZINC000006725833	170232910	/nfs/dbraw/zinc/23/29/10/170232910.db2.gz	FOGOQJKYRLLMFU-UHFFFAOYSA-N	1	0	282.771	1.883	50	0		CDAARO
O=S(=O)(NCCC[NH+]1CCCC1)c1cccs1	ZINC000007728018	170299205	/nfs/dbraw/zinc/29/92/05/170299205.db2.gz	IFFYICPSWPDMOK-UHFFFAOYSA-N	1	0	274.411	1.512	50	0		CDAARO
CCOc1ccc(OCC[NH+]2CCC(C(N)=O)CC2)cc1	ZINC000008317253	170330399	/nfs/dbraw/zinc/33/03/99/170330399.db2.gz	XOQSDWUBCVOLCQ-UHFFFAOYSA-N	1	0	292.379	1.661	50	0		CDAARO
COc1cc(NC(=O)[C@@H]2CCC[NH2+]2)cc(OC)c1OC	ZINC000011754522	170438824	/nfs/dbraw/zinc/43/88/24/170438824.db2.gz	CJPPFQXRAPTEIX-JTQLQIEISA-N	1	0	280.324	1.403	50	0		CDAARO
COc1ccccc1OC[C@H](O)C[NH2+]CC(C)C	ZINC000016650643	170707224	/nfs/dbraw/zinc/70/72/24/170707224.db2.gz	ATVFDNXXPBKULZ-GFCCVEGCSA-N	1	0	253.342	1.681	50	0		CDAARO
CC[C@H](CO)[NH2+]C[C@H](O)COc1cccc2ccccc21	ZINC000017269051	170731515	/nfs/dbraw/zinc/73/15/15/170731515.db2.gz	OWASUJBWCYEWTB-CABCVRRESA-N	1	0	289.375	1.940	50	0		CDAARO
CCC/C=C/C[NH+]1CCC(n2cc(CO)nn2)CC1	ZINC000020256213	171110781	/nfs/dbraw/zinc/11/07/81/171110781.db2.gz	IGJZKAGDNJLZSZ-SNAWJCMRSA-N	1	0	264.373	1.764	50	0		CDAARO
COC(=O)[C@@H](c1ccc(Cl)cc1)N1CC[NH2+]CC1	ZINC000020282888	171132798	/nfs/dbraw/zinc/13/27/98/171132798.db2.gz	IEHFYAQJHKFHTJ-GFCCVEGCSA-N	1	0	268.744	1.459	50	0		CDAARO
C[NH+]1CCC(C)(c2nc(CCN3CCCC3=O)no2)CC1	ZINC000020451341	171207557	/nfs/dbraw/zinc/20/75/57/171207557.db2.gz	BESYKGXIZONOMG-UHFFFAOYSA-N	1	0	292.383	1.218	50	0		CDAARO
CO[C@H]1C[C@@H](CN(C)C(=O)c2ccnc(Cl)c2)[N@H+](C)C1	ZINC000284721998	196119214	/nfs/dbraw/zinc/11/92/14/196119214.db2.gz	SLEHJXXQPYZKTD-RYUDHWBXSA-N	1	0	297.786	1.526	50	0		CDAARO
COC(=O)[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCC[NH2+]C1	ZINC000022013896	171349133	/nfs/dbraw/zinc/34/91/33/171349133.db2.gz	HKYHGXQKYQHGFW-NXEZZACHSA-N	1	0	272.345	1.052	50	0		CDAARO
COC(=O)[C@H](C)C[NH+]1CCN(Cc2ccccc2)CC1	ZINC000022038911	171350289	/nfs/dbraw/zinc/35/02/89/171350289.db2.gz	TYEGCTFOVYJSIJ-CQSZACIVSA-N	1	0	276.380	1.613	50	0		CDAARO
COC(=O)c1ccc(CN(C)CC[NH+](C)C)cc1	ZINC000022586544	171393330	/nfs/dbraw/zinc/39/33/30/171393330.db2.gz	UPVFBCZNQNRJJV-UHFFFAOYSA-N	1	0	250.342	1.467	50	0		CDAARO
C[C@H](C(N)=O)N1CC[NH+](Cc2cccc3ccccc32)CC1	ZINC000022803490	171399623	/nfs/dbraw/zinc/39/96/23/171399623.db2.gz	XHVJENGTSCBXIM-CQSZACIVSA-N	1	0	297.402	1.831	50	0		CDAARO
O=C(NC[C@H](O)c1ccccc1)[C@@H]1Cc2ccccc2C[NH2+]1	ZINC000035349333	172143729	/nfs/dbraw/zinc/14/37/29/172143729.db2.gz	ABYODZCNDMDCOU-IRXDYDNUSA-N	1	0	296.370	1.551	50	0		CDAARO
CCC(=O)N1CCCN(C(=O)C2([NH3+])CCCCC2)CC1	ZINC000038101601	174117711	/nfs/dbraw/zinc/11/77/11/174117711.db2.gz	KDHUTPHQDFDKRS-UHFFFAOYSA-N	1	0	281.400	1.119	50	0		CDAARO
Cc1cc(NCCSc2nccn2C)nc(N)[nH+]1	ZINC000045724720	175382661	/nfs/dbraw/zinc/38/26/61/175382661.db2.gz	VBJYZEXRJMFXAW-UHFFFAOYSA-N	1	0	264.358	1.305	50	0		CDAARO
COC(=O)N[C@@H](C)c1nc(CC2CC[NH+](C)CC2)no1	ZINC000067688729	175784053	/nfs/dbraw/zinc/78/40/53/175784053.db2.gz	AIJXSBXVYHFUHI-VIFPVBQESA-N	1	0	282.344	1.371	50	0		CDAARO
OCC(CO)[N@@H+]1CCC[C@@H](CCc2ccccc2F)C1	ZINC000071707806	176248554	/nfs/dbraw/zinc/24/85/54/176248554.db2.gz	AGORSBWBZHMRIL-ZDUSSCGKSA-N	1	0	281.371	1.824	50	0		CDAARO
CCCc1cnc(C)nc1NC[C@@H]1C[NH2+]CCOC1	ZINC000072134719	176322348	/nfs/dbraw/zinc/32/23/48/176322348.db2.gz	HRBPQSXWJAXJFS-LBPRGKRZSA-N	1	0	264.373	1.385	50	0		CDAARO
NC(=O)CC[C@H]1CCC[N@H+](Cc2cccnc2N)C1	ZINC000072148478	176325593	/nfs/dbraw/zinc/32/55/93/176325593.db2.gz	OYKMTQKMYVHMTB-LLVKDONJSA-N	1	0	262.357	1.141	50	0		CDAARO
COc1ccc(/C=C/C[N@@H+]2CCOC[C@@H](CO)C2)cc1	ZINC000077300387	177250276	/nfs/dbraw/zinc/25/02/76/177250276.db2.gz	XHEVSPFAUWVDED-XYBNCVKDSA-N	1	0	277.364	1.649	50	0		CDAARO
O[C@@H]1COCC[N@@H+](C2CCN(Cc3ccccc3)CC2)C1	ZINC000077320759	177252706	/nfs/dbraw/zinc/25/27/06/177252706.db2.gz	OFVCMANMBHJEQI-KRWDZBQOSA-N	1	0	290.407	1.344	50	0		CDAARO
Cc1ccc(OC2CCN(C(=O)[C@@H](C)[NH3+])CC2)cc1	ZINC000077408157	177264157	/nfs/dbraw/zinc/26/41/57/177264157.db2.gz	JFCCPZVOBDFREW-GFCCVEGCSA-N	1	0	262.353	1.712	50	0		CDAARO
C[N@@H+](Cc1nc(-c2ccncc2)no1)C[C@H]1CCOC1	ZINC000077537058	177278918	/nfs/dbraw/zinc/27/89/18/177278918.db2.gz	VLGUTRWIKWUCGO-LLVKDONJSA-N	1	0	274.324	1.600	50	0		CDAARO
C[C@@H]1CCCN(C(=O)[C@@H]2CC23CCOCC3)[C@H]1C[NH3+]	ZINC000299739628	287334820	/nfs/dbraw/zinc/33/48/20/287334820.db2.gz	QSDXMSJZSSORFA-AGIUHOORSA-N	1	0	266.385	1.389	50	0		CDAARO
C[C@H]1CCCN(S(=O)(=O)N2CCCCCC2)[C@H]1C[NH3+]	ZINC000252097218	299846090	/nfs/dbraw/zinc/84/60/90/299846090.db2.gz	FREMGPMCPWVKSK-STQMWFEESA-N	1	0	289.445	1.166	50	0		CDAARO
CCc1cc(N[C@H]2CC[NH2+]C2)n2nc(C)c(C)c2n1	ZINC000077390598	273768096	/nfs/dbraw/zinc/76/80/96/273768096.db2.gz	GGAYBYOQPRKERW-LBPRGKRZSA-N	1	0	259.357	1.682	50	0		CDAARO
CN1CCN(C(=O)C2CC[NH+](C)CC2)Cc2ccccc21	ZINC000095402777	273867865	/nfs/dbraw/zinc/86/78/65/273867865.db2.gz	UUJQNHAOQPHENM-UHFFFAOYSA-N	1	0	287.407	1.807	50	0		CDAARO
C[C@@H](CO)NC(=O)NC[C@H](c1ccc(Cl)cc1)[NH+](C)C	ZINC000084640291	274228572	/nfs/dbraw/zinc/22/85/72/274228572.db2.gz	ODAPDMHQAFDRFU-GXFFZTMASA-N	1	0	299.802	1.623	50	0		CDAARO
C[C@H]1CCCN(C(=O)c2ccnc(-n3ccnc3)c2)[C@@H]1C[NH3+]	ZINC000179226509	274554312	/nfs/dbraw/zinc/55/43/12/274554312.db2.gz	HARKAPMUXJLUDN-GXTWGEPZSA-N	1	0	299.378	1.467	50	0		CDAARO
C([C@H]1CCCCO1)N1CC[NH+]([C@@H]2CCSC2)CC1	ZINC000097014614	275397521	/nfs/dbraw/zinc/39/75/21/275397521.db2.gz	JCZCSGBMCFDWEO-ZIAGYGMSSA-N	1	0	270.442	1.679	50	0		CDAARO
CCCc1nnc(C(=O)N2CCC[C@]3(CC[N@H+](C)C3)C2)o1	ZINC000071764963	276057315	/nfs/dbraw/zinc/05/73/15/276057315.db2.gz	IMFYLFBYMDRLSM-OAHLLOKOSA-N	1	0	292.383	1.580	50	0		CDAARO
CCO[C@@H]1CCCN(C(=O)C2([NH3+])Cc3ccccc3C2)C1	ZINC000299738739	276467247	/nfs/dbraw/zinc/46/72/47/276467247.db2.gz	FSSJYSHLUUZCOY-OAHLLOKOSA-N	1	0	288.391	1.510	50	0		CDAARO
CN(C)CC[n+]1ccc(C(=O)c2ccccc2)cc1	ZINC000005004647	276793678	/nfs/dbraw/zinc/79/36/78/276793678.db2.gz	OFDUTPNOLJAYKU-UHFFFAOYSA-N	1	0	255.341	1.767	50	0		CDAARO
CC(C)(C)NC(=O)N1CCC([C@@H]2CC[NH2+]C2)CC1	ZINC000257186572	278360445	/nfs/dbraw/zinc/36/04/45/278360445.db2.gz	ZICIECOBTWNBGO-GFCCVEGCSA-N	1	0	253.390	1.816	50	0		CDAARO
c1cncc(C[NH2+]C[C@H]2COC3(CCOCC3)O2)c1	ZINC000095991138	280501586	/nfs/dbraw/zinc/50/15/86/280501586.db2.gz	XVCOQUZNZWFKRN-ZDUSSCGKSA-N	1	0	264.325	1.093	50	0		CDAARO
C[N@@H+]1CCN(c2ccc3nnnn3n2)[C@H](c2ccccc2)C1	ZINC000037190290	290058275	/nfs/dbraw/zinc/05/82/75/290058275.db2.gz	FZZRPSSTHFOIPP-ZDUSSCGKSA-N	1	0	295.350	1.012	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@@H]1CCC[NH2+][C@@H]1C	ZINC000091496976	301317733	/nfs/dbraw/zinc/31/77/33/301317733.db2.gz	AAYHRVOVMJWPEO-ZYHUDNBSSA-N	1	0	286.372	1.553	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)[C@@H]3OCCc4ccccc43)C[C@@H]12	ZINC000195562273	303471798	/nfs/dbraw/zinc/47/17/98/303471798.db2.gz	BAHQJLDGROLBCA-DTZQCDIJSA-N	1	0	286.375	1.496	50	0		CDAARO
C[C@H](CCNC(=O)Cc1ccsc1)[NH+]1CCN(C)CC1	ZINC000534577283	328310401	/nfs/dbraw/zinc/31/04/01/328310401.db2.gz	SPGQYUSJYLOHQS-CYBMUJFWSA-N	1	0	295.452	1.433	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCNC(=O)CCc2cn[nH]c2)C1	ZINC000534584968	328314980	/nfs/dbraw/zinc/31/49/80/328314980.db2.gz	UQYYGCGMLXENLJ-LBPRGKRZSA-N	1	0	264.373	1.190	50	0		CDAARO
Cc1n[nH]c(C)c1CCCNC(=O)[C@H]1CC12CC[NH2+]CC2	ZINC000534587332	328315982	/nfs/dbraw/zinc/31/59/82/328315982.db2.gz	NETSEKQRVQEERN-CQSZACIVSA-N	1	0	290.411	1.465	50	0		CDAARO
CCC[C@H](CNC(=O)N1CC(c2ccncc2)C1)[NH+](C)C	ZINC000534587883	328316236	/nfs/dbraw/zinc/31/62/36/328316236.db2.gz	CUGOVPAANNZRNZ-OAHLLOKOSA-N	1	0	290.411	1.921	50	0		CDAARO
CCOC(=O)N1CCC([NH2+][C@H](C)c2nc(C)c[nH]2)CC1	ZINC000534660549	328339719	/nfs/dbraw/zinc/33/97/19/328339719.db2.gz	NANFFKKUINTOLG-LLVKDONJSA-N	1	0	280.372	1.990	50	0		CDAARO
CCO[C@H]1COC[C@@H]1[NH2+]C1CCN(Cc2ccco2)CC1	ZINC000534658719	328341346	/nfs/dbraw/zinc/34/13/46/328341346.db2.gz	VFKZNSPODHJHPJ-HOTGVXAUSA-N	1	0	294.395	1.638	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@@H](C)C1CCCCC1	ZINC000097373717	323207889	/nfs/dbraw/zinc/20/78/89/323207889.db2.gz	RHSHODIBZYRPCU-NSHDSACASA-N	1	0	262.419	1.484	50	0		CDAARO
c1cnc(N2CC[NH+](CC[C@H]3CCCO3)CC2)cn1	ZINC000188895840	323459869	/nfs/dbraw/zinc/45/98/69/323459869.db2.gz	NWJCYRWEBXORDY-CYBMUJFWSA-N	1	0	262.357	1.168	50	0		CDAARO
CO[C@@H]1C[NH2+][C@@H](C(=O)NCCCc2cccc(F)c2)C1	ZINC000191927084	323506894	/nfs/dbraw/zinc/50/68/94/323506894.db2.gz	PKLHHIKWRAZZSC-UONOGXRCSA-N	1	0	280.343	1.251	50	0		CDAARO
CNCc1nnc(NC2CC(C)(C)[NH2+]C(C)(C)C2)o1	ZINC001772709963	1159444116	/nfs/dbraw/zinc/44/41/16/1159444116.db2.gz	NGWXRTUNTHJELI-UHFFFAOYSA-N	1	0	267.377	1.510	50	0		CDAARO
O=C(Cc1ccc(O)cc1)N1CC[C@]2(CC[NH2+]C2)C1	ZINC000033426442	482518160	/nfs/dbraw/zinc/51/81/60/482518160.db2.gz	QLGBKHRBXZSXQT-HNNXBMFYSA-N	1	0	260.337	1.147	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CCc2nncn2C(C)C)n1	ZINC000670455791	483033567	/nfs/dbraw/zinc/03/35/67/483033567.db2.gz	ZZYHKKXMLOKGDC-CYBMUJFWSA-N	1	0	290.415	1.893	50	0		CDAARO
O[C@H]1CN(c2nc3ccccc3o2)C[C@@H]1[NH+]1CCCC1	ZINC000670459526	483040579	/nfs/dbraw/zinc/04/05/79/483040579.db2.gz	VOUQIMLBNBVVKX-STQMWFEESA-N	1	0	273.336	1.473	50	0		CDAARO
OC1(c2ccccn2)CCN([C@H]2C[NH+]3CCC2CC3)CC1	ZINC000670468984	483061106	/nfs/dbraw/zinc/06/11/06/483061106.db2.gz	XMPXUFCMKOHELR-HNNXBMFYSA-N	1	0	287.407	1.459	50	0		CDAARO
OC[C@@H](O)C[N@H+](CCC(F)(F)F)[C@H]1C=CCCC1	ZINC000096461004	534381233	/nfs/dbraw/zinc/38/12/33/534381233.db2.gz	GMJNMMBUANRRBK-QWRGUYRKSA-N	1	0	267.291	1.703	50	0		CDAARO
CC[C@H](C)[C@@H]([NH3+])C(=O)N1CCC(N2CCCCC2=O)CC1	ZINC000096499726	529213726	/nfs/dbraw/zinc/21/37/26/529213726.db2.gz	ZEABLEHPLRBBNZ-SWLSCSKDSA-N	1	0	295.427	1.363	50	0		CDAARO
C[C@@H](Cn1cccn1)[NH2+]C[C@H]1CC(=O)Nc2ccccc21	ZINC000097162381	545522499	/nfs/dbraw/zinc/52/24/99/545522499.db2.gz	HPZXYKGDYQYPPC-QWHCGFSZSA-N	1	0	284.363	1.987	50	0		CDAARO
CC[NH+](CC)CCOC1=NS(=O)(=O)c2ccccc21	ZINC000001461764	619717274	/nfs/dbraw/zinc/71/72/74/619717274.db2.gz	JYJZYWSWHBYQCA-UHFFFAOYSA-N	1	0	282.365	1.494	50	0		CDAARO
Cc1cc(N)nc(N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)[nH+]1	ZINC000871101504	630805439	/nfs/dbraw/zinc/80/54/39/630805439.db2.gz	QMUKOCGIVORDSO-WCQGTBRESA-N	1	0	260.341	1.737	50	0		CDAARO
Cc1cccc(C)c1NC(=O)N1C[C@H]2C[NH2+]C[C@]2(CO)C1	ZINC001772702051	1159436866	/nfs/dbraw/zinc/43/68/66/1159436866.db2.gz	QHDSSKOELDLMFT-CZUORRHYSA-N	1	0	289.379	1.349	50	0		CDAARO
OC[C@H](O)C1CC[NH+](CCCOCc2ccccc2)CC1	ZINC001772709139	1159443612	/nfs/dbraw/zinc/44/36/12/1159443612.db2.gz	MLHWWUJRDNBHCL-KRWDZBQOSA-N	1	0	293.407	1.659	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1CCCNCc1nccs1	ZINC000952965154	796490262	/nfs/dbraw/zinc/49/02/62/796490262.db2.gz	QLXNIPRKLFLVQZ-LBPRGKRZSA-N	1	0	269.414	1.470	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)Cc1ccccn1	ZINC000067879918	796761536	/nfs/dbraw/zinc/76/15/36/796761536.db2.gz	NAAMUMRUEDDBHC-UHFFFAOYSA-N	1	0	270.336	1.556	50	0		CDAARO
Cc1ccnn1CCC[NH+]1CCN(c2ncccn2)CC1	ZINC000137599264	797274602	/nfs/dbraw/zinc/27/46/02/797274602.db2.gz	CIBRWTWSNIZVSJ-UHFFFAOYSA-N	1	0	286.383	1.194	50	0		CDAARO
CC(=O)N1CCC[N@H+](CCc2c(C)n[nH]c2C)CC1	ZINC000426641353	797446026	/nfs/dbraw/zinc/44/60/26/797446026.db2.gz	JIGNLIAPYOJWJV-UHFFFAOYSA-N	1	0	264.373	1.123	50	0		CDAARO
CCCCCn1ncc(N2CCC(C[NH3+])CC2)cc1=O	ZINC000019742882	899214602	/nfs/dbraw/zinc/21/46/02/899214602.db2.gz	IVHGNCKQUMVPGB-UHFFFAOYSA-N	1	0	278.400	1.609	50	0		CDAARO
Cc1c[nH]c([C@@H](C)NC(=O)C(C)(C)[NH+]2CCCC2)n1	ZINC000426698183	902903380	/nfs/dbraw/zinc/90/33/80/902903380.db2.gz	GBEVXRRQOIMOIB-LLVKDONJSA-N	1	0	264.373	1.770	50	0		CDAARO
COc1ccc(C(=O)[C@H]2CCC[N@H+](CCO)C2)cc1F	ZINC000011842758	921253964	/nfs/dbraw/zinc/25/39/64/921253964.db2.gz	QGODGHRYNRYDID-LBPRGKRZSA-N	1	0	281.327	1.721	50	0		CDAARO
COC(C)(C)c1cn(CC[NH+]2CCCCC2)nn1	ZINC000952883724	910454796	/nfs/dbraw/zinc/45/47/96/910454796.db2.gz	ZDXMZVIFJKWLEO-UHFFFAOYSA-N	1	0	252.362	1.646	50	0		CDAARO
CCc1nc(CNC(=O)[C@@H]2CC(=O)N(CC(C)C)C2)c[nH]1	ZINC000952884365	910456957	/nfs/dbraw/zinc/45/69/57/910456957.db2.gz	ZCGILZQUPPEGOE-LLVKDONJSA-N	1	0	292.383	1.093	50	0		CDAARO
CCCOc1cccc(NC(=O)[C@@]2([NH3+])CC[C@H](O)C2)c1	ZINC000952884251	910458583	/nfs/dbraw/zinc/45/85/83/910458583.db2.gz	RPOJIQADDSFYRL-SWLSCSKDSA-N	1	0	278.352	1.656	50	0		CDAARO
COc1ccc(F)c(C[N@H+](C)[C@@H](C)CC(N)=O)c1	ZINC000952864688	910458752	/nfs/dbraw/zinc/45/87/52/910458752.db2.gz	LACWZNRKEPBZIU-VIFPVBQESA-N	1	0	254.305	1.530	50	0		CDAARO
OC[C@H]1CCCN(CC[NH2+]Cc2ccc3[nH]ccc3c2)C1	ZINC000952969347	910502989	/nfs/dbraw/zinc/50/29/89/910502989.db2.gz	DXRBOAOXRZOKAZ-HNNXBMFYSA-N	1	0	287.407	1.962	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)N1CCC[C@@H](c2nnc[nH]2)C1	ZINC000952991786	910538426	/nfs/dbraw/zinc/53/84/26/910538426.db2.gz	SOOWSMGOIAUFPX-CYBMUJFWSA-N	1	0	291.399	1.387	50	0		CDAARO
CC(C)c1cccc(N2CCN(CC(=O)N(C)C)CC2)n1	ZINC000827868389	925977799	/nfs/dbraw/zinc/97/77/99/925977799.db2.gz	NYBOJDOJPKWIFI-UHFFFAOYSA-N	1	0	290.411	1.415	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1CCCNc1cnccn1	ZINC000828711024	926169100	/nfs/dbraw/zinc/16/91/00/926169100.db2.gz	ZILHXPISVOJVRN-LBPRGKRZSA-N	1	0	250.346	1.125	50	0		CDAARO
CNc1nc(NCCC[N@@H+]2CCCC[C@H]2CO)ncc1F	ZINC000828710928	926169133	/nfs/dbraw/zinc/16/91/33/926169133.db2.gz	PTPGIKDFPYZAJA-NSHDSACASA-N	1	0	297.378	1.306	50	0		CDAARO
CN1CC[N@H+](Cc2cccc3cnccc32)C[C@H]1CCO	ZINC000828747176	926174116	/nfs/dbraw/zinc/17/41/16/926174116.db2.gz	IMHMYRAISBOAKT-MRXNPFEDSA-N	1	0	285.391	1.733	50	0		CDAARO
CCCS(=O)(=O)NCCn1c(C)c[nH+]c1C1CC1	ZINC000581813092	927203402	/nfs/dbraw/zinc/20/34/02/927203402.db2.gz	YYBXCUKBCLQXCR-UHFFFAOYSA-N	1	0	271.386	1.398	50	0		CDAARO
COCc1nc(-c2ccc(O[C@@H]3CC[NH2+]C3)cc2)no1	ZINC000670061794	937153050	/nfs/dbraw/zinc/15/30/50/937153050.db2.gz	LQTZCAWCTJXDFE-GFCCVEGCSA-N	1	0	275.308	1.624	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@H](C[N@@H+]2CC[C@H](C(N)=O)C2)C1	ZINC000584907098	930677649	/nfs/dbraw/zinc/67/76/49/930677649.db2.gz	PQTKIJUOLFCAEZ-NEPJUHHUSA-N	1	0	297.399	1.051	50	0		CDAARO
CC[N@H+](C)[C@H]1CCN(C(=O)Nc2c(C)n[nH]c2C)C1	ZINC000585081780	930853863	/nfs/dbraw/zinc/85/38/63/930853863.db2.gz	AJTYQFPLEKLUCZ-NSHDSACASA-N	1	0	265.361	1.584	50	0		CDAARO
O=C(NCc1nccs1)[C@H]1CCC[C@@H]2CCC[N@@H+]21	ZINC000585121981	930988160	/nfs/dbraw/zinc/98/81/60/930988160.db2.gz	ITLGEJIXZWZLIZ-GHMZBOCLSA-N	1	0	265.382	1.776	50	0		CDAARO
Cn1ccc(C(=O)N2C[C@H]([NH+](C)C)CCc3ccccc32)n1	ZINC000585122515	930989366	/nfs/dbraw/zinc/98/93/66/930989366.db2.gz	SWXORXVBZXZDIX-CQSZACIVSA-N	1	0	298.390	1.943	50	0		CDAARO
COCCN1CCC[C@@]2(CC[N@H+](Cc3ccco3)C2)C1=O	ZINC000015079658	935533097	/nfs/dbraw/zinc/53/30/97/935533097.db2.gz	BNFODSXXJXEYGE-INIZCTEOSA-N	1	0	292.379	1.741	50	0		CDAARO
O=C(c1ccc(=O)[nH]n1)N1CCCC2(CC[NH2+]CC2)CC1	ZINC000067935309	936227510	/nfs/dbraw/zinc/22/75/10/936227510.db2.gz	SYFJQEAMJSTMPT-UHFFFAOYSA-N	1	0	290.367	1.178	50	0		CDAARO
C[C@H](c1ccccc1)n1nccc1NC(=O)CC[NH3+]	ZINC001529091884	968977904	/nfs/dbraw/zinc/97/79/04/968977904.db2.gz	RXYXDLBGOKDEIM-LLVKDONJSA-N	1	0	258.325	1.780	50	0		CDAARO
O[C@@H]1C[N@H+](Cc2cccs2)C[C@H]1Cc1cnccn1	ZINC001529126816	968987866	/nfs/dbraw/zinc/98/78/66/968987866.db2.gz	QOKCITWRCXUQGZ-BXUZGUMPSA-N	1	0	275.377	1.574	50	0		CDAARO
CC[N@@H+]1CCCN(c2cccc(C(=O)N(C)C)n2)CC1	ZINC001506404251	975150046	/nfs/dbraw/zinc/15/00/46/975150046.db2.gz	YUFLHYKCOVKDJX-UHFFFAOYSA-N	1	0	276.384	1.315	50	0		CDAARO
O=C(C[NH2+][C@H]1CCN(c2ccccc2)C1)N1CCCC1	ZINC001506412405	975153776	/nfs/dbraw/zinc/15/37/76/975153776.db2.gz	CHFSUONZDAKPIB-AWEZNQCLSA-N	1	0	273.380	1.477	50	0		CDAARO
CC(C)C[N@@H+]1CCN(c2ccncc2F)C[C@@H]1CCO	ZINC001506416047	975155400	/nfs/dbraw/zinc/15/54/00/975155400.db2.gz	DBHMOTCFMOKFLW-ZDUSSCGKSA-N	1	0	281.375	1.750	50	0		CDAARO
Cc1noc(C)c1C[NH2+][C@@H](C(=O)N1CCOCC1)C(C)C	ZINC000096492104	230382904	/nfs/dbraw/zinc/38/29/04/230382904.db2.gz	HYBGVALVUXJRIB-CQSZACIVSA-N	1	0	295.383	1.264	50	0		CDAARO
O=C(NCc1cccnc1)NC1CC[NH+](CC2CC2)CC1	ZINC000193596988	342474470	/nfs/dbraw/zinc/47/44/70/342474470.db2.gz	XYXLCBAWZFZKLH-UHFFFAOYSA-N	1	0	288.395	1.755	50	0		CDAARO
Cc1nn(C)c2nc(N(C)CC[NH+](C)C)sc12	ZINC000095517986	185002225	/nfs/dbraw/zinc/00/22/25/185002225.db2.gz	XHPPBEZMWTZYSX-UHFFFAOYSA-N	1	0	253.375	1.336	50	0		CDAARO
CC[C@@H]1C[N@H+](CC2(O)CCCCC2)CCN1C[C@H](C)O	ZINC000107320818	398139536	/nfs/dbraw/zinc/13/95/36/398139536.db2.gz	VAUXIGXURRWGEN-LSDHHAIUSA-N	1	0	284.444	1.459	50	0		CDAARO
C[NH+](C)CC(=O)N[C@@H]1COCC[C@@H]1Oc1cccc(F)c1	ZINC000220548325	230397464	/nfs/dbraw/zinc/39/74/64/230397464.db2.gz	IBRCIDBVHWVVFH-KGLIPLIRSA-N	1	0	296.342	1.040	50	0		CDAARO
CCc1ccccc1OCC(=O)N1CC[NH2+]C[C@H]1C	ZINC000124568143	187143631	/nfs/dbraw/zinc/14/36/31/187143631.db2.gz	RKKSOVHGCSBUDP-GFCCVEGCSA-N	1	0	262.353	1.448	50	0		CDAARO
Cc1nc(C[NH2+][C@H]2CCCC[C@@H]2C(N)=O)cs1	ZINC000097375139	342002845	/nfs/dbraw/zinc/00/28/45/342002845.db2.gz	PKEUZMLNHMVIFL-QWRGUYRKSA-N	1	0	253.371	1.585	50	0		CDAARO
Cc1cc(C(=O)N(C)[C@H]2CC[NH2+]C2)c(C)n1C1CC1	ZINC000179088788	398217967	/nfs/dbraw/zinc/21/79/67/398217967.db2.gz	YCANDBXYDPWERB-ZDUSSCGKSA-N	1	0	261.369	1.874	50	0		CDAARO
CCc1cccc(S(=O)(=O)N2CCC([NH3+])CC2)c1	ZINC000095972575	185049431	/nfs/dbraw/zinc/04/94/31/185049431.db2.gz	ROFXRMHQDLHFRL-UHFFFAOYSA-N	1	0	268.382	1.361	50	0		CDAARO
O[C@@H]1CCC[C@H]1C[NH2+]C1CCN(c2nccs2)CC1	ZINC000095990359	185057814	/nfs/dbraw/zinc/05/78/14/185057814.db2.gz	AXMRKGQFHUAROT-WCQYABFASA-N	1	0	281.425	1.863	50	0		CDAARO
COc1ccc(OCC[N@H+](C)[C@@H](C)C[S@](C)=O)cc1	ZINC000096012896	185065674	/nfs/dbraw/zinc/06/56/74/185065674.db2.gz	NOGUJTHNANSQPL-HXPMCKFVSA-N	1	0	285.409	1.773	50	0		CDAARO
COCCC1(CNC(=O)OC(C)(C)C)CC[NH2+]CC1	ZINC000096029467	185066985	/nfs/dbraw/zinc/06/69/85/185066985.db2.gz	KOTAIMQSXQDUMT-UHFFFAOYSA-N	1	0	272.389	1.917	50	0		CDAARO
CC(C)C[C@H]([NH3+])C(=O)N1CC[C@@H](Oc2ccncc2)C1	ZINC000195554338	342625933	/nfs/dbraw/zinc/62/59/33/342625933.db2.gz	APQYKKFLZLHAJE-KGLIPLIRSA-N	1	0	277.368	1.435	50	0		CDAARO
[NH3+][C@H](CC(=O)N1CC[C@@]2(CCOC2)C1)c1ccccc1	ZINC000195544244	342626620	/nfs/dbraw/zinc/62/66/20/342626620.db2.gz	RVJQCDJBVJEHSH-GDBMZVCRSA-N	1	0	274.364	1.716	50	0		CDAARO
CN(Cc1nccs1)c1cc([C@H]2C[C@@H]([NH3+])C2)nc(N)n1	ZINC000244647084	361854798	/nfs/dbraw/zinc/85/47/98/361854798.db2.gz	GUUGDBVEHCMFMM-DTORHVGOSA-N	1	0	290.396	1.356	50	0		CDAARO
O=C(N[C@H]([C@H]1C[C@@H](O)C1)C1CC[NH2+]CC1)c1ccsc1	ZINC000244852529	361866670	/nfs/dbraw/zinc/86/66/70/361866670.db2.gz	UUAQFAMOSLTJHU-MJBXVCDLSA-N	1	0	294.420	1.617	50	0		CDAARO
C[C@@H]1SCC[N@H+](CCn2nc3ccccn3c2=O)[C@H]1C	ZINC000097002213	185150613	/nfs/dbraw/zinc/15/06/13/185150613.db2.gz	VLVVEDQLEMGFBA-RYUDHWBXSA-N	1	0	292.408	1.322	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@@H]1NC(=O)C[C@@H](O)c1cccc(F)c1	ZINC000585136912	342216241	/nfs/dbraw/zinc/21/62/41/342216241.db2.gz	YLIFJFXVUZISMR-MMYVAXCBSA-N	1	0	294.370	1.752	50	0		CDAARO
C[C@@H]1C[N@H+](C)CC[C@H]1N(C)C(=O)Nc1cccn(C)c1=O	ZINC000685939647	539045762	/nfs/dbraw/zinc/04/57/62/539045762.db2.gz	ATXFIQXNONHXKE-DGCLKSJQSA-N	1	0	292.383	1.189	50	0		CDAARO
Nc1nc([C@H]2CC[N@H+](Cc3cccc(F)c3)C2)cc(=O)[nH]1	ZINC000585116317	362043177	/nfs/dbraw/zinc/04/31/77/362043177.db2.gz	QKAURUNSOJWTKT-NSHDSACASA-N	1	0	288.326	1.723	50	0		CDAARO
COc1cc(C2(C(=O)N3CC[C@@H](C[NH3+])C3)CC2)ccc1C	ZINC000178551968	362246899	/nfs/dbraw/zinc/24/68/99/362246899.db2.gz	VYNJEESDWYXQOX-ZDUSSCGKSA-N	1	0	288.391	1.842	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+]C[C@H](O)COC)C12CCCCC2	ZINC000087301410	362299923	/nfs/dbraw/zinc/29/99/23/362299923.db2.gz	CMLARJRSBFUGMT-MELADBBJSA-N	1	0	271.401	1.711	50	0		CDAARO
COc1ccccc1CNC(=O)CC[NH+]1CCSCC1	ZINC000252497609	362389008	/nfs/dbraw/zinc/38/90/08/362389008.db2.gz	QKSDRIFIMSHAJA-UHFFFAOYSA-N	1	0	294.420	1.750	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1C(=O)NCCCc1ccco1	ZINC000097805652	530051701	/nfs/dbraw/zinc/05/17/01/530051701.db2.gz	XLQIEEZQAHTLIW-CYBMUJFWSA-N	1	0	250.342	1.813	50	0		CDAARO
C[NH+](C)C[C@H]1CCN(C(=O)NCC[C@@H]2CCCO2)C1	ZINC000129430105	345576440	/nfs/dbraw/zinc/57/64/40/345576440.db2.gz	DFOWEIOKSNEEQC-OLZOCXBDSA-N	1	0	269.389	1.149	50	0		CDAARO
O=C1N(Cc2ccc(F)cc2)CCN1[C@H]1CCC[NH2+]C1	ZINC000085347904	179028694	/nfs/dbraw/zinc/02/86/94/179028694.db2.gz	CSJTVVNQJKQVBT-AWEZNQCLSA-N	1	0	277.343	1.815	50	0		CDAARO
CCn1cc(C[NH2+]C[C@@H]2CCO[C@@H]2c2cnn(C)c2)cn1	ZINC000089306027	346755911	/nfs/dbraw/zinc/75/59/11/346755911.db2.gz	AYWCLUAOFFXEQM-ZFWWWQNUSA-N	1	0	289.383	1.504	50	0		CDAARO
O[C@@]1(C[NH2+][C@H]2CCN(Cc3ccccc3)C2)CCSC1	ZINC000088738922	179661783	/nfs/dbraw/zinc/66/17/83/179661783.db2.gz	VKTZYAJZIOAOCW-JKSUJKDBSA-N	1	0	292.448	1.719	50	0		CDAARO
O=C(NCC[C@@H]1CC[NH2+]C1)c1cccc2c1OCCO2	ZINC000110794419	349172207	/nfs/dbraw/zinc/17/22/07/349172207.db2.gz	XUKVZSLABKGNRS-NSHDSACASA-N	1	0	276.336	1.187	50	0		CDAARO
CO[C@H]1[C@@H]2CC[C@H]1CN(C(=O)[C@@H]1CC13CC[NH2+]CC3)C2	ZINC000584885639	349343824	/nfs/dbraw/zinc/34/38/24/349343824.db2.gz	ALRGWHZJYVMSGY-RFQIPJPRSA-N	1	0	278.396	1.260	50	0		CDAARO
CN(CCC1(O)CCCC1)C(=O)C[NH+]1CCCC1	ZINC000584886430	349344924	/nfs/dbraw/zinc/34/49/24/349344924.db2.gz	LWGCVRRQPHPFPD-UHFFFAOYSA-N	1	0	254.374	1.236	50	0		CDAARO
COCCc1noc([C@H](C)[NH2+]C2CCOCC2)n1	ZINC000584887297	349345699	/nfs/dbraw/zinc/34/56/99/349345699.db2.gz	YMXJWLDXXPRCTL-VIFPVBQESA-N	1	0	255.318	1.088	50	0		CDAARO
CO[C@H]1[C@@H]2CC[C@H]1CN(C(=O)c1ccc(CC[NH3+])cc1)C2	ZINC000584889661	349348790	/nfs/dbraw/zinc/34/87/90/349348790.db2.gz	RDDOOSNINNJBQR-ZSHCYNCHSA-N	1	0	288.391	1.685	50	0		CDAARO
COc1ccc2ncn(CC[C@H](C)[NH+](C)C)c(=O)c2c1	ZINC000584891173	349350161	/nfs/dbraw/zinc/35/01/61/349350161.db2.gz	ZRWJBARQCWIZIE-NSHDSACASA-N	1	0	275.352	1.745	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@@H](CN(C)C(=O)C2(C)COC2)C1	ZINC000584895111	349354965	/nfs/dbraw/zinc/35/49/65/349354965.db2.gz	BSPBSXFROBJBSA-ZDUSSCGKSA-N	1	0	268.401	1.459	50	0		CDAARO
O[C@]1(C[NH2+][C@H]2CCSc3ccccc32)CCOC1	ZINC000090848012	180044342	/nfs/dbraw/zinc/04/43/42/180044342.db2.gz	PWWOPMHLPUYEJZ-JSGCOSHPSA-N	1	0	265.378	1.965	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)c2ccncc2Cl)C1	ZINC000091456866	180160336	/nfs/dbraw/zinc/16/03/36/180160336.db2.gz	UIVBOMKKEFURBH-VIFPVBQESA-N	1	0	253.733	1.559	50	0		CDAARO
CN(C(=O)c1ccncc1Cl)C1CC[NH2+]CC1	ZINC000091456779	180160446	/nfs/dbraw/zinc/16/04/46/180160446.db2.gz	GTFZGPVVNKPKIF-UHFFFAOYSA-N	1	0	253.733	1.559	50	0		CDAARO
COc1cccc(S(=O)(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)c1	ZINC000091391488	180144806	/nfs/dbraw/zinc/14/48/06/180144806.db2.gz	RWWGFUVGRGWQRE-KGLIPLIRSA-N	1	0	296.392	1.053	50	0		CDAARO
C[N@@H+]1C[C@@H]2CC[C@H](C1)N(Cc1cccc(OCCO)c1)C2	ZINC000091562757	180192824	/nfs/dbraw/zinc/19/28/24/180192824.db2.gz	FDGGZPHEEVOWBU-JKSUJKDBSA-N	1	0	290.407	1.584	50	0		CDAARO
CC[C@@H](C(=O)NCC[NH+]1CCCC1)n1cccn1	ZINC000091755859	180246623	/nfs/dbraw/zinc/24/66/23/180246623.db2.gz	CRRKXZWNCZCFMO-LBPRGKRZSA-N	1	0	250.346	1.046	50	0		CDAARO
CN1CCO[C@H](C[NH2+]Cc2c[nH]nc2-c2ccccc2)C1	ZINC000105471825	186059697	/nfs/dbraw/zinc/05/96/97/186059697.db2.gz	WJTWNAOSNPYJCH-OAHLLOKOSA-N	1	0	286.379	1.497	50	0		CDAARO
CN1CCO[C@H](C[NH2+]Cc2cccc(Cl)c2)C1	ZINC000105472189	186059842	/nfs/dbraw/zinc/05/98/42/186059842.db2.gz	ACMLBZFJGAGMEW-CYBMUJFWSA-N	1	0	254.761	1.760	50	0		CDAARO
CC[NH+]1CCC(CC(=O)N(C)Cc2cc[nH]n2)CC1	ZINC000092028122	180309384	/nfs/dbraw/zinc/30/93/84/180309384.db2.gz	HIDDLKCUEJNPJS-UHFFFAOYSA-N	1	0	264.373	1.490	50	0		CDAARO
CC[C@@H]1CN(Cc2c(C)noc2C)CC[N@@H+]1C[C@H](C)O	ZINC000106929181	186152183	/nfs/dbraw/zinc/15/21/83/186152183.db2.gz	OKCAQCOZLIWETM-SMDDNHRTSA-N	1	0	281.400	1.568	50	0		CDAARO
C1=C[C@@H]2[C@@H](C[C@@H]2[NH2+]CCc2nnc3ccccn32)C1	ZINC000107082969	186160141	/nfs/dbraw/zinc/16/01/41/186160141.db2.gz	GXMVTAFHYUDMKT-UPJWGTAASA-N	1	0	254.337	1.826	50	0		CDAARO
OCc1ccc(C[NH2+][C@H]2CCCN(c3ncccn3)C2)o1	ZINC000012304133	366045138	/nfs/dbraw/zinc/04/51/38/366045138.db2.gz	ISSUTJKGDMACAM-LBPRGKRZSA-N	1	0	288.351	1.321	50	0		CDAARO
CC(C)(C)c1ccc(S(=O)(=O)NCC[NH3+])s1	ZINC000122468889	187033991	/nfs/dbraw/zinc/03/39/91/187033991.db2.gz	BWOTXQQNKSCTRX-UHFFFAOYSA-N	1	0	262.400	1.283	50	0		CDAARO
c1nc(CC[NH2+]C[C@@H]2CCC[N@@H+]3CCCC[C@H]23)c[nH]1	ZINC000065503327	363292964	/nfs/dbraw/zinc/29/29/64/363292964.db2.gz	QYPAGXVZHQFHEQ-DZGCQCFKSA-N	1	0	262.401	1.806	50	0		CDAARO
C[NH2+]C[C@@H](O)Cn1c2ccccc2nc1C(F)(F)F	ZINC000000818927	355923283	/nfs/dbraw/zinc/92/32/83/355923283.db2.gz	YZDOPYVGAQAWIW-MRVPVSSYSA-N	1	0	273.258	1.635	50	0		CDAARO
Cc1ccc(C(=O)N[C@@H](C[NH+](C)C)c2ccccc2)c(=O)[nH]1	ZINC000097465155	356160885	/nfs/dbraw/zinc/16/08/85/356160885.db2.gz	FQBDZZIKIGTYJQ-HNNXBMFYSA-N	1	0	299.374	1.716	50	0		CDAARO
Cc1ccc(C)c(O[C@H](C)C(=O)N2CCN(C)CC2)c1	ZINC000013710658	356353975	/nfs/dbraw/zinc/35/39/75/356353975.db2.gz	KLCKVASULLWZDI-CQSZACIVSA-N	1	0	276.380	1.845	50	0		CDAARO
C[C@H]1C[C@H](C)C[NH+](CC(=O)NCc2ccco2)C1	ZINC000014194572	356378920	/nfs/dbraw/zinc/37/89/20/356378920.db2.gz	FNBHEMCKPFVINB-RYUDHWBXSA-N	1	0	250.342	1.874	50	0		CDAARO
C[C@H](CNC(=O)c1cc(Cl)ccn1)N1CCOCC1	ZINC000032817365	356379691	/nfs/dbraw/zinc/37/96/91/356379691.db2.gz	DTQNAPBKSHIIIK-SNVBAGLBSA-N	1	0	283.759	1.186	50	0		CDAARO
CCN1C(=O)N(C)C(=O)C12CC[NH+](Cc1ccoc1)CC2	ZINC000014535541	356390564	/nfs/dbraw/zinc/39/05/64/356390564.db2.gz	FNIQXHFZRNOZFY-UHFFFAOYSA-N	1	0	291.351	1.528	50	0		CDAARO
C[NH+](C)C[C@@H](O)COc1ccc(CN2CCCCO2)cc1	ZINC000015061538	356405494	/nfs/dbraw/zinc/40/54/94/356405494.db2.gz	WXVMKBNIENTOSL-OAHLLOKOSA-N	1	0	294.395	1.515	50	0		CDAARO
OCC[C@@H]1C[NH2+]CCN1Cc1c[nH]c2ccccc12	ZINC000019368017	356483356	/nfs/dbraw/zinc/48/33/56/356483356.db2.gz	ILBFTINLKPCDMK-CYBMUJFWSA-N	1	0	259.353	1.324	50	0		CDAARO
Fc1cccc(Cl)c1C[NH2+]CCN1CCOCC1	ZINC000019871905	356511972	/nfs/dbraw/zinc/51/19/72/356511972.db2.gz	WSYQOQKVICASJG-UHFFFAOYSA-N	1	0	272.751	1.901	50	0		CDAARO
OCC[NH+]1CCN(Cc2ccccc2Cl)CC1	ZINC000019607076	356493334	/nfs/dbraw/zinc/49/33/34/356493334.db2.gz	PGCGYLAMXVYWQH-UHFFFAOYSA-N	1	0	254.761	1.450	50	0		CDAARO
CC(C)=CCC[C@H](C)C[NH+]1CCN(CCOCCO)CC1	ZINC000019632849	356494200	/nfs/dbraw/zinc/49/42/00/356494200.db2.gz	YHQTWPCGEFEOQU-KRWDZBQOSA-N	1	0	298.471	1.995	50	0		CDAARO
CC(C)(CO)C[N@@H+]1CCC[C@H](N2CCC(CO)CC2)C1	ZINC000019794598	356505155	/nfs/dbraw/zinc/50/51/55/356505155.db2.gz	FOMMSUURWXOQMF-HNNXBMFYSA-N	1	0	284.444	1.174	50	0		CDAARO
COc1cccc(OCCCCN2CC[NH2+]CC2)c1	ZINC000022942763	356625441	/nfs/dbraw/zinc/62/54/41/356625441.db2.gz	CFNLYQVPLKKDKS-UHFFFAOYSA-N	1	0	264.369	1.759	50	0		CDAARO
C[C@@H](C(=O)NC[C@@H]1COc2ccccc2O1)[NH+]1CCCC1	ZINC000028286247	356719416	/nfs/dbraw/zinc/71/94/16/356719416.db2.gz	UITYIZHPSJIEGD-QWHCGFSZSA-N	1	0	290.363	1.427	50	0		CDAARO
O=S(=O)(NC[C@@H]1CCCC[NH2+]1)c1ccccc1F	ZINC000019400225	356795688	/nfs/dbraw/zinc/79/56/88/356795688.db2.gz	SRRJARZLXSMNLE-JTQLQIEISA-N	1	0	272.345	1.246	50	0		CDAARO
Cc1cnc(CNc2cc(C)[nH+]c(N(C)C)n2)cn1	ZINC000032586963	356782680	/nfs/dbraw/zinc/78/26/80/356782680.db2.gz	CDBNBUJJKWNIJU-UHFFFAOYSA-N	1	0	258.329	1.562	50	0		CDAARO
C[NH+]1CCN(CCNc2ccc(-c3ccccc3)nn2)CC1	ZINC000032590282	356783973	/nfs/dbraw/zinc/78/39/73/356783973.db2.gz	ZZPYKCHVOJNKER-UHFFFAOYSA-N	1	0	297.406	1.803	50	0		CDAARO
O=C(COc1ccc(Cl)cc1)N[C@H]1C[NH+]2CCC1CC2	ZINC000000537718	357210628	/nfs/dbraw/zinc/21/06/28/357210628.db2.gz	IYTACMQBGIPOIJ-AWEZNQCLSA-N	1	0	294.782	1.929	50	0		CDAARO
CCN(C(=O)CC[NH+]1CCCCCCC1)[C@H]1COC[C@@H]1O	ZINC000055088891	357328400	/nfs/dbraw/zinc/32/84/00/357328400.db2.gz	YUMOAUYVUKGWCH-GJZGRUSLSA-N	1	0	298.427	1.251	50	0		CDAARO
CCS(=O)(=O)N[C@@H](C)C[N@H+]1C[C@H](C)C[C@H](C)C1	ZINC000096470376	357479440	/nfs/dbraw/zinc/47/94/40/357479440.db2.gz	TZRBOVVJLDBQPF-TUAOUCFPSA-N	1	0	262.419	1.292	50	0		CDAARO
COc1ccc(F)cc1S(=O)(=O)NCCC[NH+](C)C	ZINC000065363403	357531286	/nfs/dbraw/zinc/53/12/86/357531286.db2.gz	IAVSQFQRDBELPC-UHFFFAOYSA-N	1	0	290.360	1.064	50	0		CDAARO
C[C@H](c1ccc(Cl)cc1)n1c(C[NH3+])n[nH]c1=O	ZINC000065393440	357535223	/nfs/dbraw/zinc/53/52/23/357535223.db2.gz	AQARFKFUPXPAHR-SSDOTTSWSA-N	1	0	252.705	1.293	50	0		CDAARO
c1cncc(-c2noc(CC[NH2+][C@H]3CCSC3)n2)c1	ZINC000065395293	357537068	/nfs/dbraw/zinc/53/70/68/357537068.db2.gz	LBIZWTNUXFCZKQ-NSHDSACASA-N	1	0	276.365	1.769	50	0		CDAARO
COC(=O)[C@H](C)NC(=O)C1CC[NH+](Cc2ccco2)CC1	ZINC000065508870	357547215	/nfs/dbraw/zinc/54/72/15/357547215.db2.gz	PFMIWMNADAOSOV-NSHDSACASA-N	1	0	294.351	1.169	50	0		CDAARO
CCN(CC)C(=O)C(=O)NC[C@@H]1CC[N@@H+](C2CCCC2)C1	ZINC000067841541	357630835	/nfs/dbraw/zinc/63/08/35/357630835.db2.gz	POPDCMCHYJFOPC-ZDUSSCGKSA-N	1	0	295.427	1.236	50	0		CDAARO
CCc1ccc(S(=O)(=O)NCC2CC[NH+](C)CC2)cc1	ZINC000022999706	357581844	/nfs/dbraw/zinc/58/18/44/357581844.db2.gz	ZGBWCTLEMFRKTL-UHFFFAOYSA-N	1	0	296.436	1.869	50	0		CDAARO
CC(C)(C)[C@@H](O)C[C@@H](CO)[NH2+]Cc1cccs1	ZINC000283897461	357609366	/nfs/dbraw/zinc/60/93/66/357609366.db2.gz	HSHABHJEJDPIQO-JQWIXIFHSA-N	1	0	257.399	1.996	50	0		CDAARO
COc1ncc(C[N@@H+]2CC[C@@]3(O)CCCC[C@H]3C2)cn1	ZINC000067643034	357616812	/nfs/dbraw/zinc/61/68/12/357616812.db2.gz	OUUCEPPWUVVZOG-ZFWWWQNUSA-N	1	0	277.368	1.612	50	0		CDAARO
C[C@H](Cn1cccn1)C(=O)NCc1cccnc1N(C)C	ZINC000067689001	357619071	/nfs/dbraw/zinc/61/90/71/357619071.db2.gz	FFESWGDESGXMAQ-GFCCVEGCSA-N	1	0	287.367	1.297	50	0		CDAARO
Cc1nc(NCc2cccnc2N)cc(C2CC[NH2+]CC2)n1	ZINC000067956233	357640784	/nfs/dbraw/zinc/64/07/84/357640784.db2.gz	UVFKYVFYDINMJE-UHFFFAOYSA-N	1	0	298.394	1.841	50	0		CDAARO
OCCC[N@@H+]1CCc2[nH]nc(-c3cccc(F)c3)c2C1	ZINC000067974407	357640963	/nfs/dbraw/zinc/64/09/63/357640963.db2.gz	SYPAZHQUOCMCLT-UHFFFAOYSA-N	1	0	275.327	1.956	50	0		CDAARO
Cc1cccc2[nH]c(CCC(=O)N3CC[NH2+][C@H](C)C3)nc21	ZINC000188395285	357657741	/nfs/dbraw/zinc/65/77/41/357657741.db2.gz	AYWHPIMTWADQCT-GFCCVEGCSA-N	1	0	286.379	1.624	50	0		CDAARO
CCC[C@]1(C2CC[NH2+]CC2)NC(=O)N(CCCCF)C1=O	ZINC000067868650	357634113	/nfs/dbraw/zinc/63/41/13/357634113.db2.gz	GIQJMZVGZYLYJT-OAHLLOKOSA-N	1	0	299.390	1.826	50	0		CDAARO
CCCCc1cn([C@H]2C[NH2+][C@H](C(=O)NC(C)C)C2)nn1	ZINC000067880567	357634876	/nfs/dbraw/zinc/63/48/76/357634876.db2.gz	BBESMIUWVWIHCX-OLZOCXBDSA-N	1	0	279.388	1.048	50	0		CDAARO
CCCc1nccn1C[C@@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000095438670	357869604	/nfs/dbraw/zinc/86/96/04/357869604.db2.gz	RTOIJHSTFSBJHW-MJBXVCDLSA-N	1	0	281.400	1.306	50	0		CDAARO
Cc1nn[nH]c1C(=O)NC[C@@H](c1ccc(C)cc1)[NH+](C)C	ZINC000188785410	357936980	/nfs/dbraw/zinc/93/69/80/357936980.db2.gz	ZNDLJHHDRRZHPB-ZDUSSCGKSA-N	1	0	287.367	1.454	50	0		CDAARO
CNC(=O)[C@@H]1C[N@H+](Cc2cccc3[nH]ccc32)CCO1	ZINC000097081628	357944988	/nfs/dbraw/zinc/94/49/88/357944988.db2.gz	ZUFHULYNTJNYMZ-AWEZNQCLSA-N	1	0	273.336	1.115	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@H]([NH3+])c2ccccc2)C[C@H](C)O1	ZINC000299747988	358026883	/nfs/dbraw/zinc/02/68/83/358026883.db2.gz	FSENOTCKPFGQDB-IACUBPJLSA-N	1	0	262.353	1.712	50	0		CDAARO
C[NH+](C)[C@H]1CCCCN(Cc2ccc(OCCO)cc2)C1	ZINC000082108179	358146963	/nfs/dbraw/zinc/14/69/63/358146963.db2.gz	HIUFMDXWPXZVCZ-INIZCTEOSA-N	1	0	292.423	1.974	50	0		CDAARO
O=C(NC[C@@H]1C[C@H](F)C[NH2+]1)OCc1ccccc1	ZINC000082107841	358146994	/nfs/dbraw/zinc/14/69/94/358146994.db2.gz	ZUOSZQZSRZGEPM-RYUDHWBXSA-N	1	0	252.289	1.613	50	0		CDAARO
CO[C@@H]1CCN(C(=O)CCc2ccsc2)[C@H](C[NH3+])C1	ZINC000195557567	358560629	/nfs/dbraw/zinc/56/06/29/358560629.db2.gz	WAAWANDTJORIIL-QWHCGFSZSA-N	1	0	282.409	1.645	50	0		CDAARO
Cc1cnn(CCCNC(=O)CC[C@H]2CCCC[N@H+]2C)c1	ZINC000095392502	358692911	/nfs/dbraw/zinc/69/29/11/358692911.db2.gz	WLHBUCRSVOXLQP-OAHLLOKOSA-N	1	0	292.427	1.962	50	0		CDAARO
COC[C@H](O)C[NH+]1CCN([C@@H](C)c2ccsc2)CC1	ZINC000185477587	358781347	/nfs/dbraw/zinc/78/13/47/358781347.db2.gz	GLGABHAQZMKIBU-GXTWGEPZSA-N	1	0	284.425	1.434	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1C(=O)N(C)CCn1cccn1	ZINC000097527191	358782463	/nfs/dbraw/zinc/78/24/63/358782463.db2.gz	WGAYRUCJDHVLMH-CYBMUJFWSA-N	1	0	264.373	1.216	50	0		CDAARO
CCCn1ccnc1CN1C[C@H]2[C@H](C[NH+](C)C)[C@H]2C1	ZINC000102483063	358879944	/nfs/dbraw/zinc/87/99/44/358879944.db2.gz	RCFIDPZDGOGOAN-ZSOGYDGISA-N	1	0	262.401	1.533	50	0		CDAARO
C[NH+]1CCC(CNC(=O)c2cn[nH]c2)(c2ccccc2)CC1	ZINC000215637455	358897201	/nfs/dbraw/zinc/89/72/01/358897201.db2.gz	AGMJNHJAQCMMRO-UHFFFAOYSA-N	1	0	298.390	1.803	50	0		CDAARO
C[C@@H](c1ccc(-c2cc3nncn3c(N)n2)cc1)[NH+](C)C	ZINC000216432582	358944948	/nfs/dbraw/zinc/94/49/48/358944948.db2.gz	XMQLVQXQJLTDRH-JTQLQIEISA-N	1	0	282.351	1.996	50	0		CDAARO
C[NH2+]CCN(C)C(=O)CCCc1ccc(F)cc1	ZINC000219903683	359137288	/nfs/dbraw/zinc/13/72/88/359137288.db2.gz	CHQPFVMUOBCGQN-UHFFFAOYSA-N	1	0	252.333	1.826	50	0		CDAARO
COC[C@H]1CN(C(=O)NC2CCCC2)CC12CC[NH2+]CC2	ZINC000257179246	359162822	/nfs/dbraw/zinc/16/28/22/359162822.db2.gz	IFZUATSBEYNZMY-CYBMUJFWSA-N	1	0	295.427	1.587	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(C(=O)COc2cccnc2)CC1	ZINC000221430776	359247171	/nfs/dbraw/zinc/24/71/71/359247171.db2.gz	LHYCSNLMLFUPJR-ZDUSSCGKSA-N	1	0	277.368	1.403	50	0		CDAARO
O=C(c1cc(C(F)F)n[nH]1)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000221452406	359250384	/nfs/dbraw/zinc/25/03/84/359250384.db2.gz	UCUFUFMLOXKGSP-QMMMGPOBSA-N	1	0	270.283	1.268	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+]1C[C@H]1C(C)=CCC[C@H]1C	ZINC000261361239	359282841	/nfs/dbraw/zinc/28/28/41/359282841.db2.gz	GVMYSEUEEJARIT-RFGFWPKPSA-N	1	0	267.369	1.587	50	0		CDAARO
CN(Cc1cccnc1)c1cc(C2CC([NH3+])C2)nc(N)n1	ZINC000222369673	359337629	/nfs/dbraw/zinc/33/76/29/359337629.db2.gz	DHRUIBZUFVAUAP-UHFFFAOYSA-N	1	0	284.367	1.295	50	0		CDAARO
Cc1c[nH+]ccc1N1CCN(C(=O)c2cnccn2)CC1	ZINC000222387255	359338848	/nfs/dbraw/zinc/33/88/48/359338848.db2.gz	CQEOQKRSONGTLI-UHFFFAOYSA-N	1	0	283.335	1.142	50	0		CDAARO
O=C(Cc1ccccn1)N1CC([NH+]2CCCCC2)C1	ZINC000222480618	359347029	/nfs/dbraw/zinc/34/70/29/359347029.db2.gz	ABGZVAWVPIHZQB-UHFFFAOYSA-N	1	0	259.353	1.321	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(CC(=O)NCC2CCCCC2)C1	ZINC000113516561	359454466	/nfs/dbraw/zinc/45/44/66/359454466.db2.gz	MRJMMBWGEOCFFY-HNNXBMFYSA-N	1	0	281.444	1.566	50	0		CDAARO
c1ccc(CN2CCC[N@@H+](C[C@H]3CCOC3)CC2)nc1	ZINC000225346771	359579105	/nfs/dbraw/zinc/57/91/05/359579105.db2.gz	CUUWAPMNXINYBJ-OAHLLOKOSA-N	1	0	275.396	1.626	50	0		CDAARO
Cc1cc2nc(C[n+]3cccc(C(N)=O)c3)[nH]c2cc1C	ZINC000000386939	359666955	/nfs/dbraw/zinc/66/69/55/359666955.db2.gz	BYGARMKLWGIFSY-UHFFFAOYSA-O	1	0	281.339	1.614	50	0		CDAARO
C[C@H](c1cccnc1)[N@@H+]1CCC[C@H]1Cn1cncn1	ZINC000257365775	359946359	/nfs/dbraw/zinc/94/63/59/359946359.db2.gz	LZTUOJFDLLVRJU-OCCSQVGLSA-N	1	0	257.341	1.899	50	0		CDAARO
COc1cc(F)cc(CNC2=[NH+]CCCCN2)c1	ZINC000521396970	359970173	/nfs/dbraw/zinc/97/01/73/359970173.db2.gz	ZALUXVPMQRTDBB-UHFFFAOYSA-N	1	0	251.305	1.663	50	0		CDAARO
CS[C@@H](C(=O)N1CC[C@H]([NH3+])C1)c1ccccc1	ZINC000178271847	189101815	/nfs/dbraw/zinc/10/18/15/189101815.db2.gz	PZLYPYPMRIUDGD-NWDGAFQWSA-N	1	0	250.367	1.650	50	0		CDAARO
CC(C)(C(=O)NCCCn1ccccc1=O)[NH+]1CCCC1	ZINC000426518228	360680357	/nfs/dbraw/zinc/68/03/57/360680357.db2.gz	GNQFHSQEFUSSSW-UHFFFAOYSA-N	1	0	291.395	1.229	50	0		CDAARO
Cn1c(SCCn2cccn2)nnc1[C@@H]1CCC[NH2+]C1	ZINC000426546171	360683605	/nfs/dbraw/zinc/68/36/05/360683605.db2.gz	LXEGPEJRYCALFA-LLVKDONJSA-N	1	0	292.412	1.271	50	0		CDAARO
CC(C)c1cc(CSc2nnc(C[NH3+])n2C)on1	ZINC000426376458	360661480	/nfs/dbraw/zinc/66/14/80/360661480.db2.gz	SLNXMQJQFRRVFU-UHFFFAOYSA-N	1	0	267.358	1.678	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)/C=C/c2ccc(-n3ccnc3)cc2)C1	ZINC000178547319	189125864	/nfs/dbraw/zinc/12/58/64/189125864.db2.gz	MLWYFTSHBBNXSJ-YFCVBGDOSA-N	1	0	296.374	1.693	50	0		CDAARO
Cc1c[nH]c(CNC(=O)[C@@H](C)C[NH+]2CCCC2)c(C)c1=O	ZINC000426689156	360696687	/nfs/dbraw/zinc/69/66/87/360696687.db2.gz	IUDPLQJNHQHQGK-LBPRGKRZSA-N	1	0	291.395	1.340	50	0		CDAARO
CCO[C@@H](C)CN(C)C(=O)c1cc(C)ccc1OCC[NH3+]	ZINC000426628870	360851846	/nfs/dbraw/zinc/85/18/46/360851846.db2.gz	VNIJVGAWLLNWSM-ZDUSSCGKSA-N	1	0	294.395	1.830	50	0		CDAARO
COC(=O)c1cccc(NC(=O)NCC[C@H]2CCC[NH2+]2)c1	ZINC000299756325	200859103	/nfs/dbraw/zinc/85/91/03/200859103.db2.gz	GSUPUGUDGTZAPR-GFCCVEGCSA-N	1	0	291.351	1.737	50	0		CDAARO
CN1C(=O)N(CCc2ccccc2)C(=O)C12CC[NH2+]CC2	ZINC000299787381	200872078	/nfs/dbraw/zinc/87/20/78/200872078.db2.gz	UUCZGSBAVXWOLO-UHFFFAOYSA-N	1	0	287.363	1.245	50	0		CDAARO
Cc1ccccc1[C@@H](O)CNC(=O)[C@@H]([NH3+])CC(C)C	ZINC000236699609	361360880	/nfs/dbraw/zinc/36/08/80/361360880.db2.gz	JHHWKBFXRVOILL-KBPBESRZSA-N	1	0	264.369	1.518	50	0		CDAARO
CCCC[C@@H]([NH3+])C(=O)NCCn1cc(Cl)cn1	ZINC000299773116	361602638	/nfs/dbraw/zinc/60/26/38/361602638.db2.gz	AOUSOTYZQPDWND-SNVBAGLBSA-N	1	0	258.753	1.170	50	0		CDAARO
COc1cccc(CNC[C@H]2C[N@H+](CC(C)C)CCO2)n1	ZINC000190694629	363998947	/nfs/dbraw/zinc/99/89/47/363998947.db2.gz	DOWNCDFHARDOPU-HNNXBMFYSA-N	1	0	293.411	1.537	50	0		CDAARO
CN(Cc1ccc2c(c1)OCCO2)C(=O)CC1([NH3+])CCC1	ZINC000094294363	365282558	/nfs/dbraw/zinc/28/25/58/365282558.db2.gz	IXNJSDWTEGCWAT-UHFFFAOYSA-N	1	0	290.363	1.688	50	0		CDAARO
C[C@@H](CC(=O)N1C[C@@H](C)OC[C@@H]1C)[C@H]1CCC[NH2+]C1	ZINC000251704643	366871178	/nfs/dbraw/zinc/87/11/78/366871178.db2.gz	OJDVBUFDOCBURR-FQUUOJAGSA-N	1	0	268.401	1.648	50	0		CDAARO
CCC(C)(C)NC(=O)[C@@H](C)N(C)CC[NH+]1CCCC1	ZINC000089899646	366962127	/nfs/dbraw/zinc/96/21/27/366962127.db2.gz	QYUIDNONOSYADH-CYBMUJFWSA-N	1	0	269.433	1.707	50	0		CDAARO
COc1ccc(OC)c([C@@H](O)CN2CC[N@H+](C)C[C@@H]2C)c1	ZINC000089939201	366973417	/nfs/dbraw/zinc/97/34/17/366973417.db2.gz	GSJMUGFGZXJONF-WFASDCNBSA-N	1	0	294.395	1.373	50	0		CDAARO
COC(=O)c1ccccc1OCCOCC[NH+](C)C	ZINC000002825518	367130887	/nfs/dbraw/zinc/13/08/87/367130887.db2.gz	KSPKAEPOUSEXFU-UHFFFAOYSA-N	1	0	267.325	1.430	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)CC2(OC)CCC2)CC1	ZINC000252483372	367568928	/nfs/dbraw/zinc/56/89/28/367568928.db2.gz	DZUZNDBXYQYPDB-UHFFFAOYSA-N	1	0	298.427	1.420	50	0		CDAARO
O=C(c1cc(C2CC2)on1)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000252551874	368158474	/nfs/dbraw/zinc/15/84/74/368158474.db2.gz	UIQGQKLHEUDQSV-MNOVXSKESA-N	1	0	261.325	1.519	50	0		CDAARO
CCNC(=O)C[N@@H+]1CCSC2(CCCCC2)C1	ZINC000079785427	369886286	/nfs/dbraw/zinc/88/62/86/369886286.db2.gz	AMLULTUERFIMLO-UHFFFAOYSA-N	1	0	256.415	1.874	50	0		CDAARO
Cc1oncc1C(=O)NCC1CC[NH+]([C@H]2CCOC2)CC1	ZINC000575609062	370628365	/nfs/dbraw/zinc/62/83/65/370628365.db2.gz	XZYGAIQFBJOUFK-ZDUSSCGKSA-N	1	0	293.367	1.214	50	0		CDAARO
CCCN(C(=O)c1cccc2cn[nH]c21)[C@@H]1CC[NH2+]C1	ZINC000178910876	372222060	/nfs/dbraw/zinc/22/20/60/372222060.db2.gz	BBXVIKUMDGODNP-GFCCVEGCSA-N	1	0	272.352	1.777	50	0		CDAARO
C[NH+](C)CC[C@H]1CCCN(C(=O)CCc2cn[nH]c2)C1	ZINC000299784214	372758711	/nfs/dbraw/zinc/75/87/11/372758711.db2.gz	LLNJXQBBFMGMNR-CYBMUJFWSA-N	1	0	278.400	1.533	50	0		CDAARO
CN(CC1(C)COC1)C(=O)c1ccc(C[NH+](C)C)cc1	ZINC000299785501	372762033	/nfs/dbraw/zinc/76/20/33/372762033.db2.gz	SNJHHDVKDVWGNY-UHFFFAOYSA-N	1	0	276.380	1.857	50	0		CDAARO
COc1ccnc(C[NH2+][C@H]2CCC[C@]2(C)CO)c1OC	ZINC000241447050	189904676	/nfs/dbraw/zinc/90/46/76/189904676.db2.gz	NQTKSJYJWGMUTO-DZGCQCFKSA-N	1	0	280.368	1.740	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc(F)c(Cl)c2)C[C@H]1CO	ZINC000225344420	373039829	/nfs/dbraw/zinc/03/98/29/373039829.db2.gz	IZSSHQHTOUHKLC-NSHDSACASA-N	1	0	272.751	1.587	50	0		CDAARO
COCCNC(=O)CC[NH2+][C@H]1C[C@H](C)C[C@H](C)C1	ZINC000253370059	373677734	/nfs/dbraw/zinc/67/77/34/373677734.db2.gz	LMTILIARBQGAJC-ITGUQSILSA-N	1	0	256.390	1.553	50	0		CDAARO
COCc1noc([C@H](C)[NH2+][C@H]2CCCC[C@H]2CO)n1	ZINC000253370473	373680204	/nfs/dbraw/zinc/68/02/04/373680204.db2.gz	RGSSMHKFNNLJBB-DCAQKATOSA-N	1	0	269.345	1.418	50	0		CDAARO
O=C(CC1CC1)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CO	ZINC000253414495	373723129	/nfs/dbraw/zinc/72/31/29/373723129.db2.gz	XQPWSCFANQMZBW-JKSUJKDBSA-N	1	0	288.391	1.396	50	0		CDAARO
COC(=O)CCC[N@@H+]1CCN(C(C)=O)C2(CCCCC2)C1	ZINC000368466500	373842982	/nfs/dbraw/zinc/84/29/82/373842982.db2.gz	MTJRDNGKSUUMDD-UHFFFAOYSA-N	1	0	296.411	1.807	50	0		CDAARO
CCn1cc(CCN2CC[N@H+](C)CC2(C)C)cn1	ZINC000390834707	374851289	/nfs/dbraw/zinc/85/12/89/374851289.db2.gz	RZKNJYRCSLSTMA-UHFFFAOYSA-N	1	0	250.390	1.472	50	0		CDAARO
COc1ccc([C@@H](C)[C@H](C)[NH2+]CCS(C)(=O)=O)cc1	ZINC000095421224	374923103	/nfs/dbraw/zinc/92/31/03/374923103.db2.gz	NJTVEEXVJZRKER-RYUDHWBXSA-N	1	0	285.409	1.821	50	0		CDAARO
CC(C)=CC[NH2+]CCN1CCN(c2ncccn2)CC1	ZINC000095428447	374928160	/nfs/dbraw/zinc/92/81/60/374928160.db2.gz	CSHFTTMHKQBXQJ-UHFFFAOYSA-N	1	0	275.400	1.154	50	0		CDAARO
CCC[C@H]([NH3+])C(=O)N1CCC(N2CCCCC2=O)CC1	ZINC000095466812	374961296	/nfs/dbraw/zinc/96/12/96/374961296.db2.gz	JCHFVOYADMJKGH-ZDUSSCGKSA-N	1	0	281.400	1.117	50	0		CDAARO
CCCC(=O)NCc1ccccc1C[N@@H+]1CC[C@H](O)C1	ZINC000097237867	375158060	/nfs/dbraw/zinc/15/80/60/375158060.db2.gz	BMAMDNDTGCUBGK-HNNXBMFYSA-N	1	0	276.380	1.670	50	0		CDAARO
[NH3+][C@@H]1CCC[C@@H]1C(=O)N1CCO[C@H](c2nccs2)C1	ZINC000299739482	375199312	/nfs/dbraw/zinc/19/93/12/375199312.db2.gz	OXRXGJYDBGWIHJ-AXFHLTTASA-N	1	0	281.381	1.170	50	0		CDAARO
CCn1ncc(C(=O)N(C)[C@@H]2CC[NH2+]C2)c1C(F)(F)F	ZINC000299739544	375199538	/nfs/dbraw/zinc/19/95/38/375199538.db2.gz	PWXHJOZRZBAEQN-MRVPVSSYSA-N	1	0	290.289	1.356	50	0		CDAARO
CC(C)([NH3+])C(=O)N1CCC([C@@H](O)c2ccc(F)cc2)CC1	ZINC000299747475	375207472	/nfs/dbraw/zinc/20/74/72/375207472.db2.gz	DDDXEHCWNCVGFB-AWEZNQCLSA-N	1	0	294.370	1.835	50	0		CDAARO
COc1cccc(NC(=S)NCC[NH+](C)C)c1	ZINC000004192908	375915021	/nfs/dbraw/zinc/91/50/21/375915021.db2.gz	NJYDCTNEIHZLBA-UHFFFAOYSA-N	1	0	253.371	1.543	50	0		CDAARO
C[C@@H]1CCC[C@H]1OC[C@@H](O)C[NH+]1C[C@@H](C)O[C@H](C)C1	ZINC000240499911	376017343	/nfs/dbraw/zinc/01/73/43/376017343.db2.gz	NOPQVBCPBSUPGR-ARILJUKYSA-N	1	0	271.401	1.662	50	0		CDAARO
O=C(NCC1CC1)c1ccc([C@@H]2CCC[NH2+]C2)nc1	ZINC000242554686	376021231	/nfs/dbraw/zinc/02/12/31/376021231.db2.gz	MTNUKEQYBPWAQH-GFCCVEGCSA-N	1	0	259.353	1.688	50	0		CDAARO
C[C@H](C(=O)N1Cc2cnc(C(C)(C)C)nc2C1)[NH+](C)C	ZINC000067432018	377073878	/nfs/dbraw/zinc/07/38/78/377073878.db2.gz	MCEURBZYNHKDCS-SNVBAGLBSA-N	1	0	276.384	1.566	50	0		CDAARO
CCC[C@H]([NH3+])C(=O)N1CCC(c2n[nH]cc2CC)CC1	ZINC000067833918	377251676	/nfs/dbraw/zinc/25/16/76/377251676.db2.gz	GOEYXOHIPZPBPK-ZDUSSCGKSA-N	1	0	278.400	1.806	50	0		CDAARO
OC(C[C@@H]1C[NH2+]CCN1)(c1ccccc1)c1ccccc1	ZINC000071771311	285232306	/nfs/dbraw/zinc/23/23/06/285232306.db2.gz	ZBTILVNCHKEHME-QGZVFWFLSA-N	1	0	282.387	1.874	50	0		CDAARO
O[C@H]1c2ccccc2C[C@@H]1[N@@H+]1CCc2n[nH]cc2C1	ZINC000097034167	285372623	/nfs/dbraw/zinc/37/26/23/285372623.db2.gz	OLZWDSAQPFZIQJ-GJZGRUSLSA-N	1	0	255.321	1.426	50	0		CDAARO
Cc1csc(NC(=O)NCC[NH2+]C(C)(C)C)n1	ZINC000096417589	390512104	/nfs/dbraw/zinc/51/21/04/390512104.db2.gz	HXBFUELBXYBZPA-UHFFFAOYSA-N	1	0	256.375	1.961	50	0		CDAARO
CC1CCC(O)(C[N@H+](C)Cc2cnn(C)c2)CC1	ZINC000096435771	390518955	/nfs/dbraw/zinc/51/89/55/390518955.db2.gz	GLMNQZBJUPOAKN-UHFFFAOYSA-N	1	0	251.374	1.793	50	0		CDAARO
CN(Cc1ccco1)C(=O)Nc1ccn(CC[NH+](C)C)n1	ZINC000096435357	390519227	/nfs/dbraw/zinc/51/92/27/390519227.db2.gz	WAJMKXSGLIFEMG-UHFFFAOYSA-N	1	0	291.355	1.702	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]CCNC(=O)c1ccc(C)c(F)c1	ZINC000097159533	390801067	/nfs/dbraw/zinc/80/10/67/390801067.db2.gz	XCKXYXRVTYUFNY-UHFFFAOYSA-N	1	0	290.342	1.685	50	0		CDAARO
C[C@@]1(O)N(C2CC2)C(=O)OC12CC(C)(C)[NH2+]C(C)(C)C2	ZINC000000036888	390801985	/nfs/dbraw/zinc/80/19/85/390801985.db2.gz	XZUBYKNEMFCNPL-AWEZNQCLSA-N	1	0	282.384	1.989	50	0		CDAARO
CC(C)N1CC[C@H]([NH2+][C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)C1	ZINC000097228404	390816668	/nfs/dbraw/zinc/81/66/68/390816668.db2.gz	ZIRKEUWASJAMDP-FQUUOJAGSA-N	1	0	252.402	1.872	50	0		CDAARO
NC(=O)COc1cccc(C[NH+]2CCC(F)CC2)c1	ZINC000215576703	390995656	/nfs/dbraw/zinc/99/56/56/390995656.db2.gz	KEOMUIJJDZOMBG-UHFFFAOYSA-N	1	0	266.316	1.485	50	0		CDAARO
C[C@@H]1C[C@H](C)CN(C(=O)C[N@@H+]2C[C@@H]3CCC[C@@H]32)C1	ZINC000252511490	391911731	/nfs/dbraw/zinc/91/17/31/391911731.db2.gz	HHERRFZGXGBAHR-CRWXNKLISA-N	1	0	250.386	1.975	50	0		CDAARO
CCN(Cc1ccccc1)C(=O)[C@H](C)[N@@H+]1CC[C@](C)(O)C1	ZINC000252485849	131135431	/nfs/dbraw/zinc/13/54/31/131135431.db2.gz	BCKSAFNNSDBULF-YOEHRIQHSA-N	1	0	290.407	1.880	50	0		CDAARO
C[NH+]1CCC2(CC1)CN(C(=O)c1ccncc1)CCO2	ZINC000649136806	392837978	/nfs/dbraw/zinc/83/79/78/392837978.db2.gz	ZAOQFRYYRCNXEB-UHFFFAOYSA-N	1	0	275.352	1.018	50	0		CDAARO
[NH2+]=C1Nc2nc3ccccc3n2[C@]2(CCSC2)N1	ZINC000007738384	393002224	/nfs/dbraw/zinc/00/22/24/393002224.db2.gz	LQXPHTULLHSHCI-LBPRGKRZSA-N	1	0	259.338	1.375	50	0		CDAARO
C[C@@H](CNC(=O)c1c(F)cccc1F)N1CC[NH+](C)CC1	ZINC000096403435	393178744	/nfs/dbraw/zinc/17/87/44/393178744.db2.gz	USKTWAWSEMOQCA-NSHDSACASA-N	1	0	297.349	1.331	50	0		CDAARO
[NH3+][C@@H](C(=O)Nc1cnc2ccccc2c1)C1CCOCC1	ZINC000261726738	140380955	/nfs/dbraw/zinc/38/09/55/140380955.db2.gz	JRDVZMXVZJOIFU-OAHLLOKOSA-N	1	0	285.347	1.927	50	0		CDAARO
CC(C)N(C)C(=O)[C@H]1CCC[N@@H+]1C1CCOCC1	ZINC000192940185	397609546	/nfs/dbraw/zinc/60/95/46/397609546.db2.gz	CTVOFHCQACHAKX-CYBMUJFWSA-N	1	0	254.374	1.497	50	0		CDAARO
CC[C@H](O)C[N@H+](C)C[C@H]1CC(c2ccccc2)=NO1	ZINC000104984628	397983918	/nfs/dbraw/zinc/98/39/18/397983918.db2.gz	PGUBUSZXBGFZBV-UONOGXRCSA-N	1	0	262.353	1.882	50	0		CDAARO
COC[C@H]([NH2+][C@@H](C)c1nccn1C)C1CCOCC1	ZINC000658098353	413197279	/nfs/dbraw/zinc/19/72/79/413197279.db2.gz	YCSMOQPPJVASBF-AAEUAGOBSA-N	1	0	267.373	1.512	50	0		CDAARO
CCO[C@H]1C[C@@H](O)C12CCN(C(=O)C1([NH3+])CCCC1)CC2	ZINC000262477397	286496871	/nfs/dbraw/zinc/49/68/71/286496871.db2.gz	QKNQMCAIJVEOQQ-OLZOCXBDSA-N	1	0	296.411	1.036	50	0		CDAARO
CCCCC[NH+](CCCCC)C(CO)(CO)CO	ZINC000003159953	169863054	/nfs/dbraw/zinc/86/30/54/169863054.db2.gz	ALZBELOYRYTVJO-UHFFFAOYSA-N	1	0	261.406	1.385	50	0		CDAARO
Cc1ccc2c(c1)[C@@H]1C[N@H+](C)CC[C@@H]1N2S(C)(=O)=O	ZINC000004019999	292354798	/nfs/dbraw/zinc/35/47/98/292354798.db2.gz	DGKGNEDJNWYORV-JSGCOSHPSA-N	1	0	280.393	1.562	50	0		CDAARO
CO[C@@H](C[NH2+][C@@H]1CCC(=O)NC1(C)C)C1CCCC1	ZINC000658317408	413367749	/nfs/dbraw/zinc/36/77/49/413367749.db2.gz	VSZIMXMVLJCXAK-QWHCGFSZSA-N	1	0	268.401	1.838	50	0		CDAARO
C[C@@H](C(=O)NC(C)(C)C)[NH+]1CCC2(CC1)OCCO2	ZINC000032765352	286767693	/nfs/dbraw/zinc/76/76/93/286767693.db2.gz	ZXVSDHACUORJPH-NSHDSACASA-N	1	0	270.373	1.129	50	0		CDAARO
COc1ccc(-c2nc3scc(CC[NH3+])n3n2)cc1	ZINC000004374864	169962875	/nfs/dbraw/zinc/96/28/75/169962875.db2.gz	XOHZUYVSVNVJQG-UHFFFAOYSA-N	1	0	274.349	1.968	50	0		CDAARO
C[C@H](c1ccccc1)S(=O)(=O)CCSC(N)=[NH2+]	ZINC000004697664	170000910	/nfs/dbraw/zinc/00/09/10/170000910.db2.gz	GFLGZLRLTYTSMA-SECBINFHSA-N	1	0	272.395	1.789	50	0		CDAARO
Cc1cccc2[nH]c3c(ncn(CC[NH+](C)C)c3=O)c21	ZINC000005478267	170103545	/nfs/dbraw/zinc/10/35/45/170103545.db2.gz	HTZUKBBOWDWXGZ-UHFFFAOYSA-N	1	0	270.336	1.748	50	0		CDAARO
COC[C@H](O)c1ccc(OC[C@H](O)C[NH2+]C(C)C)cc1	ZINC000005760531	170138057	/nfs/dbraw/zinc/13/80/57/170138057.db2.gz	OFRYBPCSEMMZHR-HIFRSBDPSA-N	1	0	283.368	1.104	50	0	world	CDAARO
C[NH+](C)CCNC(=O)C[C@H]1Sc2ccccc2NC1=O	ZINC000006177122	170180580	/nfs/dbraw/zinc/18/05/80/170180580.db2.gz	ZQEIPLMOPVLOSA-GFCCVEGCSA-N	1	0	293.392	1.167	50	0		CDAARO
Cc1ccc(NC(=O)C[N+](C)=c2ccccn2C)cc1	ZINC000006603902	170218361	/nfs/dbraw/zinc/21/83/61/170218361.db2.gz	UUVRAXRNRACGIC-UHFFFAOYSA-O	1	0	270.356	1.894	50	0		CDAARO
CC(C)CCC[C@H]1CN(C(=O)C[NH+](C)C)CCO1	ZINC000011772792	170440693	/nfs/dbraw/zinc/44/06/93/170440693.db2.gz	RGZFYEJIQWPJCJ-ZDUSSCGKSA-N	1	0	256.390	1.602	50	0		CDAARO
COC(=O)c1ccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)cc1	ZINC000020307189	171142490	/nfs/dbraw/zinc/14/24/90/171142490.db2.gz	VWYNLFPCRJZKHX-ZDUSSCGKSA-N	1	0	276.336	1.171	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2ccc(C)cc2)CC1	ZINC000020608829	171267723	/nfs/dbraw/zinc/26/77/23/171267723.db2.gz	FLPNSUHCHYSIBW-UHFFFAOYSA-N	1	0	261.369	1.571	50	0		CDAARO
CC[C@H](C)[NH+]1CCC2(CC1)C(=O)N(C)C(=O)N2CC	ZINC000020868964	171277081	/nfs/dbraw/zinc/27/70/81/171277081.db2.gz	KHMKAFBGBAVBEA-NSHDSACASA-N	1	0	267.373	1.533	50	0		CDAARO
C[N@@H+]1CCN(Cc2cccc(F)c2)C[C@@H]1CCO	ZINC000020910964	171279210	/nfs/dbraw/zinc/27/92/10/171279210.db2.gz	MCEYKJRSBANTCZ-AWEZNQCLSA-N	1	0	252.333	1.324	50	0		CDAARO
Cc1ccc([C@@H](C)CC[NH+]2CCN(CCO)CC2)o1	ZINC000022077683	171352551	/nfs/dbraw/zinc/35/25/51/171352551.db2.gz	YLCXWHVBAKFNAY-ZDUSSCGKSA-N	1	0	266.385	1.692	50	0		CDAARO
O=C1C[C@H]([NH2+]CCc2ccncc2)C(=O)N1c1ccccc1	ZINC000022133880	171354930	/nfs/dbraw/zinc/35/49/30/171354930.db2.gz	MWJPRBOYMFPZNG-HNNXBMFYSA-N	1	0	295.342	1.546	50	0		CDAARO
COc1cc(C[NH2+]CC2CC2)cc(OC)c1OCC(N)=O	ZINC000030662378	171620624	/nfs/dbraw/zinc/62/06/24/171620624.db2.gz	JMTATRSPWBJJON-UHFFFAOYSA-N	1	0	294.351	1.068	50	0		CDAARO
COc1ccc(CN(C)C(=O)[C@H]2CCC[NH2+]2)cc1F	ZINC000037497769	173236660	/nfs/dbraw/zinc/23/66/60/173236660.db2.gz	MRDKGINDIVRJRE-GFCCVEGCSA-N	1	0	266.316	1.545	50	0		CDAARO
CCc1ccc(CN2CC[N@H+](C)[C@H](CCO)C2)cc1	ZINC000039500577	174169757	/nfs/dbraw/zinc/16/97/57/174169757.db2.gz	JONWZNVZVXBIFR-MRXNPFEDSA-N	1	0	262.397	1.747	50	0		CDAARO
CCC(CC)[C@@H](CNC(=O)c1ccc(=O)[nH]c1)[NH+](C)C	ZINC000040435748	174261752	/nfs/dbraw/zinc/26/17/52/174261752.db2.gz	FOMFCZUNOLXYRW-CYBMUJFWSA-N	1	0	279.384	1.883	50	0		CDAARO
COc1cccc(SCC(=O)N[C@@H]2CC[C@@H]([NH3+])C2)c1	ZINC000067692133	175784480	/nfs/dbraw/zinc/78/44/80/175784480.db2.gz	UVVQCCOSCMLCFJ-GHMZBOCLSA-N	1	0	280.393	1.783	50	0		CDAARO
CCCSc1ncc(CN2CCO[C@H](C[NH3+])C2)cn1	ZINC000067755884	175789353	/nfs/dbraw/zinc/78/93/53/175789353.db2.gz	QEIBYSUXBCJFOA-GFCCVEGCSA-N	1	0	282.413	1.138	50	0		CDAARO
CO[C@H]1CN(C(=O)COc2cccc(C)c2C)CC[C@H]1[NH3+]	ZINC000071712015	176248820	/nfs/dbraw/zinc/24/88/20/176248820.db2.gz	OGVGEKPROMLXBC-HIFRSBDPSA-N	1	0	292.379	1.257	50	0		CDAARO
Cc1noc(C)c1C[N@@H+]1CCC[C@](O)(CO)CC1	ZINC000072166751	176331457	/nfs/dbraw/zinc/33/14/57/176331457.db2.gz	VVHJZVSIMAJSJK-CYBMUJFWSA-N	1	0	254.330	1.001	50	0		CDAARO
CN1CCC[N@H+](CCC(=O)N[C@H]2CC[C@@H]3CCC[C@@H]32)CC1	ZINC000077505436	177276288	/nfs/dbraw/zinc/27/62/88/177276288.db2.gz	IZVDPVHSWSJINI-JYJNAYRXSA-N	1	0	293.455	1.709	50	0		CDAARO
O=C(NC[C@@H]1CCCO1)c1ccc(-c2c[nH]cn2)cc1	ZINC000521396314	260071884	/nfs/dbraw/zinc/07/18/84/260071884.db2.gz	LDQRNPDOWPTMGO-ZDUSSCGKSA-N	1	0	271.320	1.986	50	0		CDAARO
CC(C)COC(=O)N1CCC([NH2+]C[C@@H]2CCC[C@H]2O)CC1	ZINC000089157738	260113192	/nfs/dbraw/zinc/11/31/92/260113192.db2.gz	IHEXHGMUIZGZMD-DZGCQCFKSA-N	1	0	298.427	1.994	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)CCOc2ccc(F)cc2)C1	ZINC000178535314	261397244	/nfs/dbraw/zinc/39/72/44/261397244.db2.gz	MWBZQIVHFAYUHR-LLVKDONJSA-N	1	0	266.316	1.402	50	0		CDAARO
C/C=C\C[C@H](CO)[NH2+]C1CCN([C@@H]2CCOC2)CC1	ZINC000655757669	424446461	/nfs/dbraw/zinc/44/64/61/424446461.db2.gz	WRSPHRZEUDJINT-OKYAQOQYSA-N	1	0	268.401	1.156	50	0		CDAARO
C[C@@H](CCN1CCOC(C)(C)C1)[N@@H+]1CCOC(C)(C)C1	ZINC000089895460	278231731	/nfs/dbraw/zinc/23/17/31/278231731.db2.gz	GBMDIPQUCZPBDT-AWEZNQCLSA-N	1	0	284.444	1.987	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)C[C@@H]1OCCc2ccccc21	ZINC000125751151	279906113	/nfs/dbraw/zinc/90/61/13/279906113.db2.gz	IQAVOOPKGCYWIG-WFASDCNBSA-N	1	0	274.364	1.511	50	0		CDAARO
CN(C)CC[NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000022798655	289165062	/nfs/dbraw/zinc/16/50/62/289165062.db2.gz	QXXLESWYFDJPFJ-NSHDSACASA-N	1	0	257.378	1.147	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCCN1C(=O)c1ccc(N(C)C)nc1	ZINC000121965614	289776956	/nfs/dbraw/zinc/77/69/56/289776956.db2.gz	AKHLLJDLOSYWSL-AAEUAGOBSA-N	1	0	276.384	1.490	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@@H]1CCC[NH2+][C@@H]1C	ZINC000091496924	301616230	/nfs/dbraw/zinc/61/62/30/301616230.db2.gz	QDJCZGJAGSHCQR-ZYHUDNBSSA-N	1	0	286.372	1.553	50	0		CDAARO
Cn1nccc1[C@@H]1CCCCN1C[C@@H]1CCC[NH2+]C1	ZINC000261629222	303073027	/nfs/dbraw/zinc/07/30/27/303073027.db2.gz	CLLJPKHCJXBMMA-HIFRSBDPSA-N	1	0	262.401	1.947	50	0		CDAARO
Cc1cc2ccccc2n1CCNC(=O)[C@@H]1C=CC[NH2+]1	ZINC000534584535	328314695	/nfs/dbraw/zinc/31/46/95/328314695.db2.gz	NVUXVWNPLFGPMA-AWEZNQCLSA-N	1	0	269.348	1.594	50	0		CDAARO
Cc1cc(C(=O)N[C@@H](c2nccn2C)C2CC2)cc(=O)[nH]1	ZINC000534585012	328314945	/nfs/dbraw/zinc/31/49/45/328314945.db2.gz	ROEWVMSDMGELEM-CYBMUJFWSA-N	1	0	286.335	1.710	50	0		CDAARO
Cn1cc(CSc2nnc([C@H]3CCC[NH2+]C3)n2C)cn1	ZINC000534632352	328331854	/nfs/dbraw/zinc/33/18/54/328331854.db2.gz	MXLFAFGNGFCRIM-NSHDSACASA-N	1	0	292.412	1.308	50	0		CDAARO
Cc1nccn1CC(=O)N[C@H](C)c1cccc(C)n1	ZINC000534634816	328333209	/nfs/dbraw/zinc/33/32/09/328333209.db2.gz	JYZPEQNLKSXGFB-LLVKDONJSA-N	1	0	258.325	1.772	50	0		CDAARO
O=C(NC[C@@H]1CC[NH2+]C[C@H]1O)Nc1ccc(F)c(F)c1	ZINC000534635479	328333358	/nfs/dbraw/zinc/33/33/58/328333358.db2.gz	GIDANUNRFFQSCB-QPUJVOFHSA-N	1	0	285.294	1.057	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]CCN1CCC(CO)CC1	ZINC000534637019	328334060	/nfs/dbraw/zinc/33/40/60/328334060.db2.gz	VEETUCGVBNQIJM-CQSZACIVSA-N	1	0	294.443	1.128	50	0		CDAARO
Nc1ncc(C(=O)N2CCCC3(CC[NH2+]CC3)CC2)s1	ZINC000534656061	328339970	/nfs/dbraw/zinc/33/99/70/328339970.db2.gz	LZRZTGCBSUSSPV-UHFFFAOYSA-N	1	0	294.424	1.552	50	0		CDAARO
Cc1cc(C(=O)NC[C@@H]2CC[N@@H+](C3CCCC3)C2)nn1C	ZINC000534658076	328340961	/nfs/dbraw/zinc/34/09/61/328340961.db2.gz	MUMQCUFFCGWTNZ-ZDUSSCGKSA-N	1	0	290.411	1.723	50	0		CDAARO
O=C(NCCOc1ccc(F)cc1)[C@@H]1CCC[NH2+]CC1	ZINC000534665487	328344947	/nfs/dbraw/zinc/34/49/47/328344947.db2.gz	WPUUFALBUJQXEE-GFCCVEGCSA-N	1	0	280.343	1.710	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)c1ccccc1N1CCCC1	ZINC000534673767	328348826	/nfs/dbraw/zinc/34/88/26/328348826.db2.gz	KTDPJPQFRDWIKX-ZFWWWQNUSA-N	1	0	289.379	1.003	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)c2cncn2C)CC1	ZINC000534663362	328351269	/nfs/dbraw/zinc/35/12/69/328351269.db2.gz	KQOKPBFWRJMYJJ-UHFFFAOYSA-N	1	0	250.346	1.024	50	0		CDAARO
Cc1c[nH]cc1C(=O)N1CCC[C@H]([NH+]2CCOCC2)CC1	ZINC000584226322	327068641	/nfs/dbraw/zinc/06/86/41/327068641.db2.gz	QAVYIJOJHBDJCR-AWEZNQCLSA-N	1	0	291.395	1.650	50	0		CDAARO
CSCC(=O)N(Cc1ccncc1)C1CC[NH+](C)CC1	ZINC000077420227	327132252	/nfs/dbraw/zinc/13/22/52/327132252.db2.gz	CNDDTNVPQRQROK-UHFFFAOYSA-N	1	0	293.436	1.867	50	0		CDAARO
O=C1CC[C@H]([NH2+][C@H]2CCCOc3ccccc32)CN1	ZINC000096477788	329526869	/nfs/dbraw/zinc/52/68/69/329526869.db2.gz	RJLMKNUWBGBLOZ-AAEUAGOBSA-N	1	0	260.337	1.769	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)[C@H]1CSc2ccccc21	ZINC000092239304	482610683	/nfs/dbraw/zinc/61/06/83/482610683.db2.gz	GFHPBBMTFUUNDQ-JQWIXIFHSA-N	1	0	262.378	1.696	50	0		CDAARO
NC(=O)C1(C[NH2+]Cc2cc3ccccc3o2)CCOCC1	ZINC000086250234	482706529	/nfs/dbraw/zinc/70/65/29/482706529.db2.gz	GHFOULCPMXHQDM-UHFFFAOYSA-N	1	0	288.347	1.805	50	0		CDAARO
COc1c(F)cc(CN2CC[C@@H]([NH3+])[C@H](O)C2)cc1Cl	ZINC000082134523	482763622	/nfs/dbraw/zinc/76/36/22/482763622.db2.gz	ICXHMWFKKMDFTG-VXGBXAGGSA-N	1	0	288.750	1.382	50	0		CDAARO
C[NH+](C)C1(CNC(=O)Cn2ccc(=O)cc2)CCCCC1	ZINC000670436521	482973591	/nfs/dbraw/zinc/97/35/91/482973591.db2.gz	VJWUVFRZKHKTSV-UHFFFAOYSA-N	1	0	291.395	1.229	50	0		CDAARO
Cc1nc2c([nH]1)C[N@H+](C[C@H](O)c1ccccc1)CC2	ZINC000670440260	482985351	/nfs/dbraw/zinc/98/53/51/482985351.db2.gz	HBNSNZWHDQONAG-HNNXBMFYSA-N	1	0	257.337	1.810	50	0		CDAARO
CCc1noc(CC[NH2+][C@@H](C)Cn2nc(C)cc2C)n1	ZINC000670447948	483004232	/nfs/dbraw/zinc/00/42/32/483004232.db2.gz	XVTRBUFYGOJCBU-NSHDSACASA-N	1	0	277.372	1.666	50	0		CDAARO
Cn1ccc2ccc(C[NH+]3C[C@@H](CO)[C@H](CO)C3)cc21	ZINC000670456466	483035180	/nfs/dbraw/zinc/03/51/80/483035180.db2.gz	RRBKZHXPSMGQIP-GJZGRUSLSA-N	1	0	274.364	1.211	50	0		CDAARO
O=C(CCC(F)(F)F)NCCC[N@H+]1CCCC[C@@H]1CO	ZINC000670456221	483036004	/nfs/dbraw/zinc/03/60/04/483036004.db2.gz	ZRWVZHZYDIXTJG-LLVKDONJSA-N	1	0	296.333	1.682	50	0		CDAARO
Cc1cc(C(=O)N(C)[C@H]2CC[NH2+]C2)nn1C(C)(C)C	ZINC000179081892	526228360	/nfs/dbraw/zinc/22/83/60/526228360.db2.gz	GEGVXEBXNLXLKD-NSHDSACASA-N	1	0	264.373	1.380	50	0		CDAARO
CC(=O)c1cc(C(=O)N[C@@H](C)C2=CC[N@H+](C)CC2)n(C)c1	ZINC000272998607	527198179	/nfs/dbraw/zinc/19/81/79/527198179.db2.gz	RSNBVVRMGNZXSD-NSHDSACASA-N	1	0	289.379	1.608	50	0		CDAARO
[NH3+]Cc1cc(C(=O)N[C@@H]2CCC[C@H]3OCC[C@@H]32)co1	ZINC000188015637	527248142	/nfs/dbraw/zinc/24/81/42/527248142.db2.gz	JKCHHYXZWKSVSL-JHJVBQTASA-N	1	0	264.325	1.426	50	0		CDAARO
CCOC(C[N@@H+]1CCC[C@@H](c2cc[nH]n2)C1)OCC	ZINC000184950931	535735908	/nfs/dbraw/zinc/73/59/08/535735908.db2.gz	UJMNELQBUUAXFL-GFCCVEGCSA-N	1	0	267.373	1.988	50	0		CDAARO
C[C@@H]1C[C@H](N)C[NH2+][C@@H]1[C@H]1CC[C@@H](C(F)(F)F)NC1	ZINC000757213056	577036297	/nfs/dbraw/zinc/03/62/97/577036297.db2.gz	NNGYGHVINMQSEQ-NMUGVGKYSA-N	1	0	265.323	1.242	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@@H]([NH3+])C2CCC2)C1	ZINC000958527909	613973371	/nfs/dbraw/zinc/97/33/71/613973371.db2.gz	IGZIYFQHBFBKLT-JTQLQIEISA-N	1	0	256.346	1.096	50	0		CDAARO
CCn1ccc(C[NH2+]C[C@@H]2CC(=O)N(C3CCCC3)C2)n1	ZINC000952966477	616031708	/nfs/dbraw/zinc/03/17/08/616031708.db2.gz	WNCLMOVOWJAVEW-ZDUSSCGKSA-N	1	0	290.411	1.784	50	0		CDAARO
C[NH2+][C@@H](CC(C)(C)C)C(=O)NC1(c2nc[nH]n2)CCC1	ZINC000888096466	617758290	/nfs/dbraw/zinc/75/82/90/617758290.db2.gz	WFLXBGJNLGXYET-JTQLQIEISA-N	1	0	279.388	1.324	50	0		CDAARO
C[N@@H+]1C[C@H](C(=O)N2CC=CCC2)[C@H](C(F)(F)F)C1	ZINC000952992020	616282666	/nfs/dbraw/zinc/28/26/66/616282666.db2.gz	HVGWLJGCGPURMA-VHSXEESVSA-N	1	0	262.275	1.515	50	0		CDAARO
COCCCCN(C)C(=O)[C@@H]1CC[C@H]2C[C@@H](C)C[N@@H+]2C1	ZINC000952995799	616862430	/nfs/dbraw/zinc/86/24/30/616862430.db2.gz	ZFNHYCKCPNNLIC-KFWWJZLASA-N	1	0	282.428	1.992	50	0		CDAARO
CC(=O)c1cnc(NCC[C@@H]2CCC[N@H+]2C)nc1C	ZINC001704325071	1177687727	/nfs/dbraw/zinc/68/77/27/1177687727.db2.gz	CQAGAYXUTSSZPS-LBPRGKRZSA-N	1	0	262.357	1.884	50	0		CDAARO
CC[N@H+](C)[C@@H](C)CCNc1nccnc1N(C)C	ZINC001704335871	1177692498	/nfs/dbraw/zinc/69/24/98/1177692498.db2.gz	HRDWVJQBFYMOKX-NSHDSACASA-N	1	0	251.378	1.685	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3ncccc3C)C[C@@H]2O)[nH]n1	ZINC001704338993	1177695060	/nfs/dbraw/zinc/69/50/60/1177695060.db2.gz	AZGHVGUPMHVRRU-CJNGLKHVSA-N	1	0	286.379	1.457	50	0		CDAARO
COc1ccc(/C=C(/C)C[NH2+][C@H]2CCS(=O)(=O)C2)cc1	ZINC000095437357	812427416	/nfs/dbraw/zinc/42/74/16/812427416.db2.gz	CPHUICYZRDUNRZ-UQTJOTSZSA-N	1	0	295.404	1.875	50	0		CDAARO
CSCC[C@@H](C)[NH2+]CCn1c(C)cc(C)nc1=O	ZINC000065386424	805228669	/nfs/dbraw/zinc/22/86/69/805228669.db2.gz	KFRWUVQPINAMSM-SNVBAGLBSA-N	1	0	269.414	1.591	50	0		CDAARO
C[NH+](C)CCCNC(=O)[C@H]1CC(c2ccc(F)cc2)=NO1	ZINC000020602424	811801840	/nfs/dbraw/zinc/80/18/40/811801840.db2.gz	RQAPWBFKVNMFQD-CQSZACIVSA-N	1	0	293.342	1.387	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@@H]1CC2(CO1)CC[NH2+]CC2	ZINC000215644335	812229610	/nfs/dbraw/zinc/22/96/10/812229610.db2.gz	UDRFMMANEMUIEH-NSHDSACASA-N	1	0	270.373	1.670	50	0		CDAARO
O=c1[nH]ccnc1N1CC[NH+](CCCc2cccnc2)CC1	ZINC000253537067	812327776	/nfs/dbraw/zinc/32/77/76/812327776.db2.gz	WJUKPSMNGRLCOX-UHFFFAOYSA-N	1	0	299.378	1.332	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1CCNc1cnc2ccccc2n1	ZINC000952978578	812807552	/nfs/dbraw/zinc/80/75/52/812807552.db2.gz	AUHNLXVDVRTCPY-ZDUSSCGKSA-N	1	0	286.379	1.889	50	0		CDAARO
COCCn1cnnc1[C@H](C)n1ccnc1C1CC1	ZINC000072164857	813352380	/nfs/dbraw/zinc/35/23/80/813352380.db2.gz	IHSCREFEFDZTFB-JTQLQIEISA-N	1	0	261.329	1.608	50	0		CDAARO
OC[C@H]1CCC[N@H+](CCNc2ncnc3ccccc32)C1	ZINC000952986003	814563167	/nfs/dbraw/zinc/56/31/67/814563167.db2.gz	VUMXLDWQAVODHT-ZDUSSCGKSA-N	1	0	286.379	1.746	50	0		CDAARO
CN1CC[N@H+](C)CC12CCN(c1ccc(Cl)cn1)CC2	ZINC000067894741	814684635	/nfs/dbraw/zinc/68/46/35/814684635.db2.gz	JWHSZXBDTUMAFN-UHFFFAOYSA-N	1	0	294.830	1.951	50	0		CDAARO
O=C(/C=C\c1c(F)cccc1F)N[C@H]1COC2(C[NH2+]C2)C1	ZINC000952832845	910399657	/nfs/dbraw/zinc/39/96/57/910399657.db2.gz	SNXALYQQXVZJFH-UMCURTJPSA-N	1	0	294.301	1.225	50	0		CDAARO
C[N@H+]1C[C@H](C(F)(F)F)[C@H](C(=O)Nc2c[nH]ccc2=O)C1	ZINC000952880130	910442545	/nfs/dbraw/zinc/44/25/45/910442545.db2.gz	BRSNONYTFKMKPW-SFYZADRCSA-N	1	0	289.257	1.054	50	0		CDAARO
CNC(=O)N[C@H]1CCCN(Cc2ccc(F)cn2)C1	ZINC000952884298	910457640	/nfs/dbraw/zinc/45/76/40/910457640.db2.gz	XEBRIFNIVPHEQE-LBPRGKRZSA-N	1	0	266.320	1.114	50	0		CDAARO
C/C=C/CC(=O)N1CCC[C@@](CO)(C[NH+](C)C)C1	ZINC000820394973	925522300	/nfs/dbraw/zinc/52/23/00/925522300.db2.gz	MVBMVROBMGDQMX-ISZGNANSSA-N	1	0	254.374	1.115	50	0		CDAARO
Cc1cccc(Cn2ncnc2CN2CC[C@@H]([NH+](C)C)C2)c1	ZINC000823664780	925719862	/nfs/dbraw/zinc/71/98/62/925719862.db2.gz	NWDGRNUCZCGQTN-MRXNPFEDSA-N	1	0	299.422	1.771	50	0		CDAARO
Cc1ccc(-n2cccn2)c(CN2C[C@@H]3[NH2+]CCO[C@H]3C2)c1	ZINC000825159228	925855460	/nfs/dbraw/zinc/85/54/60/925855460.db2.gz	UUXPGZLXQTYUDN-RDJZCZTQSA-N	1	0	298.390	1.353	50	0		CDAARO
CC(C)(O)CC[NH+]1CCC(CNC(=O)c2ccon2)CC1	ZINC000828196598	926066316	/nfs/dbraw/zinc/06/63/16/926066316.db2.gz	XRFGQCNPSXNSPF-UHFFFAOYSA-N	1	0	295.383	1.277	50	0		CDAARO
Cn1ccc(C(=O)N[C@H]2C[C@@H]([NH+](C)C)C23CCC3)n1	ZINC000585127618	931010691	/nfs/dbraw/zinc/01/06/91/931010691.db2.gz	FMEVUGRAGYXFMJ-NWDGAFQWSA-N	1	0	262.357	1.023	50	0		CDAARO
CSCC[NH+]1CCN(Cc2nccn2C2CC2)CC1	ZINC001506399773	975149072	/nfs/dbraw/zinc/14/90/72/975149072.db2.gz	FANQKDQUWKIUMZ-UHFFFAOYSA-N	1	0	280.441	1.699	50	0		CDAARO
CN(C)C(=O)c1cccc(N2[C@@H]3CC[C@H]2C[N@H+](C)CC3)n1	ZINC001506405253	975151693	/nfs/dbraw/zinc/15/16/93/975151693.db2.gz	YJGNOHHWMHYDIK-OLZOCXBDSA-N	1	0	288.395	1.456	50	0		CDAARO
Cn1ccnc1CC[N@H+](C)C[C@H](O)c1ccccc1	ZINC001506408954	975153037	/nfs/dbraw/zinc/15/30/37/975153037.db2.gz	NZBDOGHNYIBHGL-AWEZNQCLSA-N	1	0	259.353	1.628	50	0		CDAARO
COC1CC[NH+]([C@H]2CCC(=O)N(CC3CC3)CC2)CC1	ZINC001506420864	975157996	/nfs/dbraw/zinc/15/79/96/975157996.db2.gz	BHLBYHAUSRZNTQ-AWEZNQCLSA-N	1	0	280.412	1.888	50	0		CDAARO
CCN(CC[NH+]1CCCC1)C(=O)CCc1cn[nH]c1	ZINC001506425949	975160647	/nfs/dbraw/zinc/16/06/47/975160647.db2.gz	SPWTZXTUQHCONL-UHFFFAOYSA-N	1	0	264.373	1.287	50	0		CDAARO
CCN(C)C[C@@H](C)[NH2+]CCn1nc(C)c(C)c1C	ZINC001506430932	975161771	/nfs/dbraw/zinc/16/17/71/975161771.db2.gz	ZREKGHVIQZFTSF-LLVKDONJSA-N	1	0	252.406	1.738	50	0		CDAARO
CCOCC[N@H+](C)[C@H]1CCC(=O)N(CC2CC2)CC1	ZINC001506430176	975162107	/nfs/dbraw/zinc/16/21/07/975162107.db2.gz	XNWQJSJXIPMWIL-AWEZNQCLSA-N	1	0	268.401	1.746	50	0		CDAARO
Cc1nsc(N2CCC(CO)([NH2+]CC3CC3)CC2)n1	ZINC000408523851	230405813	/nfs/dbraw/zinc/40/58/13/230405813.db2.gz	NYVKJQOKPCMXMT-UHFFFAOYSA-N	1	0	282.413	1.177	50	0		CDAARO
CO[C@H]1C[N@H+](C)C[C@@H]1Nc1nc(C)c2c(n1)CCCC2	ZINC000584903297	341986706	/nfs/dbraw/zinc/98/67/06/341986706.db2.gz	AGICQURRUKXVTE-KBPBESRZSA-N	1	0	276.384	1.405	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCC[C@@H]2CC[NH2+]C2)cc1F	ZINC000110797775	230394098	/nfs/dbraw/zinc/39/40/98/230394098.db2.gz	OIJIKBRPJHWECM-NSHDSACASA-N	1	0	286.372	1.412	50	0		CDAARO
Cc1cc(S(=O)(=O)N[C@@H]2C[N@@H+](C)C[C@@H]2C)ccc1F	ZINC000084090236	539086118	/nfs/dbraw/zinc/08/61/18/539086118.db2.gz	XKNJIQIIMXAVOD-GXFFZTMASA-N	1	0	286.372	1.363	50	0		CDAARO
Cn1ccc(C(=O)NC[C@H](c2ccccc2)[NH+](C)C)cc1=O	ZINC000095948426	185039193	/nfs/dbraw/zinc/03/91/93/185039193.db2.gz	XJQCDIPPUVWIKP-OAHLLOKOSA-N	1	0	299.374	1.418	50	0		CDAARO
CC(C)c1cccc(S(=O)(=O)N2CCC[C@H]2C[NH3+])c1	ZINC000095972653	185049251	/nfs/dbraw/zinc/04/92/51/185049251.db2.gz	SOQCXHFZWMXDTO-ZDUSSCGKSA-N	1	0	282.409	1.922	50	0		CDAARO
CCCN1C(=O)N=NC1SCC[C@@H]1CCC[N@@H+]1C	ZINC000095975906	185050893	/nfs/dbraw/zinc/05/08/93/185050893.db2.gz	GVSCPRNHZBEISV-JTQLQIEISA-N	1	0	270.402	1.970	50	0		CDAARO
O=C(CCc1ccc(O)cc1)NCC[NH+]1CCCCC1	ZINC000096004299	185061516	/nfs/dbraw/zinc/06/15/16/185061516.db2.gz	SPIOJWYBNLWWGY-UHFFFAOYSA-N	1	0	276.380	1.927	50	0		CDAARO
CCOCC[NH2+][C@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000309737744	342024098	/nfs/dbraw/zinc/02/40/98/342024098.db2.gz	RBLKKLHZIBIXSO-MNOVXSKESA-N	1	0	260.378	1.914	50	0		CDAARO
C[NH+]1CCN(CCOc2ccc3c(c2)CCC3)CC1	ZINC000020652521	342088952	/nfs/dbraw/zinc/08/89/52/342088952.db2.gz	WTNJGBOBOZXTTD-UHFFFAOYSA-N	1	0	260.381	1.802	50	0		CDAARO
CC[C@H](COc1ccccc1)NC(=O)C[C@@H]1C[NH2+]CCO1	ZINC000195543511	342626604	/nfs/dbraw/zinc/62/66/04/342626604.db2.gz	GQGBOMLGJNVUAQ-UKRRQHHQSA-N	1	0	292.379	1.339	50	0		CDAARO
Cc1ccnc(-c2noc(CC3CC[NH2+]CC3)n2)c1	ZINC000093679553	539087917	/nfs/dbraw/zinc/08/79/17/539087917.db2.gz	ZUCQELXOPUTCNG-UHFFFAOYSA-N	1	0	258.325	1.982	50	0		CDAARO
COc1cccc2c1OCCC[N@H+](C[C@H]1COCCO1)C2	ZINC000244626510	361853844	/nfs/dbraw/zinc/85/38/44/361853844.db2.gz	FNBYYUMCYCAQCZ-AWEZNQCLSA-N	1	0	293.363	1.695	50	0		CDAARO
CC[C@@H](C(=O)NCc1ccc(C(=O)NC)o1)[NH+]1CCCC1	ZINC000244594260	361854110	/nfs/dbraw/zinc/85/41/10/361854110.db2.gz	DJKQRXQQKUABHX-LBPRGKRZSA-N	1	0	293.367	1.130	50	0		CDAARO
CCC1=NO[C@H](C[N@H+](C)CCCn2cccn2)C1	ZINC000244724405	361860787	/nfs/dbraw/zinc/86/07/87/361860787.db2.gz	MTGRIRCEVJSWJF-ZDUSSCGKSA-N	1	0	250.346	1.760	50	0		CDAARO
CCCCOc1ccccc1C(=O)NCC[NH2+]C	ZINC000244787628	361863343	/nfs/dbraw/zinc/86/33/43/361863343.db2.gz	QAMUHNLQQLHAJU-UHFFFAOYSA-N	1	0	250.342	1.815	50	0		CDAARO
C[C@@H](Cc1ccc(F)cc1)NC(=O)C[NH2+]C[C@@H]1CCCO1	ZINC000097229050	342204814	/nfs/dbraw/zinc/20/48/14/342204814.db2.gz	GRUWFDVRQOFPOO-WFASDCNBSA-N	1	0	294.370	1.642	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@@]2(C1)NC(=O)N(C(C)C)C2=O	ZINC000084544265	342264321	/nfs/dbraw/zinc/26/43/21/342264321.db2.gz	VJLXVUBIOLPZRW-ZDUSSCGKSA-N	1	0	253.346	1.047	50	0		CDAARO
COc1ncccc1C[N@@H+]1CC[C@@H](C)[C@@H](OC)C1	ZINC000193573897	362042669	/nfs/dbraw/zinc/04/26/69/362042669.db2.gz	NOCAKIYTRXPEDZ-YPMHNXCESA-N	1	0	250.342	1.947	50	0		CDAARO
CO[C@H](C[NH2+]CCc1ccncc1C)[C@H]1CCOC1	ZINC000585117413	362046526	/nfs/dbraw/zinc/04/65/26/362046526.db2.gz	BKKSGWQSUHKYSX-LSDHHAIUSA-N	1	0	264.369	1.574	50	0		CDAARO
Cc1nccc(Sc2nnc(C3CC[NH2+]CC3)n2C)n1	ZINC000078267289	343595283	/nfs/dbraw/zinc/59/52/83/343595283.db2.gz	HWRAELNDOVFCHY-UHFFFAOYSA-N	1	0	290.396	1.532	50	0		CDAARO
Cn1ccnc1C[NH2+]CC(C)(C)NC(=O)OC(C)(C)C	ZINC000083475207	362248740	/nfs/dbraw/zinc/24/87/40/362248740.db2.gz	WCJMCSRZKMLJFM-UHFFFAOYSA-N	1	0	282.388	1.813	50	0		CDAARO
Cc1nc(-c2ccc(C(=O)N3CC[NH2+]C[C@H]3C)cc2)n[nH]1	ZINC000124596612	282309522	/nfs/dbraw/zinc/30/95/22/282309522.db2.gz	LBHATLVXIHSFRA-SNVBAGLBSA-N	1	0	285.351	1.214	50	0		CDAARO
C[C@@H](CN1CCN(c2cccc(O)c2)CC1)[NH+]1CCCC1	ZINC000252479837	362384181	/nfs/dbraw/zinc/38/41/81/362384181.db2.gz	BNQDJADHHGCSSS-HNNXBMFYSA-N	1	0	289.423	1.999	50	0		CDAARO
COC[C@@H]1CCC[N@@H+]1CCC(=O)NCc1ccccc1F	ZINC000252494491	362388846	/nfs/dbraw/zinc/38/88/46/362388846.db2.gz	NXGVBRPIPOJGDQ-AWEZNQCLSA-N	1	0	294.370	1.943	50	0		CDAARO
CC(C)[C@@H](C[NH2+][C@H]1CCOC1)ONC(=O)OC(C)(C)C	ZINC000398827650	345586688	/nfs/dbraw/zinc/58/66/88/345586688.db2.gz	CNJHTUQJDFQOBX-NWDGAFQWSA-N	1	0	288.388	1.846	50	0		CDAARO
COc1ccnc(NC2CC[NH+](Cc3ccccn3)CC2)n1	ZINC000097476625	185612879	/nfs/dbraw/zinc/61/28/79/185612879.db2.gz	RJMJRYLGNAHXMM-UHFFFAOYSA-N	1	0	299.378	1.957	50	0		CDAARO
Cc1ccccc1OCCN(C)C(=O)[C@H]1CCC[C@H]1[NH3+]	ZINC000085367453	179037569	/nfs/dbraw/zinc/03/75/69/179037569.db2.gz	OVZWLLRPFSXDRH-UONOGXRCSA-N	1	0	276.380	1.960	50	0		CDAARO
CCNC(=O)C[NH2+]Cc1ccc(Br)c(C)c1	ZINC000085706744	179121556	/nfs/dbraw/zinc/12/15/56/179121556.db2.gz	YOCGGGJHYRKMFB-UHFFFAOYSA-N	1	0	285.185	1.983	50	0		CDAARO
O=C(Nc1snnc1-c1ccccc1)[C@@H]1CCC[NH2+]1	ZINC000145823129	348724729	/nfs/dbraw/zinc/72/47/29/348724729.db2.gz	IDWNJOLWBHWNSN-JTQLQIEISA-N	1	0	274.349	1.896	50	0		CDAARO
Cc1nn(C)c(C)c1[C@@H](C)NC(=O)CC[NH+]1CCCC1	ZINC000076319997	348748629	/nfs/dbraw/zinc/74/86/29/348748629.db2.gz	OTHBXYOQVQHEOB-LLVKDONJSA-N	1	0	278.400	1.700	50	0		CDAARO
Cc1nc(N)nc(NC[C@H]2CC[N@@H+](C3CC3)C2)c1Cl	ZINC000584885248	349342896	/nfs/dbraw/zinc/34/28/96/349342896.db2.gz	LHAJYHBVTXYMDP-SECBINFHSA-N	1	0	281.791	1.169	50	0		CDAARO
CCC[C@@H](CNc1nccc(NCC)n1)[NH+](C)C	ZINC000584889562	349349035	/nfs/dbraw/zinc/34/90/35/349349035.db2.gz	POWBMITYEQALLK-NSHDSACASA-N	1	0	251.378	1.473	50	0		CDAARO
CC1(CCC(=O)NCCC[N@@H+]2CCC[C@H](O)C2)CC1	ZINC000584897871	349360035	/nfs/dbraw/zinc/36/00/35/349360035.db2.gz	VZLPQSILXSLQCQ-ZDUSSCGKSA-N	1	0	268.401	1.530	50	0		CDAARO
Cc1nn(CCO)cc1CN1C[C@H]([NH+](C)C)[C@@H](C(C)C)C1	ZINC000091351058	180137735	/nfs/dbraw/zinc/13/77/35/180137735.db2.gz	WEAOWVLPKZKVQN-CVEARBPZSA-N	1	0	294.443	1.202	50	0		CDAARO
Cc1cc(NC[C@@H](O)c2ccc(O)cc2)nc(N)[nH+]1	ZINC000091440832	180156722	/nfs/dbraw/zinc/15/67/22/180156722.db2.gz	LAZLWBBOIFQRLC-LLVKDONJSA-N	1	0	260.297	1.218	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1F	ZINC000091496839	180172600	/nfs/dbraw/zinc/17/26/00/180172600.db2.gz	MQBPSBGQDSAOIF-KWQFWETISA-N	1	0	290.335	1.384	50	0		CDAARO
COc1ccccc1CN(C(=O)C1C[NH2+]C1)C1CC1	ZINC000091411341	180149081	/nfs/dbraw/zinc/14/90/81/180149081.db2.gz	XWTHYZZIJXLLJZ-UHFFFAOYSA-N	1	0	260.337	1.406	50	0		CDAARO
CC[C@@H]1CN(C(=O)CCCn2ccnc2)CC[N@@H+]1C(C)C	ZINC000091536102	180182152	/nfs/dbraw/zinc/18/21/52/180182152.db2.gz	KSDWFVIKRKIUCC-OAHLLOKOSA-N	1	0	292.427	1.995	50	0		CDAARO
Cc1ccccc1OCCN(C)C(=O)[C@@H]1CC[C@H]([NH3+])C1	ZINC000091544112	180185067	/nfs/dbraw/zinc/18/50/67/180185067.db2.gz	GAWVMXAIRMSFQS-KGLIPLIRSA-N	1	0	276.380	1.960	50	0		CDAARO
CCC[C@H]1CN(C(=O)Cc2ccc(O)c(F)c2)C[C@@H]1[NH3+]	ZINC000091548243	180188461	/nfs/dbraw/zinc/18/84/61/180188461.db2.gz	BXGSPOPYDSXURS-AAEUAGOBSA-N	1	0	280.343	1.660	50	0		CDAARO
COCC[C@@]1(CO)CCC[N@H+](Cc2cnc(C)cn2)C1	ZINC000091551867	180189332	/nfs/dbraw/zinc/18/93/32/180189332.db2.gz	FMHQRHIBEWRKQB-HNNXBMFYSA-N	1	0	279.384	1.396	50	0		CDAARO
COCC[C@]1(CO)CCC[N@H+](Cc2cnc(C)cn2)C1	ZINC000091551869	180189432	/nfs/dbraw/zinc/18/94/32/180189432.db2.gz	FMHQRHIBEWRKQB-OAHLLOKOSA-N	1	0	279.384	1.396	50	0		CDAARO
Cc1c2cc(C)cc(C)c2[nH]c1C(=O)N[C@@H]1C[NH2+]C[C@H]1O	ZINC000091643567	180214225	/nfs/dbraw/zinc/21/42/25/180214225.db2.gz	RPAOAGODXZXMMN-CHWSQXEVSA-N	1	0	287.363	1.156	50	0		CDAARO
CCn1ncc(Cl)c1C(=O)N1C[C@H]([NH3+])[C@@H](C2CC2)C1	ZINC000091679548	180226038	/nfs/dbraw/zinc/22/60/38/180226038.db2.gz	LWWDBTSLVDWLAQ-KOLCDFICSA-N	1	0	282.775	1.366	50	0		CDAARO
CC(=O)N1C[C@H]2CC[C@H](C[N@H+]2Cc2cccnc2N)C1	ZINC000091691674	180227604	/nfs/dbraw/zinc/22/76/04/180227604.db2.gz	LKIMUMYFSJAOEH-GXTWGEPZSA-N	1	0	274.368	1.107	50	0		CDAARO
COc1ccccc1C[NH2+]C[C@@H]1CN(C)CCO1	ZINC000105472236	186058601	/nfs/dbraw/zinc/05/86/01/186058601.db2.gz	IJVGNPHYJQRQHZ-CYBMUJFWSA-N	1	0	250.342	1.115	50	0		CDAARO
OCCO[C@H]1C[C@@H](O)C12CC[NH+](Cc1ccoc1)CC2	ZINC000091746357	180245216	/nfs/dbraw/zinc/24/52/16/180245216.db2.gz	AGGNUDVXVJOLQQ-KGLIPLIRSA-N	1	0	281.352	1.004	50	0		CDAARO
Cc1cc(NCc2cc(C(C)(C)C)n[nH]2)nc(N)[nH+]1	ZINC000091906516	180283913	/nfs/dbraw/zinc/28/39/13/180283913.db2.gz	OIZAYTAZGWLSLL-UHFFFAOYSA-N	1	0	260.345	2.000	50	0		CDAARO
COc1nccnc1N1C[C@H]2CC[C@H](C[N@H+]2CC2CC2)C1	ZINC000092080888	180319562	/nfs/dbraw/zinc/31/95/62/180319562.db2.gz	URTDPSRUEBGWCW-ZIAGYGMSSA-N	1	0	288.395	1.796	50	0		CDAARO
COc1ncccc1NC(=O)NC[C@@H]1CCC[N@H+](C)C1	ZINC000108433642	186216451	/nfs/dbraw/zinc/21/64/51/186216451.db2.gz	RQJZEPVHPPFUGF-NSHDSACASA-N	1	0	278.356	1.554	50	0		CDAARO
COCC[C@H](C)NC(=O)N1CC[C@H](C[NH+](C)C)C1	ZINC000129815089	187455030	/nfs/dbraw/zinc/45/50/30/187455030.db2.gz	VGCJGTBMYWVQOJ-NWDGAFQWSA-N	1	0	257.378	1.005	50	0		CDAARO
CC[C@H](C)CS(=O)(=O)NC[C@@H]([NH3+])c1ccccc1	ZINC000123795420	351287015	/nfs/dbraw/zinc/28/70/15/351287015.db2.gz	RHFAFYFXLURTRJ-WCQYABFASA-N	1	0	270.398	1.652	50	0		CDAARO
[NH3+]C[C@@H]1CCCN1C(=O)Cc1cccc(Br)c1	ZINC000122319854	187026454	/nfs/dbraw/zinc/02/64/54/187026454.db2.gz	JTNZLDIMEZWCGT-LBPRGKRZSA-N	1	0	297.196	1.941	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)Cc1ccc(OC)cc1	ZINC000122581840	187039644	/nfs/dbraw/zinc/03/96/44/187039644.db2.gz	YVPPODHABXREGU-CYBMUJFWSA-N	1	0	262.353	1.448	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CC[C@H]([NH3+])C2)cc1Cl	ZINC000123589836	187099982	/nfs/dbraw/zinc/09/99/82/187099982.db2.gz	XPJMSNHMYNFETG-VIFPVBQESA-N	1	0	274.773	1.370	50	0		CDAARO
COC(=O)N1CC([NH2+]Cc2c(C)nn(C(C)(C)C)c2C)C1	ZINC000195546059	363454110	/nfs/dbraw/zinc/45/41/10/363454110.db2.gz	SGPDBTDFKXROAN-UHFFFAOYSA-N	1	0	294.399	1.795	50	0		CDAARO
COc1ccc(C(=O)N2CC[NH+](C(C)C)CC2)cc1	ZINC000000300481	355902247	/nfs/dbraw/zinc/90/22/47/355902247.db2.gz	KQFRGWRZZZSFEP-UHFFFAOYSA-N	1	0	262.353	1.861	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]1)N1CCN(c2cccc(Cl)c2)CC1	ZINC000000390540	355908920	/nfs/dbraw/zinc/90/89/20/355908920.db2.gz	BBOVDLDPCZRHEZ-AWEZNQCLSA-N	1	0	293.798	1.741	50	0		CDAARO
Cc1ccc(OCCOCC[NH2+]CCO)cc1C	ZINC000002981028	355989952	/nfs/dbraw/zinc/98/99/52/355989952.db2.gz	MBOYTJMCERVLJO-UHFFFAOYSA-N	1	0	253.342	1.281	50	0		CDAARO
Cc1cccc(NC(=O)C(=O)NC[C@H](C)C[NH+](C)C)c1	ZINC000002252454	355965803	/nfs/dbraw/zinc/96/58/03/355965803.db2.gz	WCRAYGZWBUYZLW-LBPRGKRZSA-N	1	0	277.368	1.247	50	0		CDAARO
OC[C@H](Cc1ccccc1)[NH2+]C[C@@H](O)C(F)(F)F	ZINC000004092333	356017934	/nfs/dbraw/zinc/01/79/34/356017934.db2.gz	SJSOKMKUAWKDDB-WDEREUQCSA-N	1	0	263.259	1.103	50	0		CDAARO
C[C@H](CCc1cccc(F)c1)[N@@H+]1CCNC(=O)CC1	ZINC000097370750	356089083	/nfs/dbraw/zinc/08/90/83/356089083.db2.gz	XBYATSKDWOOZOT-GFCCVEGCSA-N	1	0	264.344	1.969	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)Cc2ccc(OC)cc2Cl)C1	ZINC000299738694	356263952	/nfs/dbraw/zinc/26/39/52/356263952.db2.gz	FIPJXIMJENRQLY-LLVKDONJSA-N	1	0	296.798	1.959	50	0		CDAARO
CCN1CCC[C@H]1C[NH2+]C[C@@H](O)COc1cccc(C)c1	ZINC000022918996	356268849	/nfs/dbraw/zinc/26/88/49/356268849.db2.gz	IMTNEWYWNBRNEN-JKSUJKDBSA-N	1	0	292.423	1.809	50	0		CDAARO
COC(=O)C1(C[NH3+])CCN(C(=O)OC(C)(C)C)CC1	ZINC000012650244	356316215	/nfs/dbraw/zinc/31/62/15/356316215.db2.gz	HZHZQEZZXBLFHO-UHFFFAOYSA-N	1	0	272.345	1.135	50	0		CDAARO
C[C@@H]1C[NH+](CCCNC(=O)c2cccs2)C[C@@H](C)O1	ZINC000032826832	356383051	/nfs/dbraw/zinc/38/30/51/356383051.db2.gz	SBRVKAJGGMVBPE-VXGBXAGGSA-N	1	0	282.409	1.977	50	0		CDAARO
COc1ccc(CN2CCC[N@H+](C)CC2)c(OC)c1	ZINC000019536116	356490549	/nfs/dbraw/zinc/49/05/49/356490549.db2.gz	XVRHKHGKCZWMNN-UHFFFAOYSA-N	1	0	264.369	1.841	50	0		CDAARO
CN(C(=O)c1ccc2c(c1)OCCO2)C1CC[NH+](C)CC1	ZINC000019221518	356477008	/nfs/dbraw/zinc/47/70/08/356477008.db2.gz	PWDAZWMXRZCWCF-UHFFFAOYSA-N	1	0	290.363	1.624	50	0		CDAARO
C[NH+]1CCN(Cc2c[nH]nc2-c2ccccc2)CC1	ZINC000019590075	356493326	/nfs/dbraw/zinc/49/33/26/356493326.db2.gz	JFPAELUWAINHLQ-UHFFFAOYSA-N	1	0	256.353	1.824	50	0		CDAARO
CCCCOc1ccc(CN2CC[NH+](CCO)CC2)cc1	ZINC000019633502	356494328	/nfs/dbraw/zinc/49/43/28/356494328.db2.gz	AQVNCDSEGURSFW-UHFFFAOYSA-N	1	0	292.423	1.975	50	0		CDAARO
COCCC[NH2+]Cc1ccc(OCCOC)cc1	ZINC000019738584	356498976	/nfs/dbraw/zinc/49/89/76/356498976.db2.gz	FDPVZEQUWBIPNB-UHFFFAOYSA-N	1	0	253.342	1.838	50	0		CDAARO
Cc1ccnc(N2CCC(Cn3cc(CO)nn3)CC2)c1	ZINC000020775762	356552658	/nfs/dbraw/zinc/55/26/58/356552658.db2.gz	XWKVHAYHFSJLIX-UHFFFAOYSA-N	1	0	287.367	1.390	50	0		CDAARO
CC(C)CC[N@@H+]1CCN(Cc2cnn(C)c2)C[C@@H]1CCO	ZINC000023360080	356641652	/nfs/dbraw/zinc/64/16/52/356641652.db2.gz	QAWZNOZXRDDSAH-INIZCTEOSA-N	1	0	294.443	1.335	50	0		CDAARO
CCO[C@@H]1C[C@H]([N@H+](C)CC(=O)NC[C@H]2CCCO2)C1(C)C	ZINC000247312223	357430855	/nfs/dbraw/zinc/43/08/55/357430855.db2.gz	WBPCDOZWOBPXHX-HZSPNIEDSA-N	1	0	298.427	1.417	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H]([NH+](C)C)CN1C/C=C/c1ccco1	ZINC000065383930	357534316	/nfs/dbraw/zinc/53/43/16/357534316.db2.gz	MATWKYLTCKJNHG-HRLNJXSSSA-N	1	0	278.352	1.470	50	0		CDAARO
CCOCC[N@H+]1CC=C(Cn2nccc2NC(C)=O)CC1	ZINC000065384325	357534401	/nfs/dbraw/zinc/53/44/01/357534401.db2.gz	QNVMJQQYHKGBTH-UHFFFAOYSA-N	1	0	292.383	1.510	50	0		CDAARO
O=C1CC2(CN1)CC[NH+](CCc1ccccc1)CC2	ZINC000065405930	357539236	/nfs/dbraw/zinc/53/92/36/357539236.db2.gz	JGPGSIJRVFHSDT-UHFFFAOYSA-N	1	0	258.365	1.831	50	0		CDAARO
C[N@@H+]1CC[C@H](CNC(=O)COCc2ccccc2)C1	ZINC000066652971	357576419	/nfs/dbraw/zinc/57/64/19/357576419.db2.gz	SNACYYKNAXUOEJ-CQSZACIVSA-N	1	0	262.353	1.271	50	0		CDAARO
C[C@H]1CCCN(C(=O)CC[NH2+]CCSc2c[nH]nn2)C1	ZINC000065452851	357542629	/nfs/dbraw/zinc/54/26/29/357542629.db2.gz	UOQRBCBZNVJGKJ-NSHDSACASA-N	1	0	297.428	1.135	50	0		CDAARO
CCc1nccn1CC(=O)N1CCC[C@]2(CC[NH2+]C2)C1	ZINC000067784795	357627387	/nfs/dbraw/zinc/62/73/87/357627387.db2.gz	VWCSGZFORBMPIH-OAHLLOKOSA-N	1	0	276.384	1.048	50	0		CDAARO
C[C@@H]1CN(C(=O)c2c[nH]nc2-c2ccccc2F)CC[NH2+]1	ZINC000188442661	357685217	/nfs/dbraw/zinc/68/52/17/357685217.db2.gz	WOALNTNIYSDTGB-SNVBAGLBSA-N	1	0	288.326	1.650	50	0		CDAARO
COC(=O)Cn1cc(C[NH2+][C@@H]2CCC[C@H](C)[C@H]2C)nn1	ZINC000097080742	357945025	/nfs/dbraw/zinc/94/50/25/357945025.db2.gz	ZLVQHAVNPPONMD-DMDPSCGWSA-N	1	0	280.372	1.365	50	0		CDAARO
COC(C)(C)C[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1C(N)=O	ZINC000097095716	357953562	/nfs/dbraw/zinc/95/35/62/357953562.db2.gz	YQECQZLYZUSYRN-SDDRHHMPSA-N	1	0	256.390	1.824	50	0		CDAARO
CC[N@H+](Cc1cccc(C(=O)NC)c1)C(C)(C)CO	ZINC000097096291	357953587	/nfs/dbraw/zinc/95/35/87/357953587.db2.gz	PNCKLPUBUBLUIK-UHFFFAOYSA-N	1	0	264.369	1.639	50	0		CDAARO
CNC(=O)c1cccnc1NC[C@H](C)C[NH+]1CCCC1	ZINC000097104567	357968157	/nfs/dbraw/zinc/96/81/57/357968157.db2.gz	HGCHFINSLAMEKS-LBPRGKRZSA-N	1	0	276.384	1.585	50	0		CDAARO
Cc1cc(NC(=O)C[NH2+][C@H]2CC(C)(C)OC2(C)C)n(C)n1	ZINC000097100299	357971500	/nfs/dbraw/zinc/97/15/00/357971500.db2.gz	TXUOIJRXFXCDFU-NSHDSACASA-N	1	0	294.399	1.603	50	0		CDAARO
C[C@@H](NCc1nncn1C)[C@@H]1CCC[N@@H+](C2CCC2)C1	ZINC000097110951	357986842	/nfs/dbraw/zinc/98/68/42/357986842.db2.gz	VUZZMUCDIAPGBP-CHWSQXEVSA-N	1	0	277.416	1.558	50	0		CDAARO
COCC[NH+]1[C@@H](C)CN(c2cncc(SC)n2)C[C@@H]1C	ZINC000097162962	358004534	/nfs/dbraw/zinc/00/45/34/358004534.db2.gz	BJJCZQXECRHJDN-RYUDHWBXSA-N	1	0	296.440	1.744	50	0		CDAARO
COC(=O)C(=C/C=C/[NH+]1CCCCC1)C(=O)OC	ZINC000019338301	358056765	/nfs/dbraw/zinc/05/67/65/358056765.db2.gz	KXBXGTUZPSFMEP-UXBLZVDNSA-N	1	0	253.298	1.258	50	0		CDAARO
C[C@@H]1C[C@@H](Nc2ccnn2C[C@@H]2CCOC2)C[N@@H+]1C1CC1	ZINC000097045671	358109311	/nfs/dbraw/zinc/10/93/11/358109311.db2.gz	FPLPJJACKCPSGZ-HZSPNIEDSA-N	1	0	290.411	1.957	50	0		CDAARO
O=c1cc([C@H]2CCC[NH2+]C2)nc(-c2ccc3c(c2)OCO3)[nH]1	ZINC000023153438	358093218	/nfs/dbraw/zinc/09/32/18/358093218.db2.gz	QJZYOOPDKVBQQE-NSHDSACASA-N	1	0	299.330	1.633	50	0		CDAARO
COC[C@H]([NH2+]CC(=O)N1CCc2ccccc2C1)C1CC1	ZINC000097049012	358116125	/nfs/dbraw/zinc/11/61/25/358116125.db2.gz	HZYJHHOYVFRUHG-INIZCTEOSA-N	1	0	288.391	1.586	50	0		CDAARO
O=C(Nc1nc2c(s1)C[NH2+]CC2)c1ccccn1	ZINC000036233128	295971644	/nfs/dbraw/zinc/97/16/44/295971644.db2.gz	PTZQQTVITLOZFO-UHFFFAOYSA-N	1	0	260.322	1.436	50	0		CDAARO
Cc1cc(CN2CC[NH+](C3CCSCC3)CC2)on1	ZINC000092894003	358573178	/nfs/dbraw/zinc/57/31/78/358573178.db2.gz	FRGRSYBUPKPMRC-UHFFFAOYSA-N	1	0	281.425	1.996	50	0		CDAARO
CCc1n[nH]c(=O)c(C[NH2+][C@H]2CCSC2)c1CC	ZINC000194662216	358528200	/nfs/dbraw/zinc/52/82/00/358528200.db2.gz	AMFBPJNCMAUYCK-VIFPVBQESA-N	1	0	267.398	1.490	50	0		CDAARO
Cc1noc(C(=O)NCCC[NH2+]Cc2ccccc2)n1	ZINC000095115796	358679405	/nfs/dbraw/zinc/67/94/05/358679405.db2.gz	CYVUFJUFNBFCLM-UHFFFAOYSA-N	1	0	274.324	1.288	50	0		CDAARO
C[NH2+]CCCNC(=O)[C@@H](c1ccccc1F)N(C)C	ZINC000095356003	358683996	/nfs/dbraw/zinc/68/39/96/358683996.db2.gz	BJGRQKPLQWTFLN-CYBMUJFWSA-N	1	0	267.348	1.154	50	0		CDAARO
CCc1nnc(CNC(=O)CC[C@H]2CCC[N@H+](C)C2)s1	ZINC000095356924	358684032	/nfs/dbraw/zinc/68/40/32/358684032.db2.gz	GPEXQXKAGXNNRR-LLVKDONJSA-N	1	0	296.440	1.839	50	0		CDAARO
CCC[C@H]1CN(S(=O)(=O)c2ccccc2)C[C@@H]1[NH3+]	ZINC000095361272	358685789	/nfs/dbraw/zinc/68/57/89/358685789.db2.gz	UFHUUBKSUUESOY-AAEUAGOBSA-N	1	0	268.382	1.435	50	0		CDAARO
COCc1cc(NC[C@@H](c2ccco2)[NH+](C)C)ncn1	ZINC000095365819	358686948	/nfs/dbraw/zinc/68/69/48/358686948.db2.gz	VGPCBGAYIBDVJW-LBPRGKRZSA-N	1	0	276.340	1.931	50	0		CDAARO
CCOCCC[N@@H+]1CCC[C@H](c2nnc3n2CCC3)C1	ZINC000120360335	358797055	/nfs/dbraw/zinc/79/70/55/358797055.db2.gz	PQPJAPNGWKOWFU-ZDUSSCGKSA-N	1	0	278.400	1.830	50	0		CDAARO
CCn1nc(C)c(C[N@@H+]2CCC[C@@H]2CCO)c1C	ZINC000097772851	358797620	/nfs/dbraw/zinc/79/76/20/358797620.db2.gz	MRWLWLQEVQBVPZ-CYBMUJFWSA-N	1	0	251.374	1.867	50	0		CDAARO
OC[C@@]1(O)CC[N@H+](Cc2cccc(OC3CCCC3)c2)C1	ZINC000215946337	358911501	/nfs/dbraw/zinc/91/15/01/358911501.db2.gz	ZQQTUPUJGFXMLN-QGZVFWFLSA-N	1	0	291.391	1.937	50	0		CDAARO
Cc1cc(=O)cc(C(=O)N2CC[C@H]([NH+]3CCCCC3)C2)o1	ZINC000215748771	358900953	/nfs/dbraw/zinc/90/09/53/358900953.db2.gz	LSLJIUFHMLMMLT-ZDUSSCGKSA-N	1	0	290.363	1.649	50	0		CDAARO
Cc1c(F)cccc1C[N@H+]1CC[C@@H](N2CCN(C)CC2)C1	ZINC000216300896	358935941	/nfs/dbraw/zinc/93/59/41/358935941.db2.gz	QQZKCZQPBNIAGY-MRXNPFEDSA-N	1	0	291.414	1.956	50	0		CDAARO
CC(C)(C)c1cc(CN2CCc3n[nH]cc3C2)[nH]n1	ZINC000216407260	358944164	/nfs/dbraw/zinc/94/41/64/358944164.db2.gz	YIFNHBFFLUXPDG-UHFFFAOYSA-N	1	0	259.357	1.989	50	0		CDAARO
CNC(=O)C1CC[NH+](CC(=O)N(C(C)C)C(C)C)CC1	ZINC000012333820	359011233	/nfs/dbraw/zinc/01/12/33/359011233.db2.gz	OTIAYEJYWWIAHC-UHFFFAOYSA-N	1	0	283.416	1.090	50	0		CDAARO
C[NH+](C)CCn1ccc(NC(=O)c2cccnc2)n1	ZINC000120059390	359077866	/nfs/dbraw/zinc/07/78/66/359077866.db2.gz	KZCIAHYRYHIZQU-UHFFFAOYSA-N	1	0	259.313	1.092	50	0		CDAARO
CN1Cc2cccn2C[C@H]1CNC(=O)NC1CCCC1	ZINC000257177798	359134841	/nfs/dbraw/zinc/13/48/41/359134841.db2.gz	FHMQPZJITPWYSV-CQSZACIVSA-N	1	0	276.384	1.544	50	0		CDAARO
Nc1ccc(NC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3[NH2+]2)cn1	ZINC000262450058	359170651	/nfs/dbraw/zinc/17/06/51/359170651.db2.gz	RDCZMMMSVGSZQK-WCQGTBRESA-N	1	0	260.341	1.523	50	0		CDAARO
CC[N@@H+]1CC2(C[C@@H]1c1nnc(C)o1)CCN(C(C)=O)CC2	ZINC000257188621	359532259	/nfs/dbraw/zinc/53/22/59/359532259.db2.gz	FWMJTUCAAVVARH-CYBMUJFWSA-N	1	0	292.383	1.773	50	0		CDAARO
Cc1cc(C)n2nc(Cc3nc(C4([NH3+])CCC4)no3)nc2n1	ZINC000261906302	359582661	/nfs/dbraw/zinc/58/26/61/359582661.db2.gz	ZEBNJWBBTFNNMF-UHFFFAOYSA-N	1	0	299.338	1.053	50	0		CDAARO
CC[NH+]1CCC2(C[C@H](c3nnc(C)o3)N(C(C)=O)C2)CC1	ZINC000257193735	359605359	/nfs/dbraw/zinc/60/53/59/359605359.db2.gz	ZKHRLNUOTRCGDB-CYBMUJFWSA-N	1	0	292.383	1.773	50	0		CDAARO
CN(CC(N)=O)Cc1ccccc1OC(F)(F)F	ZINC000012782166	359672245	/nfs/dbraw/zinc/67/22/45/359672245.db2.gz	ZULGNBVQAGPGCB-UHFFFAOYSA-N	1	0	262.231	1.502	50	0		CDAARO
CCC(=O)N1CCC[C@@H]1[C@@H]1CCCN1[C@H]1C[C@@H](C)OC1=O	ZINC000257365297	359943720	/nfs/dbraw/zinc/94/37/20/359943720.db2.gz	FUKDQXQUNIJGPV-RQJABVFESA-N	1	0	294.395	1.556	50	0		CDAARO
Cn1nccc1[C@@H]1CCC[N@H+](CCOC[C@H]2CCCO2)C1	ZINC000257365604	359946660	/nfs/dbraw/zinc/94/66/60/359946660.db2.gz	XGJAVXYGOXDYAZ-HUUCEWRRSA-N	1	0	293.411	1.795	50	0		CDAARO
CC(C)[C@H]1OCCC[C@@H]1CNC1=[NH+]CCCCN1	ZINC000521396962	359970423	/nfs/dbraw/zinc/97/04/23/359970423.db2.gz	WVUSBDGPCVXKRL-CHWSQXEVSA-N	1	0	253.390	1.767	50	0		CDAARO
Cc1n[nH]cc1CCCNC(=O)[C@@H]1CCC[NH2+][C@@H]1C	ZINC000289770081	363717848	/nfs/dbraw/zinc/71/78/48/363717848.db2.gz	IODIJLYYWVUYRL-DGCLKSJQSA-N	1	0	264.373	1.155	50	0		CDAARO
c1ncn(C[C@@H]2CCC[N@@H+]2C[C@H]2CCCCO2)n1	ZINC000248126219	360385453	/nfs/dbraw/zinc/38/54/53/360385453.db2.gz	WZRQXOUFTGEWQR-QWHCGFSZSA-N	1	0	250.346	1.312	50	0		CDAARO
Cc1ccc(C[N@@H+]2CC[C@@H](O)[C@@H](CO)C2)cc1Cl	ZINC000335631571	360609172	/nfs/dbraw/zinc/60/91/72/360609172.db2.gz	CCUHCNHJABQPQG-TZMCWYRMSA-N	1	0	269.772	1.824	50	0		CDAARO
[NH3+]CCc1nnc(SCCCO)n1-c1ccc(F)cc1	ZINC000426510633	360678149	/nfs/dbraw/zinc/67/81/49/360678149.db2.gz	NFPCNKATMHLWQM-UHFFFAOYSA-N	1	0	296.371	1.382	50	0		CDAARO
[NH3+]CCOc1cccc(CC(=O)NCC(F)(F)F)c1	ZINC000426595059	360688136	/nfs/dbraw/zinc/68/81/36/360688136.db2.gz	RGOLBTWMORJODI-UHFFFAOYSA-N	1	0	276.258	1.245	50	0		CDAARO
COc1cc(C(=O)N2CC=C(C)CC2)ccc1OCC[NH3+]	ZINC000426399452	360665291	/nfs/dbraw/zinc/66/52/91/360665291.db2.gz	SPQXICZLQZPMBQ-UHFFFAOYSA-N	1	0	290.363	1.825	50	0		CDAARO
Cc1cc(C(=O)N2CC[C@H](C[NH3+])C2)nn1-c1ccccc1	ZINC000178549834	189126174	/nfs/dbraw/zinc/12/61/74/189126174.db2.gz	ZTYBITPGYUGUQC-CYBMUJFWSA-N	1	0	284.363	1.602	50	0		CDAARO
Cc1nc(CSc2nnc(CC[NH3+])n2C)c(C)s1	ZINC000426711543	360698779	/nfs/dbraw/zinc/69/87/79/360698779.db2.gz	ZWKLAMRCBXDMOY-UHFFFAOYSA-N	1	0	283.426	1.682	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2ccc(-n3cccn3)cc2)C1	ZINC000178980460	189158780	/nfs/dbraw/zinc/15/87/80/189158780.db2.gz	FLBRRZCOFKONDJ-CYBMUJFWSA-N	1	0	284.363	1.554	50	0		CDAARO
COc1ccc(CCC(=O)N(C)[C@@H]2CC[NH2+]C2)cc1F	ZINC000179057215	189165855	/nfs/dbraw/zinc/16/58/55/189165855.db2.gz	ARRBXYIEUGDLKZ-GFCCVEGCSA-N	1	0	280.343	1.587	50	0		CDAARO
CN(C(=O)c1cc(C(C)(C)C)nn1C)[C@H]1CC[NH2+]C1	ZINC000179108420	189169838	/nfs/dbraw/zinc/16/98/38/189169838.db2.gz	LLUHGLJFIVKYAA-JTQLQIEISA-N	1	0	264.373	1.152	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@H](Cn2cnc3ncccc3c2=O)C1	ZINC000032516104	360969909	/nfs/dbraw/zinc/96/99/09/360969909.db2.gz	HWHLHFYNBPYACZ-ZDUSSCGKSA-N	1	0	286.379	1.912	50	0		CDAARO
O=C(C[C@@H]1CCOC1)NC1CC[NH+](Cc2ccco2)CC1	ZINC000426537704	360999290	/nfs/dbraw/zinc/99/92/90/360999290.db2.gz	NPWKMSUZIXFUQV-ZDUSSCGKSA-N	1	0	292.379	1.787	50	0		CDAARO
[NH3+][C@H]1CC(=O)N(Cc2ccccc2C(F)(F)F)C1	ZINC000061627439	283620560	/nfs/dbraw/zinc/62/05/60/283620560.db2.gz	XZJLAMVKYUITNU-VIFPVBQESA-N	1	0	258.243	1.765	50	0		CDAARO
Cc1ccc(C(=O)NCCF)cc1OCCC[NH3+]	ZINC000299796819	200877692	/nfs/dbraw/zinc/87/76/92/200877692.db2.gz	PVPFTODWXYGPFN-UHFFFAOYSA-N	1	0	254.305	1.422	50	0		CDAARO
Cc1cc(Cl)ccc1S(=O)(=O)NC1CC[NH2+]CC1	ZINC000036286111	361425221	/nfs/dbraw/zinc/42/52/21/361425221.db2.gz	XJPUEQJOHCMCRZ-UHFFFAOYSA-N	1	0	288.800	1.679	50	0		CDAARO
O=C(C[C@@H]1CC[NH2+]C1)NCCCn1cc(Cl)cn1	ZINC000299792544	361602375	/nfs/dbraw/zinc/60/23/75/361602375.db2.gz	FRMDYHFKGMBQQW-JTQLQIEISA-N	1	0	270.764	1.042	50	0		CDAARO
C[C@H]([NH2+]C[C@]1(O)CCOC1)c1ccc(Br)o1	ZINC000193050114	364166114	/nfs/dbraw/zinc/16/61/14/364166114.db2.gz	HWZLLKWHWZIIAF-GZMMTYOYSA-N	1	0	290.157	1.844	50	0		CDAARO
CC[N@H+](C)C[C@@H]1CCN(C(=O)N[C@H](C)c2cn[nH]c2)C1	ZINC000270377592	364571566	/nfs/dbraw/zinc/57/15/66/364571566.db2.gz	VDQXQGUMPCRGIG-NEPJUHHUSA-N	1	0	279.388	1.454	50	0		CDAARO
CCCN1CCN(CCN2CCOC[C@H]2C)C(C)(C)C1=O	ZINC000249528344	364813129	/nfs/dbraw/zinc/81/31/29/364813129.db2.gz	JFBNTGQIWKRHIW-CQSZACIVSA-N	1	0	297.443	1.040	50	0		CDAARO
c1ccc(CN2CCO[C@H]3C[N@@H+](CC4CC4)C[C@@H]32)cc1	ZINC000089835002	366942528	/nfs/dbraw/zinc/94/25/28/366942528.db2.gz	TZNJOKPYGZMSLG-IRXDYDNUSA-N	1	0	272.392	1.982	50	0		CDAARO
COC(=O)Cc1ccccc1C[N@H+](C)Cc1cnn(C)c1	ZINC000089755720	366926837	/nfs/dbraw/zinc/92/68/37/366926837.db2.gz	ZYQGXJALJDYLMU-UHFFFAOYSA-N	1	0	287.363	1.768	50	0		CDAARO
CC[C@H](O)C[NH+]1CCN(Cc2noc(CC(C)C)n2)CC1	ZINC000089943371	366975762	/nfs/dbraw/zinc/97/57/62/366975762.db2.gz	DZQRVGIADOOMEL-ZDUSSCGKSA-N	1	0	296.415	1.157	50	0		CDAARO
CCC(CC)NC(=O)C[N@@H+]1CCC[C@@](C)(CO)C1	ZINC000089943167	366976110	/nfs/dbraw/zinc/97/61/10/366976110.db2.gz	FOICFBOJFSSCDE-CQSZACIVSA-N	1	0	256.390	1.386	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@@H]1[NH2+]Cc1c[nH]nc1C	ZINC000089948801	366977523	/nfs/dbraw/zinc/97/75/23/366977523.db2.gz	CFWLSPBMPBTRQR-OCCSQVGLSA-N	1	0	264.373	1.455	50	0		CDAARO
CCNC(=O)NC(=O)[C@@H](C)[N@H+](C)[C@@H](C)Cc1ccsc1	ZINC000089977461	366992795	/nfs/dbraw/zinc/99/27/95/366992795.db2.gz	PVLMFJZZDGRMOY-WDEREUQCSA-N	1	0	297.424	1.845	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@@H]1NS(=O)(=O)c1ccccc1F	ZINC000094345702	367486233	/nfs/dbraw/zinc/48/62/33/367486233.db2.gz	KFFVUHRHKHUWJF-ONGXEEELSA-N	1	0	272.345	1.102	50	0		CDAARO
CCc1ccc(S(=O)(=O)N[C@@H]2CCC[C@@H]2C[NH3+])cc1	ZINC000089092062	368833610	/nfs/dbraw/zinc/83/36/10/368833610.db2.gz	MEFXCPYLYLUFTH-TZMCWYRMSA-N	1	0	282.409	1.655	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CCCC[C@@H]2C[NH3+])s1	ZINC000089107944	368997864	/nfs/dbraw/zinc/99/78/64/368997864.db2.gz	OKPKJKRHOAZBCS-GHMZBOCLSA-N	1	0	288.438	1.852	50	0		CDAARO
COc1cccc2c(C)cc(N3CC[NH2+]CC3)nc12	ZINC000040175227	369456585	/nfs/dbraw/zinc/45/65/85/369456585.db2.gz	NXYKBSZAHPSHIH-UHFFFAOYSA-N	1	0	257.337	1.961	50	0		CDAARO
FC(F)(F)CN1CC[C@@H](C[NH2+]Cc2cc[nH]n2)C1	ZINC000037648515	369521063	/nfs/dbraw/zinc/52/10/63/369521063.db2.gz	BTPHRYCSQVBPOW-VIFPVBQESA-N	1	0	262.279	1.384	50	0		CDAARO
C[C@@H]1C[NH+](C[C@@H]2CCOC2)C[C@@H](C)N1C[C@@H]1CCOC1	ZINC000253396702	373686545	/nfs/dbraw/zinc/68/65/45/373686545.db2.gz	DXKAABMWUJOQEF-WCVJEAGWSA-N	1	0	282.428	1.454	50	0		CDAARO
CC[N@@H+]1CC[C@@H]2[C@H](C1)OCCN2C(=O)Cc1ccsc1	ZINC000253416421	373725345	/nfs/dbraw/zinc/72/53/45/373725345.db2.gz	VXQYEWILSPELCL-KGLIPLIRSA-N	1	0	294.420	1.612	50	0		CDAARO
Cc1c[nH]cc1C(=O)N1CCOC[C@H]1[C@@H]1CCC[N@H+]1C	ZINC000520566401	373824697	/nfs/dbraw/zinc/82/46/97/373824697.db2.gz	XXVQAFHFSGAGHJ-KBPBESRZSA-N	1	0	277.368	1.258	50	0		CDAARO
c1ccc2c(c1)CCO[C@H]2C[NH2+]CCN1CCCC1	ZINC000019367169	373878129	/nfs/dbraw/zinc/87/81/29/373878129.db2.gz	QTKLXCLCMLIESY-INIZCTEOSA-N	1	0	260.381	1.986	50	0	biogenic	CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)C1	ZINC000247129403	189936459	/nfs/dbraw/zinc/93/64/59/189936459.db2.gz	NMCQEBHVPJQZPZ-NDMJEZRESA-N	1	0	280.318	1.876	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@@H]1CCC[C@@H]([NH3+])C1	ZINC000111668880	374198198	/nfs/dbraw/zinc/19/81/98/374198198.db2.gz	COFVBRSMGXOXRA-GHMZBOCLSA-N	1	0	267.398	1.927	50	0		CDAARO
C[C@H](O)[C@H]1CCN(C(=O)NCCC[N@@H+]2CCC[C@@H](C)C2)C1	ZINC000108468610	412828510	/nfs/dbraw/zinc/82/85/10/412828510.db2.gz	WGFUVSUSWANNRR-ILXRZTDVSA-N	1	0	297.443	1.521	50	0		CDAARO
Cc1cc(Cl)ccc1C(=O)NC[C@@]1(O)CC[NH2+]C1	ZINC000252502617	189979537	/nfs/dbraw/zinc/97/95/37/189979537.db2.gz	URQHLJWPEOUVRL-CYBMUJFWSA-N	1	0	268.744	1.103	50	0		CDAARO
CC[C@@H]([NH2+]C[C@H]1CC=CCC1)C(=O)N1CCOCC1	ZINC000095434096	374934423	/nfs/dbraw/zinc/93/44/23/374934423.db2.gz	PMHNHCZOSREWDT-UONOGXRCSA-N	1	0	266.385	1.570	50	0		CDAARO
COc1cc(C)cc(CNC(=O)CC[NH+](C)C)c1	ZINC000095434393	374936206	/nfs/dbraw/zinc/93/62/06/374936206.db2.gz	XPZMVIXCYHSBMF-UHFFFAOYSA-N	1	0	250.342	1.572	50	0		CDAARO
O=C(NCC1CC1)[C@H]1CCC[N@@H+]([C@@H]2CCOC2)C1	ZINC000095410377	374913340	/nfs/dbraw/zinc/91/33/40/374913340.db2.gz	HWBVEDWMDFFTOQ-QWHCGFSZSA-N	1	0	252.358	1.014	50	0		CDAARO
COC(=O)[C@@H]1CCCCC[C@@H]1[NH2+]Cc1nnc(C)n1C	ZINC000097099598	375147960	/nfs/dbraw/zinc/14/79/60/375147960.db2.gz	LNZDVKWXQHOOQY-NEPJUHHUSA-N	1	0	280.372	1.335	50	0		CDAARO
C[NH+](C)CC(=O)NCc1ncc(C(F)(F)F)cc1Cl	ZINC000261495012	190039880	/nfs/dbraw/zinc/03/98/80/190039880.db2.gz	IWGVEPXAKVXZPN-UHFFFAOYSA-N	1	0	295.692	1.932	50	0		CDAARO
C[N@H+](CC(=O)Nc1cccnc1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C	ZINC000241644549	376019799	/nfs/dbraw/zinc/01/97/99/376019799.db2.gz	PRQQPRIPAUFXED-NWANDNLSSA-N	1	0	289.379	1.765	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)CO[C@@H]2CCC[C@H]2C)CC1	ZINC000245228854	376025418	/nfs/dbraw/zinc/02/54/18/376025418.db2.gz	HOQJEEHSQKXMCX-QLFBSQMISA-N	1	0	270.417	1.190	50	0		CDAARO
COC(=O)[C@@H](NC(=O)C[NH+](C)C)c1cc(C)cc(C)c1	ZINC000188880371	377099223	/nfs/dbraw/zinc/09/92/23/377099223.db2.gz	QCXZBEUFHTZGGE-AWEZNQCLSA-N	1	0	278.352	1.195	50	0		CDAARO
COC1CCC(C(=O)NC[C@H]2CCC[N@H+](C)C2)CC1	ZINC000067967976	377335747	/nfs/dbraw/zinc/33/57/47/377335747.db2.gz	VMNSOKWZKRWGCD-IYXRBSQSSA-N	1	0	268.401	1.650	50	0		CDAARO
Cc1n[nH]c(C)c1CNc1cc(CC[NH3+])nc(C)n1	ZINC000067909920	377295921	/nfs/dbraw/zinc/29/59/21/377295921.db2.gz	FYTOCWCQVCKMQN-UHFFFAOYSA-N	1	0	260.345	1.238	50	0		CDAARO
O[C@H]([C@H]1CCC[N@@H+]1CCOC[C@H]1CCCO1)C(F)(F)F	ZINC000245281201	378035705	/nfs/dbraw/zinc/03/57/05/378035705.db2.gz	AEMRESOZUGYQLY-IJLUTSLNSA-N	1	0	297.317	1.570	50	0		CDAARO
O=C1CC[C@@H]([NH2+][C@@H]2CCCOc3ccc(F)cc32)CN1	ZINC000098020489	296325421	/nfs/dbraw/zinc/32/54/21/296325421.db2.gz	SAQAQIVVWOIHAD-DGCLKSJQSA-N	1	0	278.327	1.908	50	0		CDAARO
COc1ccc(/C=C\C(=O)NOC[C@@H](C)[NH3+])cc1OC	ZINC000493133996	253379466	/nfs/dbraw/zinc/37/94/66/253379466.db2.gz	UMTLKQVFCRAMIA-ONRRBMGISA-N	1	0	280.324	1.112	50	0		CDAARO
NC(=[NH2+])Nc1nc2ccc(Br)cc2c(=O)[nH]1	ZINC000001274730	390137818	/nfs/dbraw/zinc/13/78/18/390137818.db2.gz	UCKZCSWWTVQVFN-UHFFFAOYSA-N	1	0	282.101	1.403	50	0		CDAARO
Cc1noc(CN(C)C(=O)CC[C@H]2CCC[N@H+](C)C2)n1	ZINC000095361777	184953034	/nfs/dbraw/zinc/95/30/34/184953034.db2.gz	NDUXTHUBHWHLCO-GFCCVEGCSA-N	1	0	280.372	1.458	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)c1cccc(F)c1	ZINC000095431210	184981645	/nfs/dbraw/zinc/98/16/45/184981645.db2.gz	JKTUEULTZTYYFN-UHFFFAOYSA-N	1	0	274.361	1.622	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1ccc(C)cc1F	ZINC000095432151	184982924	/nfs/dbraw/zinc/98/29/24/184982924.db2.gz	WPXJKKCVXIQDEM-JTQLQIEISA-N	1	0	274.361	1.540	50	0		CDAARO
[NH3+]Cc1nnc2c(-c3nc(C4CC4)no3)cccn12	ZINC000096516537	390534348	/nfs/dbraw/zinc/53/43/48/390534348.db2.gz	RLVHGCSAUICIPO-UHFFFAOYSA-N	1	0	256.269	1.115	50	0		CDAARO
COc1ccccc1-c1ccc(N2CC[NH2+]CC2)nn1	ZINC000070458487	390606394	/nfs/dbraw/zinc/60/63/94/390606394.db2.gz	DKJLCEORAIHAMJ-UHFFFAOYSA-N	1	0	270.336	1.562	50	0		CDAARO
COc1cc(C)sc1C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178581715	390680535	/nfs/dbraw/zinc/68/05/35/390680535.db2.gz	ZRAHTGPOZPMBGT-SECBINFHSA-N	1	0	254.355	1.486	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F)[C@@H]1CC[NH2+]C1	ZINC000179074403	390940304	/nfs/dbraw/zinc/94/03/04/390940304.db2.gz	JSVRXNAALNFYKK-NQBHXWOUSA-N	1	0	280.318	1.889	50	0		CDAARO
CCCC[N@H+](C)CCNC(=O)N1CCOCC[C@@H]1C	ZINC000095984079	393155247	/nfs/dbraw/zinc/15/52/47/393155247.db2.gz	BYNNUOIBEJPVQI-ZDUSSCGKSA-N	1	0	271.405	1.539	50	0		CDAARO
OCCC[C@H]1CCC[N@@H+]1CCOC[C@@H]1CCCO1	ZINC000096421777	393185267	/nfs/dbraw/zinc/18/52/67/393185267.db2.gz	NCIBJVVAJGTZMR-KGLIPLIRSA-N	1	0	257.374	1.419	50	0		CDAARO
CC(=O)N1CC[C@@]([NH3+])(C(=O)Nc2cnc3ccccc3c2)C1	ZINC000649284470	393318460	/nfs/dbraw/zinc/31/84/60/393318460.db2.gz	AIUDWVMOQPLNJP-INIZCTEOSA-N	1	0	298.346	1.123	50	0		CDAARO
Cc1cc(C[NH+]2CCN(c3ccccn3)CC2)c(=O)[nH]c1C	ZINC000023398236	134743186	/nfs/dbraw/zinc/74/31/86/134743186.db2.gz	KOJHSDNUTGHNEN-UHFFFAOYSA-N	1	0	298.390	1.709	50	0		CDAARO
NC(=O)c1cccc(CN2CCN(c3cc[nH+]cc3)CC2)c1	ZINC000089774453	135060831	/nfs/dbraw/zinc/06/08/31/135060831.db2.gz	JSMXSFLUGHOXHA-UHFFFAOYSA-N	1	0	296.374	1.503	50	0		CDAARO
COC(C)(C)C[C@H](C)[NH2+]C1CCN(S(C)(=O)=O)CC1	ZINC000036828121	292075849	/nfs/dbraw/zinc/07/58/49/292075849.db2.gz	ZWBUJBAQOGMWAM-NSHDSACASA-N	1	0	292.445	1.204	50	0		CDAARO
COc1ccccc1/C=C\C[NH2+][C@@H]1CCc2ncnn2C1	ZINC000104060967	397930204	/nfs/dbraw/zinc/93/02/04/397930204.db2.gz	NWUXIXQAYDIMRC-KXQLTZBTSA-N	1	0	284.363	1.905	50	0		CDAARO
CC[C@@H](C)[NH2+]C[C@H](O)COc1cccc(OC)c1	ZINC000002451790	169792710	/nfs/dbraw/zinc/79/27/10/169792710.db2.gz	DKKSGKTWOPLXOM-NEPJUHHUSA-N	1	0	253.342	1.823	50	0		CDAARO
COc1ccc(N2C(=O)C[C@@H]([NH2+]C3CC3)C2=O)cc1	ZINC000005043797	170059617	/nfs/dbraw/zinc/05/96/17/170059617.db2.gz	DBEPSKCIPJVWBE-GFCCVEGCSA-N	1	0	260.293	1.079	50	0		CDAARO
Cc1cc(C)[n+](-c2ccc(S(N)(=O)=O)cc2)c(C)c1	ZINC000005378634	170091760	/nfs/dbraw/zinc/09/17/60/170091760.db2.gz	SXIUNUKMSHZRRJ-UHFFFAOYSA-N	1	0	277.369	1.536	50	0		CDAARO
C[C@H]1CN(CCOc2cccc(C=O)c2)C[C@H](C)O1	ZINC000020653369	171268831	/nfs/dbraw/zinc/26/88/31/171268831.db2.gz	QFOPVDKLMMOVFU-STQMWFEESA-N	1	0	263.337	1.987	50	0		CDAARO
NC(=O)NC(=O)CCC[N@@H+]1CCC=C(c2ccccc2)C1	ZINC000284745156	196122805	/nfs/dbraw/zinc/12/28/05/196122805.db2.gz	LENZPODWHNVBLX-UHFFFAOYSA-N	1	0	287.363	1.751	50	0		CDAARO
CC(C)Nc1nc(NCC[NH+](C)C)nc2c1cnn2C	ZINC000021929694	171337710	/nfs/dbraw/zinc/33/77/10/171337710.db2.gz	ZCGXVMBZHSLURA-UHFFFAOYSA-N	1	0	277.376	1.157	50	0		CDAARO
CCc1cc(OCCOCCNCC[NH3+])ccc1Cl	ZINC000022079121	171352445	/nfs/dbraw/zinc/35/24/45/171352445.db2.gz	QXMXFKOIUYILFX-UHFFFAOYSA-N	1	0	286.803	1.846	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(C)(N2CC[NH2+]CC2)CC1	ZINC000023471844	171422534	/nfs/dbraw/zinc/42/25/34/171422534.db2.gz	QVPYGRQWAZUZHX-UHFFFAOYSA-N	1	0	283.416	1.681	50	0		CDAARO
CNC(=O)CN1CCC([NH2+]Cc2ccc(C)cc2C)CC1	ZINC000030905526	171626610	/nfs/dbraw/zinc/62/66/10/171626610.db2.gz	MGNAJBRISUVTPK-UHFFFAOYSA-N	1	0	289.423	1.603	50	0		CDAARO
Cc1ccc(C(=O)NC2CC[NH+](C(C)C)CC2)n1C	ZINC000032842931	171755213	/nfs/dbraw/zinc/75/52/13/171755213.db2.gz	LUPFSLGPGMJKDQ-UHFFFAOYSA-N	1	0	263.385	1.936	50	0		CDAARO
COc1ccccc1S(=O)(=O)N1CCC(C[NH3+])CC1	ZINC000036296866	172590025	/nfs/dbraw/zinc/59/00/25/172590025.db2.gz	DJXACTLGRKEZMH-UHFFFAOYSA-N	1	0	284.381	1.055	50	0		CDAARO
CCCN([C@@H]1CC[NH2+]C1)S(=O)(=O)c1ccccc1F	ZINC000037539499	173260831	/nfs/dbraw/zinc/26/08/31/173260831.db2.gz	YDLZRKWILPYNFG-LLVKDONJSA-N	1	0	286.372	1.588	50	0		CDAARO
Brc1ccsc1CN1CC[NH2+]CC1	ZINC000039947594	174176483	/nfs/dbraw/zinc/17/64/83/174176483.db2.gz	GCNNNMWMDIYQJI-UHFFFAOYSA-N	1	0	261.188	1.916	50	0		CDAARO
OCC[NH+]1CCN(CCOc2ccccc2Cl)CC1	ZINC000040456302	174267640	/nfs/dbraw/zinc/26/76/40/174267640.db2.gz	JCLFRNOOPXBQLW-UHFFFAOYSA-N	1	0	284.787	1.329	50	0		CDAARO
Cc1c2cc(F)ccc2[nH]c1CN1CCO[C@H](C[NH3+])C1	ZINC000067559202	175778059	/nfs/dbraw/zinc/77/80/59/175778059.db2.gz	UQGAYEWVXOWPEK-GFCCVEGCSA-N	1	0	277.343	1.775	50	0		CDAARO
CN(Cc1cscn1)C(=O)[C@@H]1CC12CC[NH2+]CC2	ZINC000070255794	175884900	/nfs/dbraw/zinc/88/49/00/175884900.db2.gz	LIPWYUHYIKLKAA-NSHDSACASA-N	1	0	265.382	1.491	50	0		CDAARO
CC(C)Cc1cc(C[N@H+]2C[C@@H]3C[C@@H](O)[C@@H](O)C[C@@H]3C2)[nH]n1	ZINC000072126583	176320672	/nfs/dbraw/zinc/32/06/72/176320672.db2.gz	QKEBLXLLJQMEPJ-CRJCFHLZSA-N	1	0	293.411	1.172	50	0		CDAARO
Cc1nc2c(cnn2C)c(N(C)C[C@@H]2CCCC[N@@H+]2C)n1	ZINC000072135630	176322321	/nfs/dbraw/zinc/32/23/21/176322321.db2.gz	WEOQPKLZESFVKB-LBPRGKRZSA-N	1	0	288.399	1.592	50	0		CDAARO
CCc1ccc(C[N@@H+]2CCC[C@](O)(CO)CC2)nc1	ZINC000072145012	176324839	/nfs/dbraw/zinc/32/48/39/176324839.db2.gz	NPICSJXQTKYIRV-OAHLLOKOSA-N	1	0	264.369	1.353	50	0		CDAARO
CCOCCC(=O)N1CCCN(Cc2cccnc2)CC1	ZINC000077341769	177254755	/nfs/dbraw/zinc/25/47/55/177254755.db2.gz	PYTUCTBIYCMLIF-UHFFFAOYSA-N	1	0	291.395	1.543	50	0		CDAARO
COc1ccccc1OC1CN(C[C@@H]2CC[NH2+]C2)C1	ZINC000077471920	177272526	/nfs/dbraw/zinc/27/25/26/177272526.db2.gz	WNGMDULOYUQCPZ-GFCCVEGCSA-N	1	0	262.353	1.368	50	0		CDAARO
COc1ccc(Cl)cc1NC(=O)CN1CC[NH2+]CC1	ZINC000019976763	260115058	/nfs/dbraw/zinc/11/50/58/260115058.db2.gz	OJBNFZZWSHNVDK-UHFFFAOYSA-N	1	0	283.759	1.192	50	0		CDAARO
CC(C)[C@@H](NC(=O)Cn1ccnc1)c1cccnc1	ZINC000218963093	262348278	/nfs/dbraw/zinc/34/82/78/262348278.db2.gz	SLKRDJIGHDERRC-CQSZACIVSA-N	1	0	258.325	1.792	50	0		CDAARO
COc1cccc2[nH]c3c(ncnc3N3CC[NH+](C)CC3)c21	ZINC000005189626	274149360	/nfs/dbraw/zinc/14/93/60/274149360.db2.gz	FTQBNZUQGAVUNG-UHFFFAOYSA-N	1	0	297.362	1.872	50	0		CDAARO
Cc1nc(N(C)C)nc(N2CC[C@H]([NH+](C)C)C2)c1C	ZINC000065458133	274840353	/nfs/dbraw/zinc/84/03/53/274840353.db2.gz	YENCGHQMGQEYTK-LBPRGKRZSA-N	1	0	263.389	1.300	50	0		CDAARO
CCS(=O)(=O)c1ccc(N2CCC([NH3+])CC2)cc1	ZINC000035061886	276393635	/nfs/dbraw/zinc/39/36/35/276393635.db2.gz	ASJLUYBQOQKLDW-UHFFFAOYSA-N	1	0	268.382	1.408	50	0		CDAARO
CN1C[C@H]([NH2+][C@@H]2CCc3ccccc3C2)CCC1=O	ZINC000084060303	277205017	/nfs/dbraw/zinc/20/50/17/277205017.db2.gz	MSJNOVANOURGMA-HUUCEWRRSA-N	1	0	258.365	1.754	50	0		CDAARO
CO[C@@H]1CC[C@@H]2OCC[N@H+](C[C@H]3CCCCO3)[C@@H]2C1	ZINC000246596547	277295877	/nfs/dbraw/zinc/29/58/77/277295877.db2.gz	MPHNQPNMJZTTOF-TUVASFSCSA-N	1	0	269.385	1.824	50	0		CDAARO
COc1cc(OC)nc(N2CCC3(CC[N@H+](C)C3)CC2)n1	ZINC000065409413	277387387	/nfs/dbraw/zinc/38/73/87/277387387.db2.gz	ZDLSWGXTDRZQAV-UHFFFAOYSA-N	1	0	292.383	1.416	50	0		CDAARO
CC[N@H+](C)C[C@@]1(O)CCCN(CC(C)(C)C)C1=O	ZINC000012090050	279037631	/nfs/dbraw/zinc/03/76/31/279037631.db2.gz	BDTQLUMKRLVOKC-AWEZNQCLSA-N	1	0	256.390	1.338	50	0		CDAARO
Cc1cc2oc(=O)cc(C)c2cc1NC(=O)[C@@H]1CC[NH2+]C1	ZINC000055413927	280709975	/nfs/dbraw/zinc/70/99/75/280709975.db2.gz	IAIPZJFUYHGRNY-LLVKDONJSA-N	1	0	286.331	1.958	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)/C=C\c1ccc(-n2ccnc2)cc1	ZINC000254950659	289346700	/nfs/dbraw/zinc/34/67/00/289346700.db2.gz	NSQVXHDSSXLMRW-HJHHMULASA-N	1	0	296.374	1.706	50	0		CDAARO
C[C@H]([NH2+][C@H](C(N)=O)c1ccc(F)cc1)[C@@H]1CCCO1	ZINC000097374165	290034951	/nfs/dbraw/zinc/03/49/51/290034951.db2.gz	IJUHIDWPZOLMOQ-XDTLVQLUSA-N	1	0	266.316	1.509	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)[C@@H]2CCOc3ccccc32)C1	ZINC000104201379	295274123	/nfs/dbraw/zinc/27/41/23/295274123.db2.gz	IRKBBIUKQDYPGS-DGCLKSJQSA-N	1	0	260.337	1.360	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2c[nH]c(=O)cn2)CCCCCC1	ZINC000534581148	328311732	/nfs/dbraw/zinc/31/17/32/328311732.db2.gz	FTFMWGWOOZQENX-UHFFFAOYSA-N	1	0	292.383	1.154	50	0		CDAARO
c1sc(-c2cnccn2)nc1C[NH2+][C@H]1CCCOC1	ZINC000534581903	328312205	/nfs/dbraw/zinc/31/22/05/328312205.db2.gz	CCKVKUWJFDBVLO-JTQLQIEISA-N	1	0	276.365	1.869	50	0		CDAARO
C[NH+](C)CC[C@H](NC(=O)c1cn[nH]c1)c1ccccc1	ZINC000534581922	328312402	/nfs/dbraw/zinc/31/24/02/328312402.db2.gz	JYWGTJMDENBXIO-AWEZNQCLSA-N	1	0	272.352	1.833	50	0		CDAARO
Cc1nn[nH]c1C(=O)NC[C@@H](c1cccc(C)c1)[NH+](C)C	ZINC000534582604	328312509	/nfs/dbraw/zinc/31/25/09/328312509.db2.gz	RWDZNPHNHIQBDA-ZDUSSCGKSA-N	1	0	287.367	1.454	50	0		CDAARO
Cc1cc(C2CCC2)nc(N2C[C@@H]3[NH2+]CCO[C@H]3C2)n1	ZINC000534591403	328318258	/nfs/dbraw/zinc/31/82/58/328318258.db2.gz	GBLZMBHSZLMYFL-KBPBESRZSA-N	1	0	274.368	1.230	50	0		CDAARO
O=C(C[NH+]1CCCCCCC1)NC[C@@H]1CCC[NH2+]1	ZINC000534634920	328333112	/nfs/dbraw/zinc/33/31/12/328333112.db2.gz	VKIMAGOZKDHLQL-ZDUSSCGKSA-N	1	0	253.390	1.121	50	0		CDAARO
CC1(C)CC([NH2+]Cc2nc(N)n[nH]2)CC(C)(C)C1	ZINC000534655206	328339258	/nfs/dbraw/zinc/33/92/58/328339258.db2.gz	XOYVXYVDTHQTLG-UHFFFAOYSA-N	1	0	251.378	1.912	50	0		CDAARO
O=C1CC[C@H]([NH2+]CCc2ncc[nH]2)CN1Cc1ccccc1	ZINC000534649324	328343880	/nfs/dbraw/zinc/34/38/80/328343880.db2.gz	JMDVFMVWHLRJLS-HNNXBMFYSA-N	1	0	298.390	1.733	50	0		CDAARO
c1cncc(C[N@@H+]2CCC[C@@H](N3CCOCC3)C2)c1	ZINC000020909434	323207064	/nfs/dbraw/zinc/20/70/64/323207064.db2.gz	HINMPSFDKGMRDB-OAHLLOKOSA-N	1	0	261.369	1.378	50	0		CDAARO
O=C(CCC(F)(F)F)NCC[C@@H]1CCCC[NH2+]1	ZINC000088832993	328448673	/nfs/dbraw/zinc/44/86/73/328448673.db2.gz	ICBPPVVLVIBPSX-VIFPVBQESA-N	1	0	252.280	1.977	50	0		CDAARO
N[C@H](Cc1ccccc1)c1nnc(NCCCC[NH3+])o1	ZINC001772701798	1159437642	/nfs/dbraw/zinc/43/76/42/1159437642.db2.gz	BMFJWJRLHGLHDD-GFCCVEGCSA-N	1	0	275.356	1.463	50	0		CDAARO
Cc1cc(C)cc(NC(=O)N2C[C@@H]3C[NH2+]C[C@@]3(CO)C2)c1	ZINC001772709226	1159444222	/nfs/dbraw/zinc/44/42/22/1159444222.db2.gz	IXBQSBIRTZGNKX-BBRMVZONSA-N	1	0	289.379	1.349	50	0		CDAARO
Cc1ccc(NC(=O)N2C[C@H]3C[NH2+]C[C@@]3(CO)C2)cc1	ZINC001772711024	1159445284	/nfs/dbraw/zinc/44/52/84/1159445284.db2.gz	VVYLQHTXASLBOH-DOMZBBRYSA-N	1	0	275.352	1.041	50	0		CDAARO
[NH3+][C@H]1CCC[C@H]1C(=O)N1CCOc2ccccc2C1	ZINC000085370632	482579302	/nfs/dbraw/zinc/57/93/02/482579302.db2.gz	KRQDRGKPVDOLFI-OLZOCXBDSA-N	1	0	260.337	1.535	50	0		CDAARO
NC(=O)C1(C[NH2+]Cc2ccc3ccccc3n2)CCOCC1	ZINC000086250732	482706729	/nfs/dbraw/zinc/70/67/29/482706729.db2.gz	HOVGBAQJOCUPLD-UHFFFAOYSA-N	1	0	299.374	1.607	50	0		CDAARO
COC[C@@](C)(O)C(=O)NC1CCC([NH+]2CCCCC2)CC1	ZINC000086591354	482738823	/nfs/dbraw/zinc/73/88/23/482738823.db2.gz	HMTLNGBXAKZYOT-ZBCRRDGASA-N	1	0	298.427	1.297	50	0		CDAARO
COC(=O)c1ccc(N2CC[NH+](C)CC2)cc1Cl	ZINC000575435704	482888413	/nfs/dbraw/zinc/88/84/13/482888413.db2.gz	IZOWVEYIEHNRMX-UHFFFAOYSA-N	1	0	268.744	1.878	50	0		CDAARO
CCNC(=O)N1CCC[C@H]([NH2+]Cc2ccccc2)C1	ZINC000084791049	483327069	/nfs/dbraw/zinc/32/70/69/483327069.db2.gz	SHASNFHKMFENKX-AWEZNQCLSA-N	1	0	261.369	1.970	50	0		CDAARO
CCC(CC)(C[NH3+])C(=O)NC[C@@H](O)c1ccccc1C	ZINC000236675879	521423480	/nfs/dbraw/zinc/42/34/80/521423480.db2.gz	HLBBJSFCSZBAGT-CQSZACIVSA-N	1	0	278.396	1.910	50	0		CDAARO
CN(C(=O)c1ccc(N2CCCC2)c(F)c1)[C@@H]1CC[NH2+]C1	ZINC000179103716	523934611	/nfs/dbraw/zinc/93/46/11/523934611.db2.gz	BYFSIFZUFVPXIE-CYBMUJFWSA-N	1	0	291.370	1.860	50	0		CDAARO
CCNC(=O)NC[C@H](c1ccco1)[NH+](CC)CC	ZINC000194846189	528179460	/nfs/dbraw/zinc/17/94/60/528179460.db2.gz	KLEDTKZJBQDFIL-LLVKDONJSA-N	1	0	253.346	1.982	50	0		CDAARO
CCc1cc(OCCOCC[NH2+]CCO)ccc1Cl	ZINC000002974994	538148809	/nfs/dbraw/zinc/14/88/09/538148809.db2.gz	KJHIVMIYQNICGG-UHFFFAOYSA-N	1	0	287.787	1.880	50	0		CDAARO
O=C(NC[C@@H]1OCCc2sccc21)[C@@H]1CCC[NH2+]1	ZINC000072501369	538343077	/nfs/dbraw/zinc/34/30/77/538343077.db2.gz	JDLWHCNSYXUGPE-QWRGUYRKSA-N	1	0	266.366	1.230	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCN(c2ccc(F)cc2OC)CC1	ZINC000299738965	567901422	/nfs/dbraw/zinc/90/14/22/567901422.db2.gz	JBSILVKZRMODQJ-LBPRGKRZSA-N	1	0	295.358	1.220	50	0		CDAARO
COc1cc(C[NH2+]CCN2CCCC[C@H]2CO)ccc1F	ZINC000952988760	617188943	/nfs/dbraw/zinc/18/89/43/617188943.db2.gz	PDGPHAZABRZTOU-AWEZNQCLSA-N	1	0	296.386	1.771	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1nccnc1OC	ZINC000952963663	615114021	/nfs/dbraw/zinc/11/40/21/615114021.db2.gz	HWOJSEHTCDLROF-LLVKDONJSA-N	1	0	250.346	1.772	50	0		CDAARO
COC[C@@H](C)[N@@H+]1CCCN(C(=O)C2(C)CC2)CC1	ZINC000981215605	616796571	/nfs/dbraw/zinc/79/65/71/616796571.db2.gz	HUIVCCXMPCKTJD-GFCCVEGCSA-N	1	0	254.374	1.356	50	0		CDAARO
CCc1cc(NCCc2ncc[nH]2)nc(N(C)C)[nH+]1	ZINC001704297224	1177678677	/nfs/dbraw/zinc/67/86/77/1177678677.db2.gz	KEXSPDCDLLDXAK-UHFFFAOYSA-N	1	0	260.345	1.483	50	0		CDAARO
CN(C)c1nc2c(c(N[C@H]3CCC[NH2+]C3)n1)CCCC2	ZINC001704299920	1177679792	/nfs/dbraw/zinc/67/97/92/1177679792.db2.gz	OBNNIECTINGEOU-NSHDSACASA-N	1	0	275.400	1.585	50	0		CDAARO
CO[C@@H]1CCC[C@]12CCC[N@H+](CC(=O)N1CCCC1)C2	ZINC001704305476	1177681535	/nfs/dbraw/zinc/68/15/35/1177681535.db2.gz	QRJYNTNNAOZMNK-GDBMZVCRSA-N	1	0	280.412	1.890	50	0		CDAARO
CC[N@H+](C)[C@H](C)CCNc1nccnc1N(C)C	ZINC001704335869	1177693518	/nfs/dbraw/zinc/69/35/18/1177693518.db2.gz	HRDWVJQBFYMOKX-LLVKDONJSA-N	1	0	251.378	1.685	50	0		CDAARO
COCCN(CCOC)C[C@H]([NH3+])Cc1ccccc1	ZINC000048895634	1166507113	/nfs/dbraw/zinc/50/71/13/1166507113.db2.gz	WYXYPMLBMCSUSU-OAHLLOKOSA-N	1	0	266.385	1.151	50	0		CDAARO
Cc1cnc(N2CCC([N@@H+]3CCC[C@@H](CO)C3)CC2)nc1	ZINC000095360456	818333480	/nfs/dbraw/zinc/33/34/80/818333480.db2.gz	ZOGFDULKLQOTJR-CQSZACIVSA-N	1	0	290.411	1.458	50	0		CDAARO
C[N@@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCCS1	ZINC000887268504	818846948	/nfs/dbraw/zinc/84/69/48/818846948.db2.gz	NMEULACYEZDUFK-TUAOUCFPSA-N	1	0	254.399	1.577	50	0		CDAARO
OC[C@@H]1CCCN(CC[NH2+]C2CSCCSC2)C1	ZINC000952990806	819015651	/nfs/dbraw/zinc/01/56/51/819015651.db2.gz	XENAPDFQADJMOE-GFCCVEGCSA-N	1	0	290.498	1.129	50	0		CDAARO
CN(C)c1ccnc(C(=O)N[C@H]2C[C@H]([NH3+])C2(C)C)c1	ZINC000864091919	819820426	/nfs/dbraw/zinc/82/04/26/819820426.db2.gz	JJPURZDWXFGCHD-RYUDHWBXSA-N	1	0	262.357	1.003	50	0		CDAARO
Cc1nc[nH]c1CNC(=O)C1(C)CC[NH+](C)CC1	ZINC000426503123	820002158	/nfs/dbraw/zinc/00/21/58/820002158.db2.gz	INQBRICGLCLORA-UHFFFAOYSA-N	1	0	250.346	1.066	50	0		CDAARO
COc1cc(C[C@@]2(C)[NH2+]CCc3nc[nH]c32)ccc1O	ZINC000065497236	821650089	/nfs/dbraw/zinc/65/00/89/821650089.db2.gz	PJTHCPDXHRQZMO-OAHLLOKOSA-N	1	0	273.336	1.728	50	0		CDAARO
CCOc1ccc(CN2CC[N@H+](C)[C@H](CCO)C2)cc1	ZINC000022853338	822639197	/nfs/dbraw/zinc/63/91/97/822639197.db2.gz	RHZYHJKNTJJCJH-OAHLLOKOSA-N	1	0	278.396	1.584	50	0		CDAARO
CCC1(O)CCC(NC(=O)C23CCC[NH+]2CCC3)CC1	ZINC000952846132	910404273	/nfs/dbraw/zinc/40/42/73/910404273.db2.gz	GOXPIXVVPCTJBX-UHFFFAOYSA-N	1	0	280.412	1.815	50	0		CDAARO
O=C(CC[NH2+]C1(CO)CCC1)Nc1cccc(F)c1	ZINC000952878162	910435579	/nfs/dbraw/zinc/43/55/79/910435579.db2.gz	ZHXNHOBAUZLBQU-UHFFFAOYSA-N	1	0	266.316	1.659	50	0		CDAARO
CN(C)C(=O)[C@H]1CC[N@H+](C[C@H]2COC3(CCCCC3)O2)C1	ZINC000952883218	910450819	/nfs/dbraw/zinc/45/08/19/910450819.db2.gz	YAGHHSLSIIVZSL-KBPBESRZSA-N	1	0	296.411	1.472	50	0		CDAARO
Cc1cccc(OCCN2CCOC[C@@H]2C(C)(C)O)c1	ZINC000952883886	910457126	/nfs/dbraw/zinc/45/71/26/910457126.db2.gz	SOWJDTNYNPPYKB-OAHLLOKOSA-N	1	0	279.380	1.846	50	0		CDAARO
O=C(NCC1CC[NH+](CCCO)CC1)c1ccc(F)cc1	ZINC001001106601	936547495	/nfs/dbraw/zinc/54/74/95/936547495.db2.gz	RPJULQJOLUHTNU-UHFFFAOYSA-N	1	0	294.370	1.650	50	0		CDAARO
Cc1cnc(NC[C@@H]2CC[N@H+](C)C2)nc1-c1cnn(C)c1	ZINC000063846169	924101416	/nfs/dbraw/zinc/10/14/16/924101416.db2.gz	WKTNNEYCELQAQU-LBPRGKRZSA-N	1	0	286.383	1.549	50	0		CDAARO
CC[N@@H+]1CC[C@H](CN(C)c2nccc(OC)n2)C1	ZINC000823104911	925673328	/nfs/dbraw/zinc/67/33/28/925673328.db2.gz	WYIREDUHHGWOGB-LLVKDONJSA-N	1	0	250.346	1.263	50	0		CDAARO
CN(Cc1cnc(N(C)C)nc1)C[C@@H]1CC[N@H+](C)C1(C)C	ZINC000823690444	925721901	/nfs/dbraw/zinc/72/19/01/925721901.db2.gz	YBRDPBBZIVRXTC-AWEZNQCLSA-N	1	0	291.443	1.705	50	0		CDAARO
COC1CCN(C(=O)C[NH+]2CCCCCC2)CC1	ZINC000824300262	925815832	/nfs/dbraw/zinc/81/58/32/925815832.db2.gz	DUONVOWHAMVDCL-UHFFFAOYSA-N	1	0	254.374	1.500	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CN(C)Cc2cnc(C)nc2)C1	ZINC000824412473	925820336	/nfs/dbraw/zinc/82/03/36/925820336.db2.gz	WIURQBOQQVXGCL-CQSZACIVSA-N	1	0	278.400	1.185	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)c1cncc(F)c1	ZINC000826630288	925912367	/nfs/dbraw/zinc/91/23/67/925912367.db2.gz	CZDYAJOMPKIMCK-UHFFFAOYSA-N	1	0	274.299	1.188	50	0		CDAARO
COC(C[NH+]1CCC(Cc2nc(C(C)C)n[nH]2)CC1)OC	ZINC000585116497	930967778	/nfs/dbraw/zinc/96/77/78/930967778.db2.gz	YPRARDHNRWZZDS-UHFFFAOYSA-N	1	0	296.415	1.802	50	0		CDAARO
CC[N@H+](C[C@H](O)[C@H](C)O)[C@@H](C)c1cccc(OC)c1	ZINC000585117090	930977526	/nfs/dbraw/zinc/97/75/26/930977526.db2.gz	QODUOPBZWMCNTC-HUBLWGQQSA-N	1	0	267.369	1.820	50	0		CDAARO
CCn1ncc(C)c1NC(=O)[C@H](CC(C)C)[NH2+]C	ZINC001529144183	968992251	/nfs/dbraw/zinc/99/22/51/968992251.db2.gz	QSBIRIWSAWGVDN-NSHDSACASA-N	1	0	252.362	1.784	50	0		CDAARO
CCCCCc1nnc(NC(=O)[C@H]2C=CC[NH2+]2)s1	ZINC001529177666	969004931	/nfs/dbraw/zinc/00/49/31/969004931.db2.gz	COJURKOTYSXGPL-SECBINFHSA-N	1	0	266.370	1.737	50	0		CDAARO
O=c1cc([C@H]2CCC[N@H+](CCCn3ccnc3)C2)nc[nH]1	ZINC001506403609	975150528	/nfs/dbraw/zinc/15/05/28/975150528.db2.gz	UPGDYSMAXFUFMS-ZDUSSCGKSA-N	1	0	287.367	1.648	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]Cc2cnc(C)cn2)n1	ZINC001506411633	975154356	/nfs/dbraw/zinc/15/43/56/975154356.db2.gz	SHULQSZBTREGEX-GFCCVEGCSA-N	1	0	259.357	1.777	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)Nc1cc(C)ccc1NC(C)=O	ZINC001506415687	975156239	/nfs/dbraw/zinc/15/62/39/975156239.db2.gz	BJJBLOOGTPDLAZ-NSHDSACASA-N	1	0	295.408	1.972	50	0		CDAARO
CN1C(=O)N=NC1CC[NH2+][C@@H]1CC2C[C@@H]3CC1C[C@H](C2)C3	ZINC001506426959	975160763	/nfs/dbraw/zinc/16/07/63/975160763.db2.gz	UJROBALLRBBFRR-XPXVYLNCSA-N	1	0	290.411	1.868	50	0		CDAARO
Cc1nc(CN2CCC(C)(CO)CC2)n(C)c1C	ZINC000584902382	341986882	/nfs/dbraw/zinc/98/68/82/341986882.db2.gz	MQIYWCUXOXYRCU-UHFFFAOYSA-N	1	0	251.374	1.631	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)CCOC	ZINC000106779581	349483969	/nfs/dbraw/zinc/48/39/69/349483969.db2.gz	MQVQLNCWJKRTFQ-CHWSQXEVSA-N	1	0	254.374	1.498	50	0		CDAARO
CC[C@H](COC)[NH2+][C@@H](C)Cc1c(C)nn(C)c1C	ZINC000095968572	185047829	/nfs/dbraw/zinc/04/78/29/185047829.db2.gz	MCLHPUZVLMNTKN-GXFFZTMASA-N	1	0	253.390	1.983	50	0		CDAARO
CC[N@H+](Cc1ccc2c(c1)OCCO2)[C@H]1COC[C@@H]1O	ZINC000097698641	342009462	/nfs/dbraw/zinc/00/94/62/342009462.db2.gz	MLACOVHVJXTYEQ-STQMWFEESA-N	1	0	279.336	1.039	50	0		CDAARO
COC(=O)c1ccc(C(=O)N[C@H]2CCC[N@H+](C)[C@@H]2C)cc1	ZINC000096009719	185064571	/nfs/dbraw/zinc/06/45/71/185064571.db2.gz	BOQPVRDYAIEFLT-RISCZKNCSA-N	1	0	290.363	1.686	50	0		CDAARO
C[C@@H]1CCC[C@H]2CCC[N@H+](CCN3CCNC3=O)[C@H]12	ZINC000242100102	361754168	/nfs/dbraw/zinc/75/41/68/361754168.db2.gz	WEIVKEJJXIIWAS-HZSPNIEDSA-N	1	0	265.401	1.912	50	0		CDAARO
COC(=O)c1cc(C[N@@H+]2CCC[C@H]([C@H](C)O)C2)n(C)c1C	ZINC000242302208	361755433	/nfs/dbraw/zinc/75/54/33/361755433.db2.gz	YQMFSWGTFMJDKR-STQMWFEESA-N	1	0	294.395	1.713	50	0		CDAARO
CCc1ccccc1OCC[N@@H+]1CC[C@@](C)(O)[C@@H](O)C1	ZINC000096138490	185106041	/nfs/dbraw/zinc/10/60/41/185106041.db2.gz	DASJDINGTMIEDL-JKSUJKDBSA-N	1	0	279.380	1.445	50	0		CDAARO
Cn1c(C[N@@H+]2CC[C@](C)(O)[C@@H](O)C2)cc2cc(F)ccc21	ZINC000096141450	185106221	/nfs/dbraw/zinc/10/62/21/185106221.db2.gz	YCCVOQXQHIQOPJ-HOTGVXAUSA-N	1	0	292.354	1.635	50	0		CDAARO
[NH2+]=C1S[C@@H]2CS(=O)(=O)C[C@H]2N1CCc1ccccc1	ZINC000137102507	342119816	/nfs/dbraw/zinc/11/98/16/342119816.db2.gz	SGQUNMIYQVOSKO-VXGBXAGGSA-N	1	0	296.417	1.378	50	0		CDAARO
CC[C@H](C(=O)N[C@@H]1C[NH2+]C[C@@H]1OC)c1ccc(OC)cc1	ZINC000195554047	342625856	/nfs/dbraw/zinc/62/58/56/342625856.db2.gz	SCBATRITYQFNPX-ZNMIVQPWSA-N	1	0	292.379	1.292	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)c1ccc2nc(C)ccc2c1	ZINC000195554115	342625946	/nfs/dbraw/zinc/62/59/46/342625946.db2.gz	LQANVXXQCUTHFK-GJZGRUSLSA-N	1	0	285.347	1.260	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1sccc1OC	ZINC000195544647	342626732	/nfs/dbraw/zinc/62/67/32/342626732.db2.gz	BEMGJBVPBNWPLP-MRVPVSSYSA-N	1	0	278.399	1.162	50	0		CDAARO
Cc1ccc(N2C(=O)C[C@@H]([NH2+]CC3CC3)C2=O)cc1	ZINC000083251948	178370308	/nfs/dbraw/zinc/37/03/08/178370308.db2.gz	IVXQJYGHXIWMRO-CYBMUJFWSA-N	1	0	258.321	1.627	50	0		CDAARO
Cc1ccc(CNC(=O)CC[N@@H+](C)Cc2cnccn2)cc1	ZINC000244575007	361853514	/nfs/dbraw/zinc/85/35/14/361853514.db2.gz	CVBNKBFNWFUKBY-UHFFFAOYSA-N	1	0	298.390	1.923	50	0		CDAARO
CCCNC(=O)N1C[C@@H](C[NH+](C)C)C2(C1)CCOCC2	ZINC000097942817	342160788	/nfs/dbraw/zinc/16/07/88/342160788.db2.gz	SYYBMTFXWLFDOB-CYBMUJFWSA-N	1	0	283.416	1.396	50	0		CDAARO
CCc1nnc(NC(=O)CC[N@@H+]2CC[C@@H](COC)C2)s1	ZINC000244795756	361865343	/nfs/dbraw/zinc/86/53/43/361865343.db2.gz	RMZGGMUVFTTZDV-SNVBAGLBSA-N	1	0	298.412	1.397	50	0		CDAARO
CCN(C(=O)CC[N@H+](C)C[C@@H](O)CO)c1ccccc1C	ZINC000244858623	361866466	/nfs/dbraw/zinc/86/64/66/361866466.db2.gz	VORJSFGCIKNZFO-CQSZACIVSA-N	1	0	294.395	1.023	50	0		CDAARO
Cc1ccccc1CNC(=O)CN1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000244884011	361869099	/nfs/dbraw/zinc/86/90/99/361869099.db2.gz	YDNABISRXWXTNZ-CVEARBPZSA-N	1	0	287.407	1.438	50	0		CDAARO
CC[NH+]1CCC(N(C(=O)c2ccc(=O)[nH]c2)C2CC2)CC1	ZINC000096999297	185150139	/nfs/dbraw/zinc/15/01/39/185150139.db2.gz	NRSZTZCVUCIHTO-UHFFFAOYSA-N	1	0	289.379	1.464	50	0		CDAARO
C[C@@H](CNC(=O)N1[C@H](C)CCC[C@@H]1C)N1CC[NH+](C)CC1	ZINC000685939744	539045695	/nfs/dbraw/zinc/04/56/95/539045695.db2.gz	OLAJWULWJPWSRV-ZNMIVQPWSA-N	1	0	296.459	1.595	50	0		CDAARO
C[NH+](C)C[C@H]1CCCC2=C1NC1(CCCCC1)NC2=O	ZINC000585152453	342226419	/nfs/dbraw/zinc/22/64/19/342226419.db2.gz	HPJBWWVPVBNVEV-GFCCVEGCSA-N	1	0	277.412	1.982	50	0		CDAARO
Cc1nc2ccccc2n1[C@@H]1CCN(S(C)(=O)=O)C1	ZINC000585149299	342225661	/nfs/dbraw/zinc/22/56/61/342225661.db2.gz	HHOWEVICYSTRSK-LLVKDONJSA-N	1	0	279.365	1.551	50	0		CDAARO
CO[C@@]1(C[NH2+]Cc2nncn2-c2ccccc2)CCOC1	ZINC000585117841	362046403	/nfs/dbraw/zinc/04/64/03/362046403.db2.gz	ZJQOHSYBMAQSFF-OAHLLOKOSA-N	1	0	288.351	1.162	50	0		CDAARO
CC1=C[C@H](C)[C@@H]2C(=O)N(c3ccc[n+](C)c3)C(=O)[C@H]2C1	ZINC000101171171	362096593	/nfs/dbraw/zinc/09/65/93/362096593.db2.gz	UYHYCNHHAGZKQZ-UBHSHLNASA-N	1	0	271.340	1.603	50	0		CDAARO
CCOC(=O)c1cccc(NC(=O)[C@@]2(F)CC[NH2+]C2)c1	ZINC000252496582	342382465	/nfs/dbraw/zinc/38/24/65/342382465.db2.gz	PMCGQNUWMUHTOV-CQSZACIVSA-N	1	0	280.299	1.503	50	0		CDAARO
Cc1nn(CC[NH3+])c(C)c1I	ZINC000034925968	282302540	/nfs/dbraw/zinc/30/25/40/282302540.db2.gz	AFGGZRCCYBRQOT-UHFFFAOYSA-N	1	0	265.098	1.063	50	0		CDAARO
CC[N@@H+]1CC[C@@H](N(C)C(=O)NCc2ccncc2)[C@H](C)C1	ZINC000084779987	362272420	/nfs/dbraw/zinc/27/24/20/362272420.db2.gz	LMHPIRAAAZWFLV-UKRRQHHQSA-N	1	0	290.411	1.953	50	0		CDAARO
COC[C@@H]1CCC[N@@H+]1CCC(=O)NCc1cccs1	ZINC000252482312	362384643	/nfs/dbraw/zinc/38/46/43/362384643.db2.gz	DCURHUNJFAXJMB-LBPRGKRZSA-N	1	0	282.409	1.865	50	0		CDAARO
Cc1nc[nH]c1CN1CC[NH+](C2CCSCC2)CC1	ZINC000252492068	362387164	/nfs/dbraw/zinc/38/71/64/362387164.db2.gz	MBUAPAWEHFCBNN-UHFFFAOYSA-N	1	0	280.441	1.731	50	0		CDAARO
CC[C@H](C(=O)NCC1([NH+](C)C)CCOCC1)n1cccn1	ZINC000252500831	362388180	/nfs/dbraw/zinc/38/81/80/362388180.db2.gz	TWECCLUHNDXJJQ-CYBMUJFWSA-N	1	0	294.399	1.061	50	0		CDAARO
Cc1cccc(O[C@H](C)C(=O)N2CCC[C@@H]([NH3+])C2)c1	ZINC000191365718	362427140	/nfs/dbraw/zinc/42/71/40/362427140.db2.gz	VAISZUWMUPEBKS-CHWSQXEVSA-N	1	0	262.353	1.712	50	0		CDAARO
C[C@@H](CCNC(=O)N1CCC[C@@H](O)C1)[NH+]1CCCCC1	ZINC000097108165	185534892	/nfs/dbraw/zinc/53/48/92/185534892.db2.gz	XKZYTXHJPVWKCQ-UONOGXRCSA-N	1	0	283.416	1.417	50	0		CDAARO
Cc1noc(C)c1[C@@H](C)NC(=O)N1CC[C@H](C[NH+](C)C)C1	ZINC000130000973	346179543	/nfs/dbraw/zinc/17/95/43/346179543.db2.gz	IYJCPMQSJPDURL-ZWNOBZJWSA-N	1	0	294.399	1.946	50	0		CDAARO
C[C@H](NC(=O)N1CCC[C@H](O)C1)C(C)(C)C[NH+](C)C	ZINC000085423137	179059166	/nfs/dbraw/zinc/05/91/66/179059166.db2.gz	PKVLMGRRLYCPJV-RYUDHWBXSA-N	1	0	271.405	1.129	50	0		CDAARO
CCN1CC[NH+](C2CCC(NC(C)=O)CC2)CC1	ZINC000098213466	185700499	/nfs/dbraw/zinc/70/04/99/185700499.db2.gz	JVRXVADAATWHAK-UHFFFAOYSA-N	1	0	253.390	1.071	50	0		CDAARO
CC[NH+](CC)[C@@H]1CC(=O)N(c2ccc(OC)cc2)C1=O	ZINC000019908963	348746098	/nfs/dbraw/zinc/74/60/98/348746098.db2.gz	GLIUXUYUAXQFRW-CYBMUJFWSA-N	1	0	276.336	1.669	50	0		CDAARO
O=C(C[C@@H]1CCCOC1)N1CCC([NH+]2CCOCC2)CC1	ZINC000584886287	349344113	/nfs/dbraw/zinc/34/41/13/349344113.db2.gz	LQOFHCNHZJBSEA-AWEZNQCLSA-N	1	0	296.411	1.126	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1NC(=O)CCc1cccn1C	ZINC000584891935	349350926	/nfs/dbraw/zinc/35/09/26/349350926.db2.gz	HMXOLSCSYNUEAC-GJZGRUSLSA-N	1	0	293.411	1.182	50	0		CDAARO
CCc1nn(C)c2c1ncn(C[C@@H]1CCCC[N@@H+]1C)c2=O	ZINC000584893678	349353534	/nfs/dbraw/zinc/35/35/34/349353534.db2.gz	PHYGZVBUASFTQF-NSHDSACASA-N	1	0	289.383	1.177	50	0		CDAARO
CCOC(=O)N1CC[C@H]([NH2+]Cc2cncn2C2CC2)C1	ZINC000584894133	349354399	/nfs/dbraw/zinc/35/43/99/349354399.db2.gz	YDWKBLBNBUITBG-NSHDSACASA-N	1	0	278.356	1.538	50	0		CDAARO
O[C@@]1(C[NH2+][C@H]2CCSc3ccccc32)CCOC1	ZINC000090848010	180044258	/nfs/dbraw/zinc/04/42/58/180044258.db2.gz	PWWOPMHLPUYEJZ-GXTWGEPZSA-N	1	0	265.378	1.965	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCC[NH2+][C@H]2C)cc1C	ZINC000091496975	180172515	/nfs/dbraw/zinc/17/25/15/180172515.db2.gz	WDDOTLZLDGROTP-JSGCOSHPSA-N	1	0	282.409	1.722	50	0		CDAARO
CNC(=O)C[N@@H+]1CCC[C@](CO)(CC=C(C)C)C1	ZINC000091548464	180188426	/nfs/dbraw/zinc/18/84/26/180188426.db2.gz	UBKALUMZBDTHQG-AWEZNQCLSA-N	1	0	254.374	1.163	50	0		CDAARO
CCn1cc(CN2C[C@H]([NH+](C)C)[C@@H](C3CC3)C2)cn1	ZINC000091663533	180221248	/nfs/dbraw/zinc/22/12/48/180221248.db2.gz	HFAASDIVAQDAGX-CABCVRRESA-N	1	0	262.401	1.675	50	0		CDAARO
C[C@@H](CO)[NH2+]Cc1cc(=O)c2cc(F)ccc2[nH]1	ZINC000091621405	180209296	/nfs/dbraw/zinc/20/92/96/180209296.db2.gz	YYURADFUQSECBT-QMMMGPOBSA-N	1	0	250.273	1.138	50	0		CDAARO
CC[C@@H]1CN(C(=O)CCn2cc(C)cn2)CC[N@@H+]1C(C)C	ZINC000091738178	180244318	/nfs/dbraw/zinc/24/43/18/180244318.db2.gz	ZIHOREXGDSRESY-OAHLLOKOSA-N	1	0	292.427	1.913	50	0		CDAARO
CN1CCO[C@H](C[NH2+]Cc2cccc(Br)c2)C1	ZINC000105472110	186058853	/nfs/dbraw/zinc/05/88/53/186058853.db2.gz	ORUUODBZPIXQPW-CYBMUJFWSA-N	1	0	299.212	1.869	50	0		CDAARO
CCC[C@H]1CN(C(=O)CCCn2cccn2)C[C@@H]1[NH3+]	ZINC000091915365	180285649	/nfs/dbraw/zinc/28/56/49/180285649.db2.gz	SNFGXRZRBNBULL-STQMWFEESA-N	1	0	264.373	1.249	50	0		CDAARO
COCC[C@@]1(CO)CCC[N@H+](Cc2[nH]cnc2C)C1	ZINC000091973882	180296494	/nfs/dbraw/zinc/29/64/94/180296494.db2.gz	TUALKOSEZRURSO-AWEZNQCLSA-N	1	0	267.373	1.329	50	0		CDAARO
C[NH+](C)C[C@@H]1CN(C(=O)c2cc(F)ccc2F)C[C@@H]1CO	ZINC000092028282	180309555	/nfs/dbraw/zinc/30/95/55/180309555.db2.gz	GAJCXVQRILBWEC-GHMZBOCLSA-N	1	0	298.333	1.207	50	0		CDAARO
C[C@H](CNc1ncnc2nc[nH]c21)[N@@H+]1CCC[C@H](C)C1	ZINC000106826562	186138104	/nfs/dbraw/zinc/13/81/04/186138104.db2.gz	IHIQOJHAWULVSS-WDEREUQCSA-N	1	0	274.372	1.885	50	0		CDAARO
C[C@@H](CO)NC(=O)N[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C	ZINC000110715281	186316086	/nfs/dbraw/zinc/31/60/86/186316086.db2.gz	PMYTZFJRKYSLSV-KCQAQPDRSA-N	1	0	291.395	1.187	50	0		CDAARO
C[N@@H+]1CCCC[C@@H](CNC(=O)NCC2=CCOCC2)C1	ZINC000624145143	351440436	/nfs/dbraw/zinc/44/04/36/351440436.db2.gz	LTJJKULBWDTLMW-AWEZNQCLSA-N	1	0	281.400	1.364	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CN(C(=O)c2ccccc2Cl)CCO1	ZINC000122884207	187057868	/nfs/dbraw/zinc/05/78/68/187057868.db2.gz	XUAAUNTWTLFWLS-CABZTGNLSA-N	1	0	268.744	1.528	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CN(C(=O)c2cccc(F)c2F)CCO1	ZINC000122896824	187058421	/nfs/dbraw/zinc/05/84/21/187058421.db2.gz	UXLQKZGYKUDKCA-KCJUWKMLSA-N	1	0	270.279	1.153	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1nccc(OC)n1	ZINC000264860841	363173808	/nfs/dbraw/zinc/17/38/08/363173808.db2.gz	LWWLTVJMRWSINJ-LLVKDONJSA-N	1	0	250.346	1.772	50	0		CDAARO
c1ccc(C[N@@H+]2CC[C@@H](Nc3ccc4nnnn4n3)C2)cc1	ZINC000012944102	366094998	/nfs/dbraw/zinc/09/49/98/366094998.db2.gz	PISYHFSXZTZLHW-CYBMUJFWSA-N	1	0	295.350	1.206	50	0		CDAARO
CC(C)OC[C@@H](O)C[NH+]1C(C)(C)CC(O)CC1(C)C	ZINC000000616674	355920074	/nfs/dbraw/zinc/92/00/74/355920074.db2.gz	ZQXIPLZTOPFMPD-ZDUSSCGKSA-N	1	0	273.417	1.786	50	0		CDAARO
Cc1ccc(C)c(OCC(=O)N2CCC[N@@H+](C)CC2)c1	ZINC000002634966	355978290	/nfs/dbraw/zinc/97/82/90/355978290.db2.gz	ZOIPXJQPPSWVKM-UHFFFAOYSA-N	1	0	276.380	1.846	50	0		CDAARO
C[NH+](C)CCCNC(=S)NC(=O)c1ccccc1	ZINC000002815806	355983317	/nfs/dbraw/zinc/98/33/17/355983317.db2.gz	ALGSTMKBZLKFGV-UHFFFAOYSA-N	1	0	265.382	1.243	50	0		CDAARO
COc1ccccc1C(=O)N1CCOC12CC[NH+](C)CC2	ZINC000013729172	356354759	/nfs/dbraw/zinc/35/47/59/356354759.db2.gz	XPAZDCZIKNJBOX-UHFFFAOYSA-N	1	0	290.363	1.590	50	0		CDAARO
C[C@H]1C[NH+](CCCNC(=O)c2ccco2)C[C@H](C)O1	ZINC000032826829	356383275	/nfs/dbraw/zinc/38/32/75/356383275.db2.gz	FSTCAMPIUUYFSY-RYUDHWBXSA-N	1	0	266.341	1.509	50	0		CDAARO
COC(=O)Cc1ccc(OCC2CC[NH2+]CC2)cc1	ZINC000014631481	356392584	/nfs/dbraw/zinc/39/25/84/356392584.db2.gz	QMXOGBUCCPOJBP-UHFFFAOYSA-N	1	0	263.337	1.781	50	0		CDAARO
COc1ccc(CCNC(=O)C[NH+]2CCCC2)cc1	ZINC000015256616	356410643	/nfs/dbraw/zinc/41/06/43/356410643.db2.gz	ZATQKEFUHBPBJG-UHFFFAOYSA-N	1	0	262.353	1.450	50	0		CDAARO
COc1ccc([C@H](C[NH3+])N2CCOCC2)c(OC)c1	ZINC000019796369	356505509	/nfs/dbraw/zinc/50/55/09/356505509.db2.gz	ZEJBQXZLSYSINH-ZDUSSCGKSA-N	1	0	266.341	1.036	50	0		CDAARO
CC(C)CNC(=O)NCC1(C(F)(F)F)CC[NH2+]CC1	ZINC000725264681	538455676	/nfs/dbraw/zinc/45/56/76/538455676.db2.gz	GZARPFJFYBGCQA-UHFFFAOYSA-N	1	0	281.322	1.874	50	0		CDAARO
Cc1ccc(C[NH+]2CCC(Cn3cc(CO)nn3)CC2)o1	ZINC000023158776	356631603	/nfs/dbraw/zinc/63/16/03/356631603.db2.gz	YSKFSCMEFLOHJT-UHFFFAOYSA-N	1	0	290.367	1.584	50	0		CDAARO
O=c1cc(CN2CC[N@@H+]3CCC[C@@H]3C2)nc2sccn21	ZINC000023249657	356637587	/nfs/dbraw/zinc/63/75/87/356637587.db2.gz	KDEZXDSZIDCVQJ-GFCCVEGCSA-N	1	0	290.392	1.036	50	0		CDAARO
COc1ccc2ccccc2c1C[NH+](CCO)CCO	ZINC000023282237	356638533	/nfs/dbraw/zinc/63/85/33/356638533.db2.gz	YPPQXIZQPTVNSF-UHFFFAOYSA-N	1	0	275.348	1.635	50	0		CDAARO
C[C@@H]1CN(C(=O)C(C)(C)n2cc(Cl)cn2)C[C@@H]1[NH+](C)C	ZINC000078896446	538477069	/nfs/dbraw/zinc/47/70/69/538477069.db2.gz	VNYOOFCPBOGLOF-PWSUYJOCSA-N	1	0	298.818	1.680	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[NH2+][C@H](c1ccccc1)C(C)C	ZINC000008002957	290500001	/nfs/dbraw/zinc/50/00/01/290500001.db2.gz	MAZKPHBZWATHRH-AAEUAGOBSA-N	1	0	277.368	1.817	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@@H](CNC(=O)c2cccs2)C1	ZINC000028013701	356716592	/nfs/dbraw/zinc/71/65/92/356716592.db2.gz	MLAQLMWEKPAXDD-LBPRGKRZSA-N	1	0	282.409	1.835	50	0		CDAARO
CCN(CCOC)Cc1nc2ccccc2c(=O)[nH]1	ZINC000030856497	356755052	/nfs/dbraw/zinc/75/50/52/356755052.db2.gz	VAFFLFLOPKWKFN-UHFFFAOYSA-N	1	0	261.325	1.391	50	0		CDAARO
COc1cc(OC)c([C@@H]2CC[N@H+](C)C[C@@H]2O)c(OC)c1	ZINC000034031282	356809740	/nfs/dbraw/zinc/80/97/40/356809740.db2.gz	MGNNDUKLPNLAFW-NEPJUHHUSA-N	1	0	281.352	1.492	50	0		CDAARO
CCN1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000036289216	356869474	/nfs/dbraw/zinc/86/94/74/356869474.db2.gz	PSXKCNHXVNGMOQ-UHFFFAOYSA-N	1	0	288.800	1.666	50	0		CDAARO
Cc1nc(N2CC[NH2+]CC2)ccc1Br	ZINC000038537926	356963110	/nfs/dbraw/zinc/96/31/10/356963110.db2.gz	BMZFOQCCRVDXRL-UHFFFAOYSA-N	1	0	256.147	1.562	50	0		CDAARO
COC(=O)[C@@H](CC[NH2+]Cc1ccccc1)[C@@H](C)O	ZINC000043214668	363572165	/nfs/dbraw/zinc/57/21/65/363572165.db2.gz	JGNJXWYXCHOBBP-YPMHNXCESA-N	1	0	251.326	1.336	50	0		CDAARO
CC(C)OCC[C@@H]1CCCC[N@@H+]1CCN1C(=O)CCC1=O	ZINC000095431957	357507250	/nfs/dbraw/zinc/50/72/50/357507250.db2.gz	XZSDENVGJWGKCG-AWEZNQCLSA-N	1	0	296.411	1.805	50	0		CDAARO
CCc1nsc(N2CCC[N@H+](CC(C)(C)O)CC2)n1	ZINC000096435857	357472110	/nfs/dbraw/zinc/47/21/10/357472110.db2.gz	ZPJZESQBUCLIED-UHFFFAOYSA-N	1	0	284.429	1.384	50	0		CDAARO
CC[NH+](CC)CCNc1nccc(N2CCC[C@@H](O)C2)n1	ZINC000065383783	357534630	/nfs/dbraw/zinc/53/46/30/357534630.db2.gz	KIKCGZRCZSKXIK-CYBMUJFWSA-N	1	0	293.415	1.191	50	0		CDAARO
Cn1nc(COc2ccc(F)cc2)c2c1CC[NH2+]C2	ZINC000066323495	357562323	/nfs/dbraw/zinc/56/23/23/357562323.db2.gz	TWRRFVWOHYUWSM-UHFFFAOYSA-N	1	0	261.300	1.784	50	0		CDAARO
O=C(CNC1CC[NH2+]CC1)Nc1ccc(F)c(F)c1F	ZINC000067774378	357626136	/nfs/dbraw/zinc/62/61/36/357626136.db2.gz	UWQDFQXINYUOKG-UHFFFAOYSA-N	1	0	287.285	1.384	50	0		CDAARO
C[NH2+]CC(=O)NCc1cccnc1N(C)Cc1ccccc1	ZINC000067784678	357626323	/nfs/dbraw/zinc/62/63/23/357626323.db2.gz	KRUUGKRBVRDYTR-UHFFFAOYSA-N	1	0	298.390	1.554	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@@H](CCNC(=O)C2([NH3+])CCCC2)C1	ZINC000067955025	357640067	/nfs/dbraw/zinc/64/00/67/357640067.db2.gz	SYLDIRPOFVFXGT-AWEZNQCLSA-N	1	0	297.443	1.121	50	0		CDAARO
COCCC[N@@H+]1CCC(=O)N(CC2CC2)[C@@H](C(C)C)C1	ZINC000071776510	357781032	/nfs/dbraw/zinc/78/10/32/357781032.db2.gz	IWBLKMDLIIDDEQ-OAHLLOKOSA-N	1	0	282.428	1.992	50	0		CDAARO
CC(C)[NH2+][C@@H]1CC[C@@H]1NC(=O)c1cnc2c(c1)ncn2C	ZINC000072425110	357834780	/nfs/dbraw/zinc/83/47/80/357834780.db2.gz	FULYFSHIWTXYGD-NEPJUHHUSA-N	1	0	287.367	1.227	50	0		CDAARO
O=C(NC1CC=CC1)N1CCN(Cc2ccccn2)CC1	ZINC000097096494	357953384	/nfs/dbraw/zinc/95/33/84/357953384.db2.gz	SJHCRVAICCBCRV-UHFFFAOYSA-N	1	0	286.379	1.627	50	0		CDAARO
CCn1cc(C[N@@H+]2CCC[C@@H](C3(C)OCCO3)C2)cn1	ZINC000097108675	357984151	/nfs/dbraw/zinc/98/41/51/357984151.db2.gz	HYFRUNUMIQBEKU-CQSZACIVSA-N	1	0	279.384	1.878	50	0		CDAARO
O=C(NCc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc[nH]1	ZINC000097081786	358165107	/nfs/dbraw/zinc/16/51/07/358165107.db2.gz	TYLANFSVIJPHOK-HNNXBMFYSA-N	1	0	299.374	1.511	50	0		CDAARO
Cc1cnc(CCN(C)C(=O)[C@@H]([NH3+])C(C)C)s1	ZINC000097234191	358192457	/nfs/dbraw/zinc/19/24/57/358192457.db2.gz	ZAAKAWVGCFSTIV-NSHDSACASA-N	1	0	255.387	1.436	50	0		CDAARO
C[C@H]([NH2+]CC(C)(C)C(N)=O)c1ccccc1N(C)C	ZINC000097033747	299276272	/nfs/dbraw/zinc/27/62/72/299276272.db2.gz	HEUHSHDIBDDXSO-NSHDSACASA-N	1	0	263.385	1.915	50	0		CDAARO
COc1ccc(C[N@H+](C)C[C@H](O)COC(C)C)c(OC)c1	ZINC000098066151	358355102	/nfs/dbraw/zinc/35/51/02/358355102.db2.gz	BVWYJZFKJQGONO-AWEZNQCLSA-N	1	0	297.395	1.922	50	0		CDAARO
C[NH+](C)C[C@@H]1CN(C(=O)Nc2ccc(F)cc2)CCO1	ZINC000089314225	358403187	/nfs/dbraw/zinc/40/31/87/358403187.db2.gz	NUZHIPKFKDTOPX-CYBMUJFWSA-N	1	0	281.331	1.620	50	0		CDAARO
CC(C)=CCC[N@@H+]1CC[C@@]2(C1)CCCN(CCO)C2=O	ZINC000091562825	358518313	/nfs/dbraw/zinc/51/83/13/358518313.db2.gz	ISKYEXKJQRWTFS-MRXNPFEDSA-N	1	0	280.412	1.650	50	0		CDAARO
C[C@H](C[N@@H+]1C[C@@H](C)O[C@H](C(N)=O)C1)c1ccc(F)cc1	ZINC000195573079	358566898	/nfs/dbraw/zinc/56/68/98/358566898.db2.gz	ONYSJKIEDCRUAN-GYSYKLTISA-N	1	0	280.343	1.504	50	0		CDAARO
Cc1noc(CN(C)C(=O)CC[C@@H]2CCC[N@H+](C)C2)n1	ZINC000095361776	358685805	/nfs/dbraw/zinc/68/58/05/358685805.db2.gz	NDUXTHUBHWHLCO-LBPRGKRZSA-N	1	0	280.372	1.458	50	0		CDAARO
Cc1nnc(N2C[C@H]3CC[C@H](C[N@H+]3CC3CC3)C2)o1	ZINC000095361566	358685818	/nfs/dbraw/zinc/68/58/18/358685818.db2.gz	WRUVRQZNWFRLAA-CHWSQXEVSA-N	1	0	262.357	1.689	50	0		CDAARO
C[C@@H](Cc1ccccc1F)[NH2+]CC(=O)N1CCOCC1	ZINC000186743203	358820838	/nfs/dbraw/zinc/82/08/38/358820838.db2.gz	XHVUZTONHINGKV-LBPRGKRZSA-N	1	0	280.343	1.205	50	0		CDAARO
O=C(c1ccc(C[NH+]2CCCCC2)cc1)N1CC(O)C1	ZINC000097499502	358780412	/nfs/dbraw/zinc/78/04/12/358780412.db2.gz	DDNUQVWOHFHILX-UHFFFAOYSA-N	1	0	274.364	1.489	50	0		CDAARO
Cc1c2ccccc2n(C)c1C(=O)NC[C@H]1CCC[NH2+]1	ZINC000097642008	358789317	/nfs/dbraw/zinc/78/93/17/358789317.db2.gz	UKQUHMSKGCHMIN-GFCCVEGCSA-N	1	0	271.364	1.969	50	0		CDAARO
COCC[NH+]1CCC(CN(C)Cc2cscn2)CC1	ZINC000215038782	358870876	/nfs/dbraw/zinc/87/08/76/358870876.db2.gz	DGMIRNWUGCCBDJ-UHFFFAOYSA-N	1	0	283.441	1.933	50	0		CDAARO
COCCOC1CC[NH+](Cc2cccnc2N)CC1	ZINC000215226925	358879553	/nfs/dbraw/zinc/87/95/53/358879553.db2.gz	FGHIYQFJKIZQPP-UHFFFAOYSA-N	1	0	265.357	1.291	50	0		CDAARO
CC(C)c1ncc(CN2CC[N@@H+]3CCC[C@@H]3C2)cn1	ZINC000215829398	358905496	/nfs/dbraw/zinc/90/54/96/358905496.db2.gz	GCLANQFQVKSWNC-CQSZACIVSA-N	1	0	260.385	1.880	50	0		CDAARO
CCc1nccc(CN2CC[NH+](CCSC)CC2)n1	ZINC000215934077	358910453	/nfs/dbraw/zinc/91/04/53/358910453.db2.gz	BSRDPDNZKHQMBP-UHFFFAOYSA-N	1	0	280.441	1.520	50	0		CDAARO
C[N@H+](Cc1ccc(F)c(Cl)c1)[C@H]1COC[C@@H]1O	ZINC000216381400	358941847	/nfs/dbraw/zinc/94/18/47/358941847.db2.gz	OUJIHQKVXNEKJT-RYUDHWBXSA-N	1	0	259.708	1.671	50	0		CDAARO
CSc1ccc2c(c1)CCN(C(=O)[C@H]1CC[NH2+]C1)C2	ZINC000216433357	358944802	/nfs/dbraw/zinc/94/48/02/358944802.db2.gz	FXXKEMIOGMCKSN-LBPRGKRZSA-N	1	0	276.405	1.903	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1ccc(OC)cc1O	ZINC000019840145	358999669	/nfs/dbraw/zinc/99/96/69/358999669.db2.gz	OYAGXVGFHWUOEU-NSHDSACASA-N	1	0	278.352	1.615	50	0		CDAARO
COC[C@@H]1C[N@H+](Cc2ccoc2)C[C@H]1C(=O)N(C)C	ZINC000257178376	359140189	/nfs/dbraw/zinc/14/01/89/359140189.db2.gz	BSSCHUVZJXMDPZ-QWHCGFSZSA-N	1	0	266.341	1.062	50	0		CDAARO
O[C@@H](c1cc2n(n1)CCN(Cc1ccncc1)C2)C1CC1	ZINC000221443327	359249118	/nfs/dbraw/zinc/24/91/18/359249118.db2.gz	WAVVOGFHKHQZDI-MRXNPFEDSA-N	1	0	284.363	1.737	50	0		CDAARO
C[NH2+][C@@H](C(=O)NCCc1cn[nH]c1)c1ccccc1	ZINC000221195848	359216115	/nfs/dbraw/zinc/21/61/15/359216115.db2.gz	XSWHLJWRIHLCOW-CYBMUJFWSA-N	1	0	258.325	1.029	50	0		CDAARO
COc1ccc(F)c(F)c1C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000222606936	359359234	/nfs/dbraw/zinc/35/92/34/359359234.db2.gz	BXGINUXHCBGQLZ-QMMMGPOBSA-N	1	0	270.279	1.394	50	0		CDAARO
C[NH+](C)[C@H]1CN(C(=O)Cc2ccc3ccccc3c2)C[C@@H]1O	ZINC000222769077	359372316	/nfs/dbraw/zinc/37/23/16/359372316.db2.gz	DDBZPAPLCNUTLQ-IRXDYDNUSA-N	1	0	298.386	1.516	50	0		CDAARO
OCCC[NH+]1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000034122270	359382363	/nfs/dbraw/zinc/38/23/63/359382363.db2.gz	ZAEAUCCGSDCTJJ-UHFFFAOYSA-N	1	0	268.788	1.840	50	0		CDAARO
CCc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)NC(N)=O)cc1	ZINC000024990398	359332534	/nfs/dbraw/zinc/33/25/34/359332534.db2.gz	FQPAYLZJLFVBNR-ZJUUUORDSA-N	1	0	263.341	1.483	50	0		CDAARO
NS(=O)(=O)c1ccc(OCC[NH+]2CCCCC2)cc1	ZINC000027269036	359479824	/nfs/dbraw/zinc/47/98/24/359479824.db2.gz	BWOSYZNIBAXVRF-UHFFFAOYSA-N	1	0	284.381	1.199	50	0		CDAARO
COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H](C)C(=O)NC(N)=O	ZINC000012781958	359659747	/nfs/dbraw/zinc/65/97/47/359659747.db2.gz	FKKBGXLWSHSIKZ-ZJUUUORDSA-N	1	0	279.340	1.238	50	0		CDAARO
CCN(CC)C(=O)[C@@H](C)OC(=O)C[C@@H](C[NH3+])CC(C)C	ZINC000408525602	359936022	/nfs/dbraw/zinc/93/60/22/359936022.db2.gz	HTWBXPQPQQWLGV-OLZOCXBDSA-N	1	0	286.416	1.798	50	0		CDAARO
CC(=O)Nc1ccc2n(CCO)c3ccccc3[n+]2c1	ZINC000000387484	360005842	/nfs/dbraw/zinc/00/58/42/360005842.db2.gz	SDHNELMZKRDXNI-UHFFFAOYSA-O	1	0	270.312	1.331	50	0		CDAARO
O=C([C@@H]1CCCC[NH2+]1)N1CCC[C@@H](C(F)(F)F)C1	ZINC000037750003	296009165	/nfs/dbraw/zinc/00/91/65/296009165.db2.gz	GFZYGWFRPFUEFF-ZJUUUORDSA-N	1	0	264.291	1.929	50	0		CDAARO
CN(C)C(=O)c1nc(-c2ccc(C[NH+](C)C)cc2)n[nH]1	ZINC000426490058	360571505	/nfs/dbraw/zinc/57/15/05/360571505.db2.gz	KDABRXHEYGNHJW-UHFFFAOYSA-N	1	0	273.340	1.235	50	0		CDAARO
Cc1nc[nH]c1CNC(=O)C[C@H]1CCCC[N@H+]1C	ZINC000426612260	360587106	/nfs/dbraw/zinc/58/71/06/360587106.db2.gz	FAXDSEFIZVYFDI-LLVKDONJSA-N	1	0	250.346	1.209	50	0		CDAARO
COc1cccc(CNC(=O)N2CC[C@@H](C[NH3+])C2)c1	ZINC000426517676	360679095	/nfs/dbraw/zinc/67/90/95/360679095.db2.gz	VBEDWGGJPZKASV-LBPRGKRZSA-N	1	0	263.341	1.185	50	0		CDAARO
Cc1ccccc1-n1c(C[NH3+])nnc1SC[C@H](C)CO	ZINC000426545186	360681791	/nfs/dbraw/zinc/68/17/91/360681791.db2.gz	SQYHXSBJHKYDDB-SNVBAGLBSA-N	1	0	292.408	1.755	50	0		CDAARO
C[NH2+]Cc1nnc(SCCO)n1-c1cccc(Cl)c1	ZINC000426545422	360682047	/nfs/dbraw/zinc/68/20/47/360682047.db2.gz	XQRKZQDZIAJROG-UHFFFAOYSA-N	1	0	298.799	1.725	50	0		CDAARO
CN(CCC[NH+](C)C)C(=O)c1cnc(-c2ccccn2)nc1	ZINC000426550075	360682836	/nfs/dbraw/zinc/68/28/36/360682836.db2.gz	REOUIXXHOJFDJI-UHFFFAOYSA-N	1	0	299.378	1.562	50	0		CDAARO
OCCn1ccc([C@H]2CCC[N@@H+](C3CCOCC3)C2)n1	ZINC000426606679	360687661	/nfs/dbraw/zinc/68/76/61/360687661.db2.gz	BZVIWULBHJUKRG-ZDUSSCGKSA-N	1	0	279.384	1.234	50	0		CDAARO
Cn1c(Sc2cnccn2)nnc1[C@@H]1CCC[NH2+]C1	ZINC000426409234	360666296	/nfs/dbraw/zinc/66/62/96/360666296.db2.gz	FZKDPYIGSPITGP-SECBINFHSA-N	1	0	276.369	1.223	50	0		CDAARO
Cc1ncn(CCNC(=O)[C@H](C)[NH+]2CCCCC2)c1C	ZINC000426443313	360670515	/nfs/dbraw/zinc/67/05/15/360670515.db2.gz	MXXRDPWYBIDBBA-AWEZNQCLSA-N	1	0	278.400	1.491	50	0		CDAARO
CO[C@]12CC[N@H+](Cc3nccnc3C)[C@H]1C[C@H](O)CC2	ZINC000426486081	360675455	/nfs/dbraw/zinc/67/54/55/360675455.db2.gz	VELZLRJBNFWLPF-VHDGCEQUSA-N	1	0	277.368	1.289	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)Cc2cn3ccccc3n2)C1	ZINC000178593898	189129684	/nfs/dbraw/zinc/12/96/84/189129684.db2.gz	SNXLLBFQUGGENC-GFCCVEGCSA-N	1	0	272.352	1.087	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)/C=C/c2cncc(F)c2)C1	ZINC000178992160	189160091	/nfs/dbraw/zinc/16/00/91/189160091.db2.gz	DLTKTBQPEBUIHO-JDGPPOGSSA-N	1	0	263.316	1.302	50	0		CDAARO
CCOC(=O)CNC(=O)C1CC[NH+]([C@H]2C=CCCC2)CC1	ZINC000179105776	189170146	/nfs/dbraw/zinc/17/01/46/189170146.db2.gz	VZBNIBMVGLSZSH-AWEZNQCLSA-N	1	0	294.395	1.486	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1cnc(-c2ccncc2)s1	ZINC000179113554	189170679	/nfs/dbraw/zinc/17/06/79/189170679.db2.gz	WMJUKDQVYQEDQN-SNVBAGLBSA-N	1	0	288.376	1.639	50	0		CDAARO
Cc1noc(C)c1S(=O)(=O)NC[C@@H](C)[NH+]1CCCC1	ZINC000036077290	360832729	/nfs/dbraw/zinc/83/27/29/360832729.db2.gz	PZCREMVNEPAZEJ-SECBINFHSA-N	1	0	287.385	1.054	50	0		CDAARO
Cc1nc[nH]c1C[NH2+][C@H]1CC(=O)N(CCc2ccccc2)C1	ZINC000012445734	361671828	/nfs/dbraw/zinc/67/18/28/361671828.db2.gz	JTPFPRUFGGQLJF-HNNXBMFYSA-N	1	0	298.390	1.651	50	0		CDAARO
CC(C)CNC(=O)NC(=O)C[N@@H+]1CCCC[C@@H]1C	ZINC000007486483	364119389	/nfs/dbraw/zinc/11/93/89/364119389.db2.gz	XZZUMZKCHBASNK-NSHDSACASA-N	1	0	255.362	1.343	50	0		CDAARO
O=C([C@@H]1CC=CCC1)N1CC[NH+](C[C@@H]2CCOC2)CC1	ZINC000098018728	364971870	/nfs/dbraw/zinc/97/18/70/364971870.db2.gz	JUZYFJBEPNTDDF-LSDHHAIUSA-N	1	0	278.396	1.523	50	0		CDAARO
NC(=O)CC[N@@H+]1CCS[C@@H](c2ccccc2)C1	ZINC000089828120	366941402	/nfs/dbraw/zinc/94/14/02/366941402.db2.gz	NTFCDVKEGMIURL-GFCCVEGCSA-N	1	0	250.367	1.652	50	0		CDAARO
CC(C)CN1CCO[C@@H](C[NH2+][C@@H](C)C2CCOCC2)C1	ZINC000089840206	366944249	/nfs/dbraw/zinc/94/42/49/366944249.db2.gz	WVFMHTWNODRJPM-HOCLYGCPSA-N	1	0	284.444	1.748	50	0		CDAARO
C[C@@H](CC(=O)N(C)C)[NH2+]C[C@H](O)c1c(F)cccc1F	ZINC000090078228	367013434	/nfs/dbraw/zinc/01/34/34/367013434.db2.gz	ZIANQVNWJLCQEV-CABZTGNLSA-N	1	0	286.322	1.455	50	0		CDAARO
Nc1[nH]c2ccc(I)cc2[nH+]1	ZINC000088270955	367267499	/nfs/dbraw/zinc/26/74/99/367267499.db2.gz	ZWCSKUASORKDRC-UHFFFAOYSA-N	1	0	259.050	1.750	50	0		CDAARO
Cc1c[nH+]c(C2CCC2)n1CCNC(=O)c1ccnn1C	ZINC000575554479	369117715	/nfs/dbraw/zinc/11/77/15/369117715.db2.gz	FADJCZPLOJDRGV-UHFFFAOYSA-N	1	0	287.367	1.623	50	0		CDAARO
CC(C)[C@H](O)C[N@@H+]1CCC[C@@H](c2ccnc(N)n2)C1	ZINC000367928099	369291148	/nfs/dbraw/zinc/29/11/48/369291148.db2.gz	HVVVGZZCRFCNFU-DGCLKSJQSA-N	1	0	264.373	1.085	50	0		CDAARO
Cn1ncc2c1ncnc2N[C@H]1CC[N@@H+](C2CC2)C1	ZINC000044411825	370349871	/nfs/dbraw/zinc/34/98/71/370349871.db2.gz	LYESEGDDRUNEAG-VIFPVBQESA-N	1	0	258.329	1.012	50	0		CDAARO
COc1cc(C(=O)CC[NH+](C)C)cc(OC)c1OC	ZINC000001670998	370542507	/nfs/dbraw/zinc/54/25/07/370542507.db2.gz	ZHYLLQLGGCGWTQ-UHFFFAOYSA-N	1	0	267.325	1.847	50	0	biogenic,in-vitro	CDAARO
O=C(NCC1CC[NH+]([C@H]2CCOC2)CC1)c1ccccc1	ZINC000575606829	370617652	/nfs/dbraw/zinc/61/76/52/370617652.db2.gz	MLKAAJVOYKVBON-INIZCTEOSA-N	1	0	288.391	1.917	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@H](CNc2ncnc(N)c2Cl)C1	ZINC000192268913	371837402	/nfs/dbraw/zinc/83/74/02/371837402.db2.gz	LWJMQQWRERJTGM-SNVBAGLBSA-N	1	0	299.806	1.481	50	0		CDAARO
Cc1ncc(C(=O)N[C@@H](C)C[NH+]2CCCCC2)c(C)n1	ZINC000179881229	372319603	/nfs/dbraw/zinc/31/96/03/372319603.db2.gz	GCXQRMLSEKRZLJ-NSHDSACASA-N	1	0	276.384	1.698	50	0		CDAARO
COC(=O)c1ccccc1C(=O)N1CCC([NH3+])CC1	ZINC000067801093	372359175	/nfs/dbraw/zinc/35/91/75/372359175.db2.gz	YVQJSULTKZYTKL-UHFFFAOYSA-N	1	0	262.309	1.037	50	0		CDAARO
Cn1ccnc1NC(=O)CC[C@@H]1CCCC[N@@H+]1C	ZINC000578484772	372474059	/nfs/dbraw/zinc/47/40/59/372474059.db2.gz	NBCVMBXYCGKOKQ-NSHDSACASA-N	1	0	250.346	1.623	50	0		CDAARO
Cn1cc(-c2cc(CN3CC[N@@H+]4CCC[C@@H]4C3)on2)cn1	ZINC000185000288	372659900	/nfs/dbraw/zinc/65/99/00/372659900.db2.gz	KPSHTDKFWUDMJW-CYBMUJFWSA-N	1	0	287.367	1.355	50	0		CDAARO
CCc1nnc(CNC(=O)C[C@H](C)n2ccnc2C)s1	ZINC000299778580	372755300	/nfs/dbraw/zinc/75/53/00/372755300.db2.gz	PSSDEZIZWJTFMB-VIFPVBQESA-N	1	0	293.396	1.873	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)c1cc(Br)c[nH]1	ZINC000004038485	372946991	/nfs/dbraw/zinc/94/69/91/372946991.db2.gz	BRFRCHRNZDLZJR-UHFFFAOYSA-N	1	0	286.173	1.603	50	0		CDAARO
C[C@H](c1cnccn1)N1C[C@@H]2C[N@@H+]3CCCC[C@H]3[C@@H]2C1	ZINC000253370470	373679210	/nfs/dbraw/zinc/67/92/10/373679210.db2.gz	RGQIXNORXCMUOF-CTASWTNQSA-N	1	0	272.396	1.954	50	0		CDAARO
CC(C)[C@H]([NH2+][C@@H](C(N)=O)c1ccc(F)cc1)C(C)(C)O	ZINC000253429355	373736087	/nfs/dbraw/zinc/73/60/87/373736087.db2.gz	MYILKVMYNZSCNO-OLZOCXBDSA-N	1	0	282.359	1.737	50	0		CDAARO
O=C([C@H]1CC[NH2+]C1)N1CCc2c1cc(F)cc2F	ZINC000253429993	373736255	/nfs/dbraw/zinc/73/62/55/373736255.db2.gz	DNTCBXJWXONKLN-QMMMGPOBSA-N	1	0	252.264	1.463	50	0		CDAARO
COc1cc(C)nc(N2CCC[C@H]([NH+](C)C)CC2)n1	ZINC000253433660	373748563	/nfs/dbraw/zinc/74/85/63/373748563.db2.gz	ZUIFWMYIXDVMJR-LBPRGKRZSA-N	1	0	264.373	1.714	50	0		CDAARO
C[C@@H](CC(=O)N1C[C@@H](C)OC[C@H]1C)[C@H]1CCC[NH2+]C1	ZINC000251704640	189971076	/nfs/dbraw/zinc/97/10/76/189971076.db2.gz	OJDVBUFDOCBURR-DGAVXFQQSA-N	1	0	268.401	1.648	50	0		CDAARO
CC[C@H](CO)[NH+]1CCN(Cc2ccc(C)s2)CC1	ZINC000093739890	374782354	/nfs/dbraw/zinc/78/23/54/374782354.db2.gz	LXLYTYHFDDLZOF-CYBMUJFWSA-N	1	0	268.426	1.945	50	0		CDAARO
CCCC[C@@H]([NH3+])C(=O)N1CCC(N2CCCCC2=O)CC1	ZINC000095466815	374962355	/nfs/dbraw/zinc/96/23/55/374962355.db2.gz	YWDOZQSUMOIHEJ-CQSZACIVSA-N	1	0	295.427	1.507	50	0		CDAARO
C[NH+]1CCC(O)(CNC(=O)Nc2cccnc2Cl)CC1	ZINC000095400075	374905362	/nfs/dbraw/zinc/90/53/62/374905362.db2.gz	ANQJAWAEDGTHEJ-UHFFFAOYSA-N	1	0	298.774	1.313	50	0		CDAARO
COc1c(C[NH2+][C@H]2COc3ccccc3C2)c(C)nn1C	ZINC000058293117	375722194	/nfs/dbraw/zinc/72/21/94/375722194.db2.gz	DMFASHIASVVPEY-CYBMUJFWSA-N	1	0	287.363	1.830	50	0		CDAARO
COCC1(CNC(=O)[C@H](C)C[NH+]2CCOCC2)CCCC1	ZINC000456864091	375829912	/nfs/dbraw/zinc/82/99/12/375829912.db2.gz	ZMWPVWJZWPEEKB-CQSZACIVSA-N	1	0	298.427	1.278	50	0		CDAARO
CCc1noc([C@H](C)[NH2+][C@H]2CCN(C(C)=O)C[C@H]2CC)n1	ZINC000241126024	376016824	/nfs/dbraw/zinc/01/68/24/376016824.db2.gz	JIZOCQKXXIGVTL-UHTWSYAYSA-N	1	0	294.399	1.930	50	0		CDAARO
COC(=O)CCC[N@@H+]1C[C@H](O)C[C@H]1C1CCCCC1	ZINC000241277609	376019963	/nfs/dbraw/zinc/01/99/63/376019963.db2.gz	LHOMIELMWPRDIO-KGLIPLIRSA-N	1	0	269.385	1.955	50	0		CDAARO
CNC(=O)[C@@H](C[NH3+])Cc1ccc(OC(F)(F)F)cc1	ZINC000050303847	376059252	/nfs/dbraw/zinc/05/92/52/376059252.db2.gz	SLRRUDOVAFEXFK-SECBINFHSA-N	1	0	276.258	1.449	50	0		CDAARO
O=C1N[C@]2(CC[NH2+]C2)C(=O)N1Cc1ccc(Cl)cc1	ZINC000098212701	296398080	/nfs/dbraw/zinc/39/80/80/296398080.db2.gz	WOBVAXIGPXLMIT-ZDUSSCGKSA-N	1	0	279.727	1.124	50	0		CDAARO
C[NH2+]Cc1cccc(N2C[C@@H](C)CS2(=O)=O)c1	ZINC000093640862	184699353	/nfs/dbraw/zinc/69/93/53/184699353.db2.gz	OJQNACRHAPGOEA-SNVBAGLBSA-N	1	0	254.355	1.192	50	0		CDAARO
CC1(C)C[C@@H]([NH2+]CCc2nnc3n2CCC3)C(C)(C)O1	ZINC000095419916	184975250	/nfs/dbraw/zinc/97/52/50/184975250.db2.gz	PGYZFRLHEAATCN-LLVKDONJSA-N	1	0	278.400	1.703	50	0		CDAARO
Cc1cc(F)cc(S(=O)(=O)NCC(C)(C)[NH3+])c1	ZINC000095432140	184982382	/nfs/dbraw/zinc/98/23/82/184982382.db2.gz	ROGZEDZGRCXDQH-UHFFFAOYSA-N	1	0	260.334	1.150	50	0		CDAARO
CC1=C[C@H](C)[C@H]2C(=O)N(CCC[NH+](C)C)C(=O)[C@H]2C1	ZINC000019757215	390229290	/nfs/dbraw/zinc/22/92/90/390229290.db2.gz	OLVIZFKZLFJCGX-RWMBFGLXSA-N	1	0	264.369	1.525	50	0		CDAARO
Cn1cc(CCCOC(=O)c2ccn3c[nH+]cc3c2)cn1	ZINC000095463426	184994021	/nfs/dbraw/zinc/99/40/21/184994021.db2.gz	CTGQSOFQAKNERW-UHFFFAOYSA-N	1	0	284.319	1.857	50	0		CDAARO
CCOC(=O)CCCC[N@H+]1C[C@H]2CCC[C@@H](C1)C2O	ZINC000096417428	390511881	/nfs/dbraw/zinc/51/18/81/390511881.db2.gz	MUIGXIWBISCLSJ-NNQSOWQGSA-N	1	0	269.385	1.813	50	0		CDAARO
c1ccc(CN2CCC[N@@H+](C3CCOCC3)CC2)nc1	ZINC000096415704	390512172	/nfs/dbraw/zinc/51/21/72/390512172.db2.gz	UEYGOUCYQDIWIO-UHFFFAOYSA-N	1	0	275.396	1.768	50	0		CDAARO
CC(C)[N@H+]1C[C@H](N[C@@H](C)c2cnn(C)c2)[C@@H](C)C1	ZINC000096478368	390523742	/nfs/dbraw/zinc/52/37/42/390523742.db2.gz	YEXXIVAENYCGHI-OBJOEFQTSA-N	1	0	250.390	1.799	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]CCCN1CCCC1=O	ZINC000097159556	390800995	/nfs/dbraw/zinc/80/09/95/390800995.db2.gz	ROSRXVXBIUSLHH-UHFFFAOYSA-N	1	0	250.346	1.129	50	0		CDAARO
C[C@@H](CCNC(=O)N1CCC(CO)CC1)[NH+]1CCCCC1	ZINC000096502600	533595672	/nfs/dbraw/zinc/59/56/72/533595672.db2.gz	BLJZMQLVOVNPCZ-AWEZNQCLSA-N	1	0	297.443	1.665	50	0		CDAARO
CCOc1cc(CNC(=O)N2CC[C@@H]([NH3+])C2)ccc1OC	ZINC000417646238	391720461	/nfs/dbraw/zinc/72/04/61/391720461.db2.gz	IHYIZQAJSCWCDA-GFCCVEGCSA-N	1	0	293.367	1.337	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCCN1C(=O)c1ccc(N(C)C)nc1	ZINC000121965761	392070856	/nfs/dbraw/zinc/07/08/56/392070856.db2.gz	AKHLLJDLOSYWSL-YPMHNXCESA-N	1	0	276.384	1.490	50	0		CDAARO
Cc1ccc([C@H](C)NC(=O)C[N@@H+]2CCC[C@H]2CO)cc1C	ZINC000240225324	131079472	/nfs/dbraw/zinc/07/94/72/131079472.db2.gz	DHEHUSFYRRZHNW-HOCLYGCPSA-N	1	0	290.407	1.937	50	0		CDAARO
C[C@@H]1COC[C@@H](C)N1C(=O)C[C@H]([NH3+])c1ccccc1	ZINC000262935872	131274918	/nfs/dbraw/zinc/27/49/18/131274918.db2.gz	TYOUAIBVGDAFRF-BZPMIXESSA-N	1	0	262.353	1.712	50	0		CDAARO
COCC1(C[NH2+][C@H](C)CS(C)(=O)=O)CCCC1	ZINC000449741516	392893496	/nfs/dbraw/zinc/89/34/96/392893496.db2.gz	KNQHRBKMEQPBDK-LLVKDONJSA-N	1	0	263.403	1.216	50	0		CDAARO
O=C(NC[C@@H](O)c1ccccc1F)[C@H]1CCCC[NH2+]1	ZINC000269099509	132111788	/nfs/dbraw/zinc/11/17/88/132111788.db2.gz	QLQQXJQCQMSLLA-CHWSQXEVSA-N	1	0	266.316	1.117	50	0		CDAARO
O=S1(=O)CCN(C2CCC3(CC[NH2+]CC3)CC2)CC1	ZINC000067856730	296484842	/nfs/dbraw/zinc/48/48/42/296484842.db2.gz	UDJORGQZEQSFKW-UHFFFAOYSA-N	1	0	286.441	1.029	50	0		CDAARO
C[NH+](C)CCN(C[C@H]1CCCO1)C(=O)Cc1cccnc1	ZINC000096410132	393181916	/nfs/dbraw/zinc/18/19/16/393181916.db2.gz	MWGFHIQRSCASAS-OAHLLOKOSA-N	1	0	291.395	1.193	50	0		CDAARO
CC[NH+](CC)CCNC(=O)Nc1nnc2ccccn21	ZINC000096410646	393182204	/nfs/dbraw/zinc/18/22/04/393182204.db2.gz	OEVRNQYFUOAEET-UHFFFAOYSA-N	1	0	276.344	1.193	50	0		CDAARO
CCN1CC[NH+](C[C@@H](C)CNc2ccccn2)CC1	ZINC000195575039	393304390	/nfs/dbraw/zinc/30/43/90/393304390.db2.gz	VIGKHYLIZMBJGH-AWEZNQCLSA-N	1	0	262.401	1.767	50	0		CDAARO
CC1=CCC[C@@H](C)[C@H]1C[N@H+](C)CC(=O)N1CCC(O)CC1	ZINC000195575803	393304472	/nfs/dbraw/zinc/30/44/72/393304472.db2.gz	AEZPCKCAXRYNGG-ZBFHGGJFSA-N	1	0	294.439	1.894	50	0		CDAARO
[NH3+]C[C@@H]1CN(c2nccc(C3CCCC3)n2)CCO1	ZINC000071750436	134976708	/nfs/dbraw/zinc/97/67/08/134976708.db2.gz	NVQDPHNJBDLEJS-GFCCVEGCSA-N	1	0	262.357	1.298	50	0		CDAARO
C[C@@H]1CCC[C@H](NC(=O)CCC(=O)NCC[NH+](C)C)[C@H]1C	ZINC000103140227	397889685	/nfs/dbraw/zinc/88/96/85/397889685.db2.gz	BVMNLTCKDVFEQL-RDBSUJKOSA-N	1	0	297.443	1.385	50	0		CDAARO
C[C@@H]1CCC[C@H]1[NH2+]Cc1cnc(N2CCOCC2)nc1	ZINC000105505299	398042322	/nfs/dbraw/zinc/04/23/22/398042322.db2.gz	DHZRXRMSZDDLFI-TZMCWYRMSA-N	1	0	276.384	1.591	50	0		CDAARO
O=C(c1ccccc1)N1CCC[N@@H+]([C@@H]2CCOC2)CC1	ZINC000335937733	151130912	/nfs/dbraw/zinc/13/09/12/151130912.db2.gz	GTHDFTZSCIJTBK-OAHLLOKOSA-N	1	0	274.364	1.623	50	0		CDAARO
COc1ccc(OC[C@H](O)C[NH+]2CCCC2)cc1	ZINC000000127550	286346382	/nfs/dbraw/zinc/34/63/82/286346382.db2.gz	KSIRTXNTGFVNAU-GFCCVEGCSA-N	1	0	251.326	1.531	50	0		CDAARO
Cn1cc(NC(=O)NCC[NH+](C)C)c2ccccc21	ZINC000005265665	170081213	/nfs/dbraw/zinc/08/12/13/170081213.db2.gz	KJYOVJWGTKUOMF-UHFFFAOYSA-N	1	0	260.341	1.861	50	0		CDAARO
CC(=O)Nc1ccccc1C(=O)NCCC[NH+](C)C	ZINC000005378589	170091575	/nfs/dbraw/zinc/09/15/75/170091575.db2.gz	SOOFOQFJLQQWFX-UHFFFAOYSA-N	1	0	263.341	1.327	50	0		CDAARO
CC[NH+](CC)CCNS(=O)(=O)c1ccccc1	ZINC000006555541	170212513	/nfs/dbraw/zinc/21/25/13/170212513.db2.gz	TYEWCFOXOODIQX-UHFFFAOYSA-N	1	0	256.371	1.307	50	0		CDAARO
[NH3+]C[C@H](c1ccco1)S(=O)(=O)c1cccs1	ZINC000007951985	170309254	/nfs/dbraw/zinc/30/92/54/170309254.db2.gz	LYCBVRRTCWLGPC-SECBINFHSA-N	1	0	257.336	1.815	50	0		CDAARO
[NH3+]C[C@@H](c1cccnc1)S(=O)(=O)c1ccccc1	ZINC000008031082	170315065	/nfs/dbraw/zinc/31/50/65/170315065.db2.gz	PPXANUXCMGIIFL-ZDUSSCGKSA-N	1	0	262.334	1.555	50	0		CDAARO
NC(=O)C1CC[NH+](CCOc2ccccc2Cl)CC1	ZINC000008317235	170330662	/nfs/dbraw/zinc/33/06/62/170330662.db2.gz	VBXJUTSQSGSQSK-UHFFFAOYSA-N	1	0	282.771	1.916	50	0		CDAARO
CCc1nc(NCC[C@H](C)[NH+]2CCN(C)CC2)no1	ZINC000534647869	411829660	/nfs/dbraw/zinc/82/96/60/411829660.db2.gz	HIODIWSBSZIALT-NSHDSACASA-N	1	0	267.377	1.070	50	0		CDAARO
COc1ccc(C[NH2+]CCN2CCOCC2)cc1	ZINC000019555888	170827420	/nfs/dbraw/zinc/82/74/20/170827420.db2.gz	OFSPJMCOJMZMPM-UHFFFAOYSA-N	1	0	250.342	1.117	50	0		CDAARO
OCC[C@@H]1C[NH2+]CCN1Cc1c(F)cccc1Cl	ZINC000020219131	171082528	/nfs/dbraw/zinc/08/25/28/171082528.db2.gz	XEVOTRDYGJQNRJ-SNVBAGLBSA-N	1	0	272.751	1.635	50	0		CDAARO
O=Cc1ccc(OCCCC[NH+]2CCOCC2)cc1	ZINC000020326114	171151057	/nfs/dbraw/zinc/15/10/57/171151057.db2.gz	OKSBZUFSSUJIAN-UHFFFAOYSA-N	1	0	263.337	1.990	50	0		CDAARO
c1nnnn1-c1ccc(N[C@H]2C[NH+]3CCC2CC3)cc1	ZINC000020441228	171204253	/nfs/dbraw/zinc/20/42/53/171204253.db2.gz	UGWSBBOJQCXYMW-AWEZNQCLSA-N	1	0	270.340	1.168	50	0		CDAARO
COc1ccc(C(=O)N2CCC[N@H+](C)CC2)cc1OC	ZINC000020478643	171221623	/nfs/dbraw/zinc/22/16/23/171221623.db2.gz	IWCVYSUFIIRJEL-UHFFFAOYSA-N	1	0	278.352	1.482	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)Nc2ccc(F)cc2)CC1	ZINC000020595154	171263966	/nfs/dbraw/zinc/26/39/66/171263966.db2.gz	DCRVLQUBFDKOTH-UHFFFAOYSA-N	1	0	279.359	1.792	50	0		CDAARO
CCCn1c2ccccc2nc1NCCN1CC[NH2+]CC1	ZINC000022542205	171390453	/nfs/dbraw/zinc/39/04/53/171390453.db2.gz	AUCSRSXQEVZCNW-UHFFFAOYSA-N	1	0	287.411	1.763	50	0		CDAARO
CC[NH+](CC)[C@H](CNC(=O)c1ccc(=O)[nH]n1)C(C)C	ZINC000031378997	171636645	/nfs/dbraw/zinc/63/66/45/171636645.db2.gz	RJFFKNJYTDMKTD-GFCCVEGCSA-N	1	0	280.372	1.278	50	0		CDAARO
Cn1cc(C[NH2+]C[C@H]2CCN(CC(F)(F)F)C2)cn1	ZINC000037648456	173598221	/nfs/dbraw/zinc/59/82/21/173598221.db2.gz	JMJLLXGIYHXKFZ-SNVBAGLBSA-N	1	0	276.306	1.394	50	0		CDAARO
CCC(=O)c1ccccc1OCCN1CC[NH2+][C@@H](C)C1	ZINC000040456375	174267429	/nfs/dbraw/zinc/26/74/29/174267429.db2.gz	MLFBEEPXDXFDKB-ZDUSSCGKSA-N	1	0	276.380	1.952	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)CCc1c(C)noc1C	ZINC000044867920	175268405	/nfs/dbraw/zinc/26/84/05/175268405.db2.gz	ZJQRYMLUODKSRP-CYBMUJFWSA-N	1	0	279.384	1.825	50	0		CDAARO
FC(F)(F)c1cccnc1NC[C@@H]1C[NH2+]CCOC1	ZINC000072148745	176325668	/nfs/dbraw/zinc/32/56/68/176325668.db2.gz	NDBDTWNHFWNFQD-VIFPVBQESA-N	1	0	275.274	1.748	50	0		CDAARO
c1cnc(Nc2cccc([C@@H]3C[NH2+]CCO3)n2)nc1	ZINC000072343438	176372186	/nfs/dbraw/zinc/37/21/86/176372186.db2.gz	DLFOWMWXXLOEBT-NSHDSACASA-N	1	0	257.297	1.276	50	0		CDAARO
C[C@@H]1C[NH+](C[C@H](O)COC2CCCC2)C[C@@H](C)O1	ZINC000012419916	424377492	/nfs/dbraw/zinc/37/74/92/424377492.db2.gz	VKESFLWTZYJZIP-UPJWGTAASA-N	1	0	257.374	1.416	50	0		CDAARO
CN(C)c1nccnc1-c1cccc2c1O[C@@H](C[NH3+])C2	ZINC000067883495	273825983	/nfs/dbraw/zinc/82/59/83/273825983.db2.gz	PQKRIDBPHJDWQD-LLVKDONJSA-N	1	0	270.336	1.472	50	0		CDAARO
CO[C@H](C[N@@H+]1C[C@H](O)C[C@H]1CO)c1ccc(Cl)cc1	ZINC000241383452	274077620	/nfs/dbraw/zinc/07/76/20/274077620.db2.gz	MVLKNDFMRJKBSU-BFHYXJOUSA-N	1	0	285.771	1.455	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(C(=O)c2ccc(N)nc2)CC1	ZINC000072151561	276869448	/nfs/dbraw/zinc/86/94/48/276869448.db2.gz	BFHFZUGNSCTNME-LBPRGKRZSA-N	1	0	262.357	1.220	50	0		CDAARO
C[NH+]1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1	ZINC000000354173	277115286	/nfs/dbraw/zinc/11/52/86/277115286.db2.gz	NFEURABHJCGQDE-UHFFFAOYSA-N	1	0	294.362	1.567	50	0		CDAARO
CSCCC[N@@H+]1CC[C@H]2[C@H](C1)OCc1cnnn12	ZINC000299768828	278128897	/nfs/dbraw/zinc/12/88/97/278128897.db2.gz	QJLGEABQKGLXOO-RYUDHWBXSA-N	1	0	268.386	1.177	50	0		CDAARO
CCS(=O)(=O)N1CC[NH+]([C@H]2CCCC[C@H]2C)CC1	ZINC000004746106	280015186	/nfs/dbraw/zinc/01/51/86/280015186.db2.gz	OBHKVFLZCBWBCG-OLZOCXBDSA-N	1	0	274.430	1.532	50	0		CDAARO
C[C@]1(C(N)=O)CCCC[N@@H+]1Cc1cc2ccccc2[nH]c1=O	ZINC000097112705	280152084	/nfs/dbraw/zinc/15/20/84/280152084.db2.gz	PATTWNPPMADZCD-QGZVFWFLSA-N	1	0	299.374	1.758	50	0		CDAARO
CC1(C)CCC[C@@H]1[NH2+]CCN1CCCS1(=O)=O	ZINC000089520150	281033804	/nfs/dbraw/zinc/03/38/04/281033804.db2.gz	NXAOCMDDUYKSEF-NSHDSACASA-N	1	0	260.403	1.190	50	0		CDAARO
C[C@H](CCC(=O)N1CCCn2cncc2C1)[NH+]1CCCC1	ZINC000072134713	298366106	/nfs/dbraw/zinc/36/61/06/298366106.db2.gz	DFAQCQIUAYXZEQ-CQSZACIVSA-N	1	0	290.411	1.880	50	0		CDAARO
COCc1noc(CNC(=O)C[NH+]2CCCCCCC2)n1	ZINC000534576185	328309857	/nfs/dbraw/zinc/30/98/57/328309857.db2.gz	NCUONHQSSDQFNL-UHFFFAOYSA-N	1	0	296.371	1.098	50	0		CDAARO
C[C@H](C(=O)NCCc1cc[nH]n1)[NH+]1CCCCCC1	ZINC000534578221	328310649	/nfs/dbraw/zinc/31/06/49/328310649.db2.gz	ZGEUKWBFSBKZJR-GFCCVEGCSA-N	1	0	264.373	1.333	50	0		CDAARO
c1cnc(NC[C@H]2CC[N@@H+](C3CCCCC3)C2)cn1	ZINC000534590243	328317876	/nfs/dbraw/zinc/31/78/76/328317876.db2.gz	ATFTUVWXQZHMKE-CYBMUJFWSA-N	1	0	260.385	1.965	50	0		CDAARO
Cc1noc([C@@H](C)NC(=O)Cc2ccc3[nH]c(C)nc3c2)n1	ZINC000534648691	328343506	/nfs/dbraw/zinc/34/35/06/328343506.db2.gz	LAEKYRFHUFDWCF-MRVPVSSYSA-N	1	0	299.334	1.983	50	0		CDAARO
FC(F)(F)c1noc(CN2CCC3(C2)CC[NH2+]CC3)n1	ZINC000534655135	328339485	/nfs/dbraw/zinc/33/94/85/328339485.db2.gz	PAYOQCWPPKMYRQ-UHFFFAOYSA-N	1	0	290.289	1.664	50	0		CDAARO
CCc1c(C)sc2ncnc(N[C@H]3C[NH2+]C[C@@H]3OC)c12	ZINC000534660523	328339529	/nfs/dbraw/zinc/33/95/29/328339529.db2.gz	FPLFRPNLBNZRIS-QWRGUYRKSA-N	1	0	292.408	1.961	50	0		CDAARO
COC(=O)c1cc(O)cc(C(=O)NC(C)(C)C[NH+](C)C)c1	ZINC000534670838	328347287	/nfs/dbraw/zinc/34/72/87/328347287.db2.gz	GPPRUGMQBBUMLV-UHFFFAOYSA-N	1	0	294.351	1.249	50	0		CDAARO
Cc1c[nH]c(CN(C)C(=O)N[C@@H](C)C[NH+]2CCCC2)n1	ZINC000534675424	328356066	/nfs/dbraw/zinc/35/60/66/328356066.db2.gz	HCVBCFBXJWTBKY-LBPRGKRZSA-N	1	0	279.388	1.344	50	0		CDAARO
C[NH2+]C[C@H](C)CNS(=O)(=O)c1cc(C)c(C)s1	ZINC000195555243	323571948	/nfs/dbraw/zinc/57/19/48/323571948.db2.gz	JBSQKGXLLRLAIP-QMMMGPOBSA-N	1	0	276.427	1.499	50	0		CDAARO
Cc1nn(C)c2nc(C)nc(N(C)C[C@H]3CCC[N@@H+]3C)c12	ZINC000072438068	327110614	/nfs/dbraw/zinc/11/06/14/327110614.db2.gz	AFXHVTLNYFGBEC-GFCCVEGCSA-N	1	0	288.399	1.511	50	0		CDAARO
Cc1nc[nH]c1CN(CC[NH+](C)C)Cc1[nH]cnc1C	ZINC001772703962	1159439859	/nfs/dbraw/zinc/43/98/59/1159439859.db2.gz	QZXKOPCIMABMCG-UHFFFAOYSA-N	1	0	276.388	1.313	50	0		CDAARO
[NH3+][C@H]1CCC[C@@H]1C(=O)N1CCOc2ccccc2C1	ZINC000085370633	482578821	/nfs/dbraw/zinc/57/88/21/482578821.db2.gz	KRQDRGKPVDOLFI-STQMWFEESA-N	1	0	260.337	1.535	50	0		CDAARO
CC1(C)[C@H]2CC[C@]1(C)[C@H]([NH2+]CCCNS(C)(=O)=O)C2	ZINC000092721150	482634411	/nfs/dbraw/zinc/63/44/11/482634411.db2.gz	JWXYTCGVDSQFMG-OUCADQQQSA-N	1	0	288.457	1.730	50	0		CDAARO
CCOc1ccc(C[N@@H+]2CC[C@@H](CO)C2)cc1C[NH+](C)C	ZINC000670437450	482977417	/nfs/dbraw/zinc/97/74/17/482977417.db2.gz	IVRZFIRBVJWIJK-OAHLLOKOSA-N	1	0	292.423	1.961	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN(C(=O)CCc2ccncc2)C1	ZINC000670439293	482980663	/nfs/dbraw/zinc/98/06/63/482980663.db2.gz	QFYWJTPYFWMBDK-OAHLLOKOSA-N	1	0	291.395	1.051	50	0		CDAARO
C[N@H+](CC(=O)N1CCCC1)CC1(CO)CCCC1	ZINC000670441185	482985385	/nfs/dbraw/zinc/98/53/85/482985385.db2.gz	KUHLWERJRFYXPK-UHFFFAOYSA-N	1	0	254.374	1.093	50	0		CDAARO
CCc1cc(N(C)CC2(C)COC2)nc(N(C)C)[nH+]1	ZINC000670449248	483007354	/nfs/dbraw/zinc/00/73/54/483007354.db2.gz	MGWYTUSJNQRRII-UHFFFAOYSA-N	1	0	264.373	1.578	50	0		CDAARO
CNC(=O)C[C@H]1CC[N@H+](CCOc2cccc(OC)c2)C1	ZINC000670449431	483008788	/nfs/dbraw/zinc/00/87/88/483008788.db2.gz	GMRUUDGNBJXWIF-CYBMUJFWSA-N	1	0	292.379	1.532	50	0		CDAARO
COCCOC1CC[NH+]([C@@H](C)C(=O)N2CCCC2)CC1	ZINC000670452007	483014446	/nfs/dbraw/zinc/01/44/46/483014446.db2.gz	GNQNMINSOSRFRN-ZDUSSCGKSA-N	1	0	284.400	1.125	50	0		CDAARO
OC[C@H]1CCC[N@H+](CCNc2ncnc3[nH]ccc32)C1	ZINC000670465049	483055225	/nfs/dbraw/zinc/05/52/25/483055225.db2.gz	LYXTUQYOGOFMOR-NSHDSACASA-N	1	0	275.356	1.074	50	0		CDAARO
CCC[C@]1(CO)CCC[N@H+](CCn2cnnc2C)C1	ZINC000670473655	483083346	/nfs/dbraw/zinc/08/33/46/483083346.db2.gz	OYSHJHKYJSVJJZ-AWEZNQCLSA-N	1	0	266.389	1.461	50	0		CDAARO
CC(C)CCO[C@H]1CC[N@@H+]([C@@H](C)C(=O)N(C)C)C1	ZINC000083689200	483187778	/nfs/dbraw/zinc/18/77/78/483187778.db2.gz	UTRSMERQSHLDPN-STQMWFEESA-N	1	0	256.390	1.600	50	0		CDAARO
[NH3+]CC[C@H](NC(=O)N1CCOC2(CCC2)C1)C(F)(F)F	ZINC000667868575	483465492	/nfs/dbraw/zinc/46/54/92/483465492.db2.gz	DWOLWYSPUKXSGJ-VIFPVBQESA-N	1	0	295.305	1.231	50	0		CDAARO
CO[C@]1(C)C[C@H]([N@H+](C)C[C@@H](O)Cn2cccn2)C1(C)C	ZINC000247194231	521763954	/nfs/dbraw/zinc/76/39/54/521763954.db2.gz	BVTDFVLZXCWEKV-VNHYZAJKSA-N	1	0	281.400	1.379	50	0		CDAARO
CC(C)N1CCCC[C@@H]1C[NH2+][C@@H](C)CS(C)(=O)=O	ZINC000096491731	529005742	/nfs/dbraw/zinc/00/57/42/529005742.db2.gz	DBEFSNPSGLKEPA-QWHCGFSZSA-N	1	0	276.446	1.272	50	0		CDAARO
CCCCN(Cc1ccncc1)C(=O)[C@H]1C=CC[NH2+]1	ZINC000952982117	614960713	/nfs/dbraw/zinc/96/07/13/614960713.db2.gz	VJYQEQPRPLQNIP-CQSZACIVSA-N	1	0	259.353	1.738	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](CNC(=O)C2CCCC2)C1	ZINC000952966935	616340823	/nfs/dbraw/zinc/34/08/23/616340823.db2.gz	XPAPQEJYLNWHBE-ZDUSSCGKSA-N	1	0	268.401	1.651	50	0		CDAARO
CC(C)SCC[N@H+]1C[C@@H](Cc2cnccn2)[C@H](O)C1	ZINC001704297707	1177679143	/nfs/dbraw/zinc/67/91/43/1177679143.db2.gz	CVVQWTGNJPMZFW-TZMCWYRMSA-N	1	0	281.425	1.453	50	0		CDAARO
C[N@@H+]1C[C@H]2COC[C@@H]1CN(c1ccc(Cl)cn1)C2	ZINC001704315556	1177685589	/nfs/dbraw/zinc/68/55/89/1177685589.db2.gz	KBXXGTYLCKINEW-PWSUYJOCSA-N	1	0	267.760	1.502	50	0		CDAARO
CSc1ccc2c(c1)CC[N@@H+](CCCn1cnnn1)C2	ZINC000019952776	824122942	/nfs/dbraw/zinc/12/29/42/824122942.db2.gz	NGDGPEWQNYIZIT-UHFFFAOYSA-N	1	0	289.408	1.843	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](NC(=O)c2cc(-c3ccncc3)n[nH]2)C1	ZINC000067935106	824819273	/nfs/dbraw/zinc/81/92/73/824819273.db2.gz	IFVHWVHAIJBVQX-GHMZBOCLSA-N	1	0	271.324	1.081	50	0		CDAARO
COc1ccc(C[NH2+]CCN2CCCC[C@@H]2CO)cc1F	ZINC000952991522	828709261	/nfs/dbraw/zinc/70/92/61/828709261.db2.gz	TZCAWAYISSBOIY-CQSZACIVSA-N	1	0	296.386	1.771	50	0		CDAARO
C[C@@H](CCC(=O)N(C)Cc1nccn1C)[NH+]1CCCC1	ZINC000426428401	826353510	/nfs/dbraw/zinc/35/35/10/826353510.db2.gz	UISBMSVFTMVUCU-ZDUSSCGKSA-N	1	0	278.400	1.643	50	0		CDAARO
C[C@@H](C1CCN(c2ccncn2)CC1)[NH+]1CCOCC1	ZINC000095380486	827266091	/nfs/dbraw/zinc/26/60/91/827266091.db2.gz	YEHXDQIJIKMLKE-ZDUSSCGKSA-N	1	0	276.384	1.414	50	0		CDAARO
Cc1cc(C(=O)N2CC([NH+]3CCCC3)C2)ns1	ZINC000585130805	896141566	/nfs/dbraw/zinc/14/15/66/896141566.db2.gz	CKGIKDWWJHGNNU-UHFFFAOYSA-N	1	0	251.355	1.372	50	0		CDAARO
CCCOc1cccc(NC(=O)[C@]2([NH3+])CC[C@H](O)C2)c1	ZINC000952884252	910457979	/nfs/dbraw/zinc/45/79/79/910457979.db2.gz	RPOJIQADDSFYRL-WFASDCNBSA-N	1	0	278.352	1.656	50	0		CDAARO
CCC[C@H]1COCCN1C(=O)C[NH+]1CCCCCC1	ZINC000822812320	925651887	/nfs/dbraw/zinc/65/18/87/925651887.db2.gz	YICBAGCQNBRFEE-AWEZNQCLSA-N	1	0	268.401	1.890	50	0		CDAARO
CCC[NH+]1CCC(CC(=O)NCCN2CCCC2=O)CC1	ZINC000822920184	925655107	/nfs/dbraw/zinc/65/51/07/925655107.db2.gz	CMOJRMKMJAAIKX-UHFFFAOYSA-N	1	0	295.427	1.237	50	0		CDAARO
COCC[N@@H+]1CC[C@H](c2nc(-c3ccccc3)n[nH]2)C1	ZINC000824412463	925820857	/nfs/dbraw/zinc/82/08/57/925820857.db2.gz	UUEMQROWMXHERW-ZDUSSCGKSA-N	1	0	272.352	1.907	50	0		CDAARO
COc1nc(NC[C@H]2CCC[N@@H+]2C(C)C)ncc1F	ZINC000824845772	925839623	/nfs/dbraw/zinc/83/96/23/925839623.db2.gz	IGKWMJSEJGIETQ-SNVBAGLBSA-N	1	0	268.336	1.909	50	0		CDAARO
Cc1cc(=O)[nH]c(CC[NH2+]C2Cc3ccccc3C2)n1	ZINC000825119521	925851021	/nfs/dbraw/zinc/85/10/21/925851021.db2.gz	NUTQCIXRLIYSGY-UHFFFAOYSA-N	1	0	269.348	1.790	50	0		CDAARO
Cc1nccn1CC[C@H](C)[NH2+]CCN1CCC(CO)CC1	ZINC000828719645	926167033	/nfs/dbraw/zinc/16/70/33/926167033.db2.gz	RXEJOYFUSGACBI-AWEZNQCLSA-N	1	0	294.443	1.264	50	0		CDAARO
OC[C@@H]1CCCCN1CC[NH2+]C1CSCCSC1	ZINC000828710954	926169197	/nfs/dbraw/zinc/16/91/97/926169197.db2.gz	QOLSWFBDRJLYRH-ZDUSSCGKSA-N	1	0	290.498	1.271	50	0		CDAARO
Cc1ccccc1-n1nc(CC(C)C)nc1[C@H]([NH3+])CO	ZINC000828799091	926196899	/nfs/dbraw/zinc/19/68/99/926196899.db2.gz	GATBLBCVASRZIB-GFCCVEGCSA-N	1	0	274.368	1.766	50	0		CDAARO
COC[C@@H]1[C@H](C(=O)NCc2ccc(C)o2)CCC[N@@H+]1C	ZINC000581813184	927203051	/nfs/dbraw/zinc/20/30/51/927203051.db2.gz	IJKMBSYFAGEQBG-ZIAGYGMSSA-N	1	0	280.368	1.561	50	0		CDAARO
C[C@@H]1CN(Cc2ccccn2)CCN1C(=O)Cc1cc[nH]n1	ZINC000585083107	930860943	/nfs/dbraw/zinc/86/09/43/930860943.db2.gz	WKMVWMUJERTYCO-CYBMUJFWSA-N	1	0	299.378	1.080	50	0		CDAARO
C[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)N(CC(N)=O)[C@@H]1C	ZINC000585116130	930966636	/nfs/dbraw/zinc/96/66/36/930966636.db2.gz	ICRCBPNGRCYHQT-UTUOFQBUSA-N	1	0	299.415	1.485	50	0		CDAARO
CCN(C(=O)N1CCC[C@@H](C[N@@H+]2CC[C@@H](O)C2)C1)C(C)C	ZINC000585139413	931042629	/nfs/dbraw/zinc/04/26/29/931042629.db2.gz	WMPGBSNRVZNQOT-LSDHHAIUSA-N	1	0	297.443	1.615	50	0		CDAARO
CNC(=O)c1cccnc1N(C)CC[NH+]1CCCCCC1	ZINC001529152291	968997445	/nfs/dbraw/zinc/99/74/45/968997445.db2.gz	RUJBKFJWVDWCTQ-UHFFFAOYSA-N	1	0	290.411	1.753	50	0		CDAARO
OCC[N@H+]1C[C@@H](Cc2ccnc3ccccc23)[C@H](O)C1	ZINC001529155299	968998117	/nfs/dbraw/zinc/99/81/17/968998117.db2.gz	QLFFAGLRAXAIQY-CZUORRHYSA-N	1	0	272.348	1.062	50	0		CDAARO
C[N@H+](Cc1cnc(N)nc1)[C@@H]1C[C@@H]2C[C@H](O)C[C@@H]2C1	ZINC001529182573	969006283	/nfs/dbraw/zinc/00/62/83/969006283.db2.gz	UXCNWXSRLUORJI-MPZDIEGVSA-N	1	0	262.357	1.040	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCCc2cc(OC)ccc2C1	ZINC000095971115	342468024	/nfs/dbraw/zinc/46/80/24/342468024.db2.gz	CECUYOXTCZIYCA-AWEZNQCLSA-N	1	0	262.353	1.707	50	0		CDAARO
CN(C)S(=O)(=O)CCC[N@@H+]1CCC[C@@H]1c1ccco1	ZINC000116287540	230394148	/nfs/dbraw/zinc/39/41/48/230394148.db2.gz	URENUZGVRGXZFI-GFCCVEGCSA-N	1	0	286.397	1.698	50	0		CDAARO
COC(C[N@@H+]1CC[C@@H](Oc2cccc(F)c2)C1)OC	ZINC000189183710	342526636	/nfs/dbraw/zinc/52/66/36/342526636.db2.gz	GEEMNBIJBAQMNL-CYBMUJFWSA-N	1	0	269.316	1.898	50	0		CDAARO
c1cnnc(N2CCC[C@H]([NH2+]C[C@H]3CCCCO3)C2)c1	ZINC000106774220	349480356	/nfs/dbraw/zinc/48/03/56/349480356.db2.gz	AXXLNGAKKUAGNM-UONOGXRCSA-N	1	0	276.384	1.604	50	0		CDAARO
CC(C)([NH3+])C(=O)NCc1ccc(N2CCCC2)nc1	ZINC000095956839	185042674	/nfs/dbraw/zinc/04/26/74/185042674.db2.gz	BBNHKAGNKRSARR-UHFFFAOYSA-N	1	0	262.357	1.035	50	0		CDAARO
CNC(=O)c1cccc(CC[NH2+][C@@H]2CCO[C@@H](C)C2)c1	ZINC000095983906	185054927	/nfs/dbraw/zinc/05/49/27/185054927.db2.gz	JAMKRJZZBLBZTF-SWLSCSKDSA-N	1	0	276.380	1.746	50	0		CDAARO
COC(=O)[C@]12CCC[C@@H]1C[N@H+](Cc1cncs1)C2	ZINC000096009047	185064083	/nfs/dbraw/zinc/06/40/83/185064083.db2.gz	ZJPINNYIJHGJJC-MFKMUULPSA-N	1	0	266.366	1.918	50	0		CDAARO
COc1ccc(CCC(=O)N2CC[NH2+]C[C@H]2C)cc1F	ZINC000124815363	187155540	/nfs/dbraw/zinc/15/55/40/187155540.db2.gz	HBOAZXYCFAVQFO-LLVKDONJSA-N	1	0	280.343	1.587	50	0		CDAARO
CC(C)(C)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[NH2+]CCO1	ZINC000195543494	342626666	/nfs/dbraw/zinc/62/66/66/342626666.db2.gz	BZEKFIQWLNOSJM-GJZGRUSLSA-N	1	0	290.407	1.748	50	0		CDAARO
C[C@@H](CNc1nccc(N(C)C)n1)C[NH+]1CCCC1	ZINC000195575072	342628757	/nfs/dbraw/zinc/62/87/57/342628757.db2.gz	YRCBKPYMUDLJGA-LBPRGKRZSA-N	1	0	263.389	1.686	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]C[C@@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000090914339	342157554	/nfs/dbraw/zinc/15/75/54/342157554.db2.gz	PFCSRQKJBGGIGP-HJWJTTGWSA-N	1	0	290.407	1.389	50	0		CDAARO
C[N@H+](CC(=O)NCCc1ccc(F)cc1)CC1(C)COC1	ZINC000244773812	361861940	/nfs/dbraw/zinc/86/19/40/361861940.db2.gz	PHABXEQKRPSDPF-UHFFFAOYSA-N	1	0	294.370	1.453	50	0		CDAARO
[NH3+][C@H]1C[C@@H](c2cc(N3CC(c4nccs4)C3)ncn2)C1	ZINC000244787563	361863796	/nfs/dbraw/zinc/86/37/96/361863796.db2.gz	PZKCVUPBLLQSAE-JGZJWPJOSA-N	1	0	287.392	1.742	50	0		CDAARO
CCC1=NO[C@H](C[N@@H+]2CCCN(c3ncccn3)CC2)C1	ZINC000244858578	361866378	/nfs/dbraw/zinc/86/63/78/361866378.db2.gz	VNRSIQASXIYODQ-AWEZNQCLSA-N	1	0	289.383	1.544	50	0		CDAARO
C[C@@H]1CC[NH2+][C@@H](C)[C@@H]1NC(=O)CCc1ccon1	ZINC000585136700	342216087	/nfs/dbraw/zinc/21/60/87/342216087.db2.gz	PXCILHJJNGFJOY-GBIKHYSHSA-N	1	0	251.330	1.110	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@@H]1C[N@@H+](C)C[C@H]1C	ZINC000257366051	539096177	/nfs/dbraw/zinc/09/61/77/539096177.db2.gz	HNXHOIFUTIJZKW-ZYHUDNBSSA-N	1	0	286.372	1.363	50	0		CDAARO
CCCn1cc(C[NH2+][C@H]2CCN(C(C)=O)C[C@@H]2C)cn1	ZINC000084760616	342268835	/nfs/dbraw/zinc/26/88/35/342268835.db2.gz	RXGQZULKIGPIHH-WFASDCNBSA-N	1	0	278.400	1.640	50	0		CDAARO
CCOc1ccnc(NC[C@H]2CC[N@H+](CC)C2)n1	ZINC000164484048	539125220	/nfs/dbraw/zinc/12/52/20/539125220.db2.gz	MGIHGOQYAMNKNX-LLVKDONJSA-N	1	0	250.346	1.629	50	0		CDAARO
OCC1(C[NH2+]Cc2c[nH]nc2-c2cccnc2)CCC1	ZINC000184366295	539145920	/nfs/dbraw/zinc/14/59/20/539145920.db2.gz	YXPXVOCXFUYLBA-UHFFFAOYSA-N	1	0	272.352	1.724	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1cnc(-c2ncccn2)s1	ZINC000125719836	187198070	/nfs/dbraw/zinc/19/80/70/187198070.db2.gz	AUYSESBPXPEREV-VIFPVBQESA-N	1	0	289.364	1.034	50	0		CDAARO
Cc1nccc(N2CCC[C@@H]2C[NH+]2C[C@H](C)O[C@@H](C)C2)n1	ZINC000253371030	282186065	/nfs/dbraw/zinc/18/60/65/282186065.db2.gz	ZRASOMLHLUMZES-KCQAQPDRSA-N	1	0	290.411	1.863	50	0		CDAARO
C[NH+](C)Cc1cccc(NC(=O)N2CCn3ccnc32)c1	ZINC000585119122	362038116	/nfs/dbraw/zinc/03/81/16/362038116.db2.gz	SFJBPGBAMDDMJM-UHFFFAOYSA-N	1	0	285.351	1.997	50	0		CDAARO
Cc1cc(CNC(=O)[C@H]2CC[N@@H+]2C2CCCC2)no1	ZINC000585121302	362039749	/nfs/dbraw/zinc/03/97/49/362039749.db2.gz	LKMFGADFMWMRAT-CYBMUJFWSA-N	1	0	263.341	1.616	50	0		CDAARO
CC(C)c1noc2ncc(C(=O)N3CC[C@H](C[NH3+])C3)cc21	ZINC000178576566	362246970	/nfs/dbraw/zinc/24/69/70/362246970.db2.gz	MQUUDFSHQCSRAO-SNVBAGLBSA-N	1	0	288.351	1.767	50	0		CDAARO
Cc1nn2c(nc(C)cc2N2CCC([NH3+])CC2)c1C	ZINC000072476939	282308255	/nfs/dbraw/zinc/30/82/55/282308255.db2.gz	BYLGEXRHKUPJAS-UHFFFAOYSA-N	1	0	259.357	1.582	50	0		CDAARO
C[NH2+]C1CCN(C(=O)/C=C/c2c(C)nn(C)c2Cl)CC1	ZINC000179143042	362252463	/nfs/dbraw/zinc/25/24/63/362252463.db2.gz	PQKCBSSALFKQLC-SNAWJCMRSA-N	1	0	296.802	1.606	50	0		CDAARO
C[C@H]1CN(C(=O)CCc2cscn2)C[C@H](C)[NH2+]1	ZINC000179152146	362252888	/nfs/dbraw/zinc/25/28/88/362252888.db2.gz	ZPOWYLHMXAWQJX-UWVGGRQHSA-N	1	0	253.371	1.285	50	0		CDAARO
C[C@@H]1C[N@H+](CCCOc2ccc(C(N)=O)cc2)CCCO1	ZINC000252507839	362390325	/nfs/dbraw/zinc/39/03/25/362390325.db2.gz	WUQLEOQPOLYGNR-CYBMUJFWSA-N	1	0	292.379	1.665	50	0		CDAARO
Cc1nccn1C[C@H]1CCC[N@H+]1CCN1CCO[C@@H](C)C1	ZINC000249213675	362476604	/nfs/dbraw/zinc/47/66/04/362476604.db2.gz	DIEPXTVZOYWYCS-GOEBONIOSA-N	1	0	292.427	1.377	50	0		CDAARO
Cc1noc(C)c1C[NH2+]C[C@@H]1CN(C2CC2)CCO1	ZINC000106379509	282385717	/nfs/dbraw/zinc/38/57/17/282385717.db2.gz	PWHKVVAQUITDGB-CYBMUJFWSA-N	1	0	265.357	1.244	50	0		CDAARO
CCC[N@@H+]1CC[C@H](NC(=O)c2cncc(F)c2)C1	ZINC000619901110	349954693	/nfs/dbraw/zinc/95/46/93/349954693.db2.gz	LZPDSLHEAICIIH-LBPRGKRZSA-N	1	0	251.305	1.435	50	0		CDAARO
CCOC(=O)c1cn(C2=[NH+]CCN2)c2ccc(C)cc12	ZINC000034399496	346336418	/nfs/dbraw/zinc/33/64/18/346336418.db2.gz	FVGDDEKPGXHZJW-UHFFFAOYSA-N	1	0	271.320	1.934	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2c(F)cc(F)cc2F)C1	ZINC000086997973	179377513	/nfs/dbraw/zinc/37/75/13/179377513.db2.gz	XVTUELJZXWQLCJ-QMMMGPOBSA-N	1	0	272.270	1.785	50	0		CDAARO
CC/C=C/CC(=O)N1CCC[C@@H](C[NH+]2CCOCC2)C1	ZINC000584885300	349342925	/nfs/dbraw/zinc/34/29/25/349342925.db2.gz	AEKNHSCSMDROEL-BWPKMQGJSA-N	1	0	280.412	1.914	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNC(=O)c1cnc(N)s1	ZINC000584886037	349343780	/nfs/dbraw/zinc/34/37/80/349343780.db2.gz	RIEFDGVDCBDULP-VIFPVBQESA-N	1	0	268.386	1.160	50	0		CDAARO
CC(C)[N@@H+]1CCCN(C(=O)CCCN2CCOCC2)CC1	ZINC000584887256	349345558	/nfs/dbraw/zinc/34/55/58/349345558.db2.gz	GWTBZEMSTWNPQP-UHFFFAOYSA-N	1	0	297.443	1.042	50	0		CDAARO
C/C=C/CC(=O)N1CCC(CO)(C[NH+](C)C)CC1	ZINC000584888007	349346304	/nfs/dbraw/zinc/34/63/04/349346304.db2.gz	ARJGOCJDBBRBAQ-SNAWJCMRSA-N	1	0	254.374	1.115	50	0		CDAARO
CO[C@H]1CCN(C(=O)C[NH+]2CCCCCCC2)C1	ZINC000584892654	349351761	/nfs/dbraw/zinc/35/17/61/349351761.db2.gz	YWULSEOWKMNBDJ-ZDUSSCGKSA-N	1	0	254.374	1.500	50	0		CDAARO
C[NH+]1CCC(OCCCNc2ccncc2F)CC1	ZINC000584892305	349351820	/nfs/dbraw/zinc/35/18/20/349351820.db2.gz	TYBWEFZJMUYKBR-UHFFFAOYSA-N	1	0	267.348	1.555	50	0		CDAARO
C[N@@H+]1CC[C@]2(C1)CCCN(C(=O)[C@H]1CC[C@@H](O)CC1)C2	ZINC000584892536	349352265	/nfs/dbraw/zinc/35/22/65/349352265.db2.gz	OYTYVXPKAVPBKF-LZWOXQAQSA-N	1	0	280.412	1.482	50	0		CDAARO
CO[C@H]1C[N@H+](C)C[C@@H]1Nc1ccc2ccccc2n1	ZINC000584899531	349361341	/nfs/dbraw/zinc/36/13/41/349361341.db2.gz	ILMPZGXIKVLRCO-KBPBESRZSA-N	1	0	257.337	1.976	50	0		CDAARO
C[N@@H+]1Cc2ccccc2C[C@H]1CNC(=O)Cn1cccc1	ZINC000584899466	349361497	/nfs/dbraw/zinc/36/14/97/349361497.db2.gz	FNSVQBJSQMOZBJ-INIZCTEOSA-N	1	0	283.375	1.661	50	0		CDAARO
Cc1cnc(NCC[N@@H+]2CCCC[C@H]2CO)nc1N(C)C	ZINC000065380952	362948480	/nfs/dbraw/zinc/94/84/80/362948480.db2.gz	UGUMOVCIQJFIQG-ZDUSSCGKSA-N	1	0	293.415	1.110	50	0		CDAARO
CC[C@]1(CO)CCC[N@H+](Cc2[nH]cc(C)c(=O)c2C)C1	ZINC000091462085	180162540	/nfs/dbraw/zinc/16/25/40/180162540.db2.gz	AXQRRBFEKUJFMT-INIZCTEOSA-N	1	0	278.396	1.976	50	0		CDAARO
Cc1ccc2[nH]c(C[NH2+]CCc3ncnn3C)cc(=O)c2c1	ZINC000091410484	180148249	/nfs/dbraw/zinc/14/82/49/180148249.db2.gz	YWMGCICISPLVSQ-UHFFFAOYSA-N	1	0	297.362	1.297	50	0		CDAARO
Cc1cnc(N)nc1NCCCOC1CC[NH+](C)CC1	ZINC000091551993	180189755	/nfs/dbraw/zinc/18/97/55/180189755.db2.gz	CVWGTGWYOVRJMK-UHFFFAOYSA-N	1	0	279.388	1.280	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)NCCc1ccncc1	ZINC000091656262	180217778	/nfs/dbraw/zinc/21/77/78/180217778.db2.gz	IXQHOVDDDAXCKP-CQSZACIVSA-N	1	0	261.369	1.615	50	0		CDAARO
CC(C)[N@H+]1CCCC[C@H]1CNC(=O)N1CC[C@H]([C@H](C)O)C1	ZINC000110714455	350290539	/nfs/dbraw/zinc/29/05/39/350290539.db2.gz	JVMIJQFUEURCEO-KKUMJFAQSA-N	1	0	297.443	1.662	50	0		CDAARO
Cc1ccc([C@@H](C)NC(=O)C[N@@H+]2CCC[C@H]2CO)cc1C	ZINC000106772548	186134908	/nfs/dbraw/zinc/13/49/08/186134908.db2.gz	DHEHUSFYRRZHNW-ZBFHGGJFSA-N	1	0	290.407	1.937	50	0		CDAARO
COC(C[NH2+]CC(=O)NCC(C)(C)c1ccccc1)OC	ZINC000061997373	362965059	/nfs/dbraw/zinc/96/50/59/362965059.db2.gz	VMZKOUUQKFZVIJ-UHFFFAOYSA-N	1	0	294.395	1.289	50	0		CDAARO
Cc1cccc2nc(CNC(=O)c3cn[nH]c3)cn21	ZINC000109307296	186247223	/nfs/dbraw/zinc/24/72/23/186247223.db2.gz	CZCCEMOMKLYRPQ-UHFFFAOYSA-N	1	0	255.281	1.296	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1ccc(N2CCCC2)nc1	ZINC000125854132	290935869	/nfs/dbraw/zinc/93/58/69/290935869.db2.gz	DORJCEMBFZVSNF-LBPRGKRZSA-N	1	0	274.368	1.116	50	0		CDAARO
Cc1c([C@H](C)NC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3[NH2+]2)cnn1C	ZINC000037001390	363311887	/nfs/dbraw/zinc/31/18/87/363311887.db2.gz	XAPHCLGEBSWALL-LVGORTOPSA-N	1	0	290.411	1.826	50	0		CDAARO
CCc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H](O)C[NH2+]2)cc1	ZINC000037016598	363313733	/nfs/dbraw/zinc/31/37/33/363313733.db2.gz	GKISWOWMXQUIKE-BPNCWPANSA-N	1	0	262.353	1.149	50	0		CDAARO
NC(=O)C1CC[NH+](C[C@H](O)CSc2ccccc2)CC1	ZINC000000119054	355888747	/nfs/dbraw/zinc/88/87/47/355888747.db2.gz	YSMQPPNUHYMINC-ZDUSSCGKSA-N	1	0	294.420	1.337	50	0		CDAARO
Cc1ccc(OC(C)C)c(C[NH+](CCO)CCO)c1	ZINC000000182943	355894566	/nfs/dbraw/zinc/89/45/66/355894566.db2.gz	OAFHTDSQILRLJM-UHFFFAOYSA-N	1	0	267.369	1.569	50	0		CDAARO
COc1cccc(C[NH2+]C[C@@H]2CCCO2)c1OC	ZINC000000268570	355899842	/nfs/dbraw/zinc/89/98/42/355899842.db2.gz	KRKRFPVLDYQKIR-LBPRGKRZSA-N	1	0	251.326	1.972	50	0		CDAARO
CC[N@@H+]1CCC[C@@](C)(C(=O)NCCn2cccc2)C1	ZINC000095355319	356003691	/nfs/dbraw/zinc/00/36/91/356003691.db2.gz	HSPMSXUIMVEYFG-OAHLLOKOSA-N	1	0	263.385	1.726	50	0		CDAARO
COc1ccccc1/C(C)=C\C(=O)N1CC[C@H]([NH3+])C1	ZINC000255359956	356050302	/nfs/dbraw/zinc/05/03/02/356050302.db2.gz	VLGCKZSOKJQUQU-MMRAYRKESA-N	1	0	260.337	1.658	50	0		CDAARO
Cc1c(C)n(C[C@H](O)C[NH2+]CCO)c2ccccc12	ZINC000003902834	356013101	/nfs/dbraw/zinc/01/31/01/356013101.db2.gz	LAXQLMTYVIIFCX-CYBMUJFWSA-N	1	0	262.353	1.201	50	0		CDAARO
C[NH+](C)CCCOC(=O)c1ccc2c(c1)OCCO2	ZINC000004104422	356019218	/nfs/dbraw/zinc/01/92/18/356019218.db2.gz	RNJFMOQLENOXSJ-UHFFFAOYSA-N	1	0	265.309	1.566	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1Cn1cnc2ccncc2c1=O	ZINC000032547796	356229858	/nfs/dbraw/zinc/22/98/58/356229858.db2.gz	GUZTVLIQQLTXAN-GFCCVEGCSA-N	1	0	272.352	1.666	50	0		CDAARO
COc1cccc2[nH]c(C(=O)N3CC[NH2+]CC3)cc21	ZINC000011866625	356281526	/nfs/dbraw/zinc/28/15/26/356281526.db2.gz	SMCNXVAJYOVLPD-UHFFFAOYSA-N	1	0	259.309	1.222	50	0		CDAARO
Cc1cc(=O)[nH]c2c1c(=O)[nH]n2[C@@H]1C[C@H](C)[N@@H+](C)C[C@@H]1C	ZINC000008578868	356268826	/nfs/dbraw/zinc/26/88/26/356268826.db2.gz	MVFIEUFRENOXDE-GARJFASQSA-N	1	0	290.367	1.228	50	0		CDAARO
CC[C@H](CNC(=O)Cc1c(C)nn(C)c1C)[NH+]1CCCC1	ZINC000032659987	356329034	/nfs/dbraw/zinc/32/90/34/356329034.db2.gz	OTVQTGFMICQRBM-CQSZACIVSA-N	1	0	292.427	1.570	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1C(=O)Nc1cccc(-n2cnnn2)c1	ZINC000012718384	356320774	/nfs/dbraw/zinc/32/07/74/356320774.db2.gz	AQNSOVOIMRZZSQ-CYBMUJFWSA-N	1	0	286.339	1.085	50	0		CDAARO
Cn1nc(C(F)(F)F)cc1C(=O)NCCC[NH+](C)C	ZINC000032648094	356329328	/nfs/dbraw/zinc/32/93/28/356329328.db2.gz	GAVKJBNHJLQULX-UHFFFAOYSA-N	1	0	278.278	1.120	50	0		CDAARO
C[C@H]1CCC[N@H+](C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000013154394	356340004	/nfs/dbraw/zinc/34/00/04/356340004.db2.gz	HCCKNZYVNMCZOW-QWHCGFSZSA-N	1	0	293.363	1.887	50	0		CDAARO
C[C@H](CNC(=O)[C@@]1(C)CC1(Cl)Cl)N1CCOCC1	ZINC000032817368	356379929	/nfs/dbraw/zinc/37/99/29/356379929.db2.gz	ROXJJFQFSOFHPH-MWLCHTKSSA-N	1	0	295.210	1.407	50	0		CDAARO
COc1ccccc1N1CC[NH+](CC(N)=S)CC1	ZINC000019483239	356488246	/nfs/dbraw/zinc/48/82/46/356488246.db2.gz	CIISTZWWRKNKIE-UHFFFAOYSA-N	1	0	265.382	1.103	50	0		CDAARO
C[NH+]1CCN(CCC(=O)Nc2cccc(Cl)c2)CC1	ZINC000019590025	356493277	/nfs/dbraw/zinc/49/32/77/356493277.db2.gz	KOSTWENIWBTFJN-UHFFFAOYSA-N	1	0	281.787	1.916	50	0		CDAARO
CCn1c2ccccc2nc1CN1CC[NH+](C)CC1	ZINC000020051287	356523362	/nfs/dbraw/zinc/52/33/62/356523362.db2.gz	FHCZXUCEHUEJQR-UHFFFAOYSA-N	1	0	258.369	1.804	50	0		CDAARO
Cc1nc(-c2cccc(NC(=O)C3([NH3+])CCCC3)c2)n[nH]1	ZINC000037769111	356530646	/nfs/dbraw/zinc/53/06/46/356530646.db2.gz	RGAQUYIJSDJPLF-UHFFFAOYSA-N	1	0	285.351	1.990	50	0		CDAARO
CC(C)(C)OC(=O)COc1ccc(CC[NH3+])cc1	ZINC000002599319	363530784	/nfs/dbraw/zinc/53/07/84/363530784.db2.gz	YUDXZCVRFJCEAH-UHFFFAOYSA-N	1	0	251.326	1.908	50	0		CDAARO
CC(=O)NCCNC(=O)C[N@@H+]1CCC[C@@H]1c1cccs1	ZINC000026483235	356694046	/nfs/dbraw/zinc/69/40/46/356694046.db2.gz	VXETXLFIGGPGCL-GFCCVEGCSA-N	1	0	295.408	1.137	50	0		CDAARO
CNc1snc(C)c1C(=O)NC1CC[NH+](C2CC2)CC1	ZINC000030626730	356750534	/nfs/dbraw/zinc/75/05/34/356750534.db2.gz	FPWKZLXZZVDITA-UHFFFAOYSA-N	1	0	294.424	1.850	50	0		CDAARO
COC(=O)[C@@H]1C[C@H]2CCC[N@@H+]2[C@@]12c1ccccc1NC2=O	ZINC000034099993	356809981	/nfs/dbraw/zinc/80/99/81/356809981.db2.gz	GWGXYUQKCIFYGS-XAGWURHQSA-N	1	0	286.331	1.491	50	0		CDAARO
COc1cc(C[N@@H+]2CCCC[C@@H]2CO)cc2c1OCO2	ZINC000000210327	356812622	/nfs/dbraw/zinc/81/26/22/356812622.db2.gz	KLNLDBTTZGZDAU-GFCCVEGCSA-N	1	0	279.336	1.771	50	0		CDAARO
CC(=O)N1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000095408761	357211340	/nfs/dbraw/zinc/21/13/40/357211340.db2.gz	OQFQHMCFCTWVLX-CHWSQXEVSA-N	1	0	268.401	1.744	50	0		CDAARO
C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCS(=O)(=O)C1	ZINC000095419612	357334366	/nfs/dbraw/zinc/33/43/66/357334366.db2.gz	MYZKRBHRNFAQKZ-MNOVXSKESA-N	1	0	279.471	1.931	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1cc(C)c(F)cc1F	ZINC000095432146	357516218	/nfs/dbraw/zinc/51/62/18/357516218.db2.gz	CSRLSHZLTCRDBN-SECBINFHSA-N	1	0	292.351	1.679	50	0		CDAARO
CN(CCc1cn[nH]c1)C(=O)CC[C@H]1CCCC[N@@H+]1C	ZINC000065410254	357539045	/nfs/dbraw/zinc/53/90/45/357539045.db2.gz	PHBWJLAXMUGNFB-CQSZACIVSA-N	1	0	278.400	1.675	50	0		CDAARO
COCC1(C(=O)NCc2ccc(C[NH3+])cc2)CCC1	ZINC000065456931	357542605	/nfs/dbraw/zinc/54/26/05/357542605.db2.gz	ZUYPXKOKDBBZKF-UHFFFAOYSA-N	1	0	262.353	1.578	50	0		CDAARO
CN1CCC[NH2+]CC12CCN(C(=O)OC(C)(C)C)CC2	ZINC000067425112	357607030	/nfs/dbraw/zinc/60/70/30/357607030.db2.gz	KUUNPMZOFUVVNQ-UHFFFAOYSA-N	1	0	283.416	1.681	50	0		CDAARO
CCCCCC(=O)N1C[C@@H]([NH3+])C[C@H]1C(=O)NC(C)C	ZINC000067885465	357634551	/nfs/dbraw/zinc/63/45/51/357634551.db2.gz	HLIQIGLFJRSSPY-RYUDHWBXSA-N	1	0	269.389	1.020	50	0		CDAARO
CC(C)C[C@@H]([NH3+])C(=O)NCc1cccc(-n2cccn2)c1	ZINC000071753271	357778323	/nfs/dbraw/zinc/77/83/23/357778323.db2.gz	PRZUWIYTFICFIC-OAHLLOKOSA-N	1	0	286.379	1.862	50	0		CDAARO
CCc1ccc(CN2CC[C@](O)(C[NH+](C)C)C2)nc1	ZINC000072424646	357833915	/nfs/dbraw/zinc/83/39/15/357833915.db2.gz	HBJXTUPMCQVPPL-HNNXBMFYSA-N	1	0	263.385	1.142	50	0		CDAARO
Cc1cc(N2CCN(Cc3nccn3C)CC2)cc(C)[nH+]1	ZINC000072448219	357837093	/nfs/dbraw/zinc/83/70/93/357837093.db2.gz	IDSQQTMRHFQNPO-UHFFFAOYSA-N	1	0	285.395	1.754	50	0		CDAARO
COC(=O)[C@]12CCC[C@H]1C[N@H+](Cc1cnn(C)c1C)C2	ZINC000097082969	357945733	/nfs/dbraw/zinc/94/57/33/357945733.db2.gz	HBNPJZPSOGOKLI-ZFWWWQNUSA-N	1	0	277.368	1.504	50	0		CDAARO
O=C(CN1CCN(c2cc[nH+]cc2)CC1)N1CCCCC1	ZINC000077423515	358018894	/nfs/dbraw/zinc/01/88/94/358018894.db2.gz	CYTNZCSHHAQSLY-UHFFFAOYSA-N	1	0	288.395	1.216	50	0		CDAARO
Cc1ccc(NC[C@@H]2CCN([C@@H]3CCOC3=O)C2)nc1	ZINC000097200785	358188299	/nfs/dbraw/zinc/18/82/99/358188299.db2.gz	QPPMUVPGNCNURM-QWHCGFSZSA-N	1	0	275.352	1.439	50	0		CDAARO
Cc1ccc(O)c(C[N@@H+]2CCC[C@H]2Cn2ccnc2)n1	ZINC000195573488	358567486	/nfs/dbraw/zinc/56/74/86/358567486.db2.gz	QRZKSAWDQYQKOK-ZDUSSCGKSA-N	1	0	272.352	1.957	50	0		CDAARO
C[NH2+]Cc1nnc(SCCCn2ccnc2C)n1C	ZINC000426411527	358631939	/nfs/dbraw/zinc/63/19/39/358631939.db2.gz	RGIKNTARJZCHKT-UHFFFAOYSA-N	1	0	280.401	1.222	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)NCCCNc1cccnc1	ZINC000095372306	358687501	/nfs/dbraw/zinc/68/75/01/358687501.db2.gz	AKXAFPZMMILZFU-OAHLLOKOSA-N	1	0	290.411	1.874	50	0		CDAARO
FC(F)(F)c1ccnc(NCc2cc3n(n2)CC[NH2+]C3)n1	ZINC000095372709	358688748	/nfs/dbraw/zinc/68/87/48/358688748.db2.gz	OGNYTLUUIDZNDF-UHFFFAOYSA-N	1	0	298.272	1.407	50	0		CDAARO
CCCN(C(=O)c1ccccc1F)[C@@H]1[C@H]2C[NH2+]C[C@H]21	ZINC000100010936	358817212	/nfs/dbraw/zinc/81/72/12/358817212.db2.gz	SQAKXESHSDVYAU-IMRBUKKESA-N	1	0	262.328	1.896	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(Cc2cccc(OCCO)c2)CC1	ZINC000097528089	358782377	/nfs/dbraw/zinc/78/23/77/358782377.db2.gz	MGILBBJMGUNBDP-INIZCTEOSA-N	1	0	292.423	1.974	50	0		CDAARO
Cc1cc(NC(=O)NC[C@@H]2C[C@H](F)C[NH2+]2)n(C(C)C)n1	ZINC000097745062	358796623	/nfs/dbraw/zinc/79/66/23/358796623.db2.gz	RJKDOQULCURXAD-QWRGUYRKSA-N	1	0	283.351	1.594	50	0		CDAARO
CCCc1cc(C(=O)N[C@H]2Cc3ccccc3[C@@H]2[NH3+])no1	ZINC000097814923	358800821	/nfs/dbraw/zinc/80/08/21/358800821.db2.gz	YRVCIPKRCWYRFB-ZFWWWQNUSA-N	1	0	285.347	1.982	50	0		CDAARO
COc1ccccc1OCCCN(C)C(=O)[C@H]1CC[NH2+]C1	ZINC000215897797	358908810	/nfs/dbraw/zinc/90/88/10/358908810.db2.gz	YYMUYYOXNUEIFF-ZDUSSCGKSA-N	1	0	292.379	1.532	50	0		CDAARO
C[C@H]([NH2+][C@H]1CCN(c2ccccc2)C1=O)[C@H]1CCCO1	ZINC000248481498	358960150	/nfs/dbraw/zinc/96/01/50/358960150.db2.gz	IDYYTJXAGAFCHE-AEGPPILISA-N	1	0	274.364	1.949	50	0		CDAARO
Cc1nn(CCO)cc1C[N@@H+](C)[C@@H](C)Cc1cnccn1	ZINC000216041227	358919902	/nfs/dbraw/zinc/91/99/02/358919902.db2.gz	FLFMASRURYHDIG-LBPRGKRZSA-N	1	0	289.383	1.037	50	0		CDAARO
O=C(N[C@H]1C[NH+]2CCC1CC2)c1cccn1C1CC1	ZINC000216130090	358926652	/nfs/dbraw/zinc/92/66/52/358926652.db2.gz	CXJLGNRDXHZQIB-ZDUSSCGKSA-N	1	0	259.353	1.647	50	0		CDAARO
O[C@@H]1C[C@H]2C[N@@H+](C/C=C/c3ccc(F)cc3)C[C@H]2C[C@@H]1O	ZINC000216138815	358928006	/nfs/dbraw/zinc/92/80/06/358928006.db2.gz	SGKVLFRDPNLQQL-OHBSEBSQSA-N	1	0	291.366	1.903	50	0		CDAARO
[NH3+]C1CCN([C@H]2CCc3ccccc3NC2=O)CC1	ZINC000030714521	283415634	/nfs/dbraw/zinc/41/56/34/283415634.db2.gz	KYJCXQATHSBDPJ-AWEZNQCLSA-N	1	0	259.353	1.363	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1C1CCN(S(C)(=O)=O)CC1	ZINC000257175630	359058435	/nfs/dbraw/zinc/05/84/35/359058435.db2.gz	BHXAPEPNWINSCR-UHFFFAOYSA-N	1	0	283.397	1.665	50	0		CDAARO
C[NH2+]CCC(=O)N1CCC(Oc2ccccn2)CC1	ZINC000262438719	359169518	/nfs/dbraw/zinc/16/95/18/359169518.db2.gz	URMCEDUFKSBMKS-UHFFFAOYSA-N	1	0	263.341	1.061	50	0		CDAARO
CN(C)S(=O)(=O)c1cccc(CN2CCCC2)c1	ZINC000048419035	359204770	/nfs/dbraw/zinc/20/47/70/359204770.db2.gz	QDXWSJLHWJHVNW-UHFFFAOYSA-N	1	0	268.382	1.533	50	0		CDAARO
CC[C@H](C(=O)N(C)Cc1cc[nH]n1)[NH+]1CCCC1	ZINC000221171626	359215001	/nfs/dbraw/zinc/21/50/01/359215001.db2.gz	QJCMOCOSJQYORY-GFCCVEGCSA-N	1	0	250.346	1.243	50	0		CDAARO
Nc1nc(N2CCC(F)(F)CC2)cc(C2CC(O)C2)[nH+]1	ZINC000223432012	359425679	/nfs/dbraw/zinc/42/56/79/359425679.db2.gz	KZMMSORCNZKHHE-UHFFFAOYSA-N	1	0	284.310	1.533	50	0		CDAARO
C[NH+](C)[C@H]1[C@@H]2OCC[C@@H]2[C@@H]1Nc1ncnc2ccsc21	ZINC000223827963	359459807	/nfs/dbraw/zinc/45/98/07/359459807.db2.gz	UFYTWXUBFFCERB-SASUGWTJSA-N	1	0	290.392	1.821	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)COc1cccc(F)c1	ZINC000262027813	359602440	/nfs/dbraw/zinc/60/24/40/359602440.db2.gz	NTWZVJKHOFWBDH-JTQLQIEISA-N	1	0	252.289	1.025	50	0		CDAARO
Cc1ccccc1C[N@H+]1CC[C@]2(C1)C(=O)N(C)C(=O)N2C	ZINC000257197422	359630644	/nfs/dbraw/zinc/63/06/44/359630644.db2.gz	GPSFYFBVSNIJAZ-INIZCTEOSA-N	1	0	287.363	1.463	50	0		CDAARO
COc1ccccc1C[NH2+]C[C@H](OC)[C@@H]1CCOC1	ZINC000585093631	482828607	/nfs/dbraw/zinc/82/86/07/482828607.db2.gz	PZNCWJCCKHDIAI-HIFRSBDPSA-N	1	0	265.353	1.836	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](NC(=O)CSC(C)(C)C)C1	ZINC000408512853	359891966	/nfs/dbraw/zinc/89/19/66/359891966.db2.gz	MYWIJKZRWCAKCD-GFCCVEGCSA-N	1	0	288.457	1.745	50	0		CDAARO
CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CCN2C(=O)NC[C@@H]2C1	ZINC000191080855	360050371	/nfs/dbraw/zinc/05/03/71/360050371.db2.gz	DVCHTSDRHWOKMQ-MJBXVCDLSA-N	1	0	263.385	1.688	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@@H]1CCN(C(=O)c2ccn(C)n2)C1	ZINC000409421144	360230129	/nfs/dbraw/zinc/23/01/29/360230129.db2.gz	OQNOAQLGMMLDMO-GFCCVEGCSA-N	1	0	273.340	1.321	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@H]1CCCN(C(=O)c2cn(C)cn2)C1	ZINC000409421076	360230408	/nfs/dbraw/zinc/23/04/08/360230408.db2.gz	FDGAAZLEZBJQDB-ZDUSSCGKSA-N	1	0	287.367	1.711	50	0		CDAARO
COc1ccc(CNC(=O)[C@@H]2CCC[NH2+][C@@H]2C)cc1OC	ZINC000094647260	360277193	/nfs/dbraw/zinc/27/71/93/360277193.db2.gz	SYRJYKFHUWOFCK-DGCLKSJQSA-N	1	0	292.379	1.708	50	0		CDAARO
CCCCNC(=O)C[N@H+](C)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C	ZINC000248139678	360401597	/nfs/dbraw/zinc/40/15/97/360401597.db2.gz	BIBJTIVMFSUSRC-IACUBPJLSA-N	1	0	268.401	1.648	50	0		CDAARO
CS[C@H](C(=O)N1CC[C@@H]([NH3+])C1)c1ccccc1	ZINC000178350840	189109209	/nfs/dbraw/zinc/10/92/09/189109209.db2.gz	PZLYPYPMRIUDGD-NEPJUHHUSA-N	1	0	250.367	1.650	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)COc2ccc(F)cc2)C1	ZINC000178512631	189122672	/nfs/dbraw/zinc/12/26/72/189122672.db2.gz	ADDAMXFNAGCAGQ-JTQLQIEISA-N	1	0	252.289	1.012	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)CCn2cnc3ccccc32)C1	ZINC000178535542	189125064	/nfs/dbraw/zinc/12/50/64/189125064.db2.gz	HLKUVMAYALSXDB-GFCCVEGCSA-N	1	0	272.352	1.234	50	0		CDAARO
OCCC[NH+]1CCN(Cc2cccc(F)c2)CC1	ZINC000178771472	189144968	/nfs/dbraw/zinc/14/49/68/189144968.db2.gz	CAKFSUUNBUAZJK-UHFFFAOYSA-N	1	0	252.333	1.326	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)[C@H]3OCCc4ccccc43)C[C@H]12	ZINC000248561992	361210764	/nfs/dbraw/zinc/21/07/64/361210764.db2.gz	BAHQJLDGROLBCA-BVUBDWEXSA-N	1	0	286.375	1.496	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN(C(=O)c2cc(Cl)c[nH]2)C1	ZINC000426711112	361557797	/nfs/dbraw/zinc/55/77/97/361557797.db2.gz	BDVCZBUNGPHRSV-JTQLQIEISA-N	1	0	285.775	1.318	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1cc(N)ccc1OC	ZINC000000347683	364176668	/nfs/dbraw/zinc/17/66/68/364176668.db2.gz	FKLZXOIYBRAZIN-GFCCVEGCSA-N	1	0	277.368	1.492	50	0		CDAARO
CC(C)C(=O)NCC[NH2+]Cc1ccc(-n2ccnc2)cc1	ZINC000034992630	364520681	/nfs/dbraw/zinc/52/06/81/364520681.db2.gz	MHUWGRRCWSIEPM-UHFFFAOYSA-N	1	0	286.379	1.734	50	0		CDAARO
Cc1cc(S(=O)(=O)N(C)[C@@H](C)C[NH3+])sc1C	ZINC000195555255	189679970	/nfs/dbraw/zinc/67/99/70/189679970.db2.gz	KLBPVXVVWMSQBU-QMMMGPOBSA-N	1	0	262.400	1.333	50	0		CDAARO
CC(C)N1C(=O)C[C@H]([NH2+][C@H]2CC[C@@H](C)C[C@H]2C)C1=O	ZINC000251758002	366881292	/nfs/dbraw/zinc/88/12/92/366881292.db2.gz	DLUCUVVMQQWTKV-NDBYEHHHSA-N	1	0	266.385	1.937	50	0		CDAARO
CCS(=O)(=O)C[C@@H](C)[NH2+][C@H]1CC(C)(C)OC1(C)C	ZINC000089635939	366890917	/nfs/dbraw/zinc/89/09/17/366890917.db2.gz	LXGZOTHIHGFQDF-MNOVXSKESA-N	1	0	277.430	1.745	50	0		CDAARO
O=S1(=O)CCC[C@@H]1C[NH2+]Cc1cccc2[nH]ccc21	ZINC000089774352	366931749	/nfs/dbraw/zinc/93/17/49/366931749.db2.gz	XTLQAKKDWKXMCK-GFCCVEGCSA-N	1	0	278.377	1.835	50	0		CDAARO
C[C@H](C(=O)N1C[C@@H](C)O[C@@H](C)C1)N(C)CC[NH+]1CCCC1	ZINC000089898326	366957977	/nfs/dbraw/zinc/95/79/77/366957977.db2.gz	OPDMIPYESAZPME-QLFBSQMISA-N	1	0	297.443	1.038	50	0		CDAARO
CCOCCO[C@H]1CC[N@@H+]([C@H]2CCCC[C@@H]2O)C1	ZINC000089933842	366970981	/nfs/dbraw/zinc/97/09/81/366970981.db2.gz	HCWXHEICORCUPU-IHRRRGAJSA-N	1	0	257.374	1.417	50	0		CDAARO
CC(C)(C)OC(=O)NC1CCN(C2CC[NH2+]CC2)CC1	ZINC000037373683	367491660	/nfs/dbraw/zinc/49/16/60/367491660.db2.gz	HKBOBJSFRQIKQQ-UHFFFAOYSA-N	1	0	283.416	1.728	50	0		CDAARO
CN(CC[N@H+](C)[C@H]1CCOC1)C(=O)OC(C)(C)C	ZINC000252497936	367645601	/nfs/dbraw/zinc/64/56/01/367645601.db2.gz	QRQJTDNPYVUGOJ-NSHDSACASA-N	1	0	258.362	1.574	50	0		CDAARO
O=C(NC[C@@H]1CCC[NH2+]1)[C@H]1CSc2ccccc21	ZINC000092239279	283976257	/nfs/dbraw/zinc/97/62/57/283976257.db2.gz	YNHMBSBXVYSPSK-JQWIXIFHSA-N	1	0	262.378	1.744	50	0		CDAARO
C[C@@H]1CC[C@@H]([NH2+]C[C@H]2COC3(CCOCC3)O2)C1	ZINC000252512199	367683861	/nfs/dbraw/zinc/68/38/61/367683861.db2.gz	NZKLOQYHBFZNMP-UPJWGTAASA-N	1	0	255.358	1.687	50	0		CDAARO
Cc1cc[nH]c1C(=O)N1CCC[C@H](C[NH+]2CCOCC2)C1	ZINC000282677782	367989024	/nfs/dbraw/zinc/98/90/24/367989024.db2.gz	JLBYMKFKWPOPON-CQSZACIVSA-N	1	0	291.395	1.508	50	0		CDAARO
C[C@H](O)C1CCN(C(=O)[C@@H]2C[C@@H]3CCCC[C@H]3[NH2+]2)CC1	ZINC000252585392	368161462	/nfs/dbraw/zinc/16/14/62/368161462.db2.gz	IGHSFRYLJWTOAE-MHEUCROKSA-N	1	0	280.412	1.527	50	0		CDAARO
CSCCC[NH+]1CCN(c2cccnc2)CC1	ZINC000216031348	368180545	/nfs/dbraw/zinc/18/05/45/368180545.db2.gz	FPXYALQXPMBFSI-UHFFFAOYSA-N	1	0	251.399	1.957	50	0		CDAARO
CC[N@@H+]1CC[C@H](CNCc2c(C)nn(C)c2C)C1	ZINC000037644231	369506004	/nfs/dbraw/zinc/50/60/04/369506004.db2.gz	PUCNFKACUQJDOF-CYBMUJFWSA-N	1	0	250.390	1.468	50	0		CDAARO
O=C(C[C@@H]1CCOC1)N1CCC(C[NH+]2CCCC2)CC1	ZINC000369552224	369805624	/nfs/dbraw/zinc/80/56/24/369805624.db2.gz	GYQZORYOTCLQRI-HNNXBMFYSA-N	1	0	280.412	1.747	50	0		CDAARO
O[C@H](C[NH+]1CCC(c2nnc[nH]2)CC1)c1ccccc1F	ZINC000370235269	369988271	/nfs/dbraw/zinc/98/82/71/369988271.db2.gz	FIRXXKMKZIINAW-CQSZACIVSA-N	1	0	290.342	1.857	50	0		CDAARO
O=C(NC[C@H]1CCC[N@@H+](C2CCCC2)C1)c1cncnc1	ZINC000299779770	372757381	/nfs/dbraw/zinc/75/73/81/372757381.db2.gz	QJNQUSXFZSNLHV-CYBMUJFWSA-N	1	0	288.395	1.861	50	0		CDAARO
O=c1cc(C[N@H+]2CC[C@H](O)C2)[nH]c2ccc(F)cc12	ZINC000299794546	372766523	/nfs/dbraw/zinc/76/65/23/372766523.db2.gz	JUFINOXADGMCHM-NSHDSACASA-N	1	0	262.284	1.646	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1NC(=O)c1cc(C(C)C)on1	ZINC000299797657	372769129	/nfs/dbraw/zinc/76/91/29/372769129.db2.gz	PRWQJHCOOXVYKR-JSGCOSHPSA-N	1	0	295.383	1.635	50	0		CDAARO
CC(C)OC[C@H](C)[NH2+][C@@H](CO)Cc1ccccc1	ZINC000242273490	189905385	/nfs/dbraw/zinc/90/53/85/189905385.db2.gz	YDBQGQPKXHUKQS-DZGCQCFKSA-N	1	0	251.370	1.993	50	0		CDAARO
COC[C@@H]1C[N@H+](Cc2cnn(C)c2)C[C@H]1c1ccncc1	ZINC000253409269	373716278	/nfs/dbraw/zinc/71/62/78/373716278.db2.gz	LPZCMZSBTQXYTG-HOTGVXAUSA-N	1	0	286.379	1.677	50	0		CDAARO
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]1[NH2+]CC(N)=O	ZINC000253417340	373726327	/nfs/dbraw/zinc/72/63/27/373726327.db2.gz	KJPNHIQEZNROHE-SCVCMEIPSA-N	1	0	285.388	1.095	50	0		CDAARO
CCCC[N@H+](C)C[C@H](C)NC(=O)COCc1nc(C)no1	ZINC000253418930	373728152	/nfs/dbraw/zinc/72/81/52/373728152.db2.gz	FSYQQDJOJWLSKX-NSHDSACASA-N	1	0	298.387	1.131	50	0		CDAARO
O=C(Cn1ccnc1)NC12CC3CC(CC(C3)C1)C2	ZINC000029594088	374486180	/nfs/dbraw/zinc/48/61/80/374486180.db2.gz	WKAMYXZZLKCWGL-UHFFFAOYSA-N	1	0	259.353	1.968	50	0		CDAARO
C([NH2+]C(C1CC1)C1CC1)[C@@H]([C@@H]1CCOC1)N1CCOCC1	ZINC000095420022	374922110	/nfs/dbraw/zinc/92/21/10/374922110.db2.gz	JTLKXOXAKRTJTO-CVEARBPZSA-N	1	0	294.439	1.502	50	0		CDAARO
CCCC[C@H]([NH3+])C(=O)N1CC[C@@H](Oc2cccnc2)C1	ZINC000095466801	374961366	/nfs/dbraw/zinc/96/13/66/374961366.db2.gz	DMHWQAQTDLBLIY-KGLIPLIRSA-N	1	0	277.368	1.579	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CC(Oc2ccccc2Cl)C1	ZINC000095466895	374961849	/nfs/dbraw/zinc/96/18/49/374961849.db2.gz	IQLBYAGNNWHWAS-LLVKDONJSA-N	1	0	268.744	1.667	50	0		CDAARO
c1cn(CC2CC[NH+](CCc3ccccn3)CC2)nn1	ZINC000095973431	375047132	/nfs/dbraw/zinc/04/71/32/375047132.db2.gz	OXRNUPRNBNUXNT-UHFFFAOYSA-N	1	0	271.368	1.628	50	0		CDAARO
O=C(NC[C@@H]1C[C@H](F)C[NH2+]1)c1ccc2ccccc2n1	ZINC000215686984	375275734	/nfs/dbraw/zinc/27/57/34/375275734.db2.gz	PNJYKRCENHJKOB-RYUDHWBXSA-N	1	0	273.311	1.665	50	0		CDAARO
COc1ccc(OC)c(C[NH2+]CC(OC)OC)c1	ZINC000028755071	375310836	/nfs/dbraw/zinc/31/08/36/375310836.db2.gz	FMBQHYNNSVDSFH-UHFFFAOYSA-N	1	0	255.314	1.412	50	0		CDAARO
C[C@@H]1C[C@H]([NH2+]Cc2nncn2-c2ccccc2)[C@@H](C)O1	ZINC000296284602	375367635	/nfs/dbraw/zinc/36/76/35/375367635.db2.gz	FKHXGCFFTVXXMQ-BZPMIXESSA-N	1	0	272.352	1.923	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=S)NCc1ccco1	ZINC000003286851	375623717	/nfs/dbraw/zinc/62/37/17/375623717.db2.gz	HGKPNPGBQODYCZ-NSHDSACASA-N	1	0	267.398	1.728	50	0		CDAARO
C[NH+](C)CC(C)(C)NC(=O)CCCn1cccn1	ZINC000457204629	375828995	/nfs/dbraw/zinc/82/89/95/375828995.db2.gz	JWYGDPDESWUUNG-UHFFFAOYSA-N	1	0	252.362	1.120	50	0		CDAARO
C[NH+](C)CC(C)(C)NC(=O)c1cncc(Cl)c1	ZINC000457242195	375830201	/nfs/dbraw/zinc/83/02/01/375830201.db2.gz	PEXDMWMSBDIGND-UHFFFAOYSA-N	1	0	255.749	1.805	50	0		CDAARO
[NH3+]CC(=O)Nc1nnc(CCOc2ccccc2)s1	ZINC000031959220	375856349	/nfs/dbraw/zinc/85/63/49/375856349.db2.gz	QUXUKSZDADKPPA-UHFFFAOYSA-N	1	0	278.337	1.057	50	0		CDAARO
CC[C@H]1C[N@@H+]2CCC[C@H]2CN1Cc1cn2cccnc2n1	ZINC000246018087	376357246	/nfs/dbraw/zinc/35/72/46/376357246.db2.gz	LDIOZIFBJUHSOX-GJZGRUSLSA-N	1	0	285.395	1.788	50	0		CDAARO
COc1ncccc1C(=O)NCC1CC[NH+](C)CC1	ZINC000067713194	377228785	/nfs/dbraw/zinc/22/87/85/377228785.db2.gz	ZQOHCPSVYFCWLC-UHFFFAOYSA-N	1	0	263.341	1.162	50	0		CDAARO
CNC(=O)NC(=O)C[NH2+]C(c1ccccc1)c1ccccc1	ZINC000012756398	378806118	/nfs/dbraw/zinc/80/61/18/378806118.db2.gz	ZCMRKWTULNUCAC-UHFFFAOYSA-N	1	0	297.358	1.821	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](OC(C)=O)[C@H]2CCCC[C@@H]21	ZINC000004687089	285056182	/nfs/dbraw/zinc/05/61/82/285056182.db2.gz	COHAZZNQVVNWKS-MELADBBJSA-N	1	0	255.358	1.829	50	0		CDAARO
COC[C@H](C)NC(=O)C[N@H+](C)C1CCC(C)CC1	ZINC000032751520	285342244	/nfs/dbraw/zinc/34/22/44/285342244.db2.gz	UHDXTCZTISJBRT-CPCZMJQVSA-N	1	0	256.390	1.648	50	0		CDAARO
CCOC(=O)[C@]1(CCOC)CCC[N@@H+](C2CCOCC2)C1	ZINC000012587699	390203673	/nfs/dbraw/zinc/20/36/73/390203673.db2.gz	UYAJZLWXXNNSCU-INIZCTEOSA-N	1	0	299.411	1.847	50	0		CDAARO
CC(C)NC(=O)N1CCN(CC[NH+]2CCCCC2)CC1	ZINC000095400257	184966817	/nfs/dbraw/zinc/96/68/17/184966817.db2.gz	IVUUIQNZCIRYTJ-UHFFFAOYSA-N	1	0	282.432	1.208	50	0		CDAARO
Cc1ccc(C)c(OCC(=O)NCCOCC[NH+](C)C)c1	ZINC000095465024	184993700	/nfs/dbraw/zinc/99/37/00/184993700.db2.gz	GVJMDKGHVCBEBK-UHFFFAOYSA-N	1	0	294.395	1.377	50	0		CDAARO
CCCn1ncc(CN2CC[N@H+](C)[C@@H](CCO)C2)c1C	ZINC000023145868	390240629	/nfs/dbraw/zinc/24/06/29/390240629.db2.gz	WESVWOXCDRPSSD-HNNXBMFYSA-N	1	0	280.416	1.100	50	0		CDAARO
COCCCNC(=O)C[N@@H+]1CCS[C@H]2CCCC[C@@H]21	ZINC000176928464	390376684	/nfs/dbraw/zinc/37/66/84/390376684.db2.gz	VWAYERBHOGOFSH-STQMWFEESA-N	1	0	286.441	1.499	50	0		CDAARO
CC(C)[NH+]1CCC([N@H+](C)CCOC[C@H]2CCCO2)CC1	ZINC000096421089	390514273	/nfs/dbraw/zinc/51/42/73/390514273.db2.gz	IIHREBQRRIHVLQ-MRXNPFEDSA-N	1	0	284.444	1.987	50	0		CDAARO
Cc1cccc(C)c1OCC(=O)N1CCC[C@@H]([NH3+])C1	ZINC000191327264	130221670	/nfs/dbraw/zinc/22/16/70/130221670.db2.gz	UGNKEWBPIRZCAV-CYBMUJFWSA-N	1	0	262.353	1.632	50	0		CDAARO
[NH3+]CCC(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000269131889	132117527	/nfs/dbraw/zinc/11/75/27/132117527.db2.gz	VOQHVMPHQQEOTA-UONOGXRCSA-N	1	0	262.353	1.450	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)[C@H]2Cc3cc(Cl)ccc3O2)C1	ZINC000269171701	132124409	/nfs/dbraw/zinc/12/44/09/132124409.db2.gz	VHGFLNGIVDEPJT-NOZJJQNGSA-N	1	0	280.755	1.451	50	0		CDAARO
COC[C@@H](O)C[N@@H+]1CCc2cc(F)ccc2[C@H]1C	ZINC000096415719	393183982	/nfs/dbraw/zinc/18/39/82/393183982.db2.gz	ITYQGQXFTMSJIG-MFKMUULPSA-N	1	0	253.317	1.752	50	0		CDAARO
CN(CC(=O)NCC1CC[NH+](C)CC1)Cc1ccccc1	ZINC000101522427	147135327	/nfs/dbraw/zinc/13/53/27/147135327.db2.gz	LOEHNNINPGHWFI-UHFFFAOYSA-N	1	0	289.423	1.576	50	0		CDAARO
COCC1(C(=O)NCC2([NH+](C)C)CCCC2)CC1	ZINC000352416813	155174186	/nfs/dbraw/zinc/17/41/86/155174186.db2.gz	KOKYGXMNNGZZRQ-UHFFFAOYSA-N	1	0	254.374	1.404	50	0		CDAARO
COCCC1(C(=O)NCC2(O)CC[NH+](C)CC2)CCCC1	ZINC000089375169	292294967	/nfs/dbraw/zinc/29/49/67/292294967.db2.gz	KWAOWAPNHFGFKD-UHFFFAOYSA-N	1	0	298.427	1.156	50	0		CDAARO
CCS(=O)(=O)NCCC[NH2+][C@@H]1CCC[C@H](C)[C@@H]1C	ZINC000096500625	286680274	/nfs/dbraw/zinc/68/02/74/286680274.db2.gz	NQBLXMYGWIIOIN-RWMBFGLXSA-N	1	0	276.446	1.730	50	0		CDAARO
COCCC[NH2+]CCOCCOc1ccc(OC)cc1	ZINC000002981113	169846954	/nfs/dbraw/zinc/84/69/54/169846954.db2.gz	SIYGMGYEEQQDCK-UHFFFAOYSA-N	1	0	283.368	1.717	50	0		CDAARO
CCOC(=O)C[C@@]1(C)OC[C@H](C[NH+]2CCCCC2)O1	ZINC000004811443	170021161	/nfs/dbraw/zinc/02/11/61/170021161.db2.gz	UZULUDFGYFDQFW-JSGCOSHPSA-N	1	0	271.357	1.557	50	0		CDAARO
C[C@@H](O)C[NH2+]Cc1ccc(OCC(=O)NC(C)(C)C)cc1	ZINC000005912732	170154568	/nfs/dbraw/zinc/15/45/68/170154568.db2.gz	JFIOTSHSMHDRTO-GFCCVEGCSA-N	1	0	294.395	1.451	50	0		CDAARO
O=S1(=O)CC[C@@H]([NH2+]Cc2cccc(Cl)c2)C1	ZINC000006480396	170204507	/nfs/dbraw/zinc/20/45/07/170204507.db2.gz	HQVWWFTXVGIJNO-LLVKDONJSA-N	1	0	259.758	1.617	50	0		CDAARO
CCOc1ccc(N2C(=O)C[C@H]([NH2+]C3CC3)C2=O)cc1	ZINC000020176541	171042162	/nfs/dbraw/zinc/04/21/62/171042162.db2.gz	QPMKMEGMRHAONT-ZDUSSCGKSA-N	1	0	274.320	1.469	50	0		CDAARO
O=C(NC1CC[NH2+]CC1)c1ccccc1Br	ZINC000020271968	171126783	/nfs/dbraw/zinc/12/67/83/171126783.db2.gz	GMSNLGYIYLNHOD-UHFFFAOYSA-N	1	0	283.169	1.931	50	0		CDAARO
Cc1cccc(OCC[NH+]2CCC(C(N)=O)CC2)c1	ZINC000021670832	171319197	/nfs/dbraw/zinc/31/91/97/171319197.db2.gz	AIEKJOKTGPDYPH-UHFFFAOYSA-N	1	0	262.353	1.571	50	0		CDAARO
C[N@H+](C[C@@H]1CCCCO1)CC(C)(C)CN1CCOCC1	ZINC000032523835	171731602	/nfs/dbraw/zinc/73/16/02/171731602.db2.gz	VJXOLSIKUWYICK-HNNXBMFYSA-N	1	0	284.444	1.846	50	0		CDAARO
[NH3+]C[C@@H](c1ccccc1Cl)N1CCS(=O)CC1	ZINC000035287517	172105044	/nfs/dbraw/zinc/10/50/44/172105044.db2.gz	LWOODSYOUCLNPK-LBPRGKRZSA-N	1	0	272.801	1.404	50	0		CDAARO
CCn1c(=O)n(CCC=C(C)C)nc1[C@H]1CCC[NH2+]C1	ZINC000067739814	175788278	/nfs/dbraw/zinc/78/82/78/175788278.db2.gz	ZPDFYVUHJKAOFY-ZDUSSCGKSA-N	1	0	278.400	1.888	50	0		CDAARO
O=C(Cc1ccccc1Cl)N[C@H]1CCC[NH2+]C1	ZINC000071397133	176150666	/nfs/dbraw/zinc/15/06/66/176150666.db2.gz	FCGVZYHUKUKQOK-NSHDSACASA-N	1	0	252.745	1.751	50	0		CDAARO
CCC(CC)c1nccn1CC[N@@H+]1CCC[C@@H](C(N)=O)C1	ZINC000071419286	176160470	/nfs/dbraw/zinc/16/04/70/176160470.db2.gz	BYFVOVQKTAOTLX-CQSZACIVSA-N	1	0	292.427	1.984	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1Cc1cn(-c2ccccc2)nn1	ZINC000072152129	176327417	/nfs/dbraw/zinc/32/74/17/176327417.db2.gz	ALJISQYRRMXMDG-OAHLLOKOSA-N	1	0	271.368	1.581	50	0		CDAARO
O=C(N[C@H]1C[NH+]2CCC1CC2)c1cn(-c2ccccc2)nn1	ZINC000072164974	176331179	/nfs/dbraw/zinc/33/11/79/176331179.db2.gz	JXELNNAUCLLLSX-AWEZNQCLSA-N	1	0	297.362	1.091	50	0		CDAARO
CN(C)C(=O)[C@]1(CCCc2ccccn2)CCC[NH2+]1	ZINC000072343775	176371944	/nfs/dbraw/zinc/37/19/44/176371944.db2.gz	YENKTPSIUOQLCE-HNNXBMFYSA-N	1	0	261.369	1.615	50	0		CDAARO
CC(=O)Nc1ccc([C@@H]2[NH2+]CCc3nc[nH]c32)cc1	ZINC000065399207	277083114	/nfs/dbraw/zinc/08/31/14/277083114.db2.gz	UQEIZESBGYJISQ-ZDUSSCGKSA-N	1	0	256.309	1.603	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)c1ccccc1C(F)(F)F	ZINC000036235640	277344963	/nfs/dbraw/zinc/34/49/63/277344963.db2.gz	AUGHTEKCNYRFDI-MNOVXSKESA-N	1	0	288.269	1.422	50	0		CDAARO
CC(C)C[NH2+]C[C@@]1(O)CCCN(CC(C)(C)C)C1=O	ZINC000011948063	277422637	/nfs/dbraw/zinc/42/26/37/277422637.db2.gz	PZOLWHWQNLWUJR-HNNXBMFYSA-N	1	0	270.417	1.632	50	0		CDAARO
CC(C)(C)OC(=O)N1CCOC[C@@]2(CCC[NH2+]C2)C1	ZINC000091303587	278402605	/nfs/dbraw/zinc/40/26/05/278402605.db2.gz	IRHPGRTVYQUDSJ-CQSZACIVSA-N	1	0	270.373	1.624	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@H](C[NH3+])C(F)(F)C1	ZINC000095628878	278404551	/nfs/dbraw/zinc/40/45/51/278404551.db2.gz	WYFLAUNQWVXXHB-QMMMGPOBSA-N	1	0	250.289	1.837	50	0		CDAARO
CC(C)C[C@@H](C[NH3+])NS(=O)(=O)N(C)C1CCCCC1	ZINC000111829875	278978026	/nfs/dbraw/zinc/97/80/26/278978026.db2.gz	ZUGBBWPTYCMJNJ-LBPRGKRZSA-N	1	0	291.461	1.459	50	0		CDAARO
Cc1cc(N2CCC[C@@H](c3nccn3C)C2)nc(N)[nH+]1	ZINC000082134402	280552669	/nfs/dbraw/zinc/55/26/69/280552669.db2.gz	BSTNRANYZIAVEM-LLVKDONJSA-N	1	0	272.356	1.485	50	0		CDAARO
Cc1ccc(N2CCC(N[C@H]3CC[NH2+]C3)CC2)cc1	ZINC000426380768	280864360	/nfs/dbraw/zinc/86/43/60/280864360.db2.gz	ZCRIGHZEBBRXNP-HNNXBMFYSA-N	1	0	259.397	1.915	50	0		CDAARO
CC[C@H](OC)C(=O)N1CC[C@H]([NH+]2CCCC2)[C@@H]1C	ZINC000240244258	281009119	/nfs/dbraw/zinc/00/91/19/281009119.db2.gz	DLHPMUBYESNPAV-AVGNSLFASA-N	1	0	254.374	1.497	50	0		CDAARO
Nc1ccc(C(=O)N2CC[C@H]([NH+]3CCCCC3)C2)cn1	ZINC000062984976	295351491	/nfs/dbraw/zinc/35/14/91/295351491.db2.gz	XMFJYWYBAIZOBB-ZDUSSCGKSA-N	1	0	274.368	1.364	50	0		CDAARO
CC(C)n1ccnc1CNC(=O)CCCn1cncn1	ZINC000534634892	328333107	/nfs/dbraw/zinc/33/31/07/328333107.db2.gz	NBDGAIFXBIBEIH-UHFFFAOYSA-N	1	0	276.344	1.152	50	0		CDAARO
CC(C)[C@@H](CNC(=O)Cc1ccc(CO)cc1)[NH+](C)C	ZINC000534637021	328334151	/nfs/dbraw/zinc/33/41/51/328334151.db2.gz	VIDFFRCJOZFWGD-OAHLLOKOSA-N	1	0	278.396	1.424	50	0		CDAARO
O=C(NCCCc1ccccc1Cl)[C@@H]1C=CC[NH2+]1	ZINC000534637854	328334506	/nfs/dbraw/zinc/33/45/06/328334506.db2.gz	PTQKTMQNBJOBQU-ZDUSSCGKSA-N	1	0	264.756	1.917	50	0		CDAARO
Cc1cc(C(F)(F)F)cc(N2CCO[C@@H](CC[NH3+])C2)n1	ZINC000534647830	328343095	/nfs/dbraw/zinc/34/30/95/328343095.db2.gz	QOOYHBCLTPRAPJ-NSHDSACASA-N	1	0	289.301	1.963	50	0		CDAARO
CS(=O)(=O)Nc1ccc(CC[NH+]2CCCC2)cc1	ZINC000130080441	323210534	/nfs/dbraw/zinc/21/05/34/323210534.db2.gz	XNRKLLUHMSILND-UHFFFAOYSA-N	1	0	268.382	1.696	50	0		CDAARO
CCC[C@H]1CN(C(=O)[C@@H]([NH3+])c2ccccc2)CCO1	ZINC000182850730	323304610	/nfs/dbraw/zinc/30/46/10/323304610.db2.gz	VQVKFKIGNXCKNL-KBPBESRZSA-N	1	0	262.353	1.714	50	0		CDAARO
C[C@@H](Cc1ccccc1)[NH2+]Cc1cc(=O)[nH]c(=O)[nH]1	ZINC000670419693	482938641	/nfs/dbraw/zinc/93/86/41/482938641.db2.gz	PKYQXAKQVRETGF-JTQLQIEISA-N	1	0	259.309	1.609	50	0		CDAARO
CCCc1nc(NCCC[NH+]2CCC(O)CC2)no1	ZINC000670433941	482967370	/nfs/dbraw/zinc/96/73/70/482967370.db2.gz	ROOBZMOMYUMPCP-UHFFFAOYSA-N	1	0	268.361	1.281	50	0		CDAARO
Cn1ccnc1CC[N@@H+]1CC[C@@](O)(c2ccccc2)C1	ZINC000670440804	482985463	/nfs/dbraw/zinc/98/54/63/482985463.db2.gz	KIQDCZIDMPWMBT-INIZCTEOSA-N	1	0	271.364	1.556	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H]1CN(C(=O)c1cncs1)C2	ZINC000670453850	483024009	/nfs/dbraw/zinc/02/40/09/483024009.db2.gz	FTVJSWOWYGFPEA-QWRGUYRKSA-N	1	0	265.382	1.699	50	0		CDAARO
CCOC(=O)N1CC[C@@H]([NH2+]CCc2nccs2)C1	ZINC000670462192	483047787	/nfs/dbraw/zinc/04/77/87/483047787.db2.gz	DIDXBIFIKJCDJT-SNVBAGLBSA-N	1	0	269.370	1.506	50	0		CDAARO
O=C(CC1CCCC1)NCC[N@H+]1CCCC[C@H]1CO	ZINC000670467762	483060351	/nfs/dbraw/zinc/06/03/51/483060351.db2.gz	FHDGZCBIAPCBSU-AWEZNQCLSA-N	1	0	268.401	1.530	50	0		CDAARO
C[N@H+](CC[C@H]1CCCCO1)CC(=O)N1CCCC1	ZINC000680370701	483598635	/nfs/dbraw/zinc/59/86/35/483598635.db2.gz	KALJQLVAHMZTPC-CYBMUJFWSA-N	1	0	254.374	1.500	50	0		CDAARO
COCCC(=O)N[C@H]1CCC[N@H+](CCc2ccccc2)C1	ZINC000012299520	522956225	/nfs/dbraw/zinc/95/62/25/522956225.db2.gz	KDHPIOCVANXJGA-INIZCTEOSA-N	1	0	290.407	1.846	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]CCCN1CCCCCC1=O	ZINC000097159378	567904991	/nfs/dbraw/zinc/90/49/91/567904991.db2.gz	OYNWVUXWMGVUTE-UHFFFAOYSA-N	1	0	278.400	1.909	50	0		CDAARO
O=c1c2cc(F)c(F)cc2ncn1[C@H]1CCC[NH2+]C1	ZINC000757178350	577033769	/nfs/dbraw/zinc/03/37/69/577033769.db2.gz	UIVJLSISBYBELC-QMMMGPOBSA-N	1	0	265.263	1.599	50	0		CDAARO
CC(=O)c1cc(C[NH2+]CCN2CCCC[C@@H]2CO)n(C)c1	ZINC000952962458	614248800	/nfs/dbraw/zinc/24/88/00/614248800.db2.gz	BSFBBUBMRSGZIG-OAHLLOKOSA-N	1	0	293.411	1.164	50	0		CDAARO
C[C@@H](Oc1cccnc1)C(=O)N1[C@H](C)C[C@@H](C[NH3+])C[C@@H]1C	ZINC000888095979	617757526	/nfs/dbraw/zinc/75/75/26/617757526.db2.gz	MPMINJQHOOISDC-XJFOESAGSA-N	1	0	291.395	1.823	50	0		CDAARO
Cc1cc(N)nc(N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)[nH+]1	ZINC000871101505	630804988	/nfs/dbraw/zinc/80/49/88/630804988.db2.gz	QMUKOCGIVORDSO-YUSALJHKSA-N	1	0	260.341	1.737	50	0		CDAARO
C[NH2+]Cc1cn([C@H]2CCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000849146706	631446291	/nfs/dbraw/zinc/44/62/91/631446291.db2.gz	HGGWOKCCVCIVGC-NSHDSACASA-N	1	0	281.360	1.179	50	0		CDAARO
Cc1cccc(CN2C[C@H]3COC[C@@H]2C[N@H+](C)C3)n1	ZINC001772701794	1159437449	/nfs/dbraw/zinc/43/74/49/1159437449.db2.gz	MYUPJUQFDPQXJI-ZFWWWQNUSA-N	1	0	261.369	1.152	50	0		CDAARO
Cc1nc(N2C[C@@H]3C[NH2+]C[C@@]3(CO)C2)ccc1Cl	ZINC001772703863	1159439281	/nfs/dbraw/zinc/43/92/81/1159439281.db2.gz	KAMZGNHCTSXCMH-GWCFXTLKSA-N	1	0	267.760	1.062	50	0		CDAARO
OC[C@]12C[NH2+]C[C@H]1CN(CCCOc1ccc(F)cc1)C2	ZINC001772710811	1159444972	/nfs/dbraw/zinc/44/49/72/1159444972.db2.gz	WRMMOBREASERSA-XJKSGUPXSA-N	1	0	294.370	1.108	50	0		CDAARO
OC[C@@]12C[NH2+]C[C@@H]1CN(CCCOc1ccc(F)cc1)C2	ZINC001772710806	1159445112	/nfs/dbraw/zinc/44/51/12/1159445112.db2.gz	WRMMOBREASERSA-CJNGLKHVSA-N	1	0	294.370	1.108	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000193269222	832101143	/nfs/dbraw/zinc/10/11/43/832101143.db2.gz	KHDHDRVFYYDYGM-LBPRGKRZSA-N	1	0	268.382	1.231	50	0		CDAARO
Cc1cccnc1N1CC[NH+](C[C@H]2CCCO2)CC1	ZINC000020543314	833028526	/nfs/dbraw/zinc/02/85/26/833028526.db2.gz	IEZAKGCAUVZMOK-CQSZACIVSA-N	1	0	261.369	1.691	50	0		CDAARO
C[NH2+]CC(=O)Nc1ccccc1OC[C@@H]1CCCO1	ZINC000066225825	829306207	/nfs/dbraw/zinc/30/62/07/829306207.db2.gz	HADDCQRXLFTHMF-NSHDSACASA-N	1	0	264.325	1.402	50	0		CDAARO
COc1ccc(C[NH2+]CCN2CCCC[C@H]2CO)cc1F	ZINC000952991521	833401632	/nfs/dbraw/zinc/40/16/32/833401632.db2.gz	TZCAWAYISSBOIY-AWEZNQCLSA-N	1	0	296.386	1.771	50	0		CDAARO
Cn1cc(-c2ccnc(N3CCC[C@@H]([NH+](C)C)C3)n2)cn1	ZINC000023505133	829865305	/nfs/dbraw/zinc/86/53/05/829865305.db2.gz	CJNAIZFNIKIQIY-CYBMUJFWSA-N	1	0	286.383	1.408	50	0		CDAARO
Cc1nc[nH]c1C(=O)NC[C@@H]1CCCN(c2cc[nH+]cc2)C1	ZINC000952974111	830345964	/nfs/dbraw/zinc/34/59/64/830345964.db2.gz	SRSRCKCMDHUJGV-ZDUSSCGKSA-N	1	0	299.378	1.760	50	0		CDAARO
Cc1cccc(OCCNC(=O)[C@H]2CCC[NH2+][C@H]2C)c1	ZINC000094647855	832391883	/nfs/dbraw/zinc/39/18/83/832391883.db2.gz	CLFIGCIKDCSZNW-ZFWWWQNUSA-N	1	0	276.380	1.878	50	0		CDAARO
NC(=O)[C@@H]1CCC[N@@H+]([C@H]2CCc3ccccc3C2)C1	ZINC000299872784	833844214	/nfs/dbraw/zinc/84/42/14/833844214.db2.gz	KAFBBKJAOLFKCB-CABCVRRESA-N	1	0	258.365	1.741	50	0		CDAARO
c1coc(-c2nnc(CN3CCN(C4CC4)CC3)o2)c1	ZINC000195221622	833879952	/nfs/dbraw/zinc/87/99/52/833879952.db2.gz	QHFMIJLLKPQPCM-UHFFFAOYSA-N	1	0	274.324	1.610	50	0		CDAARO
CCC[N@H+]1CCc2nnc([C@@H](C)NC(=O)C3CC3)n2CC1	ZINC000011788302	832924002	/nfs/dbraw/zinc/92/40/02/832924002.db2.gz	XSLNYZRVSSHBIT-LLVKDONJSA-N	1	0	291.399	1.133	50	0		CDAARO
CN1CC[NH+]=C1SCC(=O)NC1CCCCCC1	ZINC000725343627	832982068	/nfs/dbraw/zinc/98/20/68/832982068.db2.gz	PZGCFFNECLPLKV-UHFFFAOYSA-N	1	0	269.414	1.860	50	0		CDAARO
CC[NH+]1CCN(c2cc([C@@H]3CCOC3)ncn2)CC1	ZINC000426529375	834577989	/nfs/dbraw/zinc/57/79/89/834577989.db2.gz	ORFSIKYDHILTQA-GFCCVEGCSA-N	1	0	262.357	1.122	50	0		CDAARO
c1nc(CC[NH2+][C@@H]2CCN(c3ccccc3)C2)c[nH]1	ZINC000952969015	834802790	/nfs/dbraw/zinc/80/27/90/834802790.db2.gz	AHXNHDOZYSAQCN-CQSZACIVSA-N	1	0	256.353	1.821	50	0		CDAARO
CC(C)(C(=O)N1CCC(n2cnnc2)CC1)[NH+]1CCCC1	ZINC000426574873	835371237	/nfs/dbraw/zinc/37/12/37/835371237.db2.gz	JHWOWQNKDMTSAB-UHFFFAOYSA-N	1	0	291.399	1.316	50	0		CDAARO
O=C(Cc1ccncc1)N1CCC[C@@H](C[NH+]2CCCC2)C1	ZINC000020868370	835479774	/nfs/dbraw/zinc/47/97/74/835479774.db2.gz	SIORAWNUZQIBSW-INIZCTEOSA-N	1	0	287.407	1.959	50	0		CDAARO
O[C@@H]1CN(Cc2ccncc2)CC[C@H]1[NH+]1CCCCCC1	ZINC000023368308	898226189	/nfs/dbraw/zinc/22/61/89/898226189.db2.gz	ATGQCVHIVGVSDN-IAGOWNOFSA-N	1	0	289.423	1.893	50	0		CDAARO
C(C[C@@H]1CC[NH2+]C1)c1noc(C2CCOCC2)n1	ZINC000675023956	899878795	/nfs/dbraw/zinc/87/87/95/899878795.db2.gz	IYMJFTCARQWMDO-SNVBAGLBSA-N	1	0	251.330	1.506	50	0		CDAARO
CC[C@H]([NH3+])c1nc(-c2cccc3c2ccn3C)nn1CCO	ZINC000952873937	910427723	/nfs/dbraw/zinc/42/77/23/910427723.db2.gz	RYVDELIYUWODAE-ZDUSSCGKSA-N	1	0	299.378	1.839	50	0		CDAARO
CCc1nccn1C[C@@H](C)[NH2+]CCc1nc(C)cc(=O)[nH]1	ZINC000823557303	925710970	/nfs/dbraw/zinc/71/09/70/925710970.db2.gz	LMJAHYKBXNGDQU-GFCCVEGCSA-N	1	0	289.383	1.470	50	0		CDAARO
COC(C)(C)C[C@H](C)[NH2+]CCc1nc(C)cc(=O)[nH]1	ZINC000824250109	925810857	/nfs/dbraw/zinc/81/08/57/925810857.db2.gz	WFDDWJDNAXULSA-NSHDSACASA-N	1	0	267.373	1.826	50	0		CDAARO
COCc1nc(CN2CCCC2)n(C(C)(C)C)n1	ZINC000824485200	925824072	/nfs/dbraw/zinc/82/40/72/925824072.db2.gz	CJCLFODBDZQBPX-UHFFFAOYSA-N	1	0	252.362	1.775	50	0		CDAARO
Cn1nccc1C(=O)N1CC[NH+](CC2CCCC2)CC1	ZINC000825660896	925879691	/nfs/dbraw/zinc/87/96/91/925879691.db2.gz	CISWLGUWKKGNNV-UHFFFAOYSA-N	1	0	276.384	1.368	50	0		CDAARO
Cc1nc2cc(CNC(=O)[C@H]3C=CC[NH2+]3)ccc2n1C	ZINC000827690932	925956291	/nfs/dbraw/zinc/95/62/91/925956291.db2.gz	QNJXPTNXAIYLEZ-GFCCVEGCSA-N	1	0	270.336	1.026	50	0		CDAARO
O=CN1CCC[N@H+](C[C@@H]2CCc3ccccc3C2)CC1	ZINC000585087124	930899742	/nfs/dbraw/zinc/89/97/42/930899742.db2.gz	PDXDESOLHSMQNK-OAHLLOKOSA-N	1	0	272.392	1.956	50	0		CDAARO
C[C@H](CC(=O)NC(C)(C)CCC[NH+](C)C)N1CCCC1=O	ZINC000585121495	930986067	/nfs/dbraw/zinc/98/60/67/930986067.db2.gz	QWGKVGFZORTHHM-CYBMUJFWSA-N	1	0	297.443	1.624	50	0		CDAARO
OCC[N@@H+](Cc1cccs1)C[C@H]1CCCOC1	ZINC001207469011	940202513	/nfs/dbraw/zinc/20/25/13/940202513.db2.gz	TXOGHGCOIGIQDQ-GFCCVEGCSA-N	1	0	255.383	1.969	50	0		CDAARO
c1nncn1CCN1CCC[N@@H+](C2CCCC2)CC1	ZINC001529195285	969008357	/nfs/dbraw/zinc/00/83/57/969008357.db2.gz	IAJAXDLNQZQLFK-UHFFFAOYSA-N	1	0	263.389	1.228	50	0		CDAARO
Cc1cc(C(=O)N(C)C[C@@H]2CCCC[N@@H+]2C)c(=O)[nH]c1C	ZINC001506400533	975148959	/nfs/dbraw/zinc/14/89/59/975148959.db2.gz	WFXCHLNUGNHSHR-ZDUSSCGKSA-N	1	0	291.395	1.960	50	0		CDAARO
CCn1cnnc1CC[NH2+][C@H](C)Cn1nc(C)cc1C	ZINC001506398954	975149025	/nfs/dbraw/zinc/14/90/25/975149025.db2.gz	IHGBAJDGVLMWOB-GFCCVEGCSA-N	1	0	276.388	1.332	50	0		CDAARO
CCc1nc(CN2CCCC[C@H]([NH+](C)C)C2)no1	ZINC001506403268	975150005	/nfs/dbraw/zinc/15/00/05/975150005.db2.gz	SRSSZCBRRQCJQY-NSHDSACASA-N	1	0	252.362	1.548	50	0		CDAARO
CO[C@H]1COCC[C@@H]1Nc1cc(N2CCCCC2)ncn1	ZINC001506420989	975158113	/nfs/dbraw/zinc/15/81/13/975158113.db2.gz	MWDNUSABJKUQEF-STQMWFEESA-N	1	0	292.383	1.683	50	0		CDAARO
CC(C)c1nc(CCNc2cc(NCCO)ncn2)no1	ZINC001506421357	975158431	/nfs/dbraw/zinc/15/84/31/975158431.db2.gz	OWZRBGQPDUHYCD-UHFFFAOYSA-N	1	0	292.343	1.042	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]Cc1nnc2ccccn21	ZINC001506420145	975158475	/nfs/dbraw/zinc/15/84/75/975158475.db2.gz	VZACJDMJCCKCFS-LBPRGKRZSA-N	1	0	284.367	1.667	50	0		CDAARO
Cc1cccc(N2CCC([NH+]3CC(O)C3)CC2)c1C	ZINC001506428505	975161712	/nfs/dbraw/zinc/16/17/12/975161712.db2.gz	XMAYRHBQUTUXRP-UHFFFAOYSA-N	1	0	260.381	1.949	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)NCc1ccc(F)cc1	ZINC000019427377	230372044	/nfs/dbraw/zinc/37/20/44/230372044.db2.gz	OALNDISZAQKKCQ-UHFFFAOYSA-N	1	0	250.317	1.832	50	0		CDAARO
[NH3+]CC[C@@H]1CN(Cc2cnccc2Cl)CCO1	ZINC000426711312	230427304	/nfs/dbraw/zinc/42/73/04/230427304.db2.gz	LMPBDVDEPLOTCZ-LLVKDONJSA-N	1	0	255.749	1.285	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1ccc(-n2ccnc2)cc1	ZINC000124460448	187138343	/nfs/dbraw/zinc/13/83/43/187138343.db2.gz	VYBHJWFRLGLMNT-GFCCVEGCSA-N	1	0	270.336	1.306	50	0		CDAARO
CCO[C@H](C)c1nc(CC(=O)N2CC[NH2+]C[C@H]2C)cs1	ZINC000124571987	187143695	/nfs/dbraw/zinc/14/36/95/187143695.db2.gz	DWPQLIOQXYTPBY-GHMZBOCLSA-N	1	0	297.424	1.603	50	0		CDAARO
Cn1ccnc1C[C@H]1CCC[N@H+](Cc2ccc(CO)o2)C1	ZINC000097377013	342002931	/nfs/dbraw/zinc/00/29/31/342002931.db2.gz	JXRBIXRNEYYGPF-CYBMUJFWSA-N	1	0	289.379	1.960	50	0		CDAARO
COC(=O)c1ccc(C(=O)N[C@H]2CCC[N@H+](C)[C@H]2C)cc1	ZINC000096009720	185064746	/nfs/dbraw/zinc/06/47/46/185064746.db2.gz	BOQPVRDYAIEFLT-FZMZJTMJSA-N	1	0	290.363	1.686	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@H](CNC(=O)N2C[C@@H](C)O[C@H](C)C2)C1	ZINC000251534060	361816240	/nfs/dbraw/zinc/81/62/40/361816240.db2.gz	AYTGLUPFDHSUPD-RBSFLKMASA-N	1	0	297.443	1.926	50	0		CDAARO
Cc1cc(NC2CCN(CC(N)=O)CC2)cc(C)[nH+]1	ZINC000311447224	342089877	/nfs/dbraw/zinc/08/98/77/342089877.db2.gz	KNJSOSYYARLDHT-UHFFFAOYSA-N	1	0	262.357	1.060	50	0		CDAARO
COc1ccc(CC[C@@H](C)[NH+]2CCN(CCO)CC2)cc1	ZINC000023283342	342089178	/nfs/dbraw/zinc/08/91/78/342089178.db2.gz	VZNKOKKAZWZUCT-OAHLLOKOSA-N	1	0	292.423	1.626	50	0		CDAARO
[NH3+][C@@H](C(=O)N1CCO[C@@H](c2ccco2)C1)c1ccccc1	ZINC000195554326	342625960	/nfs/dbraw/zinc/62/59/60/342625960.db2.gz	VXYWCOPAKANRIG-HUUCEWRRSA-N	1	0	286.331	1.880	50	0		CDAARO
CC(C)COC[C@H](C)NC(=O)[C@]1(C)CCCC[NH2+]1	ZINC000195556995	342626599	/nfs/dbraw/zinc/62/65/99/342626599.db2.gz	OHLZHJGMGXSHLZ-JSGCOSHPSA-N	1	0	256.390	1.696	50	0		CDAARO
C[C@H](CNC(=O)N1[C@H](C)CCC[C@H]1C)N1CC[NH+](C)CC1	ZINC000092323889	539087907	/nfs/dbraw/zinc/08/79/07/539087907.db2.gz	OLAJWULWJPWSRV-RBSFLKMASA-N	1	0	296.459	1.595	50	0		CDAARO
O=S1(=O)CC[C@H](C[NH2+][C@H]2CCc3ccc(F)cc32)C1	ZINC000095419622	539087959	/nfs/dbraw/zinc/08/79/59/539087959.db2.gz	HDHVKYHTZIWKFY-YGRLFVJLSA-N	1	0	283.368	1.837	50	0		CDAARO
C[C@H](CNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2[NH2+]1)Cn1cccn1	ZINC000252537018	361859690	/nfs/dbraw/zinc/85/96/90/361859690.db2.gz	KELWMNCWQKZURU-BARDWOONSA-N	1	0	290.411	1.556	50	0		CDAARO
COCCN(C)c1ccc(C[N@@H+]2CC[C@@H](O)[C@@H](C)C2)cn1	ZINC000252536920	361860106	/nfs/dbraw/zinc/86/01/06/361860106.db2.gz	JUNGOBWGANKIAL-DZGCQCFKSA-N	1	0	293.411	1.367	50	0		CDAARO
CC(C)NC(=O)CC[N@@H+]1CC[C@H](CNc2ccccn2)C1	ZINC000065541065	361911700	/nfs/dbraw/zinc/91/17/00/361911700.db2.gz	JBINIKVQVRJMCU-CQSZACIVSA-N	1	0	290.411	1.730	50	0		CDAARO
CC(C)c1nn(C)cc1CN(C)C(=O)[C@@H]([NH3+])C(C)C	ZINC000097234198	342205379	/nfs/dbraw/zinc/20/53/79/342205379.db2.gz	VKPOWPVKINLGIG-LBPRGKRZSA-N	1	0	266.389	1.485	50	0		CDAARO
COC(=O)c1cc(C[NH2+][C@H](C)[C@H]2CCOC2)oc1C	ZINC000097034933	185157125	/nfs/dbraw/zinc/15/71/25/185157125.db2.gz	FYZSMVYYYOBMEO-KOLCDFICSA-N	1	0	267.325	1.889	50	0		CDAARO
NC(=O)[C@H]1CC[N@H+](C[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000585141356	342219103	/nfs/dbraw/zinc/21/91/03/342219103.db2.gz	ULHGKWXZOONNPH-KBPBESRZSA-N	1	0	273.380	1.320	50	0		CDAARO
C[C@@H]1CCC[N@H+](CC(=O)NC(=O)NC2CCCC2)C1	ZINC000007787443	539090772	/nfs/dbraw/zinc/09/07/72/539090772.db2.gz	GJENIICYXCBNSF-LLVKDONJSA-N	1	0	267.373	1.487	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)N[C@@H]1COc2ccccc2C1	ZINC000021944774	539126416	/nfs/dbraw/zinc/12/64/16/539126416.db2.gz	JNPAMFJHEJPUKK-AWEZNQCLSA-N	1	0	289.379	1.385	50	0		CDAARO
CNC(=O)[C@H](CC(C)C)NC1CC[NH+](C(C)C)CC1	ZINC000037161034	539141984	/nfs/dbraw/zinc/14/19/84/539141984.db2.gz	IEXFFUVBRYXSEG-AWEZNQCLSA-N	1	0	269.433	1.610	50	0		CDAARO
O=C([C@@H]1CCCCO1)N1CCC[C@@H]1C1CC[NH2+]CC1	ZINC000050960573	539160416	/nfs/dbraw/zinc/16/04/16/539160416.db2.gz	VHSOTTABVGCWHU-KGLIPLIRSA-N	1	0	266.385	1.546	50	0		CDAARO
CCN1CCC[C@@H]1C[NH2+][C@H](C)C(=O)NC1CCCC1	ZINC000108929584	349761990	/nfs/dbraw/zinc/76/19/90/349761990.db2.gz	ZWGSMRCMUMXBCS-TZMCWYRMSA-N	1	0	267.417	1.508	50	0		CDAARO
COC(=O)c1ccc(C[NH2+]CCc2ccncc2C)n1C	ZINC000585117618	362046270	/nfs/dbraw/zinc/04/62/70/362046270.db2.gz	NWRBAACUOLGTLJ-UHFFFAOYSA-N	1	0	287.363	1.847	50	0		CDAARO
CC[NH+](CC)CC[C@H](CO)NCc1ccoc1C	ZINC000585118098	362048208	/nfs/dbraw/zinc/04/82/08/362048208.db2.gz	BHGUEYINFMNQOJ-CQSZACIVSA-N	1	0	254.374	1.770	50	0		CDAARO
O[C@H](C[NH+]1CCC(Cn2ccnn2)CC1)CC(F)(F)F	ZINC000189393123	362056791	/nfs/dbraw/zinc/05/67/91/362056791.db2.gz	KQBJRXRLDJIHOA-NSHDSACASA-N	1	0	292.305	1.303	50	0		CDAARO
O=C(N[C@H]1CC[C@@H](CO)CC1)[C@@H]1CC[N@@H+]1C1CCCC1	ZINC000585132447	362057667	/nfs/dbraw/zinc/05/76/67/362057667.db2.gz	WXOMAVJXOMEHDS-GUTXKFCHSA-N	1	0	280.412	1.671	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNC(=O)N1CCSCC1	ZINC000078926065	362121475	/nfs/dbraw/zinc/12/14/75/362121475.db2.gz	NVIMMWDJULQHFD-LBPRGKRZSA-N	1	0	271.430	1.619	50	0		CDAARO
C[N@@H+]1CC[C@H]2CCN(C(=O)Nc3nccs3)[C@@H]2C1	ZINC000095995029	342431827	/nfs/dbraw/zinc/43/18/27/342431827.db2.gz	YIIYOZHSONORBC-VHSXEESVSA-N	1	0	266.370	1.701	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CC[C@@H](Nc2ccccc2)C1	ZINC000127900334	187339671	/nfs/dbraw/zinc/33/96/71/187339671.db2.gz	KTACGRJNZSCJIB-ZIAGYGMSSA-N	1	0	250.342	1.180	50	0		CDAARO
Cc1nc(CC(C)C)c(C(=O)N[C@H]2CC[NH2+]C2)s1	ZINC000127949146	187342347	/nfs/dbraw/zinc/34/23/47/187342347.db2.gz	NDXLLKIXYDUPNC-JTQLQIEISA-N	1	0	267.398	1.742	50	0		CDAARO
COc1cccc(Cl)c1C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179116578	362252027	/nfs/dbraw/zinc/25/20/27/362252027.db2.gz	UGDWSLONUKGEJH-VIFPVBQESA-N	1	0	268.744	1.783	50	0		CDAARO
C[C@H]1CC[N@H+](CC2CCSCC2)CC[S@@]1=O	ZINC000602637833	344510690	/nfs/dbraw/zinc/51/06/90/344510690.db2.gz	ODMHPKDLGUOQKD-ZBEGNZNMSA-N	1	0	261.456	1.973	50	0		CDAARO
Cc1c[nH]c(CN2CC[N@@H+]3CCC[C@@H]3C2)c(C)c1=O	ZINC000253536646	362435687	/nfs/dbraw/zinc/43/56/87/362435687.db2.gz	ZUCIMPZMJRJPNV-CYBMUJFWSA-N	1	0	261.369	1.684	50	0		CDAARO
C[NH+](C)CCOc1cccc(-c2cnc(N)nc2)c1	ZINC000623169934	345588916	/nfs/dbraw/zinc/58/89/16/345588916.db2.gz	SGZYCNSILJXIAH-UHFFFAOYSA-N	1	0	258.325	1.497	50	0		CDAARO
CCNC(=O)c1cc(N2CCC(C[NH+](C)C)CC2)ccn1	ZINC000095403081	136516755	/nfs/dbraw/zinc/51/67/55/136516755.db2.gz	LHHLGRDQNOMNKN-UHFFFAOYSA-N	1	0	290.411	1.609	50	0		CDAARO
COc1ccc(C[NH2+]CC2(C(N)=O)CCOCC2)cc1F	ZINC000086250373	179255825	/nfs/dbraw/zinc/25/58/25/179255825.db2.gz	BQGNKWZWXVLFGP-UHFFFAOYSA-N	1	0	296.342	1.206	50	0		CDAARO
CN(C[C@H]1CC[N@H+](C)C1(C)C)C(=O)c1cncnc1	ZINC000584888561	349347484	/nfs/dbraw/zinc/34/74/84/349347484.db2.gz	IMCREIQKAJTTEU-GFCCVEGCSA-N	1	0	262.357	1.279	50	0		CDAARO
Cc1cc(C(=O)NC[C@@H](C(C)C)[NH+]2CCCC2)c(O)cn1	ZINC000584891270	349350156	/nfs/dbraw/zinc/35/01/56/349350156.db2.gz	MRJUCFPQNHBVLH-AWEZNQCLSA-N	1	0	291.395	1.946	50	0		CDAARO
COCC1(N(C)C(=O)[C@H]2CC23CC[NH2+]CC3)CC1	ZINC000584894592	349354406	/nfs/dbraw/zinc/35/44/06/349354406.db2.gz	OPWVBXDZCDOXSG-LLVKDONJSA-N	1	0	252.358	1.014	50	0		CDAARO
COc1cccc2ncn(CC(C)(C)[NH+](C)C)c(=O)c21	ZINC000584900895	349363045	/nfs/dbraw/zinc/36/30/45/349363045.db2.gz	SAYUOUPUVHLNHT-UHFFFAOYSA-N	1	0	275.352	1.745	50	0		CDAARO
CCC[C@@]1(CO)CCC[N@H+](Cc2cnc(N)nc2)C1	ZINC000091619927	180209001	/nfs/dbraw/zinc/20/90/01/180209001.db2.gz	PYLISXVBNVIVDH-CQSZACIVSA-N	1	0	264.373	1.433	50	0		CDAARO
Cc1cc(C)c2[nH]c(C[NH2+][C@@H]3CCNC3=O)cc(=O)c2c1	ZINC000091664785	180221214	/nfs/dbraw/zinc/22/12/14/180221214.db2.gz	URCWQUBHWLQEGE-CYBMUJFWSA-N	1	0	285.347	1.123	50	0		CDAARO
COCCC[C@]1(CO)CCC[N@@H+](C2CCOCC2)C1	ZINC000091988544	180299529	/nfs/dbraw/zinc/29/95/29/180299529.db2.gz	ANDQQZWGPSYRTE-OAHLLOKOSA-N	1	0	271.401	1.667	50	0		CDAARO
COc1ccccc1C[NH2+]C[C@@H]1CN(C2CC2)CCO1	ZINC000106379645	186111740	/nfs/dbraw/zinc/11/17/40/186111740.db2.gz	QEICMBRVDLRXHG-OAHLLOKOSA-N	1	0	276.380	1.648	50	0		CDAARO
c1[nH]nc2cc(C[NH2+]C[C@@H]3CN(C4CC4)CCO3)ccc12	ZINC000106379839	186112502	/nfs/dbraw/zinc/11/25/02/186112502.db2.gz	XSVIAWKCYUPIMG-OAHLLOKOSA-N	1	0	286.379	1.516	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CCc2cc(F)ccc2[C@@H]1C	ZINC000110608905	186304459	/nfs/dbraw/zinc/30/44/59/186304459.db2.gz	ITYQGQXFTMSJIG-GXFFZTMASA-N	1	0	253.317	1.752	50	0		CDAARO
c1cc([C@@H]2CCC[N@@H+](CCOC[C@H]3CCCO3)C2)n[nH]1	ZINC000257365598	350964035	/nfs/dbraw/zinc/96/40/35/350964035.db2.gz	WMXZNDFOAFMUSG-ZIAGYGMSSA-N	1	0	279.384	1.785	50	0		CDAARO
CN1CCC[C@@](O)(C[NH2+]C2(c3ccccc3)CC2)C1=O	ZINC000011997319	282831338	/nfs/dbraw/zinc/83/13/38/282831338.db2.gz	LCCRQFVYHVPDCK-MRXNPFEDSA-N	1	0	274.364	1.249	50	0		CDAARO
CC(C)[C@H]([NH2+]Cc1cc(C(N)=O)cs1)C(C)(C)O	ZINC000276646144	366089767	/nfs/dbraw/zinc/08/97/67/366089767.db2.gz	RYEUCUPZSVGLLC-NSHDSACASA-N	1	0	270.398	1.732	50	0		CDAARO
C[C@@H](O)CN1CCN(Cc2cnc(Cl)s2)C[C@@H]1C	ZINC000175431273	366096507	/nfs/dbraw/zinc/09/65/07/366096507.db2.gz	FHYBMTWJVZDPCN-VHSXEESVSA-N	1	0	289.832	1.683	50	0		CDAARO
C[C@H](CCc1nnc(C2CC2)[nH]1)[NH+]1CCN(C)CC1	ZINC000065433545	363265164	/nfs/dbraw/zinc/26/51/64/363265164.db2.gz	CIFJWSBHRCDBPX-LLVKDONJSA-N	1	0	263.389	1.251	50	0		CDAARO
C[C@H]([NH2+]Cc1cnn(C)c1)c1ccc2c(c1)OCO2	ZINC000036981974	363311251	/nfs/dbraw/zinc/31/12/51/363311251.db2.gz	VXBLFWRFIASUEG-JTQLQIEISA-N	1	0	259.309	2.000	50	0		CDAARO
Cn1nccc1C(=O)NC[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000193840661	358499126	/nfs/dbraw/zinc/49/91/26/358499126.db2.gz	FXKSDANXEGTLRU-OAHLLOKOSA-N	1	0	298.390	1.672	50	0		CDAARO
C[C@@H](Cc1ccc(F)cc1)[NH+]1CCC(C(N)=O)CC1	ZINC000000213302	355896621	/nfs/dbraw/zinc/89/66/21/355896621.db2.gz	OUQNQUDWLHFERV-NSHDSACASA-N	1	0	264.344	1.954	50	0		CDAARO
COc1ccc(CNC(=O)[C@@H]2CCC[NH2+]2)cc1OC	ZINC000000251665	355899233	/nfs/dbraw/zinc/89/92/33/355899233.db2.gz	SJKGZYHZANRZEI-NSHDSACASA-N	1	0	264.325	1.072	50	0		CDAARO
OC[C@@H]1C[N@H+](Cc2ccccc2)CCC12OCCO2	ZINC000004566046	356037518	/nfs/dbraw/zinc/03/75/18/356037518.db2.gz	CPBVGVADXUSNKC-AWEZNQCLSA-N	1	0	263.337	1.244	50	0		CDAARO
CN(C(=O)[C@H]1CC1(Cl)Cl)C1C[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000195545097	363459556	/nfs/dbraw/zinc/45/95/56/363459556.db2.gz	HOGCXHATFAKDKR-URJDPWSZSA-N	1	0	277.195	1.922	50	0		CDAARO
Cc1cccc(NC(=S)NN2CCN(C)CC2)c1C	ZINC000008580082	356135997	/nfs/dbraw/zinc/13/59/97/356135997.db2.gz	RAENUTNLNRSMGM-UHFFFAOYSA-N	1	0	278.425	1.752	50	0		CDAARO
CN(C[C@H](O)c1ccccc1)c1cc[nH+]c(CO)c1	ZINC000032573424	356280552	/nfs/dbraw/zinc/28/05/52/356280552.db2.gz	YLIMHYUJSUSXEA-HNNXBMFYSA-N	1	0	258.321	1.744	50	0		CDAARO
C[C@@H]1C[C@H](C)C[N@@H+](CC(=O)N(C)CC(=O)NC(C)(C)C)C1	ZINC000012797015	356325435	/nfs/dbraw/zinc/32/54/35/356325435.db2.gz	ACBPUPVYUOZDKA-BETUJISGSA-N	1	0	297.443	1.337	50	0		CDAARO
CCCCNC(=O)[C@H]1C[NH2+]C[C@@H](COc2cccnc2)C1	ZINC000014539884	356391010	/nfs/dbraw/zinc/39/10/10/356391010.db2.gz	YMHKDDHOYOYTTP-UONOGXRCSA-N	1	0	291.395	1.602	50	0		CDAARO
CC(C)[NH+]1CCC([N@@H+]2CCC[C@H](C(=O)NC3CC3)C2)CC1	ZINC000015064846	356405440	/nfs/dbraw/zinc/40/54/40/356405440.db2.gz	JDOOZUBUINAGTK-AWEZNQCLSA-N	1	0	293.455	1.850	50	0		CDAARO
C[N@H+](CCN1C(=O)CCC1=O)[C@H]1CCc2ccccc21	ZINC000032928762	356454043	/nfs/dbraw/zinc/45/40/43/356454043.db2.gz	UFSPZPUFJGZNAQ-AWEZNQCLSA-N	1	0	272.348	1.755	50	0		CDAARO
Cc1ccc(OCC(=O)NC2CC[NH+](C)CC2)cc1C	ZINC000016604960	356442975	/nfs/dbraw/zinc/44/29/75/356442975.db2.gz	KIAWPTRIMZDBOV-UHFFFAOYSA-N	1	0	276.380	1.893	50	0		CDAARO
C[NH+]1CCC(NC(=O)COc2ccc(Cl)cc2)CC1	ZINC000016605351	356443003	/nfs/dbraw/zinc/44/30/03/356443003.db2.gz	NXEHWXFZCGHSGS-UHFFFAOYSA-N	1	0	282.771	1.929	50	0		CDAARO
Cc1cc(OC[C@H](O)CN2CC[NH+](C)CC2)ccc1Cl	ZINC000019363138	356482492	/nfs/dbraw/zinc/48/24/92/356482492.db2.gz	MFSWSQCIDNMMJJ-CYBMUJFWSA-N	1	0	298.814	1.636	50	0		CDAARO
CC[NH+]1CCN(CCC(=O)Nc2ccc(F)c(F)c2)CC1	ZINC000019528178	356490503	/nfs/dbraw/zinc/49/05/03/356490503.db2.gz	OHKMJOSAGGKEGL-UHFFFAOYSA-N	1	0	297.349	1.931	50	0		CDAARO
O=C(COc1ccccc1Cl)N1CC[NH2+]CC1	ZINC000019795580	356505221	/nfs/dbraw/zinc/50/52/21/356505221.db2.gz	BGRYCPZHNVWQHR-UHFFFAOYSA-N	1	0	254.717	1.151	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)c1nccnc1N)c1ccsc1	ZINC000023133337	356629762	/nfs/dbraw/zinc/62/97/62/356629762.db2.gz	XRWLPINNXOYJDQ-SNVBAGLBSA-N	1	0	291.380	1.153	50	0		CDAARO
OCc1cn(CC2CC[NH+](C[C@@H]3CC=CCC3)CC2)nn1	ZINC000023398617	356643118	/nfs/dbraw/zinc/64/31/18/356643118.db2.gz	AMLXRALZLZNINB-CQSZACIVSA-N	1	0	290.411	1.839	50	0		CDAARO
O=C(NC1CC1)[C@@H]([NH2+]C[C@H]1CCCO1)c1ccccc1	ZINC000024515308	356656775	/nfs/dbraw/zinc/65/67/75/356656775.db2.gz	CYUJPCVMCZCWRV-CABCVRRESA-N	1	0	274.364	1.775	50	0		CDAARO
O=C(CN1CC[NH+](C2CCCC2)CC1)NCc1ccco1	ZINC000027117829	356704328	/nfs/dbraw/zinc/70/43/28/356704328.db2.gz	YZGYJGJUSPPJNL-UHFFFAOYSA-N	1	0	291.395	1.456	50	0		CDAARO
Cn1cncc1CNC1CC[NH+](C(C)(C)C)CC1	ZINC000112341691	356730438	/nfs/dbraw/zinc/73/04/38/356730438.db2.gz	ADCANWJZDDAJKI-UHFFFAOYSA-N	1	0	250.390	1.773	50	0		CDAARO
Cc1ccc(C)c(CC(=O)NCC2(O)CC[NH+](C)CC2)c1	ZINC000080880380	357018259	/nfs/dbraw/zinc/01/82/59/357018259.db2.gz	XETGDRIWXMRIRE-UHFFFAOYSA-N	1	0	290.407	1.419	50	0		CDAARO
CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H]([NH2+]Cc2ccccc2)C1	ZINC000042689322	357075637	/nfs/dbraw/zinc/07/56/37/357075637.db2.gz	GVYATPKTSSTHKN-UONOGXRCSA-N	1	0	292.379	1.756	50	0		CDAARO
O=C(OCC1CC[NH2+]CC1)C(Cl)(Cl)Cl	ZINC000042768662	357079502	/nfs/dbraw/zinc/07/95/02/357079502.db2.gz	XYXPQUFAHNXMOG-UHFFFAOYSA-N	1	0	260.548	1.899	50	0		CDAARO
C[C@H]1CN(C)CCN1C(=O)c1ccc2cc[nH]c2c1	ZINC000089938630	357504382	/nfs/dbraw/zinc/50/43/82/357504382.db2.gz	VMUPJBRBQWOTGO-NSHDSACASA-N	1	0	257.337	1.944	50	0		CDAARO
CS(=O)(=O)[C@@H]1CCCC[C@H]1[NH2+]C1CCOCC1	ZINC000096491582	357515530	/nfs/dbraw/zinc/51/55/30/357515530.db2.gz	DIHOLVIIIOJXNL-VXGBXAGGSA-N	1	0	261.387	1.111	50	0		CDAARO
CC(C)([NH3+])CNS(=O)(=O)c1cccc2ccccc21	ZINC000095432133	357516152	/nfs/dbraw/zinc/51/61/52/357516152.db2.gz	FPOKGIOWIANISW-UHFFFAOYSA-N	1	0	278.377	1.855	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1cc(C)c(F)cc1F	ZINC000095432145	357516621	/nfs/dbraw/zinc/51/66/21/357516621.db2.gz	CSRLSHZLTCRDBN-VIFPVBQESA-N	1	0	292.351	1.679	50	0		CDAARO
COC[C@H](C)[NH2+]CCc1nc(C)c2c(n1)CCCC2	ZINC000065385046	357534795	/nfs/dbraw/zinc/53/47/95/357534795.db2.gz	IANBDYAHPWRTQY-NSHDSACASA-N	1	0	263.385	1.831	50	0		CDAARO
CNC(=O)C[C@H](C)[N@H+](C)Cc1cccc2nonc21	ZINC000065394648	357535870	/nfs/dbraw/zinc/53/58/70/357535870.db2.gz	LJSSDCJNDVKSPM-VIFPVBQESA-N	1	0	262.313	1.179	50	0		CDAARO
[NH3+]CCc1n[nH]c(=O)n1-c1cccc(Oc2ccccc2)c1	ZINC000065393422	357535899	/nfs/dbraw/zinc/53/58/99/357535899.db2.gz	NCCZPQWZTWOKOD-UHFFFAOYSA-N	1	0	296.330	1.854	50	0		CDAARO
CCOc1ccc(C[NH+]2CCC3(CNC(=O)C3)CC2)cn1	ZINC000065410965	357539316	/nfs/dbraw/zinc/53/93/16/357539316.db2.gz	VIAQICZNUYMSMF-UHFFFAOYSA-N	1	0	289.379	1.582	50	0		CDAARO
COc1cccc(C[C@@H](C)[NH2+]CC(=O)NC(C)C)c1	ZINC000065409071	357539328	/nfs/dbraw/zinc/53/93/28/357539328.db2.gz	KFFPWCHQULEZOE-GFCCVEGCSA-N	1	0	264.369	1.740	50	0		CDAARO
CC(C)c1nccc(CN2CCN3CC[N@H+](C)C[C@@H]3C2)n1	ZINC000065405696	357539339	/nfs/dbraw/zinc/53/93/39/357539339.db2.gz	SKSYINIXXZUMKC-OAHLLOKOSA-N	1	0	289.427	1.032	50	0		CDAARO
CCOC(=O)N1CCC([NH2+][C@@H](C)Cc2cc(C)n[nH]2)CC1	ZINC000065498542	357545933	/nfs/dbraw/zinc/54/59/33/357545933.db2.gz	RYGJIDSNDVHUAU-NSHDSACASA-N	1	0	294.399	1.860	50	0		CDAARO
CC[N@H+](CCN1CCOCC1)Cc1sc(C)nc1C	ZINC000067742844	357624166	/nfs/dbraw/zinc/62/41/66/357624166.db2.gz	IBCCRYGKLROVDH-UHFFFAOYSA-N	1	0	283.441	1.914	50	0		CDAARO
Cc1ccc2cc(C[N@@H+]3CCC[C@H](C(N)=O)C3)c(=O)[nH]c2c1	ZINC000067642258	357616425	/nfs/dbraw/zinc/61/64/25/357616425.db2.gz	UJDREUKDZRXXDX-ZDUSSCGKSA-N	1	0	299.374	1.534	50	0		CDAARO
CCCC(=O)N1CCC([NH2+][C@H]2CC(=O)N(CCC)C2)CC1	ZINC000067695453	357618992	/nfs/dbraw/zinc/61/89/92/357618992.db2.gz	WCWJOWGSRCJCGL-AWEZNQCLSA-N	1	0	295.427	1.378	50	0		CDAARO
COc1ccc(F)cc1C(=O)NC[C@@H]1CCC[N@H+](C)C1	ZINC000067974040	357641254	/nfs/dbraw/zinc/64/12/54/357641254.db2.gz	PUVHQIWTRBJFMF-NSHDSACASA-N	1	0	280.343	1.906	50	0		CDAARO
CC(C)C[N@@H+]1CCC[C@H](CNC(=O)c2ccc(N)nc2)C1	ZINC000067935385	357638700	/nfs/dbraw/zinc/63/87/00/357638700.db2.gz	QSCWRBNHEDBUOU-CYBMUJFWSA-N	1	0	290.411	1.762	50	0		CDAARO
C[C@@H]1CN(C(=O)c2cccc(Oc3cnccn3)c2)CC[NH2+]1	ZINC000188453686	357691715	/nfs/dbraw/zinc/69/17/15/357691715.db2.gz	OCZQCNCBUZFPJX-GFCCVEGCSA-N	1	0	298.346	1.703	50	0		CDAARO
Cc1ncc2c(c1CNC(=O)C1(C)CC1)CC[NH2+]C2	ZINC000072426549	357835216	/nfs/dbraw/zinc/83/52/16/357835216.db2.gz	QMHBETPHNRRLBT-UHFFFAOYSA-N	1	0	259.353	1.452	50	0		CDAARO
CCOc1ccc(C[N@@H+]2CC[C@H](C)[C@@H]2CO)nc1	ZINC000097104497	357968438	/nfs/dbraw/zinc/96/84/38/357968438.db2.gz	NVDVKJWJAUQYII-FZMZJTMJSA-N	1	0	250.342	1.683	50	0		CDAARO
C[N@H+](CCc1ccccn1)Cc1cc(C(N)=O)cs1	ZINC000097113728	357982791	/nfs/dbraw/zinc/98/27/91/357982791.db2.gz	OFVJHEYARGUSRV-UHFFFAOYSA-N	1	0	275.377	1.917	50	0		CDAARO
O[C@H]1COCC[N@@H+](C2CCN(c3ccccc3F)CC2)C1	ZINC000077517543	358020663	/nfs/dbraw/zinc/02/06/63/358020663.db2.gz	FFIYDZSTWYIQGN-CQSZACIVSA-N	1	0	294.370	1.488	50	0		CDAARO
COCC[N@@H+]1CCCN(C(=O)c2cccn2C(C)C)CC1	ZINC000097230261	358041200	/nfs/dbraw/zinc/04/12/00/358041200.db2.gz	NTDPWDCHYBCROI-UHFFFAOYSA-N	1	0	293.411	1.863	50	0		CDAARO
C[C@H](CCn1cccn1)[NH2+][C@@H](C)C(=O)N1CCCCC1	ZINC000097234797	358050496	/nfs/dbraw/zinc/05/04/96/358050496.db2.gz	IYPAOHMNQHGRSZ-KGLIPLIRSA-N	1	0	278.400	1.652	50	0		CDAARO
c1cc(C[C@@H]2CC[C@H](C[N@@H+]3CCCOCC3)O2)ccn1	ZINC000072473332	358072758	/nfs/dbraw/zinc/07/27/58/358072758.db2.gz	UCIOJGVLSJVTKO-JKSUJKDBSA-N	1	0	276.380	1.894	50	0		CDAARO
Cc1cc(N2CCC[C@H](c3nccn3C)C2)nc(N)[nH+]1	ZINC000082134400	358148573	/nfs/dbraw/zinc/14/85/73/358148573.db2.gz	BSTNRANYZIAVEM-NSHDSACASA-N	1	0	272.356	1.485	50	0		CDAARO
CCc1[nH+]c(N)nc(N2C[C@H]3CCC[C@@]3(CO)C2)c1C	ZINC000095354593	358684002	/nfs/dbraw/zinc/68/40/02/358684002.db2.gz	KKNLRNOOJCQCRP-ABAIWWIYSA-N	1	0	276.384	1.528	50	0		CDAARO
CC(C)[NH+]1CCC(CC(=O)N[C@@H](C)c2nncn2C)CC1	ZINC000095364190	358685452	/nfs/dbraw/zinc/68/54/52/358685452.db2.gz	RJWDRHCWODBGBW-LBPRGKRZSA-N	1	0	293.415	1.503	50	0		CDAARO
OCCCCC[N@@H+]1C[C@@H]2C[NH+]3CCCC[C@@H]3[C@H]2C1	ZINC000247764696	358763257	/nfs/dbraw/zinc/76/32/57/358763257.db2.gz	JUEBTNNNOCUEPL-QLFBSQMISA-N	1	0	252.402	1.565	50	0		CDAARO
C[N@@H+]1CC[C@@H](C(=O)NCCCSCc2ccco2)C1	ZINC000097259353	358763433	/nfs/dbraw/zinc/76/34/33/358763433.db2.gz	RKAKBCUJBUUPEY-GFCCVEGCSA-N	1	0	282.409	1.971	50	0		CDAARO
O[C@H]1CN(Cc2cccnc2)C[C@@H]1[NH+]1CCCCC1	ZINC000097775646	358797152	/nfs/dbraw/zinc/79/71/52/358797152.db2.gz	XQTXXZAWNHDHCJ-GJZGRUSLSA-N	1	0	261.369	1.113	50	0		CDAARO
O=C(CCCc1cn[nH]c1)N1CCC[C@@H](c2ncc[nH]2)C1	ZINC000097766441	358797981	/nfs/dbraw/zinc/79/79/81/358797981.db2.gz	WNPVTKGGDBFXPO-CYBMUJFWSA-N	1	0	287.367	1.862	50	0		CDAARO
CC[NH+](CC)CCNC(=O)N1CCc2[nH]nc(C)c2C1	ZINC000426430951	358844129	/nfs/dbraw/zinc/84/41/29/358844129.db2.gz	FAGQGJPPWRAYIS-UHFFFAOYSA-N	1	0	279.388	1.128	50	0		CDAARO
C[C@@H]1CNC(=O)CC[N@@H+]1Cc1ccc(-c2cc[nH]n2)s1	ZINC000215927205	358910942	/nfs/dbraw/zinc/91/09/42/358910942.db2.gz	UCFAMGCBHFZRCQ-SNVBAGLBSA-N	1	0	290.392	1.849	50	0		CDAARO
CNC(=O)C[C@H](C)[N@H+](C)Cc1cncn1C(C)C	ZINC000216036830	358919513	/nfs/dbraw/zinc/91/95/13/358919513.db2.gz	JZLWRDDAELTXEK-NSHDSACASA-N	1	0	252.362	1.420	50	0		CDAARO
C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)NC[C@H]1CCCO1	ZINC000095467196	358929319	/nfs/dbraw/zinc/92/93/19/358929319.db2.gz	HATHGFYMQLXGHK-TZMCWYRMSA-N	1	0	283.416	1.537	50	0		CDAARO
Cc1cc(N2CCN(Cc3c[nH]cn3)CC2)cc(C)[nH+]1	ZINC000216182187	358929924	/nfs/dbraw/zinc/92/99/24/358929924.db2.gz	KUFXAIGGNAHJPJ-UHFFFAOYSA-N	1	0	271.368	1.744	50	0		CDAARO
Nc1nc(NCC2(CO)CCCC2)cc(C2CC([NH3+])C2)n1	ZINC000219392217	359094406	/nfs/dbraw/zinc/09/44/06/359094406.db2.gz	ZKCGCIYHORJXOJ-UHFFFAOYSA-N	1	0	291.399	1.228	50	0		CDAARO
O=c1[nH]cnc2c1CC[N@H+](Cc1ccc3c(c1)CCO3)CC2	ZINC000257178176	359143443	/nfs/dbraw/zinc/14/34/43/359143443.db2.gz	ZDLGHPYGOUJQDY-UHFFFAOYSA-N	1	0	297.358	1.718	50	0		CDAARO
C[NH2+][C@@H](C(=O)N(C)Cc1cc[nH]n1)c1ccccc1	ZINC000221338938	359237527	/nfs/dbraw/zinc/23/75/27/359237527.db2.gz	SIFGCALKPSZXCS-CYBMUJFWSA-N	1	0	258.325	1.329	50	0		CDAARO
Cc1noc(C)c1CN(C)C(=O)[C@@H]([NH3+])Cc1ccccc1	ZINC000037819152	359453780	/nfs/dbraw/zinc/45/37/80/359453780.db2.gz	JKQGHJRFGYOLLD-HNNXBMFYSA-N	1	0	287.363	1.820	50	0		CDAARO
CC(C)c1noc([C@@H]2CCC[NH2+]CCC(=O)NCC2)n1	ZINC000257185057	359504793	/nfs/dbraw/zinc/50/47/93/359504793.db2.gz	VWTXZACZIODTCC-LLVKDONJSA-N	1	0	280.372	1.556	50	0		CDAARO
C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@H]1CCc2ncnn2C1	ZINC000257365870	359945932	/nfs/dbraw/zinc/94/59/32/359945932.db2.gz	XMNATQXWAPVZJM-RDBSUJKOSA-N	1	0	278.400	1.778	50	0		CDAARO
CC[C@H]1C[N@H+](CC)CCN1c1ncnc2c1ncn2CC	ZINC000521394699	359966888	/nfs/dbraw/zinc/96/68/88/359966888.db2.gz	FJZSMTXZZOSDMH-LBPRGKRZSA-N	1	0	288.399	1.767	50	0		CDAARO
C[C@H]1C[C@@H](C(=O)N[C@H]2CCCC[C@H]2CO)CC[NH2+]1	ZINC000262333624	360057309	/nfs/dbraw/zinc/05/73/09/360057309.db2.gz	FHIPHDWPCNDWSZ-CYDGBPFRSA-N	1	0	254.374	1.042	50	0		CDAARO
Cc1ccc(N2CCC[C@@H]([NH2+]C[C@H]3CCCCO3)C2)nn1	ZINC000247911180	360136056	/nfs/dbraw/zinc/13/60/56/360136056.db2.gz	LGSDQGFUDBHNLA-HUUCEWRRSA-N	1	0	290.411	1.913	50	0		CDAARO
c1cnc(N2CCC[N@@H+](C[C@H]3CCOC3)CC2)nc1	ZINC000230135244	360248913	/nfs/dbraw/zinc/24/89/13/360248913.db2.gz	GQYSYGXKPVNETO-CYBMUJFWSA-N	1	0	262.357	1.025	50	0		CDAARO
C[C@H]([NH2+]C[C@@H]1COC2(CCOCC2)O1)C(C)(C)C	ZINC000095991793	299311230	/nfs/dbraw/zinc/31/12/30/299311230.db2.gz	CVKNKIWCGDMUNL-NWDGAFQWSA-N	1	0	257.374	1.933	50	0		CDAARO
CCCC[C@@H](Sc1nnc(C[NH3+])n1C)C(=O)OC	ZINC000426599475	360687909	/nfs/dbraw/zinc/68/79/09/360687909.db2.gz	DHSWAXVCQADYNG-MRVPVSSYSA-N	1	0	272.374	1.098	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)COc2ccc(F)cc2)C1	ZINC000178961149	189157689	/nfs/dbraw/zinc/15/76/89/189157689.db2.gz	IYXDKRUZFREMKA-LLVKDONJSA-N	1	0	266.316	1.272	50	0		CDAARO
C[C@@H]1C[N@H+](CCOc2ccc(F)cc2)C[C@H]1C(N)=O	ZINC000408473916	361238729	/nfs/dbraw/zinc/23/87/29/361238729.db2.gz	RUYZJNVIBNWHFB-ZWNOBZJWSA-N	1	0	266.316	1.258	50	0		CDAARO
COc1ccc(C(=O)N(C)C2CC[NH2+]CC2)c(OC)c1	ZINC000036283229	361425190	/nfs/dbraw/zinc/42/51/90/361425190.db2.gz	XCTOJYWHPJZWCX-UHFFFAOYSA-N	1	0	278.352	1.528	50	0		CDAARO
COc1cc(CN2CC[N@H+](C)[C@H](CCO)C2)cc(OC)c1	ZINC000104316003	361586196	/nfs/dbraw/zinc/58/61/96/361586196.db2.gz	VXAODQAXKYIEAD-CQSZACIVSA-N	1	0	294.395	1.202	50	0		CDAARO
[NH3+]CCC(=O)N1CCN(Cc2c(F)cccc2Cl)CC1	ZINC000019687990	364079790	/nfs/dbraw/zinc/07/97/90/364079790.db2.gz	VWCBVAUVEUTQEW-UHFFFAOYSA-N	1	0	299.777	1.472	50	0		CDAARO
CCO[C@H]1C[C@@](CO)([NH2+]Cc2cncnc2)C1(C)C	ZINC000186578900	364611825	/nfs/dbraw/zinc/61/18/25/364611825.db2.gz	WZYBCZLURGCBQJ-JSGCOSHPSA-N	1	0	265.357	1.132	50	0		CDAARO
CCO[C@@H]1C[C@@](CO)([NH2+]Cc2cncs2)C1(C)C	ZINC000186594161	364616127	/nfs/dbraw/zinc/61/61/27/364616127.db2.gz	KDAAZVNHBSMXNC-YPMHNXCESA-N	1	0	270.398	1.799	50	0		CDAARO
CCO[C@H]1C[C@@](CO)([NH2+]Cc2cncs2)C1(C)C	ZINC000186594182	364616523	/nfs/dbraw/zinc/61/65/23/364616523.db2.gz	KDAAZVNHBSMXNC-AAEUAGOBSA-N	1	0	270.398	1.799	50	0		CDAARO
CN(CC1([NH+](C)C)CCC1)C(=O)N[C@H]1CCCOCC1	ZINC000187358872	364753317	/nfs/dbraw/zinc/75/33/17/364753317.db2.gz	DNMBHQVUZXDNPR-ZDUSSCGKSA-N	1	0	283.416	1.681	50	0		CDAARO
CCN1C(=O)N(C)C(=O)C12CC[NH+]([C@@H](C)CSC)CC2	ZINC000014742619	364962590	/nfs/dbraw/zinc/96/25/90/364962590.db2.gz	DKUFCEDXYALKCD-NSHDSACASA-N	1	0	299.440	1.486	50	0		CDAARO
C[NH2+][C@@H](CC(C)C)C(=O)N(C)Cc1nc(C)c[nH]1	ZINC000220738548	189724279	/nfs/dbraw/zinc/72/42/79/189724279.db2.gz	BFZZWJLJFFEQQX-NSHDSACASA-N	1	0	252.362	1.311	50	0		CDAARO
C[N@H+](Cc1ccccc1)CC(C)(C)NS(C)(=O)=O	ZINC000089761690	366929402	/nfs/dbraw/zinc/92/94/02/366929402.db2.gz	UJFHQWUUKGHDFU-UHFFFAOYSA-N	1	0	270.398	1.446	50	0		CDAARO
CCOCCC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1	ZINC000089986732	367004047	/nfs/dbraw/zinc/00/40/47/367004047.db2.gz	GECNANNJQUHQDR-CHWSQXEVSA-N	1	0	254.374	1.356	50	0		CDAARO
O=C(CN1CC[N@@H+]2CCC[C@H]2C1)NCc1ccccc1	ZINC000239121064	367301441	/nfs/dbraw/zinc/30/14/41/367301441.db2.gz	JFMWDCIZWBWCDF-HNNXBMFYSA-N	1	0	273.380	1.083	50	0		CDAARO
O=C(NC[C@]1(O)CCOC1)[C@@H]1CCCC[N@@H+]1C1CCCC1	ZINC000252481729	367565883	/nfs/dbraw/zinc/56/58/83/367565883.db2.gz	CRAMCAPGZSYHPZ-GOEBONIOSA-N	1	0	296.411	1.051	50	0		CDAARO
CCOC(=O)C(CC[NH+](CC)CC)C(=O)OCC	ZINC000002166419	367544089	/nfs/dbraw/zinc/54/40/89/367544089.db2.gz	VUWCENLYPTYEFB-UHFFFAOYSA-N	1	0	259.346	1.461	50	0		CDAARO
COCC1(CNC(=O)NC[C@@H]2CCC[N@H+](C)C2)CCC1	ZINC000252485418	367569570	/nfs/dbraw/zinc/56/95/70/367569570.db2.gz	GUTSEDCWOBLSMH-ZDUSSCGKSA-N	1	0	283.416	1.444	50	0		CDAARO
COc1cccc(CC(=O)NCCn2c(C)c[nH+]c2C)c1	ZINC000575555523	369132427	/nfs/dbraw/zinc/13/24/27/369132427.db2.gz	OGOQAJWJSYIMAZ-UHFFFAOYSA-N	1	0	287.363	1.867	50	0		CDAARO
O[C@H]1CC[N@@H+](C2CCN(c3nccs3)CC2)C1	ZINC000575607232	370617561	/nfs/dbraw/zinc/61/75/61/370617561.db2.gz	XCCTURGRSCMEET-NSHDSACASA-N	1	0	253.371	1.179	50	0		CDAARO
NC(=O)c1ccc(-c2ccc3c(c2)C[C@@H](C[NH3+])O3)nc1	ZINC000299758122	372747103	/nfs/dbraw/zinc/74/71/03/372747103.db2.gz	COMNQQIVNOGNNV-LBPRGKRZSA-N	1	0	269.304	1.110	50	0		CDAARO
FCCCCC[N@@H+]1CC[C@@H]2OCc3cnnn3[C@H]2C1	ZINC000299764706	372748523	/nfs/dbraw/zinc/74/85/23/372748523.db2.gz	CPTFGQKWLLOTHJ-STQMWFEESA-N	1	0	268.336	1.564	50	0		CDAARO
CN(Cc1ccccc1Cl)C(=O)[C@@H]1C[C@@H](O)C[NH2+]1	ZINC000037798677	373118539	/nfs/dbraw/zinc/11/85/39/373118539.db2.gz	DHTAFAAUTDCRCT-PWSUYJOCSA-N	1	0	268.744	1.021	50	0		CDAARO
CC(C)CC(=O)N1CCN(c2cn[nH+]c(N(C)C)c2)CC1	ZINC000206723594	374181036	/nfs/dbraw/zinc/18/10/36/374181036.db2.gz	JEXRLZMTPGPTQQ-UHFFFAOYSA-N	1	0	291.399	1.237	50	0		CDAARO
CC[NH+](CC)CC(=O)N1CCO[C@@H](Cc2ccccc2)C1	ZINC000012465402	374506070	/nfs/dbraw/zinc/50/60/70/374506070.db2.gz	RSSWVYDTQXTSML-INIZCTEOSA-N	1	0	290.407	1.798	50	0		CDAARO
C1=CC[C@@H](C[NH+]2CCN(C[C@H]3CCOC3)CC2)CC1	ZINC000093817402	374785980	/nfs/dbraw/zinc/78/59/80/374785980.db2.gz	KWJQEXKWAWKWLI-HZPDHXFCSA-N	1	0	264.413	1.997	50	0		CDAARO
CNC(=O)CN1CCC([NH2+][C@@H](C)CCC=C(C)C)CC1	ZINC000095420131	374921480	/nfs/dbraw/zinc/92/14/80/374921480.db2.gz	FTXBNHBJIQAWOU-AWEZNQCLSA-N	1	0	281.444	1.921	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@@H](C)[C@H]2CCOC2)cc1	ZINC000095988357	375048604	/nfs/dbraw/zinc/04/86/04/375048604.db2.gz	NMWJCNOCOSBYLI-FZMZJTMJSA-N	1	0	263.337	1.988	50	0		CDAARO
COc1c(F)cc(NC(=O)N2CC([NH+](C)C)C2)cc1F	ZINC000097049399	375141160	/nfs/dbraw/zinc/14/11/60/375141160.db2.gz	BUGJKXDKAGYFKI-UHFFFAOYSA-N	1	0	285.294	1.751	50	0		CDAARO
C[C@H](CCNC(=O)N[C@@H]1C=C[C@H](CO)C1)[NH+]1CCCCC1	ZINC000097107990	375148716	/nfs/dbraw/zinc/14/87/16/375148716.db2.gz	SUUTUHKJYLNAHN-QLFBSQMISA-N	1	0	295.427	1.487	50	0		CDAARO
COCCC[NH2+]C[C@@H](O)COc1ccc(C)cc1	ZINC000002646761	375285628	/nfs/dbraw/zinc/28/56/28/375285628.db2.gz	KEQGARUODFIGHT-CYBMUJFWSA-N	1	0	253.342	1.361	50	0		CDAARO
Cn1cc(C(=O)Nc2ccccc2C[NH+](C)C)cn1	ZINC000031232301	375763722	/nfs/dbraw/zinc/76/37/22/375763722.db2.gz	QCZGJBVMQKYDSX-UHFFFAOYSA-N	1	0	258.325	1.734	50	0		CDAARO
CCOCC[N@@H+]1CCN(CCc2ccncc2)C[C@H]1C	ZINC000239807506	376017747	/nfs/dbraw/zinc/01/77/47/376017747.db2.gz	CSNHOTUWRJFLEF-OAHLLOKOSA-N	1	0	277.412	1.667	50	0		CDAARO
Cc1ccccc1CS(=O)(=O)N(C)CC[NH+]1CCCC1	ZINC000074917823	376919826	/nfs/dbraw/zinc/91/98/26/376919826.db2.gz	PWRSHITUVVBRMQ-UHFFFAOYSA-N	1	0	296.436	1.852	50	0		CDAARO
OCC[C@H]1CCC[N@H+](CCOC[C@H]2CCCO2)C1	ZINC000245343948	378073225	/nfs/dbraw/zinc/07/32/25/378073225.db2.gz	WPTLQIJXXNFCME-ZIAGYGMSSA-N	1	0	257.374	1.276	50	0		CDAARO
COCC[NH+]1CCC(c2nc([C@@H]3CCOC3)no2)CC1	ZINC000096180239	256886989	/nfs/dbraw/zinc/88/69/89/256886989.db2.gz	HOUPGLRPCQUFJC-GFCCVEGCSA-N	1	0	281.356	1.399	50	0		CDAARO
C[NH+](C)C[C@H]1CSCC[C@]1(O)c1cccc(O)c1	ZINC000000347736	390136780	/nfs/dbraw/zinc/13/67/80/390136780.db2.gz	OXSWTJCCCLUDOE-JSGCOSHPSA-N	1	0	267.394	1.895	50	0		CDAARO
CCCc1nnc(N2CCN(CC[NH+]3CCCC3)CC2)o1	ZINC000095390322	184964309	/nfs/dbraw/zinc/96/43/09/184964309.db2.gz	BFSQHOWGTWDVJR-UHFFFAOYSA-N	1	0	293.415	1.240	50	0		CDAARO
C[C@H](C[NH2+][C@@H]1CCc2ncnn2C1)c1ccccc1	ZINC000095398046	184965835	/nfs/dbraw/zinc/96/58/35/184965835.db2.gz	HORPZXGPBLYPGO-TZMCWYRMSA-N	1	0	256.353	1.986	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C[C@H](O)c1ccccc1F	ZINC000097159480	390800979	/nfs/dbraw/zinc/80/09/79/390800979.db2.gz	KXNYUVDQKXXRES-AWEZNQCLSA-N	1	0	263.316	1.989	50	0		CDAARO
[NH3+]C[C@H]1CCCN1C(=O)COc1cccc(F)c1	ZINC000178274581	390860135	/nfs/dbraw/zinc/86/01/35/390860135.db2.gz	TVZPMGZQUIGFAI-LLVKDONJSA-N	1	0	252.289	1.154	50	0		CDAARO
C[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)[C@H]1C[NH3+]	ZINC000252231626	390941416	/nfs/dbraw/zinc/94/14/16/390941416.db2.gz	ZYLHJNFLAISVMB-JSGCOSHPSA-N	1	0	282.409	1.576	50	0		CDAARO
CC[C@@H]1CN(CCc2ccncc2)CC[N@@H+]1C[C@H](C)O	ZINC000107320832	391222301	/nfs/dbraw/zinc/22/23/01/391222301.db2.gz	ZXJBIFXMLOIXHL-GOEBONIOSA-N	1	0	277.412	1.401	50	0		CDAARO
CCc1nc(NC(=O)CN2CC[N@H+](C)C[C@H]2C)sc1C	ZINC000252513413	391981038	/nfs/dbraw/zinc/98/10/38/391981038.db2.gz	ZRMILZBGPIXCJG-SNVBAGLBSA-N	1	0	296.440	1.588	50	0		CDAARO
CN(C[C@@H]1CCC[N@@H+]1C)C(=O)Cc1ccsc1	ZINC000421705293	392108576	/nfs/dbraw/zinc/10/85/76/392108576.db2.gz	QZABCFARVJMFSA-LBPRGKRZSA-N	1	0	252.383	1.843	50	0		CDAARO
Cc1cc(C(=O)NC2CC[NH+](C[C@@H]3CCOC3)CC2)no1	ZINC000195183515	393105872	/nfs/dbraw/zinc/10/58/72/393105872.db2.gz	WAWLPPJORHWRRS-LBPRGKRZSA-N	1	0	293.367	1.214	50	0		CDAARO
c1ccc2c(c1)OC[C@@H](C[NH+]1CCSCC1)O2	ZINC000067947619	285521356	/nfs/dbraw/zinc/52/13/56/285521356.db2.gz	RHUGFZMYUZITCI-LLVKDONJSA-N	1	0	251.351	1.875	50	0		CDAARO
CNC(=O)NC(=O)CC[N@H+](C)CCc1ccccc1OC	ZINC000096404152	393178274	/nfs/dbraw/zinc/17/82/74/393178274.db2.gz	WHCFLDFXYXOMIK-UHFFFAOYSA-N	1	0	293.367	1.015	50	0		CDAARO
C[N@H+](CCNC(=O)NC1CCOCC1)C1CCCC1	ZINC000096404160	393178601	/nfs/dbraw/zinc/17/86/01/393178601.db2.gz	IDNBAOHPUNAWRL-UHFFFAOYSA-N	1	0	269.389	1.339	50	0		CDAARO
CCSC1(CNC(=O)C[NH+](CC)CC)CCOCC1	ZINC000096421762	393185602	/nfs/dbraw/zinc/18/56/02/393185602.db2.gz	MAUCXTCXGATKDB-UHFFFAOYSA-N	1	0	288.457	1.747	50	0		CDAARO
CCOC(=O)N1CCC2(CC1)[NH2+]CCc1nc[nH]c12	ZINC000065381750	285810573	/nfs/dbraw/zinc/81/05/73/285810573.db2.gz	PWOLHKBLRDXCDY-UHFFFAOYSA-N	1	0	264.329	1.003	50	0		CDAARO
CO[C@H]1CN(Cc2nccn2C(C)C)CC[C@H]1[NH3+]	ZINC000071661957	286073475	/nfs/dbraw/zinc/07/34/75/286073475.db2.gz	KIOPQNTTWSAMRZ-NEPJUHHUSA-N	1	0	252.362	1.012	50	0		CDAARO
CC[C@@H](C)[NH2+]CC(=O)Nc1sc2c(c1C(N)=O)CCC2	ZINC000006048333	170172306	/nfs/dbraw/zinc/17/23/06/170172306.db2.gz	SIJDIPHWRQHCEW-MRVPVSSYSA-N	1	0	295.408	1.662	50	0		CDAARO
COc1ccccc1/C=C/C(=O)NCC[NH+]1CCCC1	ZINC000006200358	170181894	/nfs/dbraw/zinc/18/18/94/170181894.db2.gz	PBDNZQOZAPTFLD-CMDGGOBGSA-N	1	0	274.364	1.920	50	0		CDAARO
OCC[NH2+]C/C=C\c1c(F)c(F)c(F)c(F)c1F	ZINC000006191577	170181961	/nfs/dbraw/zinc/18/19/61/170181961.db2.gz	BTIJTTWXCDSNPE-UPHRSURJSA-N	1	0	267.197	1.977	50	0		CDAARO
O=C(C[NH+]1CCCCC1)NC(=O)Nc1ccccc1F	ZINC000007780754	170302036	/nfs/dbraw/zinc/30/20/36/170302036.db2.gz	MFQNRRSPJNTUKE-UHFFFAOYSA-N	1	0	279.315	1.960	50	0		CDAARO
CCNC(=O)C[C@@H]1CCCC[N@@H+]1Cc1ncc(C)o1	ZINC000284362794	196039168	/nfs/dbraw/zinc/03/91/68/196039168.db2.gz	DNVSSAJTHOWKNX-LBPRGKRZSA-N	1	0	265.357	1.864	50	0		CDAARO
CC(C)(C)CN1CCC[C@@](O)(C[NH2+]C(C)(C)C)C1=O	ZINC000012373081	170480932	/nfs/dbraw/zinc/48/09/32/170480932.db2.gz	IYAKXKHUIMZKFW-OAHLLOKOSA-N	1	0	270.417	1.774	50	0		CDAARO
O=C1C[C@H]([NH2+]C2CC2)C(=O)N1c1ccc(Cl)cc1	ZINC000020458042	171208972	/nfs/dbraw/zinc/20/89/72/171208972.db2.gz	FOZCFVNDEUQBLJ-NSHDSACASA-N	1	0	264.712	1.724	50	0		CDAARO
C[NH+]1CCN(CCNC(=O)c2ccc(Cl)cc2)CC1	ZINC000020727709	171270865	/nfs/dbraw/zinc/27/08/65/171270865.db2.gz	KGRWNLAIDPQUHR-UHFFFAOYSA-N	1	0	281.787	1.317	50	0		CDAARO
CC(C)(C)OC(=O)C[C@@H]1C[C@@H](CC[NH3+])OC(C)(C)O1	ZINC000021991748	171346528	/nfs/dbraw/zinc/34/65/28/171346528.db2.gz	HWSHVKNLMBMKSR-MNOVXSKESA-N	1	0	273.373	1.977	50	0	in-vitro	CDAARO
CCc1cc(NCCC[NH+](CC)CC)n2ncnc2n1	ZINC000022320085	171384454	/nfs/dbraw/zinc/38/44/54/171384454.db2.gz	WBVVDAYSPQVOTP-UHFFFAOYSA-N	1	0	276.388	1.831	50	0		CDAARO
C[C@@H](C(N)=O)N1CC[NH+](Cc2cccc3ccccc32)CC1	ZINC000022803485	171399628	/nfs/dbraw/zinc/39/96/28/171399628.db2.gz	XHVJENGTSCBXIM-AWEZNQCLSA-N	1	0	297.402	1.831	50	0		CDAARO
Fc1ccc(F)c(C[NH2+]CCCN2CCOCC2)c1	ZINC000037233230	173052216	/nfs/dbraw/zinc/05/22/16/173052216.db2.gz	JBKJITHRQLMBPO-UHFFFAOYSA-N	1	0	270.323	1.777	50	0		CDAARO
COc1ccccc1C[C@@H](C)[NH2+][C@@H]1CCS(=O)(=O)C1	ZINC000037509965	173243393	/nfs/dbraw/zinc/24/33/93/173243393.db2.gz	KGYVVSVHOHKTCK-DGCLKSJQSA-N	1	0	283.393	1.403	50	0		CDAARO
Fc1ccc(C2=NN=C(N3CC[NH2+]CC3)SC2)cc1	ZINC000038478395	174142025	/nfs/dbraw/zinc/14/20/25/174142025.db2.gz	QWMYLLLDOYLDHC-UHFFFAOYSA-N	1	0	278.356	1.538	50	0		CDAARO
CN(C)C(=O)NC1CC[NH+](Cc2ccccc2)CC1	ZINC000040477650	174282613	/nfs/dbraw/zinc/28/26/13/174282613.db2.gz	DWYVWFMMLZNAEC-UHFFFAOYSA-N	1	0	261.369	1.922	50	0		CDAARO
CCn1c(=O)n(CCn2cccc2)nc1[C@@H]1CCC[NH2+]C1	ZINC000067515033	175777187	/nfs/dbraw/zinc/77/71/87/175777187.db2.gz	FXUGARYVSKVLBF-CYBMUJFWSA-N	1	0	289.383	1.033	50	0		CDAARO
Cc1c(C(=O)N[C@@H]2CC[C@@H]([NH3+])C2)cnn1-c1ccccn1	ZINC000067833521	175795252	/nfs/dbraw/zinc/79/52/52/175795252.db2.gz	NDVOZCQKZKKHBL-VXGBXAGGSA-N	1	0	285.351	1.185	50	0		CDAARO
Cc1nc(C(C)C)sc1C(=O)NC[C@]1(O)CC[NH2+]C1	ZINC000072135568	176322176	/nfs/dbraw/zinc/32/21/76/176322176.db2.gz	CGXZASHNMOFIMM-ZDUSSCGKSA-N	1	0	283.397	1.029	50	0		CDAARO
C[N@@H+]1CCC[C@H](C(=O)NCc2cnn3ccccc23)C1	ZINC000072156713	176328969	/nfs/dbraw/zinc/32/89/69/176328969.db2.gz	NIHWMHMKOQBIFO-LBPRGKRZSA-N	1	0	272.352	1.292	50	0		CDAARO
C[NH+]1CCC(N(Cc2ncc[nH]2)Cc2cccnc2)CC1	ZINC000072167210	176331977	/nfs/dbraw/zinc/33/19/77/176331977.db2.gz	VOBPWBYPFYBSRB-UHFFFAOYSA-N	1	0	285.395	1.901	50	0		CDAARO
Nc1ncccc1CN1CC[C@](O)(C[NH+]2CCCCC2)C1	ZINC000077379387	177260322	/nfs/dbraw/zinc/26/03/22/177260322.db2.gz	XVXIUACZBBREIS-INIZCTEOSA-N	1	0	290.411	1.087	50	0		CDAARO
Cc1ccc(N2CC[C@](O)(C[NH+]3CCCCC3)C2)nn1	ZINC000077541874	177279552	/nfs/dbraw/zinc/27/95/52/177279552.db2.gz	XYFGGKGWKDPHPK-HNNXBMFYSA-N	1	0	276.384	1.212	50	0		CDAARO
C[C@@H](C(=O)Nc1cccc(F)c1)N1CC[NH2+]CC1	ZINC000019977571	260115618	/nfs/dbraw/zinc/11/56/18/260115618.db2.gz	CRGIBILRUDDOAP-JTQLQIEISA-N	1	0	251.305	1.058	50	0		CDAARO
O=C(c1ncccc1OCc1ccncc1)N1CC[NH2+]CC1	ZINC000178343919	261386442	/nfs/dbraw/zinc/38/64/42/261386442.db2.gz	MZXSKLBDNRNXNZ-UHFFFAOYSA-N	1	0	298.346	1.101	50	0		CDAARO
COc1ccc(OC)c(CC(=O)NC2(C)CC[NH2+]CC2)c1	ZINC000193367374	267298336	/nfs/dbraw/zinc/29/83/36/267298336.db2.gz	CJDCQQMUUKHMFL-UHFFFAOYSA-N	1	0	292.379	1.505	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)N1CCn2cccc2C1	ZINC000095382048	277042804	/nfs/dbraw/zinc/04/28/04/277042804.db2.gz	IFVOCRLMFKDYGK-AWEZNQCLSA-N	1	0	261.369	1.705	50	0		CDAARO
CN1CC[NH+](CC2CCN(c3ncc(F)cn3)CC2)CC1	ZINC000301785746	277104264	/nfs/dbraw/zinc/10/42/64/277104264.db2.gz	PIHKSZTXSPSADQ-UHFFFAOYSA-N	1	0	293.390	1.080	50	0		CDAARO
CN1C[C@@H]([NH2+][C@H]2CCc3ccccc3C2)CCC1=O	ZINC000084060310	277195188	/nfs/dbraw/zinc/19/51/88/277195188.db2.gz	MSJNOVANOURGMA-GJZGRUSLSA-N	1	0	258.365	1.754	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)[C@@H]1CSc2ccccc21	ZINC000092239299	279906724	/nfs/dbraw/zinc/90/67/24/279906724.db2.gz	GFHPBBMTFUUNDQ-CMPLNLGQSA-N	1	0	262.378	1.696	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)N[C@H]2CC[C@H](O)CC2)CC1	ZINC000245539565	280218852	/nfs/dbraw/zinc/21/88/52/280218852.db2.gz	JRJMBHBPKHYDQG-HDJSIYSDSA-N	1	0	268.401	1.527	50	0		CDAARO
CC[C@H]1CN(S(C)(=O)=O)CC[C@@H]1[NH2+]CC1CC1	ZINC000095402526	281173685	/nfs/dbraw/zinc/17/36/85/281173685.db2.gz	HJAPPOWOESWXFX-RYUDHWBXSA-N	1	0	260.403	1.046	50	0		CDAARO
Cc1cccn2c(C[N@@H+]3CCC[C@@H](CC(N)=O)C3)cnc12	ZINC000093808970	289059352	/nfs/dbraw/zinc/05/93/52/289059352.db2.gz	OKZAJINDNJYSER-ZDUSSCGKSA-N	1	0	286.379	1.730	50	0		CDAARO
[NH3+][C@@H]1CCCc2nc(N3CCC(CO)CC3)ncc21	ZINC000091998100	295317141	/nfs/dbraw/zinc/31/71/41/295317141.db2.gz	FMVPZMDQWXSMND-GFCCVEGCSA-N	1	0	262.357	1.021	50	0		CDAARO
C[NH+](C)C[C@H](O)CNC(=O)c1sccc1Cl	ZINC000534577605	328310387	/nfs/dbraw/zinc/31/03/87/328310387.db2.gz	FELBRELUWOOATP-SSDOTTSWSA-N	1	0	262.762	1.054	50	0		CDAARO
Cc1ccccc1[C@H](CNC(=O)C1(CO)CC1)[NH+](C)C	ZINC000534580350	328311452	/nfs/dbraw/zinc/31/14/52/328311452.db2.gz	QQNFDRBLXPXKOJ-AWEZNQCLSA-N	1	0	276.380	1.486	50	0		CDAARO
C[NH+](C)C1(CNC(=O)Cc2ccc(CO)cc2)CCCC1	ZINC000534581024	328311679	/nfs/dbraw/zinc/31/16/79/328311679.db2.gz	PMKCOTOSSXTVHL-UHFFFAOYSA-N	1	0	290.407	1.712	50	0		CDAARO
CC[N@H+](C)[C@@H](C)CCNC(=O)N(C)Cc1ncc[nH]1	ZINC000534586267	328315648	/nfs/dbraw/zinc/31/56/48/328315648.db2.gz	JSTSCBCDPIRKPK-NSHDSACASA-N	1	0	267.377	1.281	50	0		CDAARO
CCCc1nc(N2CCC[C@@]3(CC[NH2+]C3)C2)no1	ZINC000534587817	328316243	/nfs/dbraw/zinc/31/62/43/328316243.db2.gz	WWSIXGJBUWILHM-ZDUSSCGKSA-N	1	0	250.346	1.602	50	0		CDAARO
CO[C@H]1COC[C@@H]1NC(=O)CC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000534588379	328316547	/nfs/dbraw/zinc/31/65/47/328316547.db2.gz	DBPXLUIRRVEHRU-STQMWFEESA-N	1	0	298.427	1.463	50	0		CDAARO
CCOCCC(=O)NC[C@@H]1CC[N@@H+](C2CCCC2)C1	ZINC000534632922	328332132	/nfs/dbraw/zinc/33/21/32/328332132.db2.gz	KDAKHUCZTYMVNX-ZDUSSCGKSA-N	1	0	268.401	1.794	50	0		CDAARO
[NH3+][C@H]1[C@@H]2CC[C@H]1CN(C(=O)c1ccc(O)cc1F)C2	ZINC000534633011	328332292	/nfs/dbraw/zinc/33/22/92/328332292.db2.gz	ZYNJLLKFGLUBDQ-WOFXILAISA-N	1	0	264.300	1.341	50	0		CDAARO
Cc1ccn2nc(C(=O)N3CCC[C@@]4(CC[NH2+]C4)C3)cc2c1	ZINC000534640007	328335520	/nfs/dbraw/zinc/33/55/20/328335520.db2.gz	PXQWGMMGEYJOIX-KRWDZBQOSA-N	1	0	298.390	1.858	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@H]2C(=O)Nc3c(Cl)cccc3C(=O)N2C1	ZINC000534666213	328345363	/nfs/dbraw/zinc/34/53/63/328345363.db2.gz	LLYFYYXQUKBZAH-KCJUWKMLSA-N	1	0	293.754	1.437	50	0		CDAARO
Fc1cnc(NCC2CC[NH+](CC3CC3)CC2)nc1	ZINC000534663502	328351361	/nfs/dbraw/zinc/35/13/61/328351361.db2.gz	YLXUVOCCJTVUAT-UHFFFAOYSA-N	1	0	264.348	1.572	50	0		CDAARO
CCCS(=O)(=O)N1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1	ZINC000019867991	326857530	/nfs/dbraw/zinc/85/75/30/326857530.db2.gz	ZVQNHYCDCXZQPZ-ZIAGYGMSSA-N	1	0	288.457	1.923	50	0		CDAARO
O[C@H]1C[C@@H]2C[N@H+](CCCOc3ccc(F)cc3)C[C@H]12	ZINC001772702959	1159438188	/nfs/dbraw/zinc/43/81/88/1159438188.db2.gz	WCKXMPQDJCHPNN-UGFHNGPFSA-N	1	0	265.328	1.907	50	0		CDAARO
COCc1nc(C)cc(N2CC([NH+]3CCCC3)C2)n1	ZINC000585092772	482827839	/nfs/dbraw/zinc/82/78/39/482827839.db2.gz	NBOOOSRDWHRJPN-UHFFFAOYSA-N	1	0	262.357	1.216	50	0		CDAARO
CN1CC[C@H]([NH2+]C[C@]2(O)CCCOC2)[C@H]1c1ccccc1	ZINC000585094278	482828848	/nfs/dbraw/zinc/82/88/48/482828848.db2.gz	AFPQUXSEPKLJMZ-GVDBMIGSSA-N	1	0	290.407	1.563	50	0		CDAARO
CCc1cnc(C)nc1NCCC[N@@H+]1CCC[C@H](O)C1	ZINC000670446670	482998000	/nfs/dbraw/zinc/99/80/00/482998000.db2.gz	NDDNRXRJIYHWRF-AWEZNQCLSA-N	1	0	278.400	1.606	50	0		CDAARO
CNC(=O)C[C@@H]1CC[N@H+](CCOc2cccc(OC)c2)C1	ZINC000670449432	483008283	/nfs/dbraw/zinc/00/82/83/483008283.db2.gz	GMRUUDGNBJXWIF-ZDUSSCGKSA-N	1	0	292.379	1.532	50	0		CDAARO
CC[N@@H+]1CCN(c2cncc(C(=O)N(C)C)n2)CC1(C)C	ZINC000670456927	483036232	/nfs/dbraw/zinc/03/62/32/483036232.db2.gz	GRWVCQANTLQNPU-UHFFFAOYSA-N	1	0	291.399	1.099	50	0		CDAARO
CC1CCC(O)(C[NH+]2CCN(C[C@@H]3CCOC3)CC2)CC1	ZINC000096455413	528202717	/nfs/dbraw/zinc/20/27/17/528202717.db2.gz	JKRHRFXKPCBZML-CGZBRXJRSA-N	1	0	296.455	1.582	50	0		CDAARO
CC(C)c1ncc(C(=O)N[C@@H]2C[NH+]3CCC2CC3)cn1	ZINC000097831111	528342574	/nfs/dbraw/zinc/34/25/74/528342574.db2.gz	ROSBPZMDJUBNHG-CYBMUJFWSA-N	1	0	274.368	1.424	50	0		CDAARO
CCc1cccc(S(=O)(=O)N[C@@H]2CCC[NH2+][C@H]2C)c1	ZINC000193454386	535911261	/nfs/dbraw/zinc/91/12/61/535911261.db2.gz	LWXQGQWHZHHIOO-SMDDNHRTSA-N	1	0	282.409	1.668	50	0		CDAARO
C[NH+](C)C[C@H]1C[C@H](CO)CN(c2cc(C3CC3)ncn2)C1	ZINC000091644183	535971142	/nfs/dbraw/zinc/97/11/42/535971142.db2.gz	SQHMDSMANUVOML-OLZOCXBDSA-N	1	0	290.411	1.350	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@H]([NH3+])c2ccc(F)cc2)C1	ZINC000958528859	613973378	/nfs/dbraw/zinc/97/33/78/613973378.db2.gz	WXYNHYPWMITVTN-GFCCVEGCSA-N	1	0	296.342	1.807	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@](O)([C@@H]([NH3+])C(C)(C)C)C1	ZINC000958528547	613980710	/nfs/dbraw/zinc/98/07/10/613980710.db2.gz	QFGDSVRKXYGAKX-IINYFYTJSA-N	1	0	272.389	1.732	50	0		CDAARO
CC1(C[NH2+]CCN2CCCC[C@@H]2CO)CCOCC1	ZINC000952980109	614902589	/nfs/dbraw/zinc/90/25/89/614902589.db2.gz	CLERRZFGRHJKHK-CQSZACIVSA-N	1	0	270.417	1.240	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](CNc2ncc(F)cn2)C1	ZINC000952967267	616341232	/nfs/dbraw/zinc/34/12/32/616341232.db2.gz	KFLQLTKJEDTESB-NSHDSACASA-N	1	0	268.336	1.386	50	0		CDAARO
OC[C@H](O)C1CC[NH+](CCCC(F)(F)F)CC1	ZINC001772702001	1159437574	/nfs/dbraw/zinc/43/75/74/1159437574.db2.gz	BDAAQZOONSMETH-JTQLQIEISA-N	1	0	255.280	1.394	50	0		CDAARO
Cc1noc(C)c1C[N@H+]1C[C@@H](Cc2cnccn2)[C@H](O)C1	ZINC001704302780	1177680783	/nfs/dbraw/zinc/68/07/83/1177680783.db2.gz	SQYZWQGDWHRTIU-IUODEOHRSA-N	1	0	288.351	1.117	50	0		CDAARO
[NH3+]CCc1nc2ccccc2c(NC2(CO)CCCC2)n1	ZINC000065526378	835879315	/nfs/dbraw/zinc/87/93/15/835879315.db2.gz	SKQQKTVXEOAPRJ-UHFFFAOYSA-N	1	0	286.379	1.848	50	0		CDAARO
COc1ccc(CN[C@H](C)c2nncn2C)cc1O	ZINC000037016744	836388177	/nfs/dbraw/zinc/38/81/77/836388177.db2.gz	PMMYCVJUDOJDJV-SECBINFHSA-N	1	0	262.313	1.380	50	0		CDAARO
COCc1ccc(C[N@@H+]2CCc3nn(C)c(=O)cc3C2)cc1	ZINC000093756255	836625529	/nfs/dbraw/zinc/62/55/29/836625529.db2.gz	HEAMQDWJVYJSQJ-UHFFFAOYSA-N	1	0	299.374	1.485	50	0		CDAARO
C[C@H](CC(N)=O)[N@H+](C)Cc1ccnn1-c1ccccc1	ZINC000952971189	836720005	/nfs/dbraw/zinc/72/00/05/836720005.db2.gz	FWQHJFLCAIPDAN-GFCCVEGCSA-N	1	0	272.352	1.568	50	0		CDAARO
O=C(NCC1CC[NH+](CCCO)CC1)C1CCCC1	ZINC000952977754	836990789	/nfs/dbraw/zinc/99/07/89/836990789.db2.gz	VSWJUWGCMDAIEL-UHFFFAOYSA-N	1	0	268.401	1.387	50	0		CDAARO
Cc1nccn1C[C@H](C)[NH2+]CCSc1nc[nH]n1	ZINC000952963563	839023050	/nfs/dbraw/zinc/02/30/50/839023050.db2.gz	IXOYSEARZCJRRV-VIFPVBQESA-N	1	0	266.374	1.080	50	0		CDAARO
COc1ccccc1NC1=NC2(CCCC2)NC(=[NH2+])N1	ZINC000095393729	839369899	/nfs/dbraw/zinc/36/98/99/839369899.db2.gz	ADNKJIOQXAHLOT-UHFFFAOYSA-N	1	0	273.340	1.861	50	0		CDAARO
CC(C)/C=C/CN1CC[C@@H]([NH+]2CCC(O)CC2)[C@H](O)C1	ZINC000012301151	839869395	/nfs/dbraw/zinc/86/93/95/839869395.db2.gz	IWNCAPRGEWDEFO-OBMMGQTPSA-N	1	0	282.428	1.091	50	0		CDAARO
COc1cc(C[C@]2(C)[NH2+]CCc3nc[nH]c32)ccc1O	ZINC000065497231	840394511	/nfs/dbraw/zinc/39/45/11/840394511.db2.gz	PJTHCPDXHRQZMO-HNNXBMFYSA-N	1	0	273.336	1.728	50	0		CDAARO
OC[C@H]1CCC[N@H+](CCNc2ccc(Cl)cn2)C1	ZINC000952962391	840986633	/nfs/dbraw/zinc/98/66/33/840986633.db2.gz	BCHVVVUYYQGMAD-NSHDSACASA-N	1	0	269.776	1.851	50	0		CDAARO
Cc1c[nH+]c(C2CCC2)n1CCNC(=O)c1nccn1C	ZINC000253397833	841263009	/nfs/dbraw/zinc/26/30/09/841263009.db2.gz	BQUDRYDHNUPQJB-UHFFFAOYSA-N	1	0	287.367	1.623	50	0		CDAARO
c1ccc(-c2cncnc2)c(CN2CC[NH2+]CC2)c1	ZINC000032520178	841980525	/nfs/dbraw/zinc/98/05/25/841980525.db2.gz	DSKAYPHLFQWRJL-UHFFFAOYSA-N	1	0	254.337	1.549	50	0		CDAARO
CCCC[NH2+]C[C@H](O)COc1cccc(OC)c1	ZINC000002465957	842770505	/nfs/dbraw/zinc/77/05/05/842770505.db2.gz	BRZBEIPHKZABTC-LBPRGKRZSA-N	1	0	253.342	1.825	50	0		CDAARO
Cc1nccc(C[C@@H]2CC[C@H](C[NH+]3CCSCC3)O2)n1	ZINC000952854489	910408192	/nfs/dbraw/zinc/40/81/92/910408192.db2.gz	CULUMZNNJOVKBI-LSDHHAIUSA-N	1	0	293.436	1.924	50	0		CDAARO
CC1(C)CC(CC(=O)N2C[C@@H](O)[C@H](F)C2)CC(C)(C)[NH2+]1	ZINC000952868121	910417749	/nfs/dbraw/zinc/41/77/49/910417749.db2.gz	ZARLPATZUNHPMX-VXGBXAGGSA-N	1	0	286.391	1.475	50	0		CDAARO
COc1cc(NCC2([NH+](C)C)CCCCC2)nc(N)n1	ZINC000952868044	910463550	/nfs/dbraw/zinc/46/35/50/910463550.db2.gz	XFQXNMBMUPQQMX-UHFFFAOYSA-N	1	0	279.388	1.744	50	0		CDAARO
c1c(C[NH2+]C2CSCCSC2)nc2n1CCS2	ZINC000952960531	910469234	/nfs/dbraw/zinc/46/92/34/910469234.db2.gz	ODFSUGRSSBPZSL-UHFFFAOYSA-N	1	0	287.479	1.927	50	0		CDAARO
CC(C)[C@@H](CNS(=O)(=O)CC1CCCC1)[NH+](C)C	ZINC000820694796	925544669	/nfs/dbraw/zinc/54/46/69/925544669.db2.gz	RRUGQEBQKZHHSD-CYBMUJFWSA-N	1	0	276.446	1.682	50	0		CDAARO
c1cn(Cc2ccc(NC[C@@H]3CCC[NH2+]3)nc2)cn1	ZINC000820420491	925524511	/nfs/dbraw/zinc/52/45/11/925524511.db2.gz	RLGDULYUKSOVGO-ZDUSSCGKSA-N	1	0	257.341	1.490	50	0		CDAARO
C[C@@H](Nc1cccc(C(N)=O)n1)C1CC[NH+](C)CC1	ZINC000820838700	925552979	/nfs/dbraw/zinc/55/29/79/925552979.db2.gz	ZRVYNINYDYGVDB-SNVBAGLBSA-N	1	0	262.357	1.323	50	0		CDAARO
CCOc1ccnc(N2CCC[C@H]([NH+](C)C)C2)n1	ZINC000823399299	925691385	/nfs/dbraw/zinc/69/13/85/925691385.db2.gz	LCOPCPVTJYIRBK-NSHDSACASA-N	1	0	250.346	1.406	50	0		CDAARO
COCC(=O)N1CC([N@@H+](Cc2ccncc2)CC(C)C)C1	ZINC000581776500	927194590	/nfs/dbraw/zinc/19/45/90/927194590.db2.gz	VWFILYIBBDETHK-UHFFFAOYSA-N	1	0	291.395	1.397	50	0		CDAARO
C[C@H](CCNCc1cccc2c1OCO2)[NH+](C)C	ZINC000585117160	930978426	/nfs/dbraw/zinc/97/84/26/930978426.db2.gz	SNRSXRITNHKIGZ-LLVKDONJSA-N	1	0	250.342	1.845	50	0		CDAARO
CSC[C@H](C)C(=O)N[C@H]1C[C@@H]([NH+](C)C)C12CCC2	ZINC000585130857	931022212	/nfs/dbraw/zinc/02/22/12/931022212.db2.gz	DPPKEWIMOJCZRC-SDDRHHMPSA-N	1	0	270.442	1.975	50	0		CDAARO
CCN(C(=O)N1CCC[C@H](C[N@@H+]2CC[C@H](O)C2)C1)C(C)C	ZINC000585139410	931043260	/nfs/dbraw/zinc/04/32/60/931043260.db2.gz	WMPGBSNRVZNQOT-CABCVRRESA-N	1	0	297.443	1.615	50	0		CDAARO
COc1cnc(N2CCC[N@@H+](C(C)C)CC2)nc1	ZINC001529158986	968996461	/nfs/dbraw/zinc/99/64/61/968996461.db2.gz	LWZPIBGQMDLQAP-UHFFFAOYSA-N	1	0	250.346	1.406	50	0		CDAARO
Cc1noc(C[N@@H+](C)[C@@H]2C[C@@H]3C[C@H](O)C[C@@H]3C2)n1	ZINC001529153421	968997182	/nfs/dbraw/zinc/99/71/82/968997182.db2.gz	BDPINCXRFIYASQ-BKUVIOGVSA-N	1	0	251.330	1.359	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNc2cc(N)nc(SC)n2)C1	ZINC001529158728	968997927	/nfs/dbraw/zinc/99/79/27/968997927.db2.gz	JSYHBCXRQBLDRR-JTQLQIEISA-N	1	0	297.428	1.161	50	0		CDAARO
C[C@@H](C[N@H+](C)CCCn1cccc1)N1CCOCC1	ZINC001529196092	969010906	/nfs/dbraw/zinc/01/09/06/969010906.db2.gz	UXKWLVBFWXDXGN-HNNXBMFYSA-N	1	0	265.401	1.531	50	0		CDAARO
CCc1nc(N(C)CC[C@@H](C)[NH+]2CCCC2)no1	ZINC001506398580	975149315	/nfs/dbraw/zinc/14/93/15/975149315.db2.gz	SFSLIRGDROOWAA-LLVKDONJSA-N	1	0	252.362	1.943	50	0		CDAARO
CCC1(CC)C[N@H+](CCc2nccn2C)CCO1	ZINC001506409432	975152818	/nfs/dbraw/zinc/15/28/18/975152818.db2.gz	XGBBBMKLHSCVCE-UHFFFAOYSA-N	1	0	251.374	1.854	50	0		CDAARO
CCS(=O)(=O)NCCC[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C	ZINC000096500627	230384786	/nfs/dbraw/zinc/38/47/86/230384786.db2.gz	NQBLXMYGWIIOIN-FRRDWIJNSA-N	1	0	276.446	1.730	50	0		CDAARO
Brc1cc2c(ncnc2N2CC[NH2+]CC2)s1	ZINC000095629775	342476290	/nfs/dbraw/zinc/47/62/90/342476290.db2.gz	VFMXNDQBLSNLDL-UHFFFAOYSA-N	1	0	299.197	1.863	50	0		CDAARO
Cn1cncc1C[NH2+][C@@H]1CCN(c2ccccc2)C1	ZINC000106475778	230393789	/nfs/dbraw/zinc/39/37/89/230393789.db2.gz	WFHVFLRKJQGIIT-CYBMUJFWSA-N	1	0	256.353	1.789	50	0		CDAARO
COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2C(N)=O)cc1F	ZINC000097375122	342002730	/nfs/dbraw/zinc/00/27/30/342002730.db2.gz	WQBBRKGGPPIIHS-DGCLKSJQSA-N	1	0	280.343	1.968	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1cncc(OCCO)n1	ZINC000095941841	185036586	/nfs/dbraw/zinc/03/65/86/185036586.db2.gz	ZXCNEROZZQRXKG-GFCCVEGCSA-N	1	0	280.372	1.134	50	0		CDAARO
O=C(CC[N@H+]1CCC[C@@H]1CO)N1CCc2ccccc21	ZINC000095948542	185038979	/nfs/dbraw/zinc/03/89/79/185038979.db2.gz	DSYOGDCWZQJQRU-CQSZACIVSA-N	1	0	274.364	1.423	50	0		CDAARO
CCOC(=O)[C@]1(COC)CCC[N@H+](Cc2cncn2C)C1	ZINC000252486690	398216932	/nfs/dbraw/zinc/21/69/32/398216932.db2.gz	HOPWNVXDEPCBDN-OAHLLOKOSA-N	1	0	295.383	1.212	50	0		CDAARO
Cc1cc(C)cc(N(C)C(=O)[C@@H]([NH3+])CCS(C)(=O)=O)c1	ZINC000095956298	185042492	/nfs/dbraw/zinc/04/24/92/185042492.db2.gz	QMORIXLNJCUIRT-ZDUSSCGKSA-N	1	0	298.408	1.028	50	0		CDAARO
O=C(C[NH2+][C@H]1CCSC1)NCCc1ccccc1	ZINC000095991226	185058246	/nfs/dbraw/zinc/05/82/46/185058246.db2.gz	XWRRDMSMPNJXSQ-ZDUSSCGKSA-N	1	0	264.394	1.440	50	0		CDAARO
CC(C)[N@H+](C)CC(=O)NC[C@H]1COC2(CCCCCC2)O1	ZINC000095992268	185059213	/nfs/dbraw/zinc/05/92/13/185059213.db2.gz	ZBBYFJRPKCXJDK-AWEZNQCLSA-N	1	0	298.427	1.909	50	0		CDAARO
C[C@](O)(C[N@@H+]1CCC[C@@H](Cn2ccnn2)C1)C(F)(F)F	ZINC000241587906	361753737	/nfs/dbraw/zinc/75/37/37/361753737.db2.gz	OYBLWSZGJUEHQP-MNOVXSKESA-N	1	0	292.305	1.303	50	0		CDAARO
OCc1ccc(Cn2cc([C@@H]3CCC[NH2+]C3)nn2)cc1	ZINC000095370305	398228907	/nfs/dbraw/zinc/22/89/07/398228907.db2.gz	ZDVGBCFIPPPMAT-CQSZACIVSA-N	1	0	272.352	1.286	50	0		CDAARO
CC(C)[NH2+]C[C@@H](O)COc1cc2c(cn1)CCCC2	ZINC000003683846	342089057	/nfs/dbraw/zinc/08/90/57/342089057.db2.gz	OPVJJXUSUVCARF-CQSZACIVSA-N	1	0	264.369	1.698	50	0		CDAARO
Cc1nn(C)cc1NC(=O)NCC[C@@H]1CCC[N@@H+]1C	ZINC000096131946	185104750	/nfs/dbraw/zinc/10/47/50/185104750.db2.gz	NVCXRCGHFQXPKV-NSHDSACASA-N	1	0	265.361	1.334	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)[C@@H](C)Cc1ccccc1Cl	ZINC000195553985	342625791	/nfs/dbraw/zinc/62/57/91/342625791.db2.gz	SBSGREQCZXQENQ-BPNCWPANSA-N	1	0	296.798	1.622	50	0		CDAARO
Cc1ccnc(N2CCC[C@H]2C(=O)N2CCOCC2)c1	ZINC000195539159	342626549	/nfs/dbraw/zinc/62/65/49/342626549.db2.gz	JLQSNYJLHKDDEW-ZDUSSCGKSA-N	1	0	275.352	1.218	50	0		CDAARO
NC(=O)[C@H](C[NH2+][C@H]1CCCSC1)Cc1ccc(F)cc1	ZINC000195561838	342628603	/nfs/dbraw/zinc/62/86/03/342628603.db2.gz	AVOVMYYDHOHUFD-JSGCOSHPSA-N	1	0	296.411	1.955	50	0		CDAARO
O=C(C[NH2+]Cc1cccc(Br)c1)NC1CC1	ZINC000096797775	185114379	/nfs/dbraw/zinc/11/43/79/185114379.db2.gz	IUCQXKLMFANTRU-UHFFFAOYSA-N	1	0	283.169	1.817	50	0		CDAARO
Cc1c[nH]c(CNC(=O)C[NH+]2CCCCCC2)c(C)c1=O	ZINC000244773733	361862125	/nfs/dbraw/zinc/86/21/25/361862125.db2.gz	PFKOKIMHDPXGBU-UHFFFAOYSA-N	1	0	291.395	1.896	50	0		CDAARO
Cc1nnc(CN(C)CC[N@H+]2CCCC[C@@H]2C)[nH]1	ZINC000244795436	361864800	/nfs/dbraw/zinc/86/48/00/361864800.db2.gz	RGJGZXJDOBZZGS-NSHDSACASA-N	1	0	251.378	1.419	50	0		CDAARO
CN1C(=O)CCC12CC[NH+](C[C@H](O)c1ccccc1)CC2	ZINC000244840249	361866682	/nfs/dbraw/zinc/86/66/82/361866682.db2.gz	UJRXYALPUJEPNY-HNNXBMFYSA-N	1	0	288.391	1.807	50	0		CDAARO
Nc1cc(N)[nH+]c(SCC(=O)Nc2ccc(F)cc2)n1	ZINC000000422481	361916970	/nfs/dbraw/zinc/91/69/70/361916970.db2.gz	IINIECJJDMSTBR-UHFFFAOYSA-N	1	0	293.327	1.511	50	0		CDAARO
CSCC[C@@H](C)[N@H+](C)C[C@@H]1CCCS(=O)(=O)C1	ZINC000253416406	361936335	/nfs/dbraw/zinc/93/63/35/361936335.db2.gz	VAOQNVHZUJWKBJ-NEPJUHHUSA-N	1	0	279.471	1.885	50	0		CDAARO
C[C@@H]([NH3+])CONC(=O)/C=C/c1c(F)cccc1F	ZINC000585136822	342216144	/nfs/dbraw/zinc/21/61/44/342216144.db2.gz	UHFYAXUZWYZVNJ-HQZHTGGTSA-N	1	0	256.252	1.373	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+](CCOC(C)=O)C1	ZINC000585141409	342219291	/nfs/dbraw/zinc/21/92/91/342219291.db2.gz	VLVVWKCIDAIAKJ-GXTWGEPZSA-N	1	0	284.400	1.566	50	0		CDAARO
COC(=O)C1CC2(C1)C[NH2+]C[C@H]2C(=O)OC(C)(C)C	ZINC000585139544	539103363	/nfs/dbraw/zinc/10/33/63/539103363.db2.gz	WAIXTEHZHVQHLH-XIRUVYRFSA-N	1	0	269.341	1.117	50	0		CDAARO
CCO[C@@H](C)c1nc(CC(=O)N2CC[NH2+]C[C@@H]2C)cs1	ZINC000125708354	187197095	/nfs/dbraw/zinc/19/70/95/187197095.db2.gz	DWPQLIOQXYTPBY-QWRGUYRKSA-N	1	0	297.424	1.603	50	0		CDAARO
CSCCC[N@@H+]1C[C@@H](C)[C@H](N2CCN(C(C)=O)CC2)C1	ZINC000107323418	349698972	/nfs/dbraw/zinc/69/89/72/349698972.db2.gz	MFLUMRARBCPHCN-UKRRQHHQSA-N	1	0	299.484	1.224	50	0		CDAARO
C[NH+]1CCN(Cc2ccc(Br)nc2)CC1	ZINC000142083281	529773667	/nfs/dbraw/zinc/77/36/67/529773667.db2.gz	MUKOKIXKKLJMMH-UHFFFAOYSA-N	1	0	270.174	1.592	50	0		CDAARO
CCn1ccc(CN2CCC[C@H](c3n[nH]c(C)n3)C2)n1	ZINC000252478186	362383611	/nfs/dbraw/zinc/38/36/11/362383611.db2.gz	AFGUAJYEVZQTNW-LBPRGKRZSA-N	1	0	274.372	1.709	50	0		CDAARO
CNC(=O)C[C@H](C)[N@H+](C)Cc1[nH]cc(C)c(=O)c1C	ZINC000253536118	362435506	/nfs/dbraw/zinc/43/55/06/362435506.db2.gz	AGHZVANZQVGDOD-JTQLQIEISA-N	1	0	265.357	1.360	50	0		CDAARO
COC(=O)N1CCC([NH2+][C@H](C)CCn2cccn2)CC1	ZINC000097234835	185569758	/nfs/dbraw/zinc/56/97/58/185569758.db2.gz	XGOGIYWNNZLAAN-GFCCVEGCSA-N	1	0	280.372	1.482	50	0		CDAARO
Cc1[nH+]c2ccccc2c(N2CCN(C(=O)CO)CC2)c1C	ZINC000097086034	136521696	/nfs/dbraw/zinc/52/16/96/136521696.db2.gz	VZNGPKMMZQQAOC-UHFFFAOYSA-N	1	0	299.374	1.493	50	0		CDAARO
CCOC(=O)Cc1c(C)n(O)c2ccccc2[n+]1=O	ZINC000136611764	348750480	/nfs/dbraw/zinc/75/04/80/348750480.db2.gz	IHILMIQKLKUVNY-UHFFFAOYSA-N	1	0	263.273	1.207	50	0		CDAARO
COC(=O)c1ccc(C2=NOC3(C2)CC[NH2+]CC3)cc1	ZINC000140772763	348752016	/nfs/dbraw/zinc/75/20/16/348752016.db2.gz	JJOHSZVPLZFRTD-UHFFFAOYSA-N	1	0	274.320	1.720	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(F)(F)CC[C@H]1C[NH3+]	ZINC000107271501	349340515	/nfs/dbraw/zinc/34/05/15/349340515.db2.gz	MUTWMGXYRJTIHT-QMMMGPOBSA-N	1	0	250.289	1.980	50	0		CDAARO
CC1(C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)OCCO1	ZINC000089920642	179883586	/nfs/dbraw/zinc/88/35/86/179883586.db2.gz	YMUXLZNBGWONJL-KGLIPLIRSA-N	1	0	269.385	1.765	50	0		CDAARO
c1cc(-c2nnc(C[NH2+][C@@H]3CCSC3)[nH]2)ccn1	ZINC000584886928	349345865	/nfs/dbraw/zinc/34/58/65/349345865.db2.gz	OMKUUUWZPNWQLJ-SNVBAGLBSA-N	1	0	261.354	1.462	50	0		CDAARO
Cc1c(CN(C)Cc2cnn3cccnc23)cnn1C	ZINC000584898463	349360109	/nfs/dbraw/zinc/36/01/09/349360109.db2.gz	DMSUBDKXCNXIMY-UHFFFAOYSA-N	1	0	270.340	1.403	50	0		CDAARO
CC[C@H]1CN(C(=O)c2ccc(=O)n(C)c2)CC[N@@H+]1C(C)C	ZINC000091426456	180151972	/nfs/dbraw/zinc/15/19/72/180151972.db2.gz	SKOPAUXXMJBFEW-AWEZNQCLSA-N	1	0	291.395	1.330	50	0		CDAARO
CN(CCOc1ccccc1F)C(=O)[C@H]1CC[C@H]([NH3+])C1	ZINC000091544109	180185284	/nfs/dbraw/zinc/18/52/84/180185284.db2.gz	MNRKJWFPKXXKOL-RYUDHWBXSA-N	1	0	280.343	1.790	50	0		CDAARO
Cc1cc(NCc2nc3cc(F)ccc3[nH]2)nc(N)[nH+]1	ZINC000091665154	180221362	/nfs/dbraw/zinc/22/13/62/180221362.db2.gz	SOETWXZUCQMWPD-UHFFFAOYSA-N	1	0	272.287	1.995	50	0		CDAARO
CC[C@H]1CN(S(C)(=O)=O)CC[C@H]1[NH2+]Cc1ccncc1	ZINC000252518056	350386472	/nfs/dbraw/zinc/38/64/72/350386472.db2.gz	YOHJKTFFEVJTDV-UONOGXRCSA-N	1	0	297.424	1.231	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+][C@H](CO)c2cnn(C)c2)C1(C)C	ZINC000108329968	186213152	/nfs/dbraw/zinc/21/31/52/186213152.db2.gz	BOAASZMUNPXNTL-JHJVBQTASA-N	1	0	267.373	1.247	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C1CCN(c2ncccn2)CC1	ZINC000036932506	363294430	/nfs/dbraw/zinc/29/44/30/363294430.db2.gz	FORCPYFGEBIPNC-UHFFFAOYSA-N	1	0	272.356	1.267	50	0		CDAARO
[NH3+][C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2F)C1	ZINC000036905549	363288316	/nfs/dbraw/zinc/28/83/16/363288316.db2.gz	OSZOOGSQIXVSND-VIFPVBQESA-N	1	0	276.308	1.077	50	0		CDAARO
CCOc1cccc(OCCCC[NH2+]CCO)c1	ZINC000003461792	356004107	/nfs/dbraw/zinc/00/41/07/356004107.db2.gz	UGDWNWBQVINZQV-UHFFFAOYSA-N	1	0	253.342	1.826	50	0		CDAARO
CC[C@@H](C)[NH2+]C[C@@H](O)COc1cccc(OC)c1	ZINC000002451793	355969993	/nfs/dbraw/zinc/96/99/93/355969993.db2.gz	DKKSGKTWOPLXOM-VXGBXAGGSA-N	1	0	253.342	1.823	50	0		CDAARO
COc1ccccc1/C(C)=C\C(=O)N1CC[C@H](C[NH3+])C1	ZINC000255212696	356019966	/nfs/dbraw/zinc/01/99/66/356019966.db2.gz	PNFYAMCHDYOILI-KIWPFMIBSA-N	1	0	274.364	1.906	50	0		CDAARO
C[C@H](OC[C@@H]1CCCO1)C(=O)N1CCC[C@H](C)[C@H]1C[NH3+]	ZINC000299739089	356267095	/nfs/dbraw/zinc/26/70/95/356267095.db2.gz	KKNJONFFNZGZQI-XDQVBPFNSA-N	1	0	284.400	1.156	50	0		CDAARO
CCO[C@H](C)c1nc(C)c(C(=O)N(C)[C@@H]2CC[NH2+]C2)s1	ZINC000299740025	356285807	/nfs/dbraw/zinc/28/58/07/356285807.db2.gz	USSVKWJDKLVXGE-GHMZBOCLSA-N	1	0	297.424	1.983	50	0		CDAARO
COc1cccc(OC[C@H](O)C[NH2+]C2CCSCC2)c1	ZINC000032576321	356287463	/nfs/dbraw/zinc/28/74/63/356287463.db2.gz	FJOCIBSNHFCDJX-CYBMUJFWSA-N	1	0	297.420	1.920	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCCN(Cc2cccc(F)c2F)C1=O	ZINC000012588776	356310050	/nfs/dbraw/zinc/31/00/50/356310050.db2.gz	YOOXFCFUFPEXRA-OAHLLOKOSA-N	1	0	298.333	1.380	50	0		CDAARO
C[C@H]1CN(c2ccc(S(C)(=O)=O)cc2F)CC[NH2+]1	ZINC000015443657	356416372	/nfs/dbraw/zinc/41/63/72/356416372.db2.gz	GIUNKEHKYNKZGE-VIFPVBQESA-N	1	0	272.345	1.027	50	0		CDAARO
COCC[NH2+]CC[C@H]1CCC(=O)N1CCc1ccccc1	ZINC000014999153	356403375	/nfs/dbraw/zinc/40/33/75/356403375.db2.gz	LFNJXNCQRGZCKB-MRXNPFEDSA-N	1	0	290.407	1.846	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F)[C@@H]1CC[NH2+]C1	ZINC000246901611	356433686	/nfs/dbraw/zinc/43/36/86/356433686.db2.gz	JSVRXNAALNFYKK-NTZNESFSSA-N	1	0	280.318	1.889	50	0		CDAARO
COc1ccc(C(=O)NCC[NH+]2CCCCC2)cc1OC	ZINC000016604053	356443019	/nfs/dbraw/zinc/44/30/19/356443019.db2.gz	NYGDFGJGRWZDMC-UHFFFAOYSA-N	1	0	292.379	1.920	50	0		CDAARO
CC(C)CC[N@@H+]1CCN(Cc2ccccn2)C[C@@H]1CCO	ZINC000019227840	356477969	/nfs/dbraw/zinc/47/79/69/356477969.db2.gz	RHZFGOSSOSMYKS-KRWDZBQOSA-N	1	0	291.439	1.996	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COc2cc(C)ccc2C)CC1	ZINC000019770755	356500792	/nfs/dbraw/zinc/50/07/92/356500792.db2.gz	AOIXIPPQTHHDSX-MRXNPFEDSA-N	1	0	292.423	1.681	50	0		CDAARO
CCCOc1ccc(C[NH2+][C@H]2CCS(=O)(=O)C2)cc1	ZINC000019772570	356501331	/nfs/dbraw/zinc/50/13/31/356501331.db2.gz	FUOWWSNDOUDKTE-ZDUSSCGKSA-N	1	0	283.393	1.752	50	0		CDAARO
CCNC(=O)N1CCC(C[NH3+])(C(F)(F)F)CC1	ZINC000725264705	538455675	/nfs/dbraw/zinc/45/56/75/538455675.db2.gz	LENNQLLQFKFFPC-UHFFFAOYSA-N	1	0	253.268	1.319	50	0		CDAARO
[NH3+]CC1(C(F)(F)F)CCN(C(=O)CC2CC2)CC1	ZINC000725264787	538455772	/nfs/dbraw/zinc/45/57/72/538455772.db2.gz	XBNLJSDUVDLTGN-UHFFFAOYSA-N	1	0	264.291	1.916	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@@H](CO)C2)c(OC)c1	ZINC000023114817	356628925	/nfs/dbraw/zinc/62/89/25/356628925.db2.gz	MRJUCIYRLPENPS-GFCCVEGCSA-N	1	0	265.353	1.908	50	0		CDAARO
C[N@@H+]1CCN(Cc2cccc(F)c2F)C[C@@H]1CCO	ZINC000023361402	356641848	/nfs/dbraw/zinc/64/18/48/356641848.db2.gz	LYONPMWCRZCWSQ-LBPRGKRZSA-N	1	0	270.323	1.463	50	0		CDAARO
Cc1cc(C[N@@H+]2CCC[C@@H]2[C@@H]2COCC[C@@]2(C)O)on1	ZINC000328954273	202126894	/nfs/dbraw/zinc/12/68/94/202126894.db2.gz	IKTWEQWPPUGCLC-RRFJBIMHSA-N	1	0	280.368	1.735	50	0		CDAARO
CC[N@H+](CCN1C(=O)NC(C)(C)C1=O)Cc1ccco1	ZINC000030275964	356747838	/nfs/dbraw/zinc/74/78/38/356747838.db2.gz	HXJSIVKFIYPBAC-UHFFFAOYSA-N	1	0	279.340	1.432	50	0		CDAARO
NC(=O)[C@@H]1CCC[N@H+](Cc2ccc(F)c(F)c2)C1	ZINC000000757468	356813164	/nfs/dbraw/zinc/81/31/64/356813164.db2.gz	BTJBAKJVJRLSPU-SNVBAGLBSA-N	1	0	254.280	1.662	50	0		CDAARO
CC(C)(C)OC(=O)N[C@@H](C[NH3+])C(=O)OC(C)(C)C	ZINC000034456714	356814992	/nfs/dbraw/zinc/81/49/92/356814992.db2.gz	OLMUCDWKBWSQKO-QMMMGPOBSA-N	1	0	260.334	1.180	50	0		CDAARO
CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1cn[nH]n1	ZINC000174919936	356819257	/nfs/dbraw/zinc/81/92/57/356819257.db2.gz	FSQDJJZXDFLNTN-AWEZNQCLSA-N	1	0	299.378	1.399	50	0		CDAARO
C[C@H]1C[NH+](CCCCNc2ncc(F)cn2)C[C@H](C)O1	ZINC000269529602	357077777	/nfs/dbraw/zinc/07/77/77/357077777.db2.gz	YDTPLFGLKSZJHI-RYUDHWBXSA-N	1	0	282.363	1.917	50	0		CDAARO
CCNC(=O)CN1CCC(C(=O)c2cccs2)CC1	ZINC000095407511	357213772	/nfs/dbraw/zinc/21/37/72/357213772.db2.gz	OFEDWTUJTZUBAD-UHFFFAOYSA-N	1	0	280.393	1.779	50	0		CDAARO
C[C@H]([NH2+]C1CCCC1)C(=O)Nc1ccc(C(N)=O)cc1	ZINC000033040234	357326568	/nfs/dbraw/zinc/32/65/68/357326568.db2.gz	LKDNLFYXAGAFMK-JTQLQIEISA-N	1	0	275.352	1.645	50	0		CDAARO
c1ncn(-c2ccc([C@H]3[NH2+]CCc4nc[nH]c43)cc2)n1	ZINC000065394163	357536026	/nfs/dbraw/zinc/53/60/26/357536026.db2.gz	IKOFMRMRUHBZOX-CYBMUJFWSA-N	1	0	266.308	1.226	50	0		CDAARO
CC[C@H](O)CNc1nc(CC[NH3+])nc2ccccc21	ZINC000065403318	357538308	/nfs/dbraw/zinc/53/83/08/357538308.db2.gz	BTSVWDRXISMOBW-JTQLQIEISA-N	1	0	260.341	1.314	50	0		CDAARO
CC[NH+]1CCN(Cc2nnc(Cc3ccccc3)[nH]2)CC1	ZINC000065434987	357541348	/nfs/dbraw/zinc/54/13/48/357541348.db2.gz	KNJBBSNQBXMAEJ-UHFFFAOYSA-N	1	0	285.395	1.533	50	0		CDAARO
[NH3+]Cc1n[nH]c(=O)n1Cc1ccc(Cl)cc1Cl	ZINC000065455747	357542352	/nfs/dbraw/zinc/54/23/52/357542352.db2.gz	XGRMAGKZCANBLQ-UHFFFAOYSA-N	1	0	273.123	1.385	50	0		CDAARO
O=C(Cc1cccs1)NCCC1=CCC[N@@H+](CCO)C1	ZINC000065504647	357545666	/nfs/dbraw/zinc/54/56/66/357545666.db2.gz	HVUXLYDNJJOAQH-UHFFFAOYSA-N	1	0	294.420	1.421	50	0		CDAARO
C[C@@H](CCc1ccccc1)[NH2+]CCSc1nnnn1C	ZINC000065528382	357548354	/nfs/dbraw/zinc/54/83/54/357548354.db2.gz	RBOFTIHGTFBXMA-LBPRGKRZSA-N	1	0	291.424	1.913	50	0		CDAARO
Cc1nnsc1C(=O)NC[C@@H]1CCC[N@@H+](CC(C)C)C1	ZINC000067772156	357625814	/nfs/dbraw/zinc/62/58/14/357625814.db2.gz	LHUHUMUCCUWVEO-LBPRGKRZSA-N	1	0	296.440	1.944	50	0		CDAARO
Cn1nc([C@@H]2CCC[N@H+](C)C2)n(-c2ccccc2)c1=O	ZINC000067854767	357632119	/nfs/dbraw/zinc/63/21/19/357632119.db2.gz	DSSQIKPALBILRJ-GFCCVEGCSA-N	1	0	272.352	1.380	50	0		CDAARO
CC[N@@H+]1CCO[C@@H](CCNC(=O)c2ccccc2NC)C1	ZINC000067867632	357633532	/nfs/dbraw/zinc/63/35/32/357633532.db2.gz	ATMUTXNEADTUFR-ZDUSSCGKSA-N	1	0	291.395	1.569	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)NCCc2nc3c(s2)CCCC3)C1	ZINC000072453822	357837105	/nfs/dbraw/zinc/83/71/05/357837105.db2.gz	CLIZVMYNGIQUHE-WDEREUQCSA-N	1	0	293.436	1.808	50	0		CDAARO
Cc1nn(C)c2ncnc(N3CCC[C@@](C)(O)C3)c12	ZINC000072479103	357837784	/nfs/dbraw/zinc/83/77/84/357837784.db2.gz	FLKXCZSDNVAQCS-CYBMUJFWSA-N	1	0	261.329	1.023	50	0		CDAARO
c1cn(-c2nc(-c3ccccc3)nc(-n3ccnc3)n2)cn1	ZINC000000056296	358079489	/nfs/dbraw/zinc/07/94/89/358079489.db2.gz	UWWDQJRBOHTCEV-UHFFFAOYSA-N	1	0	289.302	1.910	50	0		CDAARO
COc1ccccc1OC1CN(C(=O)C[NH+]2CCCC2)C1	ZINC000082098550	358147153	/nfs/dbraw/zinc/14/71/53/358147153.db2.gz	IWPAGENFWMUAJN-UHFFFAOYSA-N	1	0	290.363	1.381	50	0		CDAARO
CCn1c(CN2CCCC2)nnc1C1CC[NH+](C)CC1	ZINC000082155731	358149598	/nfs/dbraw/zinc/14/95/98/358149598.db2.gz	JRFYSKKRPYOAGM-UHFFFAOYSA-N	1	0	277.416	1.703	50	0		CDAARO
C[NH+](C)[C@H]1CCCCN(C(=O)CCc2csc(N)n2)C1	ZINC000082156715	358149717	/nfs/dbraw/zinc/14/97/17/358149717.db2.gz	UQXJHMNSAYEPBJ-LBPRGKRZSA-N	1	0	296.440	1.601	50	0		CDAARO
COC(=O)[C@]12CCC[C@H]1C[N@H+](Cc1ccncc1)C2	ZINC000097082974	358184224	/nfs/dbraw/zinc/18/42/24/358184224.db2.gz	ZHMOWTRATIEDCY-ZFWWWQNUSA-N	1	0	260.337	1.857	50	0		CDAARO
O=C(C(=O)N1CC[NH2+]CC1)c1cccc(Br)c1	ZINC000084718985	358243819	/nfs/dbraw/zinc/24/38/19/358243819.db2.gz	PHDLOPXCECWVIB-UHFFFAOYSA-N	1	0	297.152	1.064	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1C(=O)/C=C\c1nccs1	ZINC000098055875	358344291	/nfs/dbraw/zinc/34/42/91/358344291.db2.gz	YKZFLZQIXRUOKJ-UMBAGQNISA-N	1	0	251.355	1.319	50	0		CDAARO
CC(=O)NC[C@@H](c1ccc2c(c1)OCO2)[NH+](C)C	ZINC000012195987	358552611	/nfs/dbraw/zinc/55/26/11/358552611.db2.gz	DAQBJSNYZMYKAR-NSHDSACASA-N	1	0	250.298	1.154	50	0	biogenic	CDAARO
CC(C)[C@H]([NH3+])C(=O)N1CCc2c(F)cccc2C1	ZINC000195554857	358557598	/nfs/dbraw/zinc/55/75/98/358557598.db2.gz	BWVVYSUMPITXCH-ZDUSSCGKSA-N	1	0	250.317	1.694	50	0		CDAARO
O=C(NC[C@@H]1CCC[NH2+]C1)c1cnn(Cc2ccccc2)c1	ZINC000195542800	358559827	/nfs/dbraw/zinc/55/98/27/358559827.db2.gz	KGEXIYZHQPDHJG-OAHLLOKOSA-N	1	0	298.390	1.661	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)Nc1cccc2c1OCCO2	ZINC000195543293	358559857	/nfs/dbraw/zinc/55/98/57/358559857.db2.gz	CJJLSQGDXDVOLQ-UHFFFAOYSA-N	1	0	276.336	1.786	50	0		CDAARO
Fc1ccc2[nH]c(-c3cn(C4CC[NH2+]CC4)nn3)nc2c1	ZINC000091931232	358532638	/nfs/dbraw/zinc/53/26/38/358532638.db2.gz	LWOGHMZFGZQVID-UHFFFAOYSA-N	1	0	286.314	1.885	50	0		CDAARO
CCN(Cc1nc(C)no1)C(=O)CC[C@H]1CCC[N@H+](C)C1	ZINC000095362017	358685465	/nfs/dbraw/zinc/68/54/65/358685465.db2.gz	XYMAYOICALHOOZ-CYBMUJFWSA-N	1	0	294.399	1.849	50	0		CDAARO
Cc1cc(C)n([C@H]2CC[N@H+](Cc3[nH]cnc3C)C2)n1	ZINC000097600999	358787288	/nfs/dbraw/zinc/78/72/88/358787288.db2.gz	BYGAGLBVVXUWPS-ZDUSSCGKSA-N	1	0	259.357	1.978	50	0		CDAARO
C[NH+](C)CCO[C@@H]1COCC[C@H]1NC(=O)c1ccsc1	ZINC000219049709	359076045	/nfs/dbraw/zinc/07/60/45/359076045.db2.gz	TWVVCHJBDAMBJZ-CHWSQXEVSA-N	1	0	298.408	1.214	50	0		CDAARO
Cn1cc(CNc2cc(C3CC([NH3+])C3)nc(C3CC3)n2)cn1	ZINC000219264639	359084804	/nfs/dbraw/zinc/08/48/04/359084804.db2.gz	PRYPDZGYMZRWFG-UHFFFAOYSA-N	1	0	298.394	1.904	50	0		CDAARO
Cc1cc(S(=O)(=O)NCC[NH+](C)C)c(C)s1	ZINC000000117014	359111476	/nfs/dbraw/zinc/11/14/76/359111476.db2.gz	CCPIDMKPHUHFJQ-UHFFFAOYSA-N	1	0	262.400	1.205	50	0		CDAARO
CC[NH+](CC)CCNC(=O)COc1ccc(C)cc1	ZINC000003156013	359053874	/nfs/dbraw/zinc/05/38/74/359053874.db2.gz	SPBJGPMWYYTHMO-UHFFFAOYSA-N	1	0	264.369	1.832	50	0		CDAARO
C[C@H]([NH2+][C@H]1CCCN(c2ccn(C)n2)C1=O)[C@H]1CCCO1	ZINC000248493651	359147722	/nfs/dbraw/zinc/14/77/22/359147722.db2.gz	PKDVEXAPQXECKH-RWMBFGLXSA-N	1	0	292.383	1.073	50	0		CDAARO
C[C@]1(O)CCOC2(CC[NH+](Cc3ccc[nH]3)CC2)C1	ZINC000257191576	359586466	/nfs/dbraw/zinc/58/64/66/359586466.db2.gz	QREMXWRODWSOJT-AWEZNQCLSA-N	1	0	264.369	1.911	50	0		CDAARO
CC[NH+]1CCC2(C[C@@H](c3nnc(C)o3)N(C(C)=O)C2)CC1	ZINC000257193736	359605889	/nfs/dbraw/zinc/60/58/89/359605889.db2.gz	ZKHRLNUOTRCGDB-ZDUSSCGKSA-N	1	0	292.383	1.773	50	0		CDAARO
CNC(=O)NC(=O)CC[N@@H+]1CCC[C@@H]1c1ccc(C)cc1	ZINC000012782269	359676837	/nfs/dbraw/zinc/67/68/37/359676837.db2.gz	OYXCXCMXLQARPB-CQSZACIVSA-N	1	0	289.379	1.978	50	0		CDAARO
CCc1ccccc1OCC(=O)N1CCC([NH3+])CC1	ZINC000033439542	359695406	/nfs/dbraw/zinc/69/54/06/359695406.db2.gz	VSLKXECOJNSBRS-UHFFFAOYSA-N	1	0	262.353	1.578	50	0		CDAARO
CCC(=O)N(C)CCN(CC[NH+]1CCCCC1)C(=O)CC	ZINC000408516544	359898899	/nfs/dbraw/zinc/89/88/99/359898899.db2.gz	DMLMXYDJLUCQKY-UHFFFAOYSA-N	1	0	297.443	1.579	50	0		CDAARO
COCc1ncc(C)n1CC1CCN(C(C)=O)CC1	ZINC000409420956	360229234	/nfs/dbraw/zinc/22/92/34/360229234.db2.gz	LLZCJIHTELGGGS-UHFFFAOYSA-N	1	0	265.357	1.596	50	0		CDAARO
COCCN(Cc1ccc(OC)cc1)C(=O)[C@H](C)[NH+](C)C	ZINC000426529267	360681076	/nfs/dbraw/zinc/68/10/76/360681076.db2.gz	KHXFDYGUWOSJEX-ZDUSSCGKSA-N	1	0	294.395	1.620	50	0		CDAARO
CCN(CC[NH+](C)C)C(=O)c1cn2cc(Cl)cnc2n1	ZINC000426442044	360670599	/nfs/dbraw/zinc/67/05/99/360670599.db2.gz	VNDNESQOYTUGTA-UHFFFAOYSA-N	1	0	295.774	1.406	50	0		CDAARO
[NH3+]CCOc1ccc(CC(=O)NC[C@@H]2CCCOC2)cc1	ZINC000426739869	360700756	/nfs/dbraw/zinc/70/07/56/360700756.db2.gz	TYWAQFPQCCXCJI-AWEZNQCLSA-N	1	0	292.379	1.109	50	0		CDAARO
CCOc1ccc(C(=O)N2CC[C@@H](C[NH2+]C)C2)cc1OC	ZINC000178986111	189159689	/nfs/dbraw/zinc/15/96/89/189159689.db2.gz	UKAMCOGCLALGBK-LBPRGKRZSA-N	1	0	292.379	1.775	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2ccccc2OCCOC)C1	ZINC000179020531	189162348	/nfs/dbraw/zinc/16/23/48/189162348.db2.gz	IZXUSFPUUBEGFC-ZDUSSCGKSA-N	1	0	292.379	1.393	50	0		CDAARO
O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)[C@H]1CCCO1	ZINC000036090448	360895529	/nfs/dbraw/zinc/89/55/29/360895529.db2.gz	QAERRSINMWMGRW-TZMCWYRMSA-N	1	0	278.352	1.712	50	0		CDAARO
COc1ccc(-n2c(C[NH3+])nnc2SCCCO)cc1	ZINC000426503115	360932411	/nfs/dbraw/zinc/93/24/11/360932411.db2.gz	VNEYOZJPOIDNGH-UHFFFAOYSA-N	1	0	294.380	1.209	50	0		CDAARO
CC(=O)NC[C@H]1CN(Cc2cc(F)ccc2C)CCO1	ZINC000180164418	189240753	/nfs/dbraw/zinc/24/07/53/189240753.db2.gz	DWBMFJVUHHDUMU-HNNXBMFYSA-N	1	0	280.343	1.471	50	0		CDAARO
Fc1ccc(N2CCC(N[C@H]3CC[NH2+]C3)CC2)cc1F	ZINC000426602553	361158999	/nfs/dbraw/zinc/15/89/99/361158999.db2.gz	SJNUZBLPMHLWKG-LBPRGKRZSA-N	1	0	281.350	1.885	50	0		CDAARO
CC(=O)c1ccccc1C(=O)NCC1(O)CC[NH+](C)CC1	ZINC000267150945	363747158	/nfs/dbraw/zinc/74/71/58/363747158.db2.gz	RNQLZHYSGPXYCS-UHFFFAOYSA-N	1	0	290.363	1.076	50	0		CDAARO
Cc1ccc(C)c(OC[C@@H](O)C[N@@H+]2CCC[C@H](O)C2)c1C	ZINC000036264150	361375375	/nfs/dbraw/zinc/37/53/75/361375375.db2.gz	SMYHTMOTIUNERN-HOTGVXAUSA-N	1	0	293.407	1.808	50	0		CDAARO
Cc1cc(NC(=O)[C@@H](C)N(C)Cc2cccnc2)no1	ZINC000183595231	189363437	/nfs/dbraw/zinc/36/34/37/189363437.db2.gz	XQYDKGYKNWEPHN-LLVKDONJSA-N	1	0	274.324	1.837	50	0		CDAARO
Cc1ncsc1C(=O)N1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1	ZINC000184941073	189399496	/nfs/dbraw/zinc/39/94/96/189399496.db2.gz	AXEQUSCPSYJJOK-IVZWLZJFSA-N	1	0	251.355	1.261	50	0		CDAARO
C[C@@H]1CN(C(=O)CO[C@H]2CCCC[C@H]2C)CC[NH2+]1	ZINC000429342578	364325477	/nfs/dbraw/zinc/32/54/77/364325477.db2.gz	ACWTUKHACZLNOO-UPJWGTAASA-N	1	0	254.374	1.402	50	0		CDAARO
CCO[C@@H]1C[C@](CO)([NH2+]Cc2cncnc2)C1(C)C	ZINC000186578920	364612035	/nfs/dbraw/zinc/61/20/35/364612035.db2.gz	WZYBCZLURGCBQJ-TZMCWYRMSA-N	1	0	265.357	1.132	50	0		CDAARO
CNC(=O)CN1CCC([NH2+][C@H]2CC(C)(C)C[C@@H]2C)CC1	ZINC000192390566	189620582	/nfs/dbraw/zinc/62/05/82/189620582.db2.gz	HSMCYSGKMPADFU-JSGCOSHPSA-N	1	0	281.444	1.611	50	0		CDAARO
COC(=O)[C@]1(C)CC[N@@H+]([C@@H]2Cc3ccccc3[C@H]2O)C1	ZINC000271989879	365035183	/nfs/dbraw/zinc/03/51/83/365035183.db2.gz	PQPPUBZEKKLWJE-IIAWOOMASA-N	1	0	275.348	1.530	50	0		CDAARO
COc1ccc(OC)c([C@@H](O)CN2CC[N@H+](C)C[C@H]2C)c1	ZINC000089939200	366972415	/nfs/dbraw/zinc/97/24/15/366972415.db2.gz	GSJMUGFGZXJONF-DOMZBBRYSA-N	1	0	294.395	1.373	50	0		CDAARO
O=C1C[C@@H]([NH2+]C[C@H](c2ccco2)N2CCCC2)CCCN1	ZINC000630060069	366973814	/nfs/dbraw/zinc/97/38/14/366973814.db2.gz	GZHQSVKNUQZXHR-UONOGXRCSA-N	1	0	291.395	1.675	50	0		CDAARO
CCC(=O)N1CC[C@@H]([NH2+]Cc2ccc(CO)o2)[C@H](CC)C1	ZINC000089948955	366977058	/nfs/dbraw/zinc/97/70/58/366977058.db2.gz	CSVUMQVHCZBYBH-IUODEOHRSA-N	1	0	294.395	1.899	50	0		CDAARO
CO[C@@H](C)CC(=O)OCCC[N@@H+]1CCOC[C@H]1C	ZINC000252512736	367687261	/nfs/dbraw/zinc/68/72/61/367687261.db2.gz	VEIFANOOLNSDJY-NEPJUHHUSA-N	1	0	259.346	1.065	50	0		CDAARO
OCCOCC[NH2+]Cc1c[nH]nc1-c1ccc(F)cc1	ZINC000012530668	368002476	/nfs/dbraw/zinc/00/24/76/368002476.db2.gz	JAACLUOSAIROTN-UHFFFAOYSA-N	1	0	279.315	1.314	50	0		CDAARO
CCn1cc(C(=O)NCCn2c(C)c[nH+]c2C2CC2)cn1	ZINC000575553818	369117073	/nfs/dbraw/zinc/11/70/73/369117073.db2.gz	JOPMCIAJRPPVFM-UHFFFAOYSA-N	1	0	287.367	1.715	50	0		CDAARO
C[C@@H]1CN(C(=O)N[C@H]2CC[N@H+](CC3CCCC3)C2)CCO1	ZINC000076088321	369491970	/nfs/dbraw/zinc/49/19/70/369491970.db2.gz	DBSHYGAXSQOWOI-HIFRSBDPSA-N	1	0	295.427	1.681	50	0		CDAARO
CCC[NH+]1CCC(CCNC(=O)c2cncnc2)CC1	ZINC000299755454	372744922	/nfs/dbraw/zinc/74/49/22/372744922.db2.gz	CKQZWWWBAFYRGY-UHFFFAOYSA-N	1	0	276.384	1.719	50	0		CDAARO
CC(C)(C)c1noc(CNC(=O)C[N@@H+]2C[C@@H]3CC[C@H]2C3)n1	ZINC000299778374	372754377	/nfs/dbraw/zinc/75/43/77/372754377.db2.gz	QCQCBWWZXWEEFM-MNOVXSKESA-N	1	0	292.383	1.468	50	0		CDAARO
Cc1cc(C(=O)NCC2CC[NH+](CCO)CC2)cc(C)n1	ZINC000299780055	372756547	/nfs/dbraw/zinc/75/65/47/372756547.db2.gz	QZOIWNXDEFTAOA-UHFFFAOYSA-N	1	0	291.395	1.133	50	0		CDAARO
CC1(C[N@@H+]2CC[C@H]3OCc4cnnn4[C@H]3C2)CCOCC1	ZINC000299780518	372757350	/nfs/dbraw/zinc/75/73/50/372757350.db2.gz	SLRTXYNDPWEOEI-UONOGXRCSA-N	1	0	292.383	1.240	50	0		CDAARO
CCNC(=O)[C@@H](C)[N@H+](C)CCc1c(C)n[nH]c1C	ZINC000299782983	372759373	/nfs/dbraw/zinc/75/93/73/372759373.db2.gz	UMNPSNRZSJGPHD-LLVKDONJSA-N	1	0	252.362	1.025	50	0		CDAARO
O=C([C@H]1C[C@H](O)C[NH2+]1)N1CCC(c2ccccc2)CC1	ZINC000037804557	373353152	/nfs/dbraw/zinc/35/31/52/373353152.db2.gz	QYCAPEGBMQZOHB-LSDHHAIUSA-N	1	0	274.364	1.115	50	0		CDAARO
Cc1noc([C@@H]2C[N@H+](Cc3ccccc3C)C[C@H]2CO)n1	ZINC000253402598	373690162	/nfs/dbraw/zinc/69/01/62/373690162.db2.gz	GMSDKOVQOSMCNE-LSDHHAIUSA-N	1	0	287.363	1.894	50	0		CDAARO
CCOC(=O)[C@H](C)OC(=O)c1cccc(C[NH+](C)C)c1	ZINC000253424472	373732958	/nfs/dbraw/zinc/73/29/58/373732958.db2.gz	GSCAAFHEXQUOIO-NSHDSACASA-N	1	0	279.336	1.857	50	0		CDAARO
COC(=O)[C@H]1CCN(Cc2cc(F)ncc2F)C[C@H]1C	ZINC000253430650	373736194	/nfs/dbraw/zinc/73/61/94/373736194.db2.gz	NDIVOQVCHZJAGM-KOLCDFICSA-N	1	0	284.306	1.991	50	0		CDAARO
COc1ccc(Nc2cc(C)nc(NCC[NH3+])n2)cc1	ZINC000206579382	374177946	/nfs/dbraw/zinc/17/79/46/374177946.db2.gz	FFQBAXNVLPABLR-UHFFFAOYSA-N	1	0	273.340	1.908	50	0		CDAARO
Cc1ccccc1C[N@@H+](CCO)C1CCN(C)CC1	ZINC000095373384	374892714	/nfs/dbraw/zinc/89/27/14/374892714.db2.gz	YPLILWTZLQGZRL-UHFFFAOYSA-N	1	0	262.397	1.884	50	0		CDAARO
Cc1ccc([C@H](C)[NH2+]CCCNS(C)(=O)=O)c(C)c1	ZINC000095419598	374921876	/nfs/dbraw/zinc/92/18/76/374921876.db2.gz	LTAVQMJUIMGPMF-ZDUSSCGKSA-N	1	0	284.425	1.893	50	0		CDAARO
C[C@@H](CCc1cccc(F)c1)[NH2+]C[C@H]1CN(C)CCN1C	ZINC000095422305	374923701	/nfs/dbraw/zinc/92/37/01/374923701.db2.gz	WOMKCFSAAIHWEW-YOEHRIQHSA-N	1	0	293.430	1.982	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CC(Oc2ccccc2Cl)C1	ZINC000095466894	374960983	/nfs/dbraw/zinc/96/09/83/374960983.db2.gz	IQLBYAGNNWHWAS-NSHDSACASA-N	1	0	268.744	1.667	50	0		CDAARO
OCC[N@H+](CCN1CCSCC1)C1CCCCC1	ZINC000096485225	375106815	/nfs/dbraw/zinc/10/68/15/375106815.db2.gz	GSCMXOYVJMJRBE-UHFFFAOYSA-N	1	0	272.458	1.662	50	0		CDAARO
CC(C)COCCNC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@@H]21	ZINC000096499716	375107292	/nfs/dbraw/zinc/10/72/92/375107292.db2.gz	VQLPYPQRMKTEMR-CABCVRRESA-N	1	0	297.443	1.785	50	0		CDAARO
CN(C(=O)c1ccn2c[nH+]cc2c1)C1(C(N)=O)CCCC1	ZINC000097047417	375141706	/nfs/dbraw/zinc/14/17/06/375141706.db2.gz	XBDXPBHZFCAJJR-UHFFFAOYSA-N	1	0	286.335	1.204	50	0		CDAARO
COCCn1nc(C)c(CNc2cc(C)[nH+]c(N)n2)c1C	ZINC000097160092	375150920	/nfs/dbraw/zinc/15/09/20/375150920.db2.gz	SSBZYKVVERTXDW-UHFFFAOYSA-N	1	0	290.371	1.439	50	0		CDAARO
CN(C(=O)CCc1nncn1-c1ccccc1)[C@@H]1CC[NH2+]C1	ZINC000299739489	375200404	/nfs/dbraw/zinc/20/04/04/375200404.db2.gz	PAIQFCGQYZHTNA-CQSZACIVSA-N	1	0	299.378	1.020	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](CNC(=O)C2(COC)CCC2)C1	ZINC000670440554	542011307	/nfs/dbraw/zinc/01/13/07/542011307.db2.gz	FBQWFSLYKFWUQY-CQSZACIVSA-N	1	0	298.427	1.278	50	0		CDAARO
C[C@H](NC(=O)c1ccc(CC[NH3+])cc1)C(F)(F)F	ZINC000389522944	375828958	/nfs/dbraw/zinc/82/89/58/375828958.db2.gz	FARNHLQTUGUFLW-QMMMGPOBSA-N	1	0	260.259	1.868	50	0		CDAARO
O=C([C@H]1CCC[NH2+]C1)N1CCC(Cc2cccnc2)CC1	ZINC000335566449	375821807	/nfs/dbraw/zinc/82/18/07/375821807.db2.gz	AVDWMCUWWGJKPC-INIZCTEOSA-N	1	0	287.407	1.862	50	0		CDAARO
CCS(=O)(=O)NCCC[NH2+][C@H]1C[C@H](C)C[C@H](C)C1	ZINC000240786064	376016771	/nfs/dbraw/zinc/01/67/71/376016771.db2.gz	HZYAOINMQVEPOC-ITGUQSILSA-N	1	0	276.446	1.730	50	0		CDAARO
C[N@@H+]1CC[C@](O)(c2ccco2)[C@@H]([C@H](O)c2ccco2)C1	ZINC000245256784	376027616	/nfs/dbraw/zinc/02/76/16/376027616.db2.gz	SVKRQFXAPDYWAG-BYCMXARLSA-N	1	0	277.320	1.746	50	0		CDAARO
Nc1ncccc1C[N@@H+]1CCC[C@@H](c2cc[nH]n2)C1	ZINC000067847265	377260094	/nfs/dbraw/zinc/26/00/94/377260094.db2.gz	ZQJKHTPYRIDMFA-LLVKDONJSA-N	1	0	257.341	1.767	50	0		CDAARO
Cc1nnnn1-c1ccc(O[C@@]23CC[N@H+](C2)CCC3)cc1	ZINC000067921942	377311570	/nfs/dbraw/zinc/31/15/70/377311570.db2.gz	YQZASPOXVKCMTG-HNNXBMFYSA-N	1	0	285.351	1.588	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)CCc2nc3ccccc3o2)CC1	ZINC000032716519	377360246	/nfs/dbraw/zinc/36/02/46/377360246.db2.gz	RYTOPZGSTCVRLK-UHFFFAOYSA-N	1	0	287.363	1.925	50	0		CDAARO
Cc1nc(-c2cccc(C(=O)N3CC[C@H](C[NH3+])C3)c2)n[nH]1	ZINC000429022816	377787170	/nfs/dbraw/zinc/78/71/70/377787170.db2.gz	CQKGKPLLTOCBMM-LLVKDONJSA-N	1	0	285.351	1.201	50	0		CDAARO
COCCOC1CC[NH+](CC[C@@H]2CCOC2)CC1	ZINC000438119380	249570371	/nfs/dbraw/zinc/57/03/71/249570371.db2.gz	SJYMYICBWKBZSP-CYBMUJFWSA-N	1	0	257.374	1.540	50	0		CDAARO
O=S(=O)(c1ccc(N2CC[NH2+]CC2)cc1)C(F)(F)F	ZINC000035355016	285047525	/nfs/dbraw/zinc/04/75/25/285047525.db2.gz	ANLJCXQUPUPXST-UHFFFAOYSA-N	1	0	294.298	1.390	50	0		CDAARO
COCC[NH2+]C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000008698506	260032939	/nfs/dbraw/zinc/03/29/39/260032939.db2.gz	JDQHOQBFYIPISR-UHFFFAOYSA-N	1	0	258.362	1.622	50	0		CDAARO
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1[NH2+]CCCN1C(=O)CNC1=O	ZINC000097373775	390177295	/nfs/dbraw/zinc/17/72/95/390177295.db2.gz	TYDPEXTVPVODBM-HZSPNIEDSA-N	1	0	295.427	1.979	50	0		CDAARO
C[NH+](C)CCN1C(=O)[C@@H]2CC=C(Cl)C[C@@H]2C1=O	ZINC000100709709	390402584	/nfs/dbraw/zinc/40/25/84/390402584.db2.gz	ZDJWLMQGBPGACF-ZJUUUORDSA-N	1	0	256.733	1.066	50	0		CDAARO
O[C@H]1c2ccccc2C[C@H]1[N@@H+]1CCc2n[nH]cc2C1	ZINC000097034168	285374078	/nfs/dbraw/zinc/37/40/78/285374078.db2.gz	OLZWDSAQPFZIQJ-CABCVRRESA-N	1	0	255.321	1.426	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1F)[C@H]1CC[NH2+]C1	ZINC000179095594	390942094	/nfs/dbraw/zinc/94/20/94/390942094.db2.gz	WHYYFXQITIXYID-CYZMBNFOSA-N	1	0	280.318	1.889	50	0		CDAARO
c1ccc(OCCCN2CCOCC2)c(C[NH+]2CCC2)c1	ZINC000215146684	390989459	/nfs/dbraw/zinc/98/94/59/390989459.db2.gz	HHVJFAVVROYVIY-UHFFFAOYSA-N	1	0	290.407	1.993	50	0		CDAARO
Fc1ccc(N2CC[C@H](N3CCC[NH2+]CC3)C2)cc1	ZINC000259453275	391043633	/nfs/dbraw/zinc/04/36/33/391043633.db2.gz	WIRDEYVOVZBSMA-HNNXBMFYSA-N	1	0	263.360	1.700	50	0		CDAARO
CNC(=O)[C@H]1CCCC[N@@H+]1Cc1cc2ccccc2[nH]c1=O	ZINC000171916958	391964860	/nfs/dbraw/zinc/96/48/60/391964860.db2.gz	WPUUTFGOEUHWMM-OAHLLOKOSA-N	1	0	299.374	1.629	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000261753423	131166998	/nfs/dbraw/zinc/16/69/98/131166998.db2.gz	QJIYAIKCOWJNRW-PMPSAXMXSA-N	1	0	288.391	1.853	50	0		CDAARO
Cc1cc2c(cc1C)O[C@H](C(=O)N(C)[C@@H]1CC[NH2+]C1)C2	ZINC000179125524	292004421	/nfs/dbraw/zinc/00/44/21/292004421.db2.gz	DAWQPENOCVVXBI-HIFRSBDPSA-N	1	0	274.364	1.427	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cnn(-c3ccccc3C)c2)C1	ZINC000269172493	132124443	/nfs/dbraw/zinc/12/44/43/132124443.db2.gz	JTVOKRKDTZCFBX-CQSZACIVSA-N	1	0	298.390	1.862	50	0		CDAARO
Cc1ccccc1[C@H](O)CNC(=O)[C@H]1CCC[C@H]([NH3+])C1	ZINC000269213527	132132857	/nfs/dbraw/zinc/13/28/57/132132857.db2.gz	IYFBIMQUPSHZCH-KCQAQPDRSA-N	1	0	276.380	1.662	50	0		CDAARO
CNc1cc(C)[nH+]c(N2CCC3(CC2)[C@H](O)C[C@@H]3OC)n1	ZINC000092020657	135074457	/nfs/dbraw/zinc/07/44/57/135074457.db2.gz	SGYNBJQIHFOMIQ-NEPJUHHUSA-N	1	0	292.383	1.193	50	0		CDAARO
CSCC[C@@H](C)NC(=O)N1CC[C@@H]([NH+]2CC=CC2)C1	ZINC000101388699	397791789	/nfs/dbraw/zinc/79/17/89/397791789.db2.gz	MKBPMRSHANKTJG-CHWSQXEVSA-N	1	0	283.441	1.784	50	0		CDAARO
CNC(=O)[C@H]1CCCC[C@@H]1[NH2+]CCCCCOC	ZINC000097165603	397981981	/nfs/dbraw/zinc/98/19/81/397981981.db2.gz	MXPQGYVWEFYRFN-STQMWFEESA-N	1	0	256.390	1.698	50	0		CDAARO
C[NH+](C)CCCNC(=O)C(=O)c1c[nH]c2ccccc12	ZINC000003156104	169861677	/nfs/dbraw/zinc/86/16/77/169861677.db2.gz	MELQGBGCVOYTAL-UHFFFAOYSA-N	1	0	273.336	1.419	50	0		CDAARO
COc1ccc(OC)c(C[NH+]2CCC(C(N)=O)CC2)c1	ZINC000004700728	170001383	/nfs/dbraw/zinc/00/13/83/170001383.db2.gz	HFPZRCRPZMSHFH-UHFFFAOYSA-N	1	0	278.352	1.401	50	0		CDAARO
COc1ccc(C(=O)NC[C@H](C)C[NH+](C)C)cc1	ZINC000004740409	170008812	/nfs/dbraw/zinc/00/88/12/170008812.db2.gz	FULBVEAGOMQODT-NSHDSACASA-N	1	0	250.342	1.623	50	0		CDAARO
COc1ccccc1C[NH2+]CCSc1nnnn1C	ZINC000004998021	170052414	/nfs/dbraw/zinc/05/24/14/170052414.db2.gz	FJMUWNFUOPGEEW-UHFFFAOYSA-N	1	0	279.369	1.101	50	0		CDAARO
COC(=O)c1ccc(OC[C@H](O)C[NH2+]C2CCCC2)cc1	ZINC000005068352	170063316	/nfs/dbraw/zinc/06/33/16/170063316.db2.gz	KRVPGTVVOMNKKV-CQSZACIVSA-N	1	0	293.363	1.745	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1cc(=O)c2ccccc2[nH]1	ZINC000005349862	170088797	/nfs/dbraw/zinc/08/87/97/170088797.db2.gz	VYMMNYJALCBXIT-UHFFFAOYSA-N	1	0	273.336	1.622	50	0		CDAARO
CC[C@@H](C)[NH2+]Cc1ccc(OCC(N)=O)c(OC)c1	ZINC000006743648	170238535	/nfs/dbraw/zinc/23/85/35/170238535.db2.gz	JMEHNMKTHHMAJV-SNVBAGLBSA-N	1	0	266.341	1.447	50	0		CDAARO
CCc1ccc(C[N@H+](C)[C@@H](C)C(=O)N2CCNC2=O)cc1	ZINC000007683357	170297083	/nfs/dbraw/zinc/29/70/83/170297083.db2.gz	ABCYQZNXRKDINX-LBPRGKRZSA-N	1	0	289.379	1.621	50	0		CDAARO
COCCN1CC[N@H+](C[C@@H](C)c2ccccc2)CCC1=O	ZINC000012280094	170474824	/nfs/dbraw/zinc/47/48/24/170474824.db2.gz	HSFCPCMBNKCBRH-OAHLLOKOSA-N	1	0	290.407	1.971	50	0		CDAARO
OCC[C@H]1C[NH2+]CCN1Cc1ccc(F)c(F)c1	ZINC000019367998	170778095	/nfs/dbraw/zinc/77/80/95/170778095.db2.gz	GUXIIDOQCZJWFE-NSHDSACASA-N	1	0	256.296	1.121	50	0		CDAARO
COc1ccc(S(=O)(=O)N2CCC(C[NH3+])CC2)c(C)c1	ZINC000020182567	171046241	/nfs/dbraw/zinc/04/62/41/171046241.db2.gz	YAICRSYWYQSLQL-UHFFFAOYSA-N	1	0	298.408	1.363	50	0		CDAARO
CCn1nc(C(=O)NC)c2c1CC[C@H]([NH+](CC)CC)C2	ZINC000020208927	171073103	/nfs/dbraw/zinc/07/31/03/171073103.db2.gz	KCBMWLSAUPEVMD-NSHDSACASA-N	1	0	278.400	1.462	50	0		CDAARO
Cc1nc(C(=O)NCCC[N@@H+]2CCC[C@@H](CO)C2)cs1	ZINC000020232514	171094410	/nfs/dbraw/zinc/09/44/10/171094410.db2.gz	QCMFRIMIEWEPNT-GFCCVEGCSA-N	1	0	297.424	1.276	50	0		CDAARO
COc1cccc(CN2CC[N@H+](C)[C@@H](CCO)C2)c1OC	ZINC000020452260	171207766	/nfs/dbraw/zinc/20/77/66/171207766.db2.gz	PMHABCCNTFPQQH-AWEZNQCLSA-N	1	0	294.395	1.202	50	0		CDAARO
CSCC(=O)N1CCC[C@H](C[NH+]2CCCC2)C1	ZINC000020542186	171242196	/nfs/dbraw/zinc/24/21/96/171242196.db2.gz	BQBDUDIBXYUYGZ-GFCCVEGCSA-N	1	0	256.415	1.684	50	0		CDAARO
Cn1nccc1CN1CCC([N@@H+]2CCC[C@@H](CO)C2)CC1	ZINC000020599306	171266266	/nfs/dbraw/zinc/26/62/66/171266266.db2.gz	WYMBJWKSIRKKOH-CQSZACIVSA-N	1	0	292.427	1.089	50	0		CDAARO
CCOc1ccccc1NC(=O)CN1CC[NH+](CC)CC1	ZINC000020608847	171267657	/nfs/dbraw/zinc/26/76/57/171267657.db2.gz	YUVJXQZDPAEOIY-UHFFFAOYSA-N	1	0	291.395	1.661	50	0		CDAARO
CCc1ccc(C[N@H+]2CCc3nncn3CC2)cc1	ZINC000020996285	171284412	/nfs/dbraw/zinc/28/44/12/171284412.db2.gz	IDTBRQGXHWMTSO-UHFFFAOYSA-N	1	0	256.353	1.899	50	0		CDAARO
Cc1cccc(C)c1OC[C@@H](O)CN1CC[NH+](C)CC1	ZINC000021487205	171304400	/nfs/dbraw/zinc/30/44/00/171304400.db2.gz	KFADLJKPIHFAGI-HNNXBMFYSA-N	1	0	278.396	1.291	50	0		CDAARO
COC(=O)C(=C/C(C)=C/[NH+]1CCCCC1)C(=O)OC	ZINC000022108106	171353109	/nfs/dbraw/zinc/35/31/09/171353109.db2.gz	VXGDHTTTZUPODD-ZHACJKMWSA-N	1	0	267.325	1.649	50	0		CDAARO
Cc1ccc(OC[C@H](O)C[NH2+][C@@H]2CCO[C@@H]2C)c(C)c1	ZINC000032523772	171731615	/nfs/dbraw/zinc/73/16/15/171731615.db2.gz	YEGOIUNTNBMTEZ-RBSFLKMASA-N	1	0	279.380	1.810	50	0		CDAARO
COc1ccc(CC(=O)N2CCC3(C[NH2+]C3)CC2)cc1	ZINC000040450078	174266035	/nfs/dbraw/zinc/26/60/35/174266035.db2.gz	KOJLSKMVIQSXGZ-UHFFFAOYSA-N	1	0	274.364	1.450	50	0		CDAARO
CCN(Cc1noc(CC(C)C)n1)C(=O)[C@@H]1CC[NH2+]C1	ZINC000055393306	175577657	/nfs/dbraw/zinc/57/76/57/175577657.db2.gz	YLXJBXCENGRTFP-LLVKDONJSA-N	1	0	280.372	1.226	50	0		CDAARO
Cn1c(NCCC[NH+](C)C)nc2ccccc2c1=O	ZINC000071280726	176108604	/nfs/dbraw/zinc/10/86/04/176108604.db2.gz	MYEBTBVJVLTUCT-UHFFFAOYSA-N	1	0	260.341	1.297	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(C(=O)c2ccnn2C(F)F)CC1	ZINC000072134314	176321454	/nfs/dbraw/zinc/32/14/54/176321454.db2.gz	ZWFZXMVRAZEWQM-SNVBAGLBSA-N	1	0	286.326	1.835	50	0		CDAARO
CN(CCc1cn[nH]c1)C(=O)c1cccc([C@@H]2CC[NH2+]C2)c1	ZINC000072154478	176328095	/nfs/dbraw/zinc/32/80/95/176328095.db2.gz	LJZKABXDZPWCIC-MRXNPFEDSA-N	1	0	298.390	1.801	50	0		CDAARO
C[N@@H+]1CCC[C@@H](C(=O)NCc2cnn3ccccc23)C1	ZINC000072156714	176328889	/nfs/dbraw/zinc/32/88/89/176328889.db2.gz	NIHWMHMKOQBIFO-GFCCVEGCSA-N	1	0	272.352	1.292	50	0		CDAARO
COc1ccccc1CC(=O)N1CCCC[C@@H]2C[NH2+]C[C@H]21	ZINC000077010813	177146392	/nfs/dbraw/zinc/14/63/92/177146392.db2.gz	VANASYYVGCDCDD-HUUCEWRRSA-N	1	0	288.391	1.838	50	0		CDAARO
Cn1cnnc1C[NH2+][C@@H](CCO)C1CCCCC1	ZINC000097138158	424631026	/nfs/dbraw/zinc/63/10/26/424631026.db2.gz	NVGHBEIVILTNMJ-LBPRGKRZSA-N	1	0	252.362	1.236	50	0		CDAARO
O=c1[nH]c2ccc(F)c(F)c2n1C1CC[NH2+]CC1	ZINC000075946619	275042510	/nfs/dbraw/zinc/04/25/10/275042510.db2.gz	QTBUUHMIGIKYOK-UHFFFAOYSA-N	1	0	253.252	1.532	50	0		CDAARO
CN1CCN(C(=O)c2coc3ccccc23)[C@H](C[NH3+])C1	ZINC000097227699	276923816	/nfs/dbraw/zinc/92/38/16/276923816.db2.gz	GVZQQXPVRFDBCN-LLVKDONJSA-N	1	0	273.336	1.148	50	0		CDAARO
C[NH2+]C[C@@H]1CC(F)(F)CN1C(=O)OC(C)(C)C	ZINC000095742915	277026239	/nfs/dbraw/zinc/02/62/39/277026239.db2.gz	LDLHTVXAQWRDGH-QMMMGPOBSA-N	1	0	250.289	1.851	50	0		CDAARO
CN1CC[N@H+](C[C@@H]2CCOc3ccccc3C2)CCC1=O	ZINC000095498842	277107846	/nfs/dbraw/zinc/10/78/46/277107846.db2.gz	GIPFSWUCSLIBKB-CQSZACIVSA-N	1	0	288.391	1.792	50	0		CDAARO
CNc1cc(C)[nH+]c(N2C[C@@H](C)[C@](O)(C3CC3)C2)n1	ZINC000092077285	277301908	/nfs/dbraw/zinc/30/19/08/277301908.db2.gz	FIEMMTNBELNQQO-OTYXRUKQSA-N	1	0	262.357	1.424	50	0		CDAARO
CSc1nc(=NN)c2c3c(sc2[nH]1)C[N@@H+](C)CC3	ZINC000019758805	278180418	/nfs/dbraw/zinc/18/04/18/278180418.db2.gz	WMZDCKGWWRMNOV-UHFFFAOYSA-N	1	0	281.410	1.687	50	0		CDAARO
C[C@@H](CNC(=O)N1CCCC1)[N@@H+]1CCC[C@@H](C)C1	ZINC000079267673	278270968	/nfs/dbraw/zinc/27/09/68/278270968.db2.gz	KFQPFGNDVRAERH-OLZOCXBDSA-N	1	0	253.390	1.912	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCCN1C(=O)c1cccc2c1OCO2	ZINC000122110848	278312734	/nfs/dbraw/zinc/31/27/34/278312734.db2.gz	QYJJZFYSRICRRD-PWSUYJOCSA-N	1	0	276.336	1.757	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(CC1)C[NH2+]CC[C@@H]2O	ZINC000096945370	278383439	/nfs/dbraw/zinc/38/34/39/278383439.db2.gz	DZUSGBFCNIPQMO-NSHDSACASA-N	1	0	270.373	1.358	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(C[C@@H]([NH3+])CO2)CC1	ZINC000066339732	278384434	/nfs/dbraw/zinc/38/44/34/278384434.db2.gz	GBLUNQGZHFQTPW-SNVBAGLBSA-N	1	0	256.346	1.504	50	0		CDAARO
CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)N(C)CC(F)(F)F	ZINC000096486453	280321376	/nfs/dbraw/zinc/32/13/76/280321376.db2.gz	MDVZPBXLSPJHFG-NSHDSACASA-N	1	0	296.333	1.800	50	0		CDAARO
Cc1cc(C(=O)N2CCC[N@H+](CC3CC3)CC2)nn1C	ZINC000072252844	280325487	/nfs/dbraw/zinc/32/54/87/280325487.db2.gz	GMPIHHGVLFMMSH-UHFFFAOYSA-N	1	0	276.384	1.286	50	0		CDAARO
Cc1ccc2[nH]c([C@@H]3CCC[N@@H+]([C@@H]4CCNC4=O)C3)nc2c1	ZINC000097032965	281162761	/nfs/dbraw/zinc/16/27/61/281162761.db2.gz	BGRAIOFQXOHUIS-IUODEOHRSA-N	1	0	298.390	1.939	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)[C@H](O)C2CCCCC2)CC1	ZINC000534575302	328309965	/nfs/dbraw/zinc/30/99/65/328309965.db2.gz	LZNHXKZUYNIURO-CQSZACIVSA-N	1	0	282.428	1.918	50	0		CDAARO
COCC1(CNc2cc(OC)nc(N)n2)CCCC1	ZINC000534582858	328312484	/nfs/dbraw/zinc/31/24/84/328312484.db2.gz	WWWCCEDIVPBYHS-UHFFFAOYSA-N	1	0	266.345	1.516	50	0		CDAARO
CC[C@H](C[NH+](C)C)NC(=O)N1CC(Oc2ccccc2)C1	ZINC000534588400	328316603	/nfs/dbraw/zinc/31/66/03/328316603.db2.gz	OBTLGJCKRGYYCW-CYBMUJFWSA-N	1	0	291.395	1.799	50	0		CDAARO
Cc1cccc([C@H](CNC(=O)c2cn[nH]c2)[NH+](C)C)c1	ZINC000534592239	328318574	/nfs/dbraw/zinc/31/85/74/328318574.db2.gz	NODQIWFJVFTYOI-AWEZNQCLSA-N	1	0	272.352	1.751	50	0		CDAARO
Cc1n[nH]c(C)c1CCNC(=O)[C@H]1CCC[NH2+]CC1	ZINC000534660296	328342563	/nfs/dbraw/zinc/34/25/63/328342563.db2.gz	ZFNVKZMXDDJDTO-LBPRGKRZSA-N	1	0	264.373	1.075	50	0		CDAARO
Cc1c[nH]c(CN(C)C(=O)N[C@H](C)C[NH+]2CCCC2)n1	ZINC000534675423	328356185	/nfs/dbraw/zinc/35/61/85/328356185.db2.gz	HCVBCFBXJWTBKY-GFCCVEGCSA-N	1	0	279.388	1.344	50	0		CDAARO
CC1(C)C[C@H]([NH2+]CC(=O)Nc2ccncc2)C(C)(C)O1	ZINC000119675623	323208632	/nfs/dbraw/zinc/20/86/32/323208632.db2.gz	WSDBPGPVBSLZII-LBPRGKRZSA-N	1	0	277.368	1.956	50	0		CDAARO
O=C(c1ccc(Br)s1)N1CC[NH2+]CC1	ZINC000014007924	326842517	/nfs/dbraw/zinc/84/25/17/326842517.db2.gz	PWWQPDAPTAWRQX-UHFFFAOYSA-N	1	0	275.171	1.556	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]Cc1ccc(Cn2cncn2)cc1	ZINC000097159217	482458991	/nfs/dbraw/zinc/45/89/91/482458991.db2.gz	SWFLIBPQNWFTDM-UHFFFAOYSA-N	1	0	282.351	1.648	50	0		CDAARO
CC(C)(O)[C@@H]1CC[N@@H+](C2CSCCSC2)C1	ZINC000670438903	482983286	/nfs/dbraw/zinc/98/32/86/482983286.db2.gz	IFFIBRHQKTZMGC-SNVBAGLBSA-N	1	0	261.456	1.928	50	0		CDAARO
CC1(C)C[C@H](O)CC[N@H+](CCN2CCCC2=O)C1	ZINC000670450492	483008966	/nfs/dbraw/zinc/00/89/66/483008966.db2.gz	SGPQNDRGTWBKLA-GFCCVEGCSA-N	1	0	254.374	1.092	50	0		CDAARO
COCC[C@H]1C[N@H+](CCCn2cc(C)cn2)CCO1	ZINC000670451743	483014557	/nfs/dbraw/zinc/01/45/57/483014557.db2.gz	PKSILBZRSFMTQA-AWEZNQCLSA-N	1	0	267.373	1.319	50	0		CDAARO
Cc1nn2c([n-]1)nc(C[N@@H+]1CCC3(CCCC3)C1)cc2=O	ZINC000670452354	483018824	/nfs/dbraw/zinc/01/88/24/483018824.db2.gz	BYXKIWOASIIYMI-UHFFFAOYSA-N	1	0	287.367	1.904	50	0		CDAARO
COc1cc(CCC(C)=O)ccc1ON1CCC[NH2+]CC1	ZINC000426444553	533756086	/nfs/dbraw/zinc/75/60/86/533756086.db2.gz	KXEUEKSVNFAIQJ-UHFFFAOYSA-N	1	0	292.379	1.806	50	0		CDAARO
Cc1c[nH]c([C@@H](C)NC(=O)C[N@H+](C)C2CCCC2)n1	ZINC000822182675	1161927072	/nfs/dbraw/zinc/92/70/72/1161927072.db2.gz	FCUJRDFRTKRWIG-LLVKDONJSA-N	1	0	264.373	1.770	50	0		CDAARO
COc1cccc(C[N@H+](C)CCN2CCOCC2)c1OC	ZINC000020863671	525914721	/nfs/dbraw/zinc/91/47/21/525914721.db2.gz	XFLXXCSTDHKTLX-UHFFFAOYSA-N	1	0	294.395	1.468	50	0		CDAARO
CC(C)c1nccc(CN2C[C@@H]3CC[C@H]2C[NH2+]C3)n1	ZINC000426477360	528363732	/nfs/dbraw/zinc/36/37/32/528363732.db2.gz	JEPDVBVJGMTGCV-OCCSQVGLSA-N	1	0	260.385	1.784	50	0		CDAARO
COc1cc2ncn([C@@H]3CCC[NH2+]C3)c(=O)c2cc1OC	ZINC000757178338	577033667	/nfs/dbraw/zinc/03/36/67/577033667.db2.gz	TUECWXUHVURMTD-SNVBAGLBSA-N	1	0	289.335	1.338	50	0		CDAARO
COc1ccc(O)cc1CNCC[N@@H+]1CCC[C@H](CO)C1	ZINC000952970868	617274560	/nfs/dbraw/zinc/27/45/60/617274560.db2.gz	QPGZCQDXWSWIJB-ZDUSSCGKSA-N	1	0	294.395	1.195	50	0		CDAARO
CCCN1C[C@H]([NH2+]Cc2cc(C(C)=O)cn2C)CC1=O	ZINC000952971473	614813041	/nfs/dbraw/zinc/81/30/41/614813041.db2.gz	ONNRECWOQZGAGN-CYBMUJFWSA-N	1	0	277.368	1.328	50	0		CDAARO
CCNC(=O)c1ccc(NC(=O)[C@@H]2C=CC[NH2+]2)cc1Cl	ZINC000952966416	615067923	/nfs/dbraw/zinc/06/79/23/615067923.db2.gz	ITIBETBCTWVCJL-LBPRGKRZSA-N	1	0	293.754	1.556	50	0		CDAARO
CCc1ccc(C[NH2+]CCN2CCC[C@@H](CO)C2)nc1	ZINC000952970992	615673963	/nfs/dbraw/zinc/67/39/63/615673963.db2.gz	QZEARQXICOZDAB-OAHLLOKOSA-N	1	0	277.412	1.438	50	0		CDAARO
CN(CC1(C)COC1)C(=O)c1ccc(C[NH+]2CCCC2)o1	ZINC000952971269	616056501	/nfs/dbraw/zinc/05/65/01/616056501.db2.gz	JHMIMLMTDNJEDD-UHFFFAOYSA-N	1	0	292.379	1.984	50	0		CDAARO
C[NH2+]CC(=O)N[C@@H]1COC[C@H]1Cc1ccnc2ccccc12	ZINC001704279434	1177677940	/nfs/dbraw/zinc/67/79/40/1177677940.db2.gz	DAZHLGWJTGOBKX-CZUORRHYSA-N	1	0	299.374	1.128	50	0		CDAARO
Cc1cc(C)n(CCC[N@@H+](C)CCn2cc[nH]c2=O)n1	ZINC001704355679	1177698521	/nfs/dbraw/zinc/69/85/21/1177698521.db2.gz	WOZGJABUGBBHDJ-UHFFFAOYSA-N	1	0	277.372	1.424	50	0		CDAARO
C[C@H](NCc1ccc([C@H]2CCCCO2)o1)C(N)=O	ZINC000032511611	844594518	/nfs/dbraw/zinc/59/45/18/844594518.db2.gz	QSAZBTPSYJOVIS-GXSJLCMTSA-N	1	0	252.314	1.485	50	0		CDAARO
Cc1nn(C)c(C)c1[C@@H](C)Nc1cc(C)[nH+]c(N)n1	ZINC000032534904	843873578	/nfs/dbraw/zinc/87/35/78/843873578.db2.gz	VWGCZCOLSSOABY-MRVPVSSYSA-N	1	0	260.345	1.891	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2cccnc2C)n1C	ZINC000426436506	844743529	/nfs/dbraw/zinc/74/35/29/844743529.db2.gz	GVCAYOZCDSIYIU-UHFFFAOYSA-N	1	0	263.370	1.530	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCCC[NH2+][C@H]2CCOC2)cc1	ZINC000952981393	845763600	/nfs/dbraw/zinc/76/36/00/845763600.db2.gz	WKDKIDUHZVQJNC-ZDUSSCGKSA-N	1	0	298.408	1.042	50	0		CDAARO
COc1ccc(/C(C)=C/C(=O)N2CC[C@@H](C[NH3+])C2)cc1	ZINC000178544484	846167863	/nfs/dbraw/zinc/16/78/63/846167863.db2.gz	YTUXGPMBHSTNHM-SRXBQZRASA-N	1	0	274.364	1.906	50	0		CDAARO
[NH3+]Cc1ccc(C(=O)N2CC(OCC(F)F)C2)cc1	ZINC000707194669	846243111	/nfs/dbraw/zinc/24/31/11/846243111.db2.gz	MCXIQKIZTIWGCC-UHFFFAOYSA-N	1	0	270.279	1.251	50	0		CDAARO
C[C@@H](Cc1ccno1)[NH2+]C[C@](C)(O)C(=O)OC(C)(C)C	ZINC000952995707	846471185	/nfs/dbraw/zinc/47/11/85/846471185.db2.gz	WDPDXUXBWCUKNO-HZMBPMFUSA-N	1	0	284.356	1.288	50	0		CDAARO
O=c1oc2cccnc2n1CC[NH2+][C@H](CO)c1ccccc1	ZINC000183639121	847781053	/nfs/dbraw/zinc/78/10/53/847781053.db2.gz	YQRCSKBKYKXKKQ-CYBMUJFWSA-N	1	0	299.330	1.313	50	0		CDAARO
c1c(COCc2ccccc2)nnn1[C@@H]1CC[NH2+]C1	ZINC000675018351	899871478	/nfs/dbraw/zinc/87/14/78/899871478.db2.gz	QTWMTSGUFSQKHE-CQSZACIVSA-N	1	0	258.325	1.529	50	0		CDAARO
Cc1n[nH]c(C2CC[NH+]([C@H](C)Cn3cccn3)CC2)n1	ZINC000821746053	925595207	/nfs/dbraw/zinc/59/52/07/925595207.db2.gz	PFYOPNZNUXNGKS-LLVKDONJSA-N	1	0	274.372	1.578	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]C1CCS(=O)(=O)CC1	ZINC000823557289	925710601	/nfs/dbraw/zinc/71/06/01/925710601.db2.gz	JHHDZEMZJPMDFE-NSHDSACASA-N	1	0	285.413	1.001	50	0		CDAARO
Cc1nc(C[C@@H](C)[NH+]2CCCCCC2)n(CCO)n1	ZINC000828776943	926179384	/nfs/dbraw/zinc/17/93/84/926179384.db2.gz	MXVZYUVKMDWAKY-GFCCVEGCSA-N	1	0	266.389	1.386	50	0		CDAARO
COc1ccccc1C(=O)N1CC[C@@H]([NH+](C)C)[C@@H](CO)C1	ZINC000581782234	927197649	/nfs/dbraw/zinc/19/76/49/927197649.db2.gz	DXJWZXUJVFFZQK-TZMCWYRMSA-N	1	0	292.379	1.080	50	0		CDAARO
O=C(NC1CC1)[C@]1(CCO)CC[N@H+](Cc2ccccc2)C1	ZINC000581811649	927203201	/nfs/dbraw/zinc/20/32/01/927203201.db2.gz	YKOOOMWKWXLZCA-KRWDZBQOSA-N	1	0	288.391	1.540	50	0		CDAARO
C[NH2+]CC(=O)NCc1ccnc(SC(C)(C)C)c1	ZINC000585089020	930911593	/nfs/dbraw/zinc/91/15/93/930911593.db2.gz	MYYFYHXTFUSXML-UHFFFAOYSA-N	1	0	267.398	1.808	50	0		CDAARO
Cc1cc(C[N@@H+]2CCC[C@]23CCNC3=O)ccc1F	ZINC000585116550	930967720	/nfs/dbraw/zinc/96/77/20/930967720.db2.gz	AMRIZZZEGALSCH-OAHLLOKOSA-N	1	0	262.328	1.989	50	0		CDAARO
Cc1cnnc(N2CCC[C@H](C[NH+]3CCOCC3)C2)c1	ZINC000585132939	931027233	/nfs/dbraw/zinc/02/72/33/931027233.db2.gz	IGCSDALIUNRMIB-CQSZACIVSA-N	1	0	276.384	1.334	50	0		CDAARO
CCN(C)c1cc(NCCNc2cc[nH+]cc2C)ncn1	ZINC001529124987	968988760	/nfs/dbraw/zinc/98/87/60/968988760.db2.gz	CTDHUIIXTGWMSH-UHFFFAOYSA-N	1	0	286.383	1.582	50	0		CDAARO
CC[N@@H+](Cc1cc(=O)[nH]c(C)n1)C[C@@H]1CCCCO1	ZINC001529150917	968994111	/nfs/dbraw/zinc/99/41/11/968994111.db2.gz	BCCLJULMCBYYRY-ZDUSSCGKSA-N	1	0	265.357	1.882	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1C1CN(c2nccnc2N(C)C)C1	ZINC001529167454	968999996	/nfs/dbraw/zinc/99/99/96/968999996.db2.gz	JWUOWYOUWRAFAP-LBPRGKRZSA-N	1	0	275.400	1.606	50	0		CDAARO
Cc1nc(CN(C)CC[N@H+](C)C2CCCC2)cc(=O)[nH]1	ZINC001529186357	969007736	/nfs/dbraw/zinc/00/77/36/969007736.db2.gz	XOYBIEHEVNXUNQ-UHFFFAOYSA-N	1	0	278.400	1.797	50	0		CDAARO
C[C@H](CCN(C)C(=O)c1cc(O)ccc1N)[NH+]1CCCC1	ZINC001506400801	975149217	/nfs/dbraw/zinc/14/92/17/975149217.db2.gz	XFEBIQICTIMTNR-GFCCVEGCSA-N	1	0	291.395	1.921	50	0		CDAARO
CCn1cncc1C[NH2+]C1CSCCSC1	ZINC001506404387	975151771	/nfs/dbraw/zinc/15/17/71/975151771.db2.gz	XMAPUMZBQGGGHG-UHFFFAOYSA-N	1	0	257.428	1.841	50	0		CDAARO
COc1nccnc1N(C)CC[C@@H](C)[NH+]1CCCC1	ZINC001506408806	975153134	/nfs/dbraw/zinc/15/31/34/975153134.db2.gz	XHPBSKFFFQSKDN-GFCCVEGCSA-N	1	0	264.373	1.796	50	0		CDAARO
Cn1c(SCCn2cccn2)nnc1[C@H]1CCC[NH2+]C1	ZINC000426546173	230422659	/nfs/dbraw/zinc/42/26/59/230422659.db2.gz	LXEGPEJRYCALFA-NSHDSACASA-N	1	0	292.412	1.271	50	0		CDAARO
Cn1cccc1CCNC(=O)C1(C)CC[NH+](C)CC1	ZINC000426582861	230423636	/nfs/dbraw/zinc/42/36/36/230423636.db2.gz	RBKLZHSZADGNBY-UHFFFAOYSA-N	1	0	263.385	1.416	50	0		CDAARO
CCOc1ccc(/C=C/C(=O)N2CC[NH2+]C[C@H]2C)cc1	ZINC000124548639	187142609	/nfs/dbraw/zinc/14/26/09/187142609.db2.gz	RRWTYSBNNHQSMV-YSKGHYERSA-N	1	0	274.364	1.919	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@@H]1CCCN1C(=O)[C@H](C)n1cccn1	ZINC000106779468	349484281	/nfs/dbraw/zinc/48/42/81/349484281.db2.gz	RIJSKECRKBTQOE-ZNMIVQPWSA-N	1	0	290.411	1.919	50	0		CDAARO
O=C(NC[C@@H]1C[N@@H+]2CCC[C@@H]2CO1)N1C[C@@H]2CCC[C@H]2C1	ZINC000084137087	539086190	/nfs/dbraw/zinc/08/61/90/539086190.db2.gz	PBLKBKWJSOBAIQ-BYNSBNAKSA-N	1	0	293.411	1.291	50	0		CDAARO
COc1ccc(C[N@@H+]2C[C@@H](C(N)=O)CC[C@H]2C)c(OC)c1	ZINC000095982664	185053861	/nfs/dbraw/zinc/05/38/61/185053861.db2.gz	DBPIUQSOSNEJGU-YPMHNXCESA-N	1	0	292.379	1.790	50	0		CDAARO
CC(C)Cn1cncc1CN(C)Cc1cnccn1	ZINC000240517189	361748282	/nfs/dbraw/zinc/74/82/82/361748282.db2.gz	NWLDHXQGMZRULR-UHFFFAOYSA-N	1	0	259.357	1.961	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@@H](CO)C2)ccc1O	ZINC000023115116	342089035	/nfs/dbraw/zinc/08/90/35/342089035.db2.gz	NZFPAOIVNXCIEP-GFCCVEGCSA-N	1	0	251.326	1.605	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)C[C@@H](C)c1ccc(F)cc1F	ZINC000195554019	342625782	/nfs/dbraw/zinc/62/57/82/342625782.db2.gz	VIWZOWWZOAMBLT-IIMNLJJBSA-N	1	0	298.333	1.561	50	0		CDAARO
Cc1ncccc1C[NH2+][C@@H]1CCCCC[C@@H]1C(N)=O	ZINC000195562095	342628598	/nfs/dbraw/zinc/62/85/98/342628598.db2.gz	OHKSSBGAJCFZEK-UONOGXRCSA-N	1	0	261.369	1.914	50	0		CDAARO
C[NH+](C)C1CN(C(=O)CC2CCC3(CC2)OCCO3)C1	ZINC000195578005	342628884	/nfs/dbraw/zinc/62/88/84/342628884.db2.gz	NQUGVCYPULPRCA-UHFFFAOYSA-N	1	0	282.384	1.082	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@@H](CNC(=O)CCc2cn[nH]c2)C1	ZINC000244678937	361857221	/nfs/dbraw/zinc/85/72/21/361857221.db2.gz	IMSQHDNEOTZDDU-AWEZNQCLSA-N	1	0	278.400	1.436	50	0		CDAARO
CC[C@@H](C(=O)NCc1[nH]cc(C)c(=O)c1C)[N@H+](C)CC	ZINC000244734846	361860205	/nfs/dbraw/zinc/86/02/05/361860205.db2.gz	NMUVZRZAMLKRLG-ZDUSSCGKSA-N	1	0	279.384	1.751	50	0		CDAARO
[NH3+]Cc1nc(CN2C(=O)c3ccccc3C2=O)cs1	ZINC000685944705	539046148	/nfs/dbraw/zinc/04/61/48/539046148.db2.gz	SNOXGOSETQDESK-UHFFFAOYSA-N	1	0	273.317	1.398	50	0		CDAARO
COc1ccccc1C[NH2+][C@H](C)Cn1nc(C)oc1=O	ZINC000585141217	342219093	/nfs/dbraw/zinc/21/90/93/342219093.db2.gz	RNVDXPMGCGXXDU-SNVBAGLBSA-N	1	0	277.324	1.332	50	0		CDAARO
Cc1ccc([C@H](CNC(=O)c2cncnc2)[NH+](C)C)cc1	ZINC000273882001	192347291	/nfs/dbraw/zinc/34/72/91/192347291.db2.gz	XPQQYZZKDIMBKA-HNNXBMFYSA-N	1	0	284.363	1.818	50	0		CDAARO
CC1(C)C[C@H]([NH2+]CC[C@H]2CCOC2=O)C(C)(C)O1	ZINC000119832253	342270624	/nfs/dbraw/zinc/27/06/24/342270624.db2.gz	KVYGHHCBOMYYLC-QWRGUYRKSA-N	1	0	255.358	1.875	50	0		CDAARO
CC(C)(C)C[NH2+]Cc1ccc(S(N)(=O)=O)s1	ZINC000585118249	362048080	/nfs/dbraw/zinc/04/80/80/362048080.db2.gz	IDEXOFREMGQRIU-UHFFFAOYSA-N	1	0	262.400	1.531	50	0		CDAARO
Fc1c(F)c(F)c(N2CC[NH2+]CC2)c(F)c1F	ZINC000003441670	282958079	/nfs/dbraw/zinc/95/80/79/282958079.db2.gz	IXHIQLUASOVALJ-UHFFFAOYSA-N	1	0	252.186	1.792	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C/C(=O)N1CC[N@@H+](C)C[C@H]1C	ZINC000089512388	362311395	/nfs/dbraw/zinc/31/13/95/362311395.db2.gz	AWTWCPHJYBPIHE-BRAIEQGRSA-N	1	0	296.802	1.558	50	0		CDAARO
CS(=O)(=O)NCC1CC[NH+](Cc2ccccc2)CC1	ZINC000015080569	362348593	/nfs/dbraw/zinc/34/85/93/362348593.db2.gz	CVWHKURTSWYRJJ-UHFFFAOYSA-N	1	0	282.409	1.448	50	0		CDAARO
c1ccc(N2CCN(CC[NH+]3CCSCC3)CC2)cc1	ZINC000252481546	362385840	/nfs/dbraw/zinc/38/58/40/362385840.db2.gz	CNVKOVSXZNGXQZ-UHFFFAOYSA-N	1	0	291.464	1.857	50	0		CDAARO
CCc1nc(CCNC(=O)C[N@H+]2[C@H](C)CCC[C@@H]2C)no1	ZINC000252488223	362386815	/nfs/dbraw/zinc/38/68/15/362386815.db2.gz	INVCYTHCPHMBOI-TXEJJXNPSA-N	1	0	294.399	1.554	50	0		CDAARO
Nc1cc(CC[C@@H]2COc3ccccc3O2)[nH+]c(N)n1	ZINC000252504233	362389899	/nfs/dbraw/zinc/38/98/99/362389899.db2.gz	VIOGSCNRWRLFAP-SNVBAGLBSA-N	1	0	272.308	1.414	50	0		CDAARO
CSCC1CC[NH+](CCn2c(=O)cc(C)[nH]c2=O)CC1	ZINC000253537027	362434989	/nfs/dbraw/zinc/43/49/89/362434989.db2.gz	UFZYDCQDGGXBQV-UHFFFAOYSA-N	1	0	297.424	1.332	50	0		CDAARO
O=C1NCCCC[C@@H]1[NH2+]Cc1ccc2c(c1)OCCO2	ZINC000084459192	178890640	/nfs/dbraw/zinc/89/06/40/178890640.db2.gz	LIYWJZLMMXEKJM-LBPRGKRZSA-N	1	0	276.336	1.216	50	0		CDAARO
C[NH2+]CCCCNC(=O)c1ccc(C(C)C)n(C)c1=O	ZINC000097815580	185670880	/nfs/dbraw/zinc/67/08/80/185670880.db2.gz	LYRQIWOGMANDNQ-UHFFFAOYSA-N	1	0	279.384	1.238	50	0		CDAARO
O[C@H](C[NH+]1CCN(Cc2ccc(F)cc2)CC1)C1CC1	ZINC000085436860	179062702	/nfs/dbraw/zinc/06/27/02/179062702.db2.gz	RSFNQDKSLZYCNO-MRXNPFEDSA-N	1	0	278.371	1.714	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)c2ccc(F)c(F)c2)CC1	ZINC000085467930	179073634	/nfs/dbraw/zinc/07/36/34/179073634.db2.gz	GNESRRBUVLNSKT-UHFFFAOYSA-N	1	0	298.333	1.805	50	0		CDAARO
O=C(c1ccccc1)c1c(CO)n(O)c2ccccc2[n+]1=O	ZINC000138879707	348751608	/nfs/dbraw/zinc/75/16/08/348751608.db2.gz	OEEHMMXWRCCWFL-UHFFFAOYSA-N	1	0	297.290	1.516	50	0		CDAARO
C[C@@H](O)C(=O)NCC1([NH+]2CCCCC2)CCCC1	ZINC000584888973	349347077	/nfs/dbraw/zinc/34/70/77/349347077.db2.gz	VHQZGNQNANDQSP-GFCCVEGCSA-N	1	0	254.374	1.282	50	0		CDAARO
C[C@@H](CN(C)CCO)[NH2+]Cc1cnc2ccccc2c1	ZINC000584888932	349347093	/nfs/dbraw/zinc/34/70/93/349347093.db2.gz	HCJWPRSNEMGYMV-ZDUSSCGKSA-N	1	0	273.380	1.637	50	0		CDAARO
C[C@H](CCc1ccco1)[NH2+][C@H]1CC(=O)N(C2CC2)C1	ZINC000090180784	179928060	/nfs/dbraw/zinc/92/80/60/179928060.db2.gz	KYVIERBJCYEFTC-NEPJUHHUSA-N	1	0	262.353	1.954	50	0		CDAARO
Cc1cnn(CCCNC(=O)CC[C@H]2CCC[N@@H+](C)C2)c1	ZINC000091486641	180167548	/nfs/dbraw/zinc/16/75/48/180167548.db2.gz	BACXTGBTJKXDGF-OAHLLOKOSA-N	1	0	292.427	1.820	50	0		CDAARO
COc1cccc(CN2C[C@H](CO)[C@H](C[NH+](C)C)C2)c1	ZINC000091494658	180170974	/nfs/dbraw/zinc/17/09/74/180170974.db2.gz	MCJQYEOJFVRFET-HUUCEWRRSA-N	1	0	278.396	1.297	50	0		CDAARO
C[C@@H]1C[N@H+](CCC(=O)N2CCC(C)CC2)C[C@@]1(O)C1CC1	ZINC000091625311	180209613	/nfs/dbraw/zinc/20/96/13/180209613.db2.gz	LRPKXQBGCCXZEC-PBHICJAKSA-N	1	0	294.439	1.728	50	0		CDAARO
CCn1cc(-c2cn(CC[NH+](CC)CC)nn2)cn1	ZINC000091694460	180228649	/nfs/dbraw/zinc/22/86/49/180228649.db2.gz	PBHFPFMZCFCDLB-UHFFFAOYSA-N	1	0	262.361	1.503	50	0		CDAARO
CCCn1cc(CN2CC3(CC[NH2+]CC3)CCC2=O)cn1	ZINC000091931689	180288449	/nfs/dbraw/zinc/28/84/49/180288449.db2.gz	PSFCKHOQJKIVDU-UHFFFAOYSA-N	1	0	290.411	1.785	50	0		CDAARO
COC[C@H](C)NC(=O)C[N@H+](C)[C@H](C)c1ccccc1	ZINC000106620317	186129294	/nfs/dbraw/zinc/12/92/94/186129294.db2.gz	JAVKHYNAMKBZMA-QWHCGFSZSA-N	1	0	264.369	1.831	50	0		CDAARO
Cc1nn(C)c2ncc(C[NH2+][C@@H]3CCCC[C@H]3O)cc12	ZINC000107912619	186197304	/nfs/dbraw/zinc/19/73/04/186197304.db2.gz	IWDSUVXBPOJQLW-ZIAGYGMSSA-N	1	0	274.368	1.670	50	0		CDAARO
C[C@H](CCc1cccc(F)c1)[N@@H+]1C[C@@H](C)O[C@@H](C(N)=O)C1	ZINC000108467119	186219175	/nfs/dbraw/zinc/21/91/75/186219175.db2.gz	HXTRVNDAGZZWNV-LALPHHSUSA-N	1	0	294.370	1.721	50	0		CDAARO
COc1ccc(S(=O)(=O)N2CCC[C@H]([C@H](C)[NH3+])C2)cc1	ZINC000111713146	186449945	/nfs/dbraw/zinc/44/99/45/186449945.db2.gz	DQMSATPTOWMMNV-RYUDHWBXSA-N	1	0	298.408	1.443	50	0		CDAARO
Cc1ccc(C(=O)NCCC[NH+]2C[C@H](C)O[C@@H](C)C2)cn1	ZINC000036831046	363267091	/nfs/dbraw/zinc/26/70/91/363267091.db2.gz	IFTKYBHOAJHXFM-KBPBESRZSA-N	1	0	291.395	1.619	50	0		CDAARO
COc1ccc(OC[C@@H](O)C[NH2+]C(C)(C)C)cc1	ZINC000000073750	355884440	/nfs/dbraw/zinc/88/44/40/355884440.db2.gz	FYEVFMXDPUKBJG-NSHDSACASA-N	1	0	253.342	1.823	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C\C(=O)N1CC[C@H](C[NH3+])C1	ZINC000255068275	355984923	/nfs/dbraw/zinc/98/49/23/355984923.db2.gz	MNITYQZAKWKYOX-UMBAGQNISA-N	1	0	282.775	1.202	50	0		CDAARO
COc1cccc(C[NH2+]CCSc2nnnn2C)c1	ZINC000002181774	355962606	/nfs/dbraw/zinc/96/26/06/355962606.db2.gz	SMTXHKNNIPKXJY-UHFFFAOYSA-N	1	0	279.369	1.101	50	0		CDAARO
O=C(C[NH+]1CCCCC1)NC[C@H]1COc2ccccc2O1	ZINC000002292306	355966253	/nfs/dbraw/zinc/96/62/53/355966253.db2.gz	YNTXUFONQWCEHR-ZDUSSCGKSA-N	1	0	290.363	1.429	50	0		CDAARO
Cc1cc(N2CCC([NH2+]CC3(C)COC3)CC2)nc(C)n1	ZINC000286319633	356253108	/nfs/dbraw/zinc/25/31/08/356253108.db2.gz	DIKFIZUMVYBWCZ-UHFFFAOYSA-N	1	0	290.411	1.688	50	0		CDAARO
COc1ccc(/C=C2\SC(=O)N(CC[NH3+])C2=O)cc1	ZINC000012563010	356308371	/nfs/dbraw/zinc/30/83/71/356308371.db2.gz	YNCIJVJXJBRZMA-FLIBITNWSA-N	1	0	278.333	1.690	50	0		CDAARO
COc1cccc(C[NH2+]CCCN2CCCC2=O)c1	ZINC000013727718	356354653	/nfs/dbraw/zinc/35/46/53/356354653.db2.gz	ITRWIJNVNNMXOC-UHFFFAOYSA-N	1	0	262.353	1.797	50	0		CDAARO
Cn1cc(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)cn1	ZINC000014166121	356377552	/nfs/dbraw/zinc/37/75/52/356377552.db2.gz	OXPYKBQLDOQDBV-CYBMUJFWSA-N	1	0	288.351	1.580	50	0		CDAARO
COc1ccc(OCC[N@H+](C)[C@H](C)C(=O)NC(C)C)cc1	ZINC000014184284	356378153	/nfs/dbraw/zinc/37/81/53/356378153.db2.gz	NFMGGCPCNBKPFO-CYBMUJFWSA-N	1	0	294.395	1.919	50	0		CDAARO
Cc1cc(C)n(CC(=O)NCC[NH+]2C[C@@H](C)C[C@H](C)C2)n1	ZINC000019573477	356492303	/nfs/dbraw/zinc/49/23/03/356492303.db2.gz	JYOLWFUPXOQWIG-STQMWFEESA-N	1	0	292.427	1.594	50	0		CDAARO
[NH3+]CCCN1CCN(Cc2c(F)cccc2Cl)CC1	ZINC000019688191	356496074	/nfs/dbraw/zinc/49/60/74/356496074.db2.gz	CEOASWXTZYXWTP-UHFFFAOYSA-N	1	0	285.794	1.946	50	0		CDAARO
Cc1ccc(OCC(=O)N2CC[NH+](C(C)C)CC2)cc1	ZINC000019842002	356509544	/nfs/dbraw/zinc/50/95/44/356509544.db2.gz	YRAHDUMXQJYYKV-UHFFFAOYSA-N	1	0	276.380	1.926	50	0		CDAARO
COc1cccc2c(=O)c(CN3CCOCC3)c(C)[nH]c12	ZINC000019867662	356511169	/nfs/dbraw/zinc/51/11/69/356511169.db2.gz	JQZXCSURQHLZJN-UHFFFAOYSA-N	1	0	288.347	1.677	50	0		CDAARO
CCOc1cccc(C[NH2+]CCCN2CCOCC2)c1	ZINC000020018627	356521377	/nfs/dbraw/zinc/52/13/77/356521377.db2.gz	HTGRSXHZUZLKEG-UHFFFAOYSA-N	1	0	278.396	1.897	50	0		CDAARO
c1ccc(C[NH+]2CCN(C[C@@H]3CCCC[NH2+]3)CC2)cc1	ZINC000020072370	356524067	/nfs/dbraw/zinc/52/40/67/356524067.db2.gz	UHYRMPACUMZTCQ-KRWDZBQOSA-N	1	0	273.424	1.946	50	0		CDAARO
COCCC(=O)NCC1(C(F)(F)F)CC[NH2+]CC1	ZINC000725264743	538455760	/nfs/dbraw/zinc/45/57/60/538455760.db2.gz	SMMRURJVIMNFKN-UHFFFAOYSA-N	1	0	268.279	1.071	50	0		CDAARO
NC(=O)[C@@H]1C[N@@H+]([C@H]2CCCCc3ccccc32)CCO1	ZINC000078972620	538520993	/nfs/dbraw/zinc/52/09/93/538520993.db2.gz	WTVCQOLEZGUJIU-GJZGRUSLSA-N	1	0	274.364	1.640	50	0		CDAARO
C[NH+]1CCN(c2cc(-c3cccs3)nc(N)n2)CC1	ZINC000028367282	356720484	/nfs/dbraw/zinc/72/04/84/356720484.db2.gz	PZNKSQALNTWGIM-UHFFFAOYSA-N	1	0	275.381	1.539	50	0		CDAARO
[NH3+][C@@H]1CCCC[C@H]1NC(=O)c1cccnc1Cl	ZINC000079440099	356996225	/nfs/dbraw/zinc/99/62/25/356996225.db2.gz	FQRIPXUPVIYTSF-NXEZZACHSA-N	1	0	253.733	1.735	50	0		CDAARO
COCCN1CCC[C@@H]([NH2+]C2Cc3ccccc3C2)C1	ZINC000095422079	357342067	/nfs/dbraw/zinc/34/20/67/357342067.db2.gz	LGXAVSAEYBGXIJ-MRXNPFEDSA-N	1	0	274.408	1.854	50	0		CDAARO
CCNC(=O)C(C)(C)CNC(=O)[C@H](C)[NH+]1[C@@H](C)CC[C@@H]1C	ZINC000095431071	357446560	/nfs/dbraw/zinc/44/65/60/357446560.db2.gz	ZILVRDFXAZGRLD-AVGNSLFASA-N	1	0	297.443	1.526	50	0		CDAARO
COC[C@@H]1CN(C(=O)NC2CCCC2)CC12CC[NH2+]CC2	ZINC000257179248	357447568	/nfs/dbraw/zinc/44/75/68/357447568.db2.gz	IFZUATSBEYNZMY-ZDUSSCGKSA-N	1	0	295.427	1.587	50	0		CDAARO
C[C@H](Oc1cccc(F)c1F)C(=O)N1CC[NH2+]CC1	ZINC000062615135	357478089	/nfs/dbraw/zinc/47/80/89/357478089.db2.gz	ISPDEVFDXFELFF-VIFPVBQESA-N	1	0	270.279	1.164	50	0		CDAARO
CCN1CCC[C@@H]([NH2+]Cc2ccccc2-n2cncn2)C1	ZINC000065393922	357536058	/nfs/dbraw/zinc/53/60/58/357536058.db2.gz	YLRUECLBCKQFFL-OAHLLOKOSA-N	1	0	285.395	1.841	50	0		CDAARO
Cc1ccc([C@@H](C)NC(=O)C[NH2+]CC(C)(C)CO)cc1	ZINC000065461167	357543618	/nfs/dbraw/zinc/54/36/18/357543618.db2.gz	YTYWLXYGPHVOKU-CYBMUJFWSA-N	1	0	278.396	1.780	50	0		CDAARO
CCOc1ccc2[nH]c(=O)c(C[N@@H+]3CC[C@H](O)C3)cc2c1	ZINC000067773452	357626275	/nfs/dbraw/zinc/62/62/75/357626275.db2.gz	QJYSBKSNGHGQQD-ZDUSSCGKSA-N	1	0	288.347	1.493	50	0		CDAARO
C[NH+]1CCC(Cc2noc([C@@](C)(O)C(F)(F)F)n2)CC1	ZINC000067840370	357630864	/nfs/dbraw/zinc/63/08/64/357630864.db2.gz	PUFYWBURHUBIKO-LLVKDONJSA-N	1	0	293.289	1.724	50	0		CDAARO
Cc1cc(C)cc(-n2cc(C(=O)N3CCC([NH3+])CC3)nn2)c1	ZINC000071768201	357780531	/nfs/dbraw/zinc/78/05/31/357780531.db2.gz	DXFLEQLIQQLYRA-UHFFFAOYSA-N	1	0	299.378	1.447	50	0		CDAARO
CCCN(CCC)C(=O)C[NH2+][C@H]1CCC[C@@]1(C)CO	ZINC000097105299	357968424	/nfs/dbraw/zinc/96/84/24/357968424.db2.gz	GHTNERPXLJXPEW-ZFWWWQNUSA-N	1	0	270.417	1.776	50	0		CDAARO
Cc1cccc(N2CCC[C@@H]2C[N@@H+]2CCC[C@@H]2CO)n1	ZINC000097163349	358004290	/nfs/dbraw/zinc/00/42/90/358004290.db2.gz	ZCNNQUNJOGHLHP-HUUCEWRRSA-N	1	0	275.396	1.816	50	0		CDAARO
C[C@H]1COCC[C@H]1Nc1cc(C(N)=O)ccc1C[NH+](C)C	ZINC000195104731	358410844	/nfs/dbraw/zinc/41/08/44/358410844.db2.gz	BGRXQOKUDNGFGR-SMDDNHRTSA-N	1	0	291.395	1.684	50	0		CDAARO
O=C(CCc1ccc(F)cc1)NC[C@H]1CC[NH2+]C1	ZINC000195559564	358564700	/nfs/dbraw/zinc/56/47/00/358564700.db2.gz	HFVJAQJJRGQQEV-LBPRGKRZSA-N	1	0	250.317	1.484	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)N(C)CCc2cnn(C)c2)CC1	ZINC000095379631	358689407	/nfs/dbraw/zinc/68/94/07/358689407.db2.gz	RNGBZVLXZSHUFK-UHFFFAOYSA-N	1	0	292.427	1.541	50	0		CDAARO
C(Cc1nc([C@H]2CCOC2)no1)C[NH+]1CCCC1	ZINC000096138064	358709257	/nfs/dbraw/zinc/70/92/57/358709257.db2.gz	GAJSZKZAFXJKGX-NSHDSACASA-N	1	0	251.330	1.602	50	0		CDAARO
Cc1n[nH]c(C)c1-c1ccc(CN2CC[NH+](C)CC2)cn1	ZINC000097514471	358781552	/nfs/dbraw/zinc/78/15/52/358781552.db2.gz	XDJQZNNZTRTNDZ-UHFFFAOYSA-N	1	0	285.395	1.836	50	0		CDAARO
Cc1ncc(C[N@@H+]2CC[C@@](O)(c3ccccc3)C2)n1C	ZINC000097527320	358782640	/nfs/dbraw/zinc/78/26/40/358782640.db2.gz	NAUVFAMBLDGFAW-INIZCTEOSA-N	1	0	271.364	1.822	50	0		CDAARO
CC(C)c1nc(CN(C)C[C@H]2COCCO2)co1	ZINC000097823071	358801692	/nfs/dbraw/zinc/80/16/92/358801692.db2.gz	YCIZRJCTRAGUIS-LBPRGKRZSA-N	1	0	254.330	1.645	50	0		CDAARO
O=c1cc(NCCN2CC[NH2+]CC2)c2ccccc2o1	ZINC000100481155	358831198	/nfs/dbraw/zinc/83/11/98/358831198.db2.gz	ZXZQGBBLPYVQNI-UHFFFAOYSA-N	1	0	273.336	1.110	50	0		CDAARO
O=C(C=Cc1ccc2c(c1)OCO2)NCCc1c[nH]cn1	ZINC000013592178	366484001	/nfs/dbraw/zinc/48/40/01/366484001.db2.gz	QQXGKBHQEIGKLI-DUXPYHPUSA-N	1	0	285.303	1.511	50	0		CDAARO
CCc1nccc(C[N@@H+]2CC[C@]3(C2)CCCN(C)C3=O)n1	ZINC000215122158	358875375	/nfs/dbraw/zinc/87/53/75/358875375.db2.gz	ISMPCNCAZUVLJG-INIZCTEOSA-N	1	0	288.395	1.483	50	0		CDAARO
C[C@@H](C(=O)NC(=O)NC(C)(C)C)[NH+]1CCCCCC1	ZINC000008119233	359097211	/nfs/dbraw/zinc/09/72/11/359097211.db2.gz	HBGKMQYCARYEOY-NSHDSACASA-N	1	0	269.389	1.875	50	0		CDAARO
CN1CCOC[C@H]2CCN(C(=O)c3cccs3)C[C@H]21	ZINC000257178447	359146722	/nfs/dbraw/zinc/14/67/22/359146722.db2.gz	GIENREAULXNMLC-VXGBXAGGSA-N	1	0	280.393	1.541	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)c2ccc3ncccc3c2)C[C@H]1CO	ZINC000257196088	359620674	/nfs/dbraw/zinc/62/06/74/359620674.db2.gz	XNSUABRCQMVJRN-GOEBONIOSA-N	1	0	299.374	1.229	50	0		CDAARO
CCOc1cc(N2CC[C@@H]([NH+](C)C)[C@@H]2C)ncn1	ZINC000408523542	359930776	/nfs/dbraw/zinc/93/07/76/359930776.db2.gz	LBGDICQUHBGCRH-WDEREUQCSA-N	1	0	250.346	1.404	50	0		CDAARO
Cc1cc(C(F)(F)F)nc(CNC(=O)[C@@H](C)[NH+](C)C)n1	ZINC000426510929	360679026	/nfs/dbraw/zinc/67/90/26/360679026.db2.gz	ZOMNQPGIBRMQJI-MRVPVSSYSA-N	1	0	290.289	1.370	50	0		CDAARO
CCn1c(C)ccc(C(=O)NCc2cccnc2N)c1=O	ZINC000426534026	360681560	/nfs/dbraw/zinc/68/15/60/360681560.db2.gz	HPAABVWQMHKFKI-UHFFFAOYSA-N	1	0	286.335	1.084	50	0		CDAARO
C[C@H](CO)CSc1nnc(C[NH3+])n1-c1ccc(F)cc1	ZINC000426428373	360669074	/nfs/dbraw/zinc/66/90/74/360669074.db2.gz	ZETDFDMDVDCHGA-SECBINFHSA-N	1	0	296.371	1.586	50	0		CDAARO
[NH3+]CCOc1cccc(CC(=O)N2CCC(F)(F)CC2)c1	ZINC000426662228	360694653	/nfs/dbraw/zinc/69/46/53/360694653.db2.gz	NEBOULPRZWJZSZ-UHFFFAOYSA-N	1	0	298.333	1.824	50	0		CDAARO
Cc1cc(-c2ccc(C(=O)NCC[NH+](C)C)cc2)cnc1N	ZINC000426465123	360673152	/nfs/dbraw/zinc/67/31/52/360673152.db2.gz	HKNIETGCDRFKDZ-UHFFFAOYSA-N	1	0	298.390	1.761	50	0		CDAARO
O=C([C@H]1C[NH2+]CCO1)N1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000178404647	189113615	/nfs/dbraw/zinc/11/36/15/189113615.db2.gz	KHDDSKBTMNXGNQ-ZIAGYGMSSA-N	1	0	294.782	1.992	50	0		CDAARO
Cc1ccc(-c2ccc(CN3C[C@@H]([NH3+])[C@H](O)C3)o2)cc1	ZINC000426684348	360696301	/nfs/dbraw/zinc/69/63/01/360696301.db2.gz	BNADNLNYOQHJJT-HUUCEWRRSA-N	1	0	272.348	1.759	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2ncsc2C)n1C	ZINC000426698181	360697388	/nfs/dbraw/zinc/69/73/88/360697388.db2.gz	FVVCMWXOJBHDLO-UHFFFAOYSA-N	1	0	269.399	1.592	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)[C@@H]1CCCO1)c1cccs1	ZINC000036079479	360841877	/nfs/dbraw/zinc/84/18/77/360841877.db2.gz	QWPOANHMPNVXFA-QWRGUYRKSA-N	1	0	268.382	1.646	50	0		CDAARO
CN(C)C(=O)c1cc(C[NH3+])cc(NC(=O)c2ccccn2)c1	ZINC000299779930	200869158	/nfs/dbraw/zinc/86/91/58/200869158.db2.gz	QTTFJUXOKWEHSC-UHFFFAOYSA-N	1	0	298.346	1.494	50	0		CDAARO
CC(C)N(C)C[C@@H](C)[NH2+]Cc1ccc(CO)cc1	ZINC000311124095	361263520	/nfs/dbraw/zinc/26/35/20/361263520.db2.gz	YHTGAORVNGLFGW-CYBMUJFWSA-N	1	0	250.386	1.997	50	0		CDAARO
Cn1cc(C[NH2+][C@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000035009559	364614346	/nfs/dbraw/zinc/61/43/46/364614346.db2.gz	WEEJQZNWSNFNGV-INIZCTEOSA-N	1	0	270.380	1.784	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(C(=O)Nc2ccncc2F)C1	ZINC000187751535	364815232	/nfs/dbraw/zinc/81/52/32/364815232.db2.gz	YTORJNXFFYAYFX-JTQLQIEISA-N	1	0	266.320	1.636	50	0		CDAARO
C[C@@H]1[C@H](c2ccccc2)[N@H+](C)CC[C@@]12NC(=O)NC2=O	ZINC000006576969	364864707	/nfs/dbraw/zinc/86/47/07/364864707.db2.gz	FQTIIVLASVNVSP-IXPVHAAZSA-N	1	0	273.336	1.278	50	0		CDAARO
Cc1cc(C(=O)NCC2([NH+](C)C)CCCCC2)cc(=O)[nH]1	ZINC000215987483	189698869	/nfs/dbraw/zinc/69/88/69/189698869.db2.gz	HMYBNWNEUSJRDN-UHFFFAOYSA-N	1	0	291.395	1.678	50	0		CDAARO
Clc1ccccc1OCc1noc(C2C[NH2+]C2)n1	ZINC000169676227	365044928	/nfs/dbraw/zinc/04/49/28/365044928.db2.gz	JICJSONLFOADKW-UHFFFAOYSA-N	1	0	265.700	1.989	50	0		CDAARO
CC(=O)N1CC[C@H]([NH2+]Cc2cccc3c2OCO3)[C@@H](C)C1	ZINC000089937613	366973239	/nfs/dbraw/zinc/97/32/39/366973239.db2.gz	VHGBZKGSHZIIDT-FZMZJTMJSA-N	1	0	290.363	1.762	50	0		CDAARO
CC[C@H]1CN(C(C)=O)CC[C@H]1[NH2+]Cc1c[nH]nc1C	ZINC000089948804	366977217	/nfs/dbraw/zinc/97/72/17/366977217.db2.gz	CFWLSPBMPBTRQR-GXTWGEPZSA-N	1	0	264.373	1.455	50	0		CDAARO
CCOCCN1CC[N@@H+]([C@@H]2CCCOC2)C[C@H]1CC	ZINC000089949231	366981096	/nfs/dbraw/zinc/98/10/96/366981096.db2.gz	OPPOSKYGJCEKHR-HUUCEWRRSA-N	1	0	270.417	1.598	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CC[NH2+]C[C@H]2C)c(C)c1	ZINC000094345692	367482379	/nfs/dbraw/zinc/48/23/79/367482379.db2.gz	PMQJYNPUTRBAEG-OLZOCXBDSA-N	1	0	282.409	1.580	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@@H]1CC[NH2+]C[C@H]1C	ZINC000094345739	367520244	/nfs/dbraw/zinc/52/02/44/367520244.db2.gz	WSOQPGKUWNUNFQ-ZYHUDNBSSA-N	1	0	286.372	1.410	50	0		CDAARO
O=C1NCCCC[C@@H]1[N@@H+]1CCC[C@H](OCC2CC2)C1	ZINC000375321343	376204342	/nfs/dbraw/zinc/20/43/42/376204342.db2.gz	VCQHIASGRBGOKQ-KBPBESRZSA-N	1	0	266.385	1.546	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1CCN(C(=O)CCc1nc(Cl)n[nH]1)C2	ZINC000299783150	372759928	/nfs/dbraw/zinc/75/99/28/372759928.db2.gz	UVQZZRICJYGRET-VHSXEESVSA-N	1	0	297.790	1.086	50	0		CDAARO
c1coc(CCC[N@@H+]2CC[C@H]3[C@H](C2)OCc2cnnn23)c1	ZINC000299794969	372766198	/nfs/dbraw/zinc/76/61/98/372766198.db2.gz	LMJHCUQZFMOZRW-GJZGRUSLSA-N	1	0	288.351	1.650	50	0		CDAARO
Cc1ccc(O[C@@H](C)C(=O)N2CC[C@@H](C[NH3+])C2)cc1	ZINC000178556482	372975728	/nfs/dbraw/zinc/97/57/28/372975728.db2.gz	LPVSALNRXDSZAR-STQMWFEESA-N	1	0	262.353	1.570	50	0		CDAARO
CO[C@@H]1CCCC[C@@H]1NC(=O)NCC[N@H+](C)C(C)C	ZINC000107063660	373796775	/nfs/dbraw/zinc/79/67/75/373796775.db2.gz	UEBLWCGQUNQWFI-QWHCGFSZSA-N	1	0	271.405	1.583	50	0		CDAARO
O=C(CN1CCC[C@H]([NH+]2CCCC2)C1)NC1CCCC1	ZINC000095356557	374887852	/nfs/dbraw/zinc/88/78/52/374887852.db2.gz	PODRWIXPMAYIAF-HNNXBMFYSA-N	1	0	279.428	1.605	50	0		CDAARO
CCC1(CC)C[N@@H+]([C@H](C)C(=O)NC(=O)NC)CCS1	ZINC000390834051	374851192	/nfs/dbraw/zinc/85/11/92/374851192.db2.gz	QYAAOLZROJZXIP-SNVBAGLBSA-N	1	0	287.429	1.438	50	0		CDAARO
CC[C@@H](O)C[N@H+](C)C1CCN(c2ncccn2)CC1	ZINC000095415760	374917645	/nfs/dbraw/zinc/91/76/45/374917645.db2.gz	FSEGWHVQRDQYKU-CYBMUJFWSA-N	1	0	264.373	1.148	50	0		CDAARO
COC(=O)C[C@@H]1CSCC[N@@H+]1CCc1ccccn1	ZINC000095417554	374920419	/nfs/dbraw/zinc/92/04/19/374920419.db2.gz	ZJOIQDAIINEUJM-CYBMUJFWSA-N	1	0	280.393	1.605	50	0		CDAARO
C([NH2+]C(C1CC1)C1CC1)[C@H]([C@@H]1CCOC1)N1CCOCC1	ZINC000095420023	374921817	/nfs/dbraw/zinc/92/18/17/374921817.db2.gz	JTLKXOXAKRTJTO-HZPDHXFCSA-N	1	0	294.439	1.502	50	0		CDAARO
COC[C@H](C)[NH2+]C1CCN(CCc2ccncc2)CC1	ZINC000095421527	374923938	/nfs/dbraw/zinc/92/39/38/374923938.db2.gz	QZUJVECVFMAPCS-AWEZNQCLSA-N	1	0	277.412	1.713	50	0		CDAARO
CNC(=O)[C@@H]1C[C@@H]([NH2+]C2CCCCCC2)CN1C(C)C	ZINC000020600623	374979637	/nfs/dbraw/zinc/97/96/37/374979637.db2.gz	YSIOEVDFHLGRRU-CABCVRRESA-N	1	0	281.444	1.896	50	0		CDAARO
Cn1cc(C[NH2+]Cc2cccnc2-n2cccn2)cn1	ZINC000097197981	375153097	/nfs/dbraw/zinc/15/30/97/375153097.db2.gz	PXNRWWRKBPKNQW-UHFFFAOYSA-N	1	0	268.324	1.291	50	0		CDAARO
[NH3+][C@@H]1CCC[C@H]1C(=O)N1CCO[C@H](c2cccc(F)c2)C1	ZINC000299740215	375201240	/nfs/dbraw/zinc/20/12/40/375201240.db2.gz	XCAGIQKYGQNJNR-KFWWJZLASA-N	1	0	292.354	1.853	50	0		CDAARO
Cc1nc(/C=C\C(=O)N2CC[N@@H+](C)C[C@H]2C)cs1	ZINC000254734489	375393038	/nfs/dbraw/zinc/39/30/38/375393038.db2.gz	XDNVBXBGADLSAH-UMCURTJPSA-N	1	0	265.382	1.627	50	0		CDAARO
COc1ccccc1CC1([NH3+])CCS(=O)(=O)CC1	ZINC000255188020	189995863	/nfs/dbraw/zinc/99/58/63/189995863.db2.gz	IHGQWMPCYDCNDE-UHFFFAOYSA-N	1	0	269.366	1.144	50	0		CDAARO
CCn1cc(NC(=O)N[C@@H](C)C[NH+](CC)CC)cn1	ZINC000058014227	375635134	/nfs/dbraw/zinc/63/51/34/375635134.db2.gz	LXOFQKPBSSUPAQ-NSHDSACASA-N	1	0	267.377	1.755	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)/C=C\c2cccc3cccnc23)C1	ZINC000606441624	375823345	/nfs/dbraw/zinc/82/33/45/375823345.db2.gz	APNRATRZTYQONO-AFNCTOJWSA-N	1	0	267.332	1.808	50	0		CDAARO
COc1ccc(Cl)cc1/C=C/C(=O)N1CC[NH2+]CC1	ZINC000032049983	375870720	/nfs/dbraw/zinc/87/07/20/375870720.db2.gz	UKBJGOAMQRZJHH-GORDUTHDSA-N	1	0	280.755	1.794	50	0		CDAARO
C[C@H](NC(=O)N[C@H]1CCCC[C@H]1O)C(C)(C)C[NH+](C)C	ZINC000246141993	376410160	/nfs/dbraw/zinc/41/01/60/376410160.db2.gz	BZASLPIMKDGYFN-RWMBFGLXSA-N	1	0	285.432	1.565	50	0		CDAARO
[NH3+]CC(=O)N1CCC[C@@H](c2n[nH]cc2Cc2ccccc2)C1	ZINC000067742685	377235338	/nfs/dbraw/zinc/23/53/38/377235338.db2.gz	VHCYKCQCEJIZRI-CQSZACIVSA-N	1	0	298.390	1.665	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]C[C@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000245338903	378071999	/nfs/dbraw/zinc/07/19/99/378071999.db2.gz	PFCSRQKJBGGIGP-ORQFMDKSSA-N	1	0	290.407	1.389	50	0		CDAARO
CC(C)(C)[NH2+]C[C@@H](O)COc1cccc2c1CCC(=O)N2	ZINC000000000128	169502528	/nfs/dbraw/zinc/50/25/28/169502528.db2.gz	LWAFSWPYPHEXKX-LLVKDONJSA-N	1	0	292.379	1.699	50	0	fda	CDAARO
COCCN1c2ccccc2NC2(CC[NH2+]CC2)C1=O	ZINC000077377353	285064834	/nfs/dbraw/zinc/06/48/34/285064834.db2.gz	ZCTAVCDRQFJHAD-UHFFFAOYSA-N	1	0	275.352	1.214	50	0		CDAARO
COCC(=O)Nc1ccc(OCC[N@@H+]2CC[C@@H](C)C2)cc1	ZINC000096443931	533066727	/nfs/dbraw/zinc/06/67/27/533066727.db2.gz	DANBRGWHTNETSP-CYBMUJFWSA-N	1	0	292.379	1.992	50	0		CDAARO
C[C@@H]1C[C@@H]([NH3+])CCN1C(=O)/C=C\c1cncc(F)c1	ZINC000493494432	253476584	/nfs/dbraw/zinc/47/65/84/253476584.db2.gz	MVEWXZOLXAEWRH-GCNHQONWSA-N	1	0	263.316	1.572	50	0		CDAARO
Cc1ccc(C(=O)N[C@@H](CO)C[NH+]2CCCCC2)o1	ZINC000288672539	197141959	/nfs/dbraw/zinc/14/19/59/197141959.db2.gz	ZJKAWWZCHJKMLG-GFCCVEGCSA-N	1	0	266.341	1.165	50	0		CDAARO
C[N@H+](C1COC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000098181782	256890516	/nfs/dbraw/zinc/89/05/16/256890516.db2.gz	VVCIRCLHTKTYFU-UHFFFAOYSA-N	1	0	270.373	1.717	50	0		CDAARO
O=S(=O)(C1CC1)N1CCC([NH2+]C[C@H]2CC=CCC2)CC1	ZINC000095434101	184983538	/nfs/dbraw/zinc/98/35/38/184983538.db2.gz	ONYWWHQFQPCKAJ-ZDUSSCGKSA-N	1	0	298.452	1.889	50	0		CDAARO
CC[C@H]1C[N@H+](C[C@H]2CCCCO2)CCN1CCOC	ZINC000247134680	390247755	/nfs/dbraw/zinc/24/77/55/390247755.db2.gz	KPPNWDCVDXNCCP-LSDHHAIUSA-N	1	0	270.417	1.598	50	0		CDAARO
Cc1nnc(NC(=O)N2CCC[C@H](C[NH3+])C2)s1	ZINC000055108986	390488464	/nfs/dbraw/zinc/48/84/64/390488464.db2.gz	CLXKKHISIHKFLA-MRVPVSSYSA-N	1	0	255.347	1.049	50	0		CDAARO
CC(=O)N1CCC(N(C)CC[N@H+]2CCCC[C@@H]2C)CC1	ZINC000065371148	390549850	/nfs/dbraw/zinc/54/98/50/390549850.db2.gz	HWWWWDSHDWFZSG-AWEZNQCLSA-N	1	0	281.444	1.804	50	0		CDAARO
Cn1nc(-c2nc(-c3ccc(F)cc3)no2)c2c1CC[NH2+]C2	ZINC000070463094	390606620	/nfs/dbraw/zinc/60/66/20/390606620.db2.gz	XKOAOMUGOLJHKS-UHFFFAOYSA-N	1	0	299.309	1.922	50	0		CDAARO
CCCc1nnc(NC[C@@H]2CN(C)CCO2)s1	ZINC000152338508	391364759	/nfs/dbraw/zinc/36/47/59/391364759.db2.gz	LZPZBKBWBMCQTO-SECBINFHSA-N	1	0	256.375	1.233	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@@H]1CC[NH2+]C[C@@H]1C	ZINC000094345737	391543731	/nfs/dbraw/zinc/54/37/31/391543731.db2.gz	WSOQPGKUWNUNFQ-CMPLNLGQSA-N	1	0	286.372	1.410	50	0		CDAARO
COC(=O)c1cc(C[N@H+](CCO)C2CCC2)cnc1Cl	ZINC000521396489	391668585	/nfs/dbraw/zinc/66/85/85/391668585.db2.gz	GNIXDZZIUZQCGE-UHFFFAOYSA-N	1	0	298.770	1.868	50	0		CDAARO
c1cc2c(ncnc2N2CCC[C@]3(CC[NH2+]C3)C2)[nH]1	ZINC000333546641	285453357	/nfs/dbraw/zinc/45/33/57/285453357.db2.gz	OPUWGMHWVMNYEV-CQSZACIVSA-N	1	0	257.341	1.538	50	0		CDAARO
CC(C)(C)OC(=O)[C@](C)(O)C[NH2+][C@@H]1CCC[C@H]2C[C@H]21	ZINC000549376097	391934164	/nfs/dbraw/zinc/93/41/64/391934164.db2.gz	FVDLTYUJOZHBPQ-FUTJPDQTSA-N	1	0	269.385	1.857	50	0		CDAARO
C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NS(=O)(=O)CCCF	ZINC000110682476	392789220	/nfs/dbraw/zinc/78/92/20/392789220.db2.gz	OBEDVIDFJCQIIR-XQQFMLRXSA-N	1	0	294.436	1.632	50	0		CDAARO
C[N@@H+](CC(=O)NCCc1ccc(F)cc1)C[C@@H]1CCOC1	ZINC000494551438	393025085	/nfs/dbraw/zinc/02/50/85/393025085.db2.gz	ZBOTZNXEXJTCND-AWEZNQCLSA-N	1	0	294.370	1.453	50	0		CDAARO
C[C@H]1CCC[C@H](C)C1[NH2+]CCN1C(=O)NC(C)(C)C1=O	ZINC000095462561	393147825	/nfs/dbraw/zinc/14/78/25/393147825.db2.gz	HNDQKGZCBDRNMJ-QWRGUYRKSA-N	1	0	281.400	1.731	50	0		CDAARO
CC[C@@](C)(O)C[NH2+][C@H]1CCN(c2ccccc2)C(=O)C1	ZINC000193093691	393220342	/nfs/dbraw/zinc/22/03/42/393220342.db2.gz	BVQQAERQFDZAPU-XJKSGUPXSA-N	1	0	276.380	1.933	50	0		CDAARO
CCN1CC[NH+](C[C@H](C)CNc2ncccc2F)CC1	ZINC000195575069	393304706	/nfs/dbraw/zinc/30/47/06/393304706.db2.gz	UWDCFJHZBQYYHU-CYBMUJFWSA-N	1	0	280.391	1.906	50	0		CDAARO
C[C@H]1CCCN(c2cc(N3CCN(C)CC3)ncn2)C1	ZINC000089929841	135061095	/nfs/dbraw/zinc/06/10/95/135061095.db2.gz	WAHFVMYYARNGSH-ZDUSSCGKSA-N	1	0	275.400	1.465	50	0		CDAARO
[NH3+]C1(CC(=O)N2CCN(c3ccccc3O)CC2)CCC1	ZINC000094294334	135086066	/nfs/dbraw/zinc/08/60/66/135086066.db2.gz	WXMKIICYEHURKX-UHFFFAOYSA-N	1	0	289.379	1.312	50	0		CDAARO
C[NH+](C)CCCNC(=O)COc1ccccc1F	ZINC000003210204	169868248	/nfs/dbraw/zinc/86/82/48/169868248.db2.gz	QNORJHLBIGWBJX-UHFFFAOYSA-N	1	0	254.305	1.272	50	0		CDAARO
C[NH+](C)CCNC(=O)Cn1nc(C(F)F)cc1C1CC1	ZINC000004124608	169935807	/nfs/dbraw/zinc/93/58/07/169935807.db2.gz	ZBOGXKHLZDTILF-UHFFFAOYSA-N	1	0	286.326	1.376	50	0		CDAARO
CC(=O)Nc1nc2ccccc2n1CCC[NH+](C)C	ZINC000004549237	169982371	/nfs/dbraw/zinc/98/23/71/169982371.db2.gz	LEBIPWMXFWJHMF-UHFFFAOYSA-N	1	0	260.341	1.946	50	0		CDAARO
C[NH+](C)CCCn1cnc2c3cc(F)ccc3[nH]c2c1=O	ZINC000004812047	170021063	/nfs/dbraw/zinc/02/10/63/170021063.db2.gz	SUWWXFYNMKAQGU-UHFFFAOYSA-N	1	0	288.326	1.969	50	0		CDAARO
C[NH+](C)CCCNS(=O)(=O)c1ccc(Cl)c(N)c1	ZINC000020565533	171254190	/nfs/dbraw/zinc/25/41/90/171254190.db2.gz	JEOSPHCABCCECW-UHFFFAOYSA-N	1	0	291.804	1.152	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)CO[C@H]2CCC[C@@H]2C)CC1	ZINC000020707542	171269904	/nfs/dbraw/zinc/26/99/04/171269904.db2.gz	HOQJEEHSQKXMCX-KKUMJFAQSA-N	1	0	270.417	1.190	50	0		CDAARO
CC[NH+]1CCN(Cc2cc(=O)oc3ccc(O)cc23)CC1	ZINC000020755789	171271758	/nfs/dbraw/zinc/27/17/58/171271758.db2.gz	MPTXNOHMMFZQHO-UHFFFAOYSA-N	1	0	288.347	1.636	50	0	biogenic	CDAARO
COc1ccc(C[NH2+]Cc2cnc(N(C)C)nc2)cc1	ZINC000021021886	171290806	/nfs/dbraw/zinc/29/08/06/171290806.db2.gz	BCUJLLSZHGUWFA-UHFFFAOYSA-N	1	0	272.352	1.841	50	0		CDAARO
CC(C)[N@H+](CCC(=O)NC(N)=O)Cc1ccccc1	ZINC000022134707	171355176	/nfs/dbraw/zinc/35/51/76/171355176.db2.gz	OIHCGYVSMMNFER-UHFFFAOYSA-N	1	0	263.341	1.482	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1nc2ccccc2s1	ZINC000022473344	171388712	/nfs/dbraw/zinc/38/87/12/171388712.db2.gz	NAPKFRKJFGJAFA-UHFFFAOYSA-N	1	0	263.366	1.978	50	0		CDAARO
Cn1ccc(C[N@H+](C)CCOc2ccccc2)cc1=O	ZINC000032937650	171764550	/nfs/dbraw/zinc/76/45/50/171764550.db2.gz	BXUSESPEMRKPLM-UHFFFAOYSA-N	1	0	272.348	1.896	50	0		CDAARO
CCc1cccc(C)c1-n1nnnc1C(C)(C)[NH2+]C	ZINC000035511683	172243024	/nfs/dbraw/zinc/24/30/24/172243024.db2.gz	BRQUEZVDZUGPTK-UHFFFAOYSA-N	1	0	259.357	1.988	50	0		CDAARO
c1[nH]nc(-c2cccnc2)c1C[NH2+]C[C@@H]1CCOC1	ZINC000037738934	173659503	/nfs/dbraw/zinc/65/95/03/173659503.db2.gz	GNEAYIYXALPDLY-NSHDSACASA-N	1	0	258.325	1.598	50	0		CDAARO
CCCCOC(=O)c1ccc(NC(=O)C[NH3+])cc1	ZINC000040414655	174255772	/nfs/dbraw/zinc/25/57/72/174255772.db2.gz	JUZJSNKWIDBGNK-UHFFFAOYSA-N	1	0	250.298	1.541	50	0		CDAARO
COc1ccc(OCCN2CC[NH2+][C@H](C)C2)cc1	ZINC000040456361	174267605	/nfs/dbraw/zinc/26/76/05/174267605.db2.gz	OAEWWXORXMIVFZ-GFCCVEGCSA-N	1	0	250.342	1.368	50	0		CDAARO
Cc1ccc2cc(C[N@@H+]3CCC[C@@H](C(N)=O)C3)c(=O)[nH]c2c1	ZINC000067642262	175780170	/nfs/dbraw/zinc/78/01/70/175780170.db2.gz	UJDREUKDZRXXDX-CYBMUJFWSA-N	1	0	299.374	1.534	50	0		CDAARO
O=c1n(CC2CC2)nc([C@@H]2CCC[NH2+]C2)n1-c1ccccc1	ZINC000071747916	176259093	/nfs/dbraw/zinc/25/90/93/176259093.db2.gz	RRNTXSPVLYFUMR-CQSZACIVSA-N	1	0	298.390	1.911	50	0		CDAARO
CCc1ncc(C(=O)N[C@H]2CC[C@H]2[NH2+]C(C)C)cn1	ZINC000072129046	176321176	/nfs/dbraw/zinc/32/11/76/176321176.db2.gz	NNJOPOCVCDLZNK-NEPJUHHUSA-N	1	0	262.357	1.298	50	0		CDAARO
O=C(NC[C@H]1C[NH2+]CCOC1)Nc1ccccc1Cl	ZINC000072129078	176321240	/nfs/dbraw/zinc/32/12/40/176321240.db2.gz	JBHOFGGNNHXAFQ-SNVBAGLBSA-N	1	0	283.759	1.698	50	0		CDAARO
C[N@@H+](Cc1nc(-c2ccncc2)no1)C[C@@H]1CCOC1	ZINC000077537052	177278754	/nfs/dbraw/zinc/27/87/54/177278754.db2.gz	VLGUTRWIKWUCGO-NSHDSACASA-N	1	0	274.324	1.600	50	0		CDAARO
CC[NH+](CC)CCN1CCCC[C@H]1c1nc[nH]n1	ZINC000096500213	276098577	/nfs/dbraw/zinc/09/85/77/276098577.db2.gz	OABXLPWUWFYVGW-LBPRGKRZSA-N	1	0	251.378	1.674	50	0		CDAARO
C[N@@H+]1CC[C@@H]2CCN(C(=O)Nc3nccs3)[C@H]2C1	ZINC000272510268	277141776	/nfs/dbraw/zinc/14/17/76/277141776.db2.gz	YIIYOZHSONORBC-ZJUUUORDSA-N	1	0	266.370	1.701	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(C[C@H](C[NH3+])CO2)CC1	ZINC000091303568	277182631	/nfs/dbraw/zinc/18/26/31/277182631.db2.gz	RSXOKGBXILPBOM-LLVKDONJSA-N	1	0	270.373	1.751	50	0		CDAARO
COC[C@H](O)C[N@H+](C[C@H]1CCCO1)C1CCCC1	ZINC000127096489	277264249	/nfs/dbraw/zinc/26/42/49/277264249.db2.gz	ZUSQIOWQKLATDN-ZIAGYGMSSA-N	1	0	257.374	1.417	50	0		CDAARO
O=C([C@@H]1CCCC[NH2+]1)N1CCC[C@H](C(F)(F)F)C1	ZINC000037750001	280082161	/nfs/dbraw/zinc/08/21/61/280082161.db2.gz	GFZYGWFRPFUEFF-UWVGGRQHSA-N	1	0	264.291	1.929	50	0		CDAARO
Cc1nc2ccc(N3CC[NH+](C)CC3)cc2nc1C	ZINC000001407001	282062207	/nfs/dbraw/zinc/06/22/07/282062207.db2.gz	MWOMRYHUSQVCNX-UHFFFAOYSA-N	1	0	256.353	1.998	50	0		CDAARO
CN1C(=O)OC2(CC(C)(C)[NH2+]C(C)(C)C2)[C@@]1(C)O	ZINC000000036887	289855972	/nfs/dbraw/zinc/85/59/72/289855972.db2.gz	SVBLLSQZYQNSJW-GFCCVEGCSA-N	1	0	256.346	1.456	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)NCCCC[C@@H]1CCCO1	ZINC000534578284	328311024	/nfs/dbraw/zinc/31/10/24/328311024.db2.gz	XKDMQJPAXSGSRR-CQSZACIVSA-N	1	0	268.401	1.842	50	0		CDAARO
O=C(Cc1cccs1)N[C@H]1COC[C@@H]1[NH+]1CCCC1	ZINC000534592086	328318395	/nfs/dbraw/zinc/31/83/95/328318395.db2.gz	PNHXTMJEWQVYKD-STQMWFEESA-N	1	0	280.393	1.270	50	0		CDAARO
CCN(Cc1noc(C2CC2)n1)C(=O)NC[C@@H](C)[NH+](C)C	ZINC000534632497	328332063	/nfs/dbraw/zinc/33/20/63/328332063.db2.gz	LOXUZDKXPMITJR-SNVBAGLBSA-N	1	0	295.387	1.429	50	0		CDAARO
CC[N@H+](C)C1(CNC(=O)CCc2cnccn2)CCCC1	ZINC000534660299	328342539	/nfs/dbraw/zinc/34/25/39/328342539.db2.gz	GLPBWDMCHLFGQP-UHFFFAOYSA-N	1	0	290.411	1.790	50	0		CDAARO
NC(=O)c1ccc(NCC2CC[NH+](CC3CC3)CC2)nc1	ZINC000534647261	328342895	/nfs/dbraw/zinc/34/28/95/328342895.db2.gz	KYMROKCZINLAMC-UHFFFAOYSA-N	1	0	288.395	1.136	50	0		CDAARO
O=C(NCC[C@@H]1CCCC[NH2+]1)[C@H]1CC[C@H](O)CC1	ZINC000534656096	328339929	/nfs/dbraw/zinc/33/99/29/328339929.db2.gz	IVBWGYAYPYGKPP-AVGNSLFASA-N	1	0	254.374	1.186	50	0		CDAARO
CCOc1ccnc(NCC[C@@H]2CCC[N@H+](C)C2)n1	ZINC000534671621	328347844	/nfs/dbraw/zinc/34/78/44/328347844.db2.gz	FVCHIBZVAYTXFL-LBPRGKRZSA-N	1	0	264.373	1.441	50	0		CDAARO
Nc1ncc(C(=O)NC2(C[NH+]3CCCCC3)CC2)s1	ZINC000534663466	328351482	/nfs/dbraw/zinc/35/14/82/328351482.db2.gz	FPOPQINMWCVRTH-UHFFFAOYSA-N	1	0	280.397	1.304	50	0		CDAARO
c1cncc(C[N@@H+]2CCC[C@H](N3CCOCC3)C2)c1	ZINC000020909437	323206901	/nfs/dbraw/zinc/20/69/01/323206901.db2.gz	HINMPSFDKGMRDB-HNNXBMFYSA-N	1	0	261.369	1.378	50	0		CDAARO
[NH3+][C@H](C(=O)N1CCC[C@H](Cn2ccnn2)C1)c1ccccc1	ZINC000182696333	323296298	/nfs/dbraw/zinc/29/62/98/323296298.db2.gz	KDGHQCXWMSIECM-ZFWWWQNUSA-N	1	0	299.378	1.217	50	0		CDAARO
c1cn(CC[NH2+]C2CCN(Cc3ccccc3)CC2)nn1	ZINC000136319900	328448933	/nfs/dbraw/zinc/44/89/33/328448933.db2.gz	JPTNKWSMTIWFNT-UHFFFAOYSA-N	1	0	285.395	1.532	50	0		CDAARO
Cc1cccc(-n2ncnc2CC2CC[NH2+]CC2)n1	ZINC000670462309	483047953	/nfs/dbraw/zinc/04/79/53/483047953.db2.gz	YEZOOHKRMLPEOE-UHFFFAOYSA-N	1	0	257.341	1.513	50	0		CDAARO
O=C(NC1(C[NH+]2CCCC2)CCCCC1)[C@@H]1CCOC1	ZINC000670465057	483055338	/nfs/dbraw/zinc/05/53/38/483055338.db2.gz	SIZPMUAMHHOJGJ-CQSZACIVSA-N	1	0	280.412	1.938	50	0		CDAARO
C[C@@H](CCc1ccccc1)[NH2+]CCC1N=NC(=O)N1C	ZINC000670469491	483064500	/nfs/dbraw/zinc/06/45/00/483064500.db2.gz	FHYHBEFBXFTWKK-LBPRGKRZSA-N	1	0	274.368	1.674	50	0		CDAARO
COC(=O)c1ccoc1CN1CC[C@H]([NH+]2CCCC2)C1	ZINC000083897518	483219184	/nfs/dbraw/zinc/21/91/84/483219184.db2.gz	VZCXXNWGUJZKQQ-LBPRGKRZSA-N	1	0	278.352	1.736	50	0		CDAARO
C[C@@H](CNS(=O)(=O)CCCF)[N@@H+]1CCCC[C@H]1C	ZINC000096456110	534066086	/nfs/dbraw/zinc/06/60/86/534066086.db2.gz	XWISNMFQUKEOSU-NEPJUHHUSA-N	1	0	280.409	1.528	50	0		CDAARO
COCC1(C(=O)N(C)CC[NH+]2CCCC2)CCC1	ZINC000339929062	522832404	/nfs/dbraw/zinc/83/24/04/522832404.db2.gz	LSPGDIOXPLLWMP-UHFFFAOYSA-N	1	0	254.374	1.357	50	0		CDAARO
O=C(Cc1ccccc1F)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000096480906	534735166	/nfs/dbraw/zinc/73/51/66/534735166.db2.gz	KGFBMKYZQULICX-OLZOCXBDSA-N	1	0	262.328	1.721	50	0		CDAARO
COc1ccccc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C[NH3+]	ZINC000089108044	524703789	/nfs/dbraw/zinc/70/37/89/524703789.db2.gz	OOHOAQVFRBISSO-VXGBXAGGSA-N	1	0	298.408	1.491	50	0		CDAARO
O=C(NCCF)NC1CC[NH+]([C@H]2CCCC[C@H]2O)CC1	ZINC000390834687	526293465	/nfs/dbraw/zinc/29/34/65/526293465.db2.gz	PAFZGGOQTVGMNP-QWHCGFSZSA-N	1	0	287.379	1.023	50	0		CDAARO
[NH3+][C@@H](CC1CCCCC1)C(=O)N(CCO)Cc1ncc[nH]1	ZINC001772702223	1159438241	/nfs/dbraw/zinc/43/82/41/1159438241.db2.gz	AMANCWRIAVWIIZ-ZDUSSCGKSA-N	1	0	294.399	1.028	50	0		CDAARO
CNC(=O)C[C@H]1CCN(c2nc(N(C)C)[nH+]c(C)c2C)C1	ZINC001704337348	1177693404	/nfs/dbraw/zinc/69/34/04/1177693404.db2.gz	QXDDHLGNOYXQKB-GFCCVEGCSA-N	1	0	291.399	1.122	50	0		CDAARO
Cc1ncsc1C[N@H+]1C[C@@H](Cc2ccncc2)[C@H](O)C1	ZINC001704342498	1177695241	/nfs/dbraw/zinc/69/52/41/1177695241.db2.gz	DGNAMDJAQUUOFO-ZIAGYGMSSA-N	1	0	289.404	1.882	50	0		CDAARO
CNC(=O)c1cc2cc(OC)ccc2n1CC[NH+](C)C	ZINC000000103098	697859462	/nfs/dbraw/zinc/85/94/62/697859462.db2.gz	XZIUKDLQCFKQSU-UHFFFAOYSA-N	1	0	275.352	1.571	50	0		CDAARO
CCCCc1nc(CN2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)c[nH]1	ZINC000426442984	698020967	/nfs/dbraw/zinc/02/09/67/698020967.db2.gz	PXCPEGHIQJBNEX-NMWPEEMBSA-N	1	0	274.412	1.935	50	0		CDAARO
Cc1cn2c(C[NH2+][C@@H]3CCS(=O)(=O)C3)c(C)nc2s1	ZINC000036820454	698033023	/nfs/dbraw/zinc/03/30/23/698033023.db2.gz	VKQZLPCTZMSNNB-SNVBAGLBSA-N	1	0	299.421	1.289	50	0		CDAARO
COCCn1cncc1C[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1	ZINC000299794841	698828975	/nfs/dbraw/zinc/82/89/75/698828975.db2.gz	JAMMEUMSNGAXLZ-CYBMUJFWSA-N	1	0	289.383	1.632	50	0		CDAARO
[NH3+][C@H](c1ccns1)C1(O)CCC2(CC1)OCCO2	ZINC000958528168	704892106	/nfs/dbraw/zinc/89/21/06/704892106.db2.gz	KLIOAWFYTQOHJM-SNVBAGLBSA-N	1	0	270.354	1.191	50	0		CDAARO
Cc1ncn(C)c1C(=O)NC[C@@H]1CCC[N@@H+]2CCCC[C@H]12	ZINC000299801409	705194865	/nfs/dbraw/zinc/19/48/65/705194865.db2.gz	YIGQZCHRHQRHKF-UONOGXRCSA-N	1	0	290.411	1.723	50	0		CDAARO
OC[C@@H](O)CN(Cc1ccsc1)Cc1cccnc1	ZINC000055341195	705199871	/nfs/dbraw/zinc/19/98/71/705199871.db2.gz	QSBLPNDXJPTJLI-AWEZNQCLSA-N	1	0	278.377	1.499	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N1CCC[C@H]1C[NH3+]	ZINC000193296421	850371744	/nfs/dbraw/zinc/37/17/44/850371744.db2.gz	LVVOEOYVDFUULO-LBPRGKRZSA-N	1	0	268.382	1.361	50	0		CDAARO
O=S1(=O)CCC([NH2+]C2CSCCSC2)CC1	ZINC000828395655	921718065	/nfs/dbraw/zinc/71/80/65/921718065.db2.gz	UYAFSXUGXGLART-UHFFFAOYSA-N	1	0	281.468	1.002	50	0		CDAARO
Cc1n[nH]c(C)c1CC[NH2+][C@H](C)Cn1ccnc1C	ZINC000821495620	925586833	/nfs/dbraw/zinc/58/68/33/925586833.db2.gz	OTMSUZDXUBZLGS-SNVBAGLBSA-N	1	0	261.373	1.752	50	0		CDAARO
C[NH+](C)CCCN1CCN(C(=O)[C@@H]2CC2(C)C)CC1	ZINC000823693104	925721895	/nfs/dbraw/zinc/72/18/95/925721895.db2.gz	XPDKONMAXTZMBX-ZDUSSCGKSA-N	1	0	267.417	1.128	50	0		CDAARO
CN1CCC([NH2+]C[C@@H]2Cc3ccccc3CN2C)CC1	ZINC000823764772	925727870	/nfs/dbraw/zinc/72/78/70/925727870.db2.gz	FIBDOQCWAGZSDB-KRWDZBQOSA-N	1	0	273.424	1.727	50	0		CDAARO
CNC(=O)CC[N@H+](C)Cc1ccc(OC(C)C)c(CO)c1	ZINC000823819855	925731513	/nfs/dbraw/zinc/73/15/13/925731513.db2.gz	MDSFRUMAQLVEPH-UHFFFAOYSA-N	1	0	294.395	1.534	50	0		CDAARO
COc1nc(NC[C@H](C(C)C)[NH+](C)C)ncc1F	ZINC000824845748	925840641	/nfs/dbraw/zinc/84/06/41/925840641.db2.gz	FENBFGPILVJVIY-SNVBAGLBSA-N	1	0	256.325	1.622	50	0		CDAARO
COc1ncc(C[N@H+](C)CCC[C@H]2CCCO2)cn1	ZINC000824851998	925841027	/nfs/dbraw/zinc/84/10/27/925841027.db2.gz	MWBQFISYQSMNLA-ZDUSSCGKSA-N	1	0	265.357	1.876	50	0		CDAARO
C[N@H+](CCOC(=O)C[C@H]1COC(=O)C1)Cc1ccccc1	ZINC000585087038	930895964	/nfs/dbraw/zinc/89/59/64/930895964.db2.gz	ADWUKQAMRLCUOZ-CQSZACIVSA-N	1	0	291.347	1.615	50	0		CDAARO
C[C@H](O)[C@H](O)CN(C)[C@@H](C)c1nc2cc(Cl)ccc2[nH]1	ZINC000585117048	930972462	/nfs/dbraw/zinc/97/24/62/930972462.db2.gz	PWBWDRJZJOMYTR-MWODSPESSA-N	1	0	297.786	1.951	50	0		CDAARO
C[C@@H](CC(=O)NC(C)(C)CCC[NH+](C)C)N1CCCC1=O	ZINC000585121496	930986970	/nfs/dbraw/zinc/98/69/70/930986970.db2.gz	QWGKVGFZORTHHM-ZDUSSCGKSA-N	1	0	297.443	1.624	50	0		CDAARO
FC(F)(F)c1ccnc(O[C@@H]2C[NH+]3CCC2CC3)n1	ZINC000585651058	932837320	/nfs/dbraw/zinc/83/73/20/932837320.db2.gz	JQDPPWQHTMZQKD-SECBINFHSA-N	1	0	273.258	1.968	50	0		CDAARO
C=CC(=O)N1CCO[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]21	ZINC000404184076	940956548	/nfs/dbraw/zinc/95/65/48/940956548.db2.gz	ACFWICWWQPPDNO-HZPDHXFCSA-N	1	0	286.375	1.674	50	0		CDAARO
CC[C@H](C(=O)Nc1cnn(CC)c1C)[N@H+](C)CC	ZINC001529092557	968979269	/nfs/dbraw/zinc/97/92/69/968979269.db2.gz	VBADJCCWKLFEMH-GFCCVEGCSA-N	1	0	252.362	1.880	50	0		CDAARO
CC[C@H]1CN(Cc2cc(=O)[nH]c(C)n2)CC[N@@H+]1C(C)C	ZINC001529098495	968981607	/nfs/dbraw/zinc/98/16/07/968981607.db2.gz	GVVPJLVLRIUPHV-AWEZNQCLSA-N	1	0	278.400	1.795	50	0		CDAARO
C[NH+](C)CCc1nnc(NC(=O)c2ccsc2)s1	ZINC001529114245	968982803	/nfs/dbraw/zinc/98/28/03/968982803.db2.gz	NQJNCCLGUBVUTI-UHFFFAOYSA-N	1	0	282.394	1.956	50	0		CDAARO
C=Cc1ccc(NCC[N@H+]2CCCC[C@@H]2CO)nc1	ZINC001529168204	969003364	/nfs/dbraw/zinc/00/33/64/969003364.db2.gz	ZENZAAAJKMYZOY-CQSZACIVSA-N	1	0	261.369	1.983	50	0		CDAARO
C[C@@H]1CN(C(=O)C[N@H+](C)CCC[C@@H]2CCCO2)C[C@H](C)O1	ZINC001529195904	969012054	/nfs/dbraw/zinc/01/20/54/969012054.db2.gz	PZSRGGHRNQSOQS-QLFBSQMISA-N	1	0	298.427	1.513	50	0		CDAARO
Cc1ccccc1CC1([NH2+][C@@H](C)CN(C)CCO)CC1	ZINC001506398722	975149325	/nfs/dbraw/zinc/14/93/25/975149325.db2.gz	SBLCHFAIWZWSRD-HNNXBMFYSA-N	1	0	276.424	1.972	50	0		CDAARO
c1ccn2c(c1)nnc2C[NH2+]C1CSCCSC1	ZINC001506402608	975150668	/nfs/dbraw/zinc/15/06/68/975150668.db2.gz	KCHFIOFZFABWOS-UHFFFAOYSA-N	1	0	280.422	1.668	50	0		CDAARO
C[C@H](CC(N)=O)[N@H+](C)Cc1cc(=O)c2cccc(F)c2[nH]1	ZINC001506417891	975157398	/nfs/dbraw/zinc/15/73/98/975157398.db2.gz	CFXPTGRZVKRJGZ-SECBINFHSA-N	1	0	291.326	1.775	50	0		CDAARO
CC1=C(C(=O)N2CCC[C@H]([NH+](C)C)CC2)OCCO1	ZINC001506431403	975162095	/nfs/dbraw/zinc/16/20/95/975162095.db2.gz	NMKMCFZHSKWEDE-LBPRGKRZSA-N	1	0	268.357	1.207	50	0		CDAARO
COCCC[N@@H+]1CCN(CC(F)(F)F)CC1(C)C	ZINC000096492543	230382986	/nfs/dbraw/zinc/38/29/86/230382986.db2.gz	ICRCOYIQZKCNJS-UHFFFAOYSA-N	1	0	268.323	1.981	50	0		CDAARO
COC[C@@H](C)[NH2+]CC(=O)N[C@H](C)CCc1ccccc1	ZINC000002632893	230367339	/nfs/dbraw/zinc/36/73/39/230367339.db2.gz	QBNZJZNDRPVDEX-ZIAGYGMSSA-N	1	0	278.396	1.748	50	0		CDAARO
OC1CC(c2cc(N3CCC[N@@H+]4CCC[C@H]4C3)ncn2)C1	ZINC000220567272	230397645	/nfs/dbraw/zinc/39/76/45/230397645.db2.gz	AQFSLJUBZQLKFZ-MOKVOYLWSA-N	1	0	288.395	1.389	50	0		CDAARO
Cc1nc(-c2cccc(C(=O)N3CC[NH2+]C[C@H]3C)c2)n[nH]1	ZINC000124476317	187139236	/nfs/dbraw/zinc/13/92/36/187139236.db2.gz	OZQRAHZOMWJPOQ-SNVBAGLBSA-N	1	0	285.351	1.214	50	0		CDAARO
CC[N@H+](C)CCNc1cc(-c2cccnc2)nc2ncnn21	ZINC000095956003	185042983	/nfs/dbraw/zinc/04/29/83/185042983.db2.gz	YRLLAIWEHPTSLC-UHFFFAOYSA-N	1	0	297.366	1.550	50	0		CDAARO
Cc1nnc(CN2CCC[N@@H+](C3CCCC3)CC2)o1	ZINC000172582132	365579501	/nfs/dbraw/zinc/57/95/01/365579501.db2.gz	IXRJWBUBILSZMK-UHFFFAOYSA-N	1	0	264.373	1.828	50	0		CDAARO
CCCC(=O)NC[C@H]1CCC[N@H+](CC[C@@H](C)O)C1	ZINC000241439877	361751598	/nfs/dbraw/zinc/75/15/98/361751598.db2.gz	NNBBLDHKMRJCGM-CHWSQXEVSA-N	1	0	256.390	1.386	50	0		CDAARO
Fc1ccccc1OC/C=C/CN1CC[NH2+]CC1	ZINC000023116686	342089149	/nfs/dbraw/zinc/08/91/49/342089149.db2.gz	HEAKOCWNOZAKAR-ONEGZZNKSA-N	1	0	250.317	1.666	50	0		CDAARO
Cc1cccc(-c2noc(CC3CC[NH2+]CC3)n2)n1	ZINC000093679549	539087893	/nfs/dbraw/zinc/08/78/93/539087893.db2.gz	UCTKYNSDRIJLSM-UHFFFAOYSA-N	1	0	258.325	1.982	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1cc(F)c(F)c(F)c1	ZINC000097229407	342204922	/nfs/dbraw/zinc/20/49/22/342204922.db2.gz	PEBQVZZEMUQQLY-ZETCQYMHSA-N	1	0	296.314	1.510	50	0		CDAARO
CC(C)(C)C(=O)NCC1CC[NH+]([C@H]2CCOC2)CC1	ZINC000585149162	342225503	/nfs/dbraw/zinc/22/55/03/342225503.db2.gz	KBOXXWGSHAZSNZ-ZDUSSCGKSA-N	1	0	268.401	1.650	50	0		CDAARO
CCc1cccc(S(=O)(=O)N2CC[C@H]([NH2+]C)C2)c1	ZINC000095972585	342243034	/nfs/dbraw/zinc/24/30/34/342243034.db2.gz	RHNGNXMUGDGSKX-LBPRGKRZSA-N	1	0	268.382	1.231	50	0		CDAARO
CSCCC[N@H+]1C[C@H](N2CCN(C(C)=O)CC2)[C@@H](C)C1	ZINC000084714519	342268073	/nfs/dbraw/zinc/26/80/73/342268073.db2.gz	MFLUMRARBCPHCN-ZFWWWQNUSA-N	1	0	299.484	1.224	50	0		CDAARO
Cc1nnc2n1C[C@@H]([NH2+][C@H](C)[C@@H]1C[C@H]1C1CC1)CC2	ZINC000585123195	362052542	/nfs/dbraw/zinc/05/25/42/362052542.db2.gz	MPALWFUWACZIAY-HYNSBDGHSA-N	1	0	260.385	1.926	50	0		CDAARO
COC(=O)CC[N@@H+]1CCN(Cc2ccc(C)o2)[C@H](C)C1	ZINC000252585590	342385889	/nfs/dbraw/zinc/38/58/89/342385889.db2.gz	JPENZDFWDCPJBT-GFCCVEGCSA-N	1	0	280.368	1.657	50	0		CDAARO
CC(=O)N[C@H]1CC[C@H]([NH+]2CCN(CC3CC3)CC2)CC1	ZINC000257353476	342441571	/nfs/dbraw/zinc/44/15/71/342441571.db2.gz	RKDOUGDECLHTQZ-WKILWMFISA-N	1	0	279.428	1.461	50	0		CDAARO
CN1CC[C@@](O)(c2ccco2)[C@H](C(=O)c2ccco2)C1	ZINC000036550949	362188663	/nfs/dbraw/zinc/18/86/63/362188663.db2.gz	BHZYVHNGYDZQIJ-NHYWBVRUSA-N	1	0	275.304	1.895	50	0		CDAARO
c1cc(C[NH2+][C@H]2CCSC2)cc(-c2nn[nH]n2)c1	ZINC000095220660	343658817	/nfs/dbraw/zinc/65/88/17/343658817.db2.gz	YLLHVGFGTBOLPF-NSHDSACASA-N	1	0	261.354	1.462	50	0		CDAARO
Cc1ncc(CN2CCC([N@H+](C)CCCO)CC2)s1	ZINC000084290606	362262719	/nfs/dbraw/zinc/26/27/19/362262719.db2.gz	PDIZVFMIMVVXSA-UHFFFAOYSA-N	1	0	283.441	1.730	50	0		CDAARO
O=S(=O)(C1CC1)N1CCC([NH2+]Cc2ccco2)CC1	ZINC000084961879	362279417	/nfs/dbraw/zinc/27/94/17/362279417.db2.gz	BVVRDYOPTVOXND-UHFFFAOYSA-N	1	0	284.381	1.326	50	0		CDAARO
Cn1ccnc1C(=O)NC[C@@H]1CC[N@@H+](C2CCCCC2)C1	ZINC000252478847	362383815	/nfs/dbraw/zinc/38/38/15/362383815.db2.gz	AVXZPFUVPREEMK-ZDUSSCGKSA-N	1	0	290.411	1.805	50	0		CDAARO
CCOC(=O)[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1O	ZINC000252486750	362387434	/nfs/dbraw/zinc/38/74/34/362387434.db2.gz	MUPAPEDKCKNYLY-ZIAGYGMSSA-N	1	0	263.337	1.433	50	0		CDAARO
[NH3+]CC(=O)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000120545454	362460710	/nfs/dbraw/zinc/46/07/10/362460710.db2.gz	YXJVKSCXAMXBOQ-VIFPVBQESA-N	1	0	289.162	1.932	50	0		CDAARO
C[C@@H]([NH2+]CCn1cnc2c1ncnc2N)c1ccccc1	ZINC000000158697	346183634	/nfs/dbraw/zinc/18/36/34/346183634.db2.gz	KTAJYCBUOYKCRF-LLVKDONJSA-N	1	0	282.351	1.759	50	0		CDAARO
O=C(CC1CCCCC1)N1CC[NH+](C[C@@H](O)C2CC2)CC1	ZINC000085436590	179063211	/nfs/dbraw/zinc/06/32/11/179063211.db2.gz	BVKJTECRSYUJHZ-MRXNPFEDSA-N	1	0	294.439	1.872	50	0		CDAARO
CCCC(=O)N1CCC(C[N@@H+]2CCN(C)C[C@@H]2C)CC1	ZINC000085468053	179073562	/nfs/dbraw/zinc/07/35/62/179073562.db2.gz	ISKUVCPRIBJFFV-AWEZNQCLSA-N	1	0	281.444	1.661	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)c2ccco2)CC1	ZINC000085467996	179073606	/nfs/dbraw/zinc/07/36/06/179073606.db2.gz	NQQLIMJKIHPHAI-UHFFFAOYSA-N	1	0	252.314	1.120	50	0		CDAARO
CCCC(CCC)C(=O)N1C[C@H](O)[C@@H]([NH+](C)C)C1	ZINC000584670683	346391473	/nfs/dbraw/zinc/39/14/73/346391473.db2.gz	LOJYKYIYJYMSPW-STQMWFEESA-N	1	0	256.390	1.336	50	0		CDAARO
O=C(c1ccoc1)N1CCC[N@H+](C[C@@H]2CCOC2)CC1	ZINC000055059782	347835980	/nfs/dbraw/zinc/83/59/80/347835980.db2.gz	KHTYXHMIEWDCCQ-ZDUSSCGKSA-N	1	0	278.352	1.464	50	0		CDAARO
O=[N+]([O-])C1=C/C(=C2/C=C([N+](=O)[O-])C=C[N+]2=O)N(O)C=C1	ZINC000032679272	348745953	/nfs/dbraw/zinc/74/59/53/348745953.db2.gz	WXNZXNOYJCKSDV-MDZDMXLPSA-N	1	0	279.188	1.044	50	0		CDAARO
O=S1(=O)CC[C@H]([NH2+]C2CCN(Cc3ccco3)CC2)C1	ZINC000584896268	349357311	/nfs/dbraw/zinc/35/73/11/349357311.db2.gz	XUPOWCYOBFXBJO-ZDUSSCGKSA-N	1	0	298.408	1.021	50	0		CDAARO
CCNC(=O)[C@H]1CC[N@@H+](C2CSCCSC2)C1	ZINC000584884127	349341525	/nfs/dbraw/zinc/34/15/25/349341525.db2.gz	DFFDNZIQGNPXFR-JTQLQIEISA-N	1	0	274.455	1.293	50	0		CDAARO
CN(CC[NH+]1CCCC1)C(=O)[C@H]1CCOC(C)(C)C1	ZINC000584889722	349348768	/nfs/dbraw/zinc/34/87/68/349348768.db2.gz	KEVRIKYKHQPOCH-ZDUSSCGKSA-N	1	0	268.401	1.746	50	0		CDAARO
Nc1nc(C[NH2+]C2CSCCSC2)cs1	ZINC000584893260	349352828	/nfs/dbraw/zinc/35/28/28/349352828.db2.gz	YEEQKZXLSMBZIF-UHFFFAOYSA-N	1	0	261.441	1.494	50	0		CDAARO
NC(=O)C1(C(=O)NC2(C[NH+]3CCCC3)CCCCC2)CC1	ZINC000584894134	349354285	/nfs/dbraw/zinc/35/42/85/349354285.db2.gz	OZJHSLNTNWMLNP-UHFFFAOYSA-N	1	0	293.411	1.167	50	0		CDAARO
CC[C@H](C(=O)N(C)CC1(CO)CCCC1)[NH+]1CCCC1	ZINC000584897503	349359359	/nfs/dbraw/zinc/35/93/59/349359359.db2.gz	AQIRMBUVDKXLNG-CQSZACIVSA-N	1	0	282.428	1.872	50	0		CDAARO
Cc1cc(C)c(C[NH2+][C@H](C)CN2CCOCC2)cn1	ZINC000584899383	349361171	/nfs/dbraw/zinc/36/11/71/349361171.db2.gz	XAQBJVAUHHGQRZ-CQSZACIVSA-N	1	0	263.385	1.509	50	0		CDAARO
COc1nc(NCC2([NH+](C)C)CCCC2)ncc1F	ZINC000584901058	349363023	/nfs/dbraw/zinc/36/30/23/349363023.db2.gz	QILHDGHZWQECQE-UHFFFAOYSA-N	1	0	268.336	1.911	50	0		CDAARO
Cc1ccc2[nH]c(CN3CC[C@@H]([NH+](C)C)C3)cc(=O)c2c1	ZINC000091441092	180156995	/nfs/dbraw/zinc/15/69/95/180156995.db2.gz	KYCBGTXRPFDFOC-CQSZACIVSA-N	1	0	285.391	1.972	50	0		CDAARO
C[NH2+]CC1CCN(C(=O)c2ccncc2Cl)CC1	ZINC000091456887	180160456	/nfs/dbraw/zinc/16/04/56/180160456.db2.gz	ATAAGASJEINXKN-UHFFFAOYSA-N	1	0	267.760	1.807	50	0		CDAARO
CCCc1cc(C(=O)N2C[C@H]([NH3+])[C@@H](CCC)C2)no1	ZINC000091595784	180201997	/nfs/dbraw/zinc/20/19/97/180201997.db2.gz	FRGPWBLZMWJGLX-JQWIXIFHSA-N	1	0	265.357	1.827	50	0		CDAARO
CC(C)[C@H]1CN(C(=O)c2cnc3c(c2)CCC3)C[C@@H]1[NH3+]	ZINC000091651095	180217436	/nfs/dbraw/zinc/21/74/36/180217436.db2.gz	FOQFNKFXMMXGLQ-KGLIPLIRSA-N	1	0	273.380	1.626	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2ccn(C(F)F)n2)C[C@@H]1[NH3+]	ZINC000091695504	180229428	/nfs/dbraw/zinc/22/94/28/180229428.db2.gz	DMNGGPUMDNHATM-IUCAKERBSA-N	1	0	272.299	1.478	50	0		CDAARO
c1c[nH]c(CN2C[C@H]3CC[C@@H]2C[N@@H+](C2CCOCC2)C3)n1	ZINC000091724473	180241889	/nfs/dbraw/zinc/24/18/89/180241889.db2.gz	CZJUPMNBPMAFNJ-DZGCQCFKSA-N	1	0	290.411	1.485	50	0		CDAARO
Oc1cccc(CN2CC[NH+]([C@H]3CCOC3)CC2)c1	ZINC000271359526	191094936	/nfs/dbraw/zinc/09/49/36/191094936.db2.gz	NAGHNBKKEKZMRT-AWEZNQCLSA-N	1	0	262.353	1.299	50	0		CDAARO
C[C@@H](c1ncnn1CCO)[N@H+](C)C1CCCCC1	ZINC000091965386	180293695	/nfs/dbraw/zinc/29/36/95/180293695.db2.gz	QSPLLURONKITMM-NSHDSACASA-N	1	0	252.362	1.596	50	0		CDAARO
CCc1[nH+]c(N)nc(NCc2c(C)n[nH]c2C)c1C	ZINC000091907374	180284391	/nfs/dbraw/zinc/28/43/91/180284391.db2.gz	SMCMPZHTBXGUFT-UHFFFAOYSA-N	1	0	260.345	1.882	50	0		CDAARO
c1[nH]nc2cc(C[NH2+]C[C@H]3CN(C4CC4)CCO3)ccc12	ZINC000106379842	186111712	/nfs/dbraw/zinc/11/17/12/186111712.db2.gz	XSVIAWKCYUPIMG-HNNXBMFYSA-N	1	0	286.379	1.516	50	0		CDAARO
Cn1cc([C@@H]2OCC[C@H]2C[NH2+]Cc2ccccn2)cn1	ZINC000095402034	351397327	/nfs/dbraw/zinc/39/73/27/351397327.db2.gz	BCNWMBAGSMZTMO-SWLSCSKDSA-N	1	0	272.352	1.683	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCCN1C(=O)c1cccc(-n2cncn2)c1	ZINC000122217721	187021513	/nfs/dbraw/zinc/02/15/13/187021513.db2.gz	XZKPBWZSBCLWKJ-SWLSCSKDSA-N	1	0	299.378	1.609	50	0		CDAARO
Cn1nccc1C[NH2+][C@@H]1CCC[C@@H]1NC(=O)OC(C)(C)C	ZINC000122896287	187058467	/nfs/dbraw/zinc/05/84/67/187058467.db2.gz	WGQOAFFFPSMXRI-OLZOCXBDSA-N	1	0	294.399	1.956	50	0		CDAARO
Fc1ccc2nc(N3CCC[NH2+]CC3)oc2c1F	ZINC000014988039	283010830	/nfs/dbraw/zinc/01/08/30/283010830.db2.gz	YBVNVPUZIXCWCJ-UHFFFAOYSA-N	1	0	253.252	1.906	50	0		CDAARO
Cc1ccc(OCC(=O)NCC[NH+]2CCCC2)cc1	ZINC000000802600	355921854	/nfs/dbraw/zinc/92/18/54/355921854.db2.gz	AENNLRAJRNBACT-UHFFFAOYSA-N	1	0	262.353	1.586	50	0		CDAARO
Cc1nn(-c2ccc(C)cc2)c(C)c1C[NH2+]CCO	ZINC000002025625	355958187	/nfs/dbraw/zinc/95/81/87/355958187.db2.gz	WIYQDGVAJXGYEE-UHFFFAOYSA-N	1	0	259.353	1.879	50	0		CDAARO
CCOC(=O)C[C@H]([NH3+])c1ccc2c(c1)OCCO2	ZINC000003678391	356008565	/nfs/dbraw/zinc/00/85/65/356008565.db2.gz	UPDOMKNNTODYIN-JTQLQIEISA-N	1	0	251.282	1.411	50	0		CDAARO
C[C@H]([NH2+][C@@H](C)[C@H]1CCCO1)C(=O)NCc1cccs1	ZINC000097374217	356094598	/nfs/dbraw/zinc/09/45/98/356094598.db2.gz	ZJBZFEDVJDBBQK-GMXVVIOVSA-N	1	0	282.409	1.910	50	0		CDAARO
COC[C@H](O)C[N@H+](C)[C@H]1CCCN(c2ccccc2)C1=O	ZINC000126889607	356135740	/nfs/dbraw/zinc/13/57/40/356135740.db2.gz	POXWKYDMCKRORJ-CABCVRRESA-N	1	0	292.379	1.121	50	0		CDAARO
COC(=O)CC[NH+]1CCN(c2ccc(O)cc2)CC1	ZINC000032679760	356334536	/nfs/dbraw/zinc/33/45/36/356334536.db2.gz	XERUOCGZEHCUPB-UHFFFAOYSA-N	1	0	264.325	1.077	50	0		CDAARO
C[C@@H]1Cc2ccccc2N1C(=O)CCN1CC[NH+](C)CC1	ZINC000019874072	356513148	/nfs/dbraw/zinc/51/31/48/356513148.db2.gz	CVUVTUDKOZFPMB-CQSZACIVSA-N	1	0	287.407	1.602	50	0		CDAARO
O=C1C[C@H]([NH2+]C[C@@H]2CCCO2)C(=O)N1c1ccc(F)cc1	ZINC000019720183	356497026	/nfs/dbraw/zinc/49/70/26/356497026.db2.gz	JWUKCIQEXQYHGG-STQMWFEESA-N	1	0	292.310	1.226	50	0		CDAARO
Cc1c(C)n(C[C@H](O)C[NH2+]CCCO)c2ccc(C)cc12	ZINC000028297047	356719521	/nfs/dbraw/zinc/71/95/21/356719521.db2.gz	UWQHJPNDSPKRAF-OAHLLOKOSA-N	1	0	290.407	1.899	50	0		CDAARO
C[C@@H](O)C[N@H+](CCCc1ccccc1)C[C@H](C)O	ZINC000000214300	356812800	/nfs/dbraw/zinc/81/28/00/356812800.db2.gz	ADYPLABQYHBYFG-OKILXGFUSA-N	1	0	251.370	1.683	50	0		CDAARO
CC(C)=CCC[C@H](C)[NH2+]C[C@@H]1CCN(S(C)(=O)=O)C1	ZINC000090797111	356831540	/nfs/dbraw/zinc/83/15/40/356831540.db2.gz	WFOCDXJNMLLWDI-KBPBESRZSA-N	1	0	288.457	1.992	50	0		CDAARO
c1cc(CC[NH2+][C@H]2CCOC3(CCOCC3)C2)ccn1	ZINC000077428612	356957449	/nfs/dbraw/zinc/95/74/49/356957449.db2.gz	PAJHIFVWCFVXNU-HNNXBMFYSA-N	1	0	276.380	1.942	50	0		CDAARO
Cc1ccc(CCN(C[C@@H]2CCCO2)C(=O)[C@@H](C)[NH3+])cc1	ZINC000119054278	357246833	/nfs/dbraw/zinc/24/68/33/357246833.db2.gz	FTGWQSHTLZIORJ-ZBFHGGJFSA-N	1	0	290.407	1.892	50	0		CDAARO
OC1CC[NH+](Cc2ccc(-n3cccn3)cc2)CC1	ZINC000016338511	357491568	/nfs/dbraw/zinc/49/15/68/357491568.db2.gz	YSTMSNBMWGUOEU-UHFFFAOYSA-N	1	0	257.337	1.829	50	0		CDAARO
CCN(C)c1ccnc(N(C)CC[NH+]2CCCC2)n1	ZINC000065374020	357533168	/nfs/dbraw/zinc/53/31/68/357533168.db2.gz	LXDUOXPMELUYBL-UHFFFAOYSA-N	1	0	263.389	1.465	50	0		CDAARO
Cc1ccoc1CN1CCN(c2ncccn2)CC1	ZINC000065493637	357544398	/nfs/dbraw/zinc/54/43/98/357544398.db2.gz	GXNJEJKIFFKSFN-UHFFFAOYSA-N	1	0	258.325	1.700	50	0		CDAARO
O=C(NC1CC[NH+](Cc2ccccn2)CC1)[C@@H]1CCOC1	ZINC000066918603	357588684	/nfs/dbraw/zinc/58/86/84/357588684.db2.gz	HMNRPFVEJRVHQY-CYBMUJFWSA-N	1	0	289.379	1.199	50	0		CDAARO
CO[C@H](C)[C@H](C)NC(=O)N[C@H]1CC[N@H+](CC2CCCC2)C1	ZINC000188207480	357602259	/nfs/dbraw/zinc/60/22/59/357602259.db2.gz	BFIVBXCDDGYCJB-GUTXKFCHSA-N	1	0	297.443	1.974	50	0		CDAARO
CCCC(=O)NCCNc1cc(N2CCCC2)nc(C)[nH+]1	ZINC000067614078	357614635	/nfs/dbraw/zinc/61/46/35/357614635.db2.gz	KHBGHULJDKSFQH-UHFFFAOYSA-N	1	0	291.399	1.713	50	0		CDAARO
CC(=O)Nc1ccsc1C(=O)NC[C@@H]1CCC[N@@H+](C)C1	ZINC000067694631	357619289	/nfs/dbraw/zinc/61/92/89/357619289.db2.gz	WSBXWTNVQLPWQY-NSHDSACASA-N	1	0	295.408	1.778	50	0		CDAARO
CC[N@@H+]1CCO[C@H](CCNC(=O)c2ccccc2NC)C1	ZINC000067867630	357634205	/nfs/dbraw/zinc/63/42/05/357634205.db2.gz	ATMUTXNEADTUFR-CYBMUJFWSA-N	1	0	291.395	1.569	50	0		CDAARO
C[NH2+]C[C@@H](C)C(=O)N1CCN(c2ccccc2F)CC1	ZINC000092133878	357750255	/nfs/dbraw/zinc/75/02/55/357750255.db2.gz	UPDFYTAHWFMPDV-GFCCVEGCSA-N	1	0	279.359	1.330	50	0		CDAARO
COCc1cc(NCCC[NH+]2CCCC2)n2nccc2n1	ZINC000072431218	357834488	/nfs/dbraw/zinc/83/44/88/357834488.db2.gz	VBDLVDUEIQJOFK-UHFFFAOYSA-N	1	0	289.383	1.774	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1Nc1cc(C(C)C)nc2ccnn21	ZINC000072447190	357835681	/nfs/dbraw/zinc/83/56/81/357835681.db2.gz	LWBTZRZETYKVJO-RYUDHWBXSA-N	1	0	275.356	1.251	50	0		CDAARO
CCOCC[N@H+](C)Cc1cnc2nc(C)cc(C)n12	ZINC000097235429	358050484	/nfs/dbraw/zinc/05/04/84/358050484.db2.gz	NYFBRJARFUGAIG-UHFFFAOYSA-N	1	0	262.357	1.814	50	0		CDAARO
CC[C@@H](C(=O)[O-])[N@@H+]1CC[C@H](CNc2cc(C)cc[nH+]2)C1	ZINC000364253806	358126435	/nfs/dbraw/zinc/12/64/35/358126435.db2.gz	GMWJYEIZJQRLCX-OLZOCXBDSA-N	1	0	277.368	1.987	50	0		CDAARO
Cc1nc(CNC(=O)[C@H](C)[NH+]2[C@H](C)CC[C@H]2C)no1	ZINC000247375583	358144276	/nfs/dbraw/zinc/14/42/76/358144276.db2.gz	DWUGCCDWFFYKOH-BBBLOLIVSA-N	1	0	266.345	1.256	50	0		CDAARO
Cc1cc(N2CCO[C@H](c3nccs3)C2)nc(N)[nH+]1	ZINC000097203829	358191482	/nfs/dbraw/zinc/19/14/82/358191482.db2.gz	FZCZPSUTONCHKD-VIFPVBQESA-N	1	0	277.353	1.402	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)[C@H](C)Oc2cccnc2)C1	ZINC000247116518	358404246	/nfs/dbraw/zinc/40/42/46/358404246.db2.gz	LYTVFLHLPODGPA-FRRDWIJNSA-N	1	0	277.368	1.435	50	0		CDAARO
CN(C)c1cccc(C[N@H+](C)[C@@H]2CCN(C3CC3)C2=O)c1	ZINC000095442086	358441140	/nfs/dbraw/zinc/44/11/40/358441140.db2.gz	CNLIUFTWNUMRKF-MRXNPFEDSA-N	1	0	287.407	1.948	50	0		CDAARO
Cc1cnn(CCCNC(=O)CC[C@@H]2CCCC[N@H+]2C)c1	ZINC000095392501	358692920	/nfs/dbraw/zinc/69/29/20/358692920.db2.gz	WLHBUCRSVOXLQP-HNNXBMFYSA-N	1	0	292.427	1.962	50	0		CDAARO
O=C(CCc1ccc(Cl)cc1)N1CC[NH2+]C[C@H](O)C1	ZINC000097528857	358782124	/nfs/dbraw/zinc/78/21/24/358782124.db2.gz	XHUNFOFMXBJEBT-ZDUSSCGKSA-N	1	0	282.771	1.065	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)c2c[nH]c(=O)c3ccccc23)C1	ZINC000097775778	358798640	/nfs/dbraw/zinc/79/86/40/358798640.db2.gz	KMFBWCIIFALXJB-JTQLQIEISA-N	1	0	271.320	1.091	50	0		CDAARO
OC[C@]1(O)CC[N@H+](Cc2cccc(OC3CCCC3)c2)C1	ZINC000215946387	358911448	/nfs/dbraw/zinc/91/14/48/358911448.db2.gz	ZQQTUPUJGFXMLN-KRWDZBQOSA-N	1	0	291.391	1.937	50	0		CDAARO
Cn1c2ccccc2cc(C(=O)NCC[NH+]2CCCC2)c1=O	ZINC000215409240	358888591	/nfs/dbraw/zinc/88/85/91/358888591.db2.gz	FWUQWZFBGRVCAY-UHFFFAOYSA-N	1	0	299.374	1.364	50	0		CDAARO
CN1C(=O)[C@H]2C[N@H+](Cc3cc(F)cc(F)c3)C[C@H]2C1=O	ZINC000257176729	359076756	/nfs/dbraw/zinc/07/67/56/359076756.db2.gz	DBFWYVMUENZUKP-TXEJJXNPSA-N	1	0	280.274	1.011	50	0		CDAARO
CCN1CCC[C@H]1C[NH2+]C[C@@H](O)COc1ccccc1	ZINC000022924106	359142700	/nfs/dbraw/zinc/14/27/00/359142700.db2.gz	MYZHMUCEOWWVOD-LSDHHAIUSA-N	1	0	278.396	1.500	50	0		CDAARO
CN1Cc2cccn2C[C@H]1CNC(=O)c1ccsc1	ZINC000257178997	359154960	/nfs/dbraw/zinc/15/49/60/359154960.db2.gz	HRTSNGGIKHHYEK-CYBMUJFWSA-N	1	0	275.377	1.794	50	0		CDAARO
CCCn1cc(CNc2cc(C3CC([NH3+])C3)ncn2)cn1	ZINC000223748955	359451713	/nfs/dbraw/zinc/45/17/13/359451713.db2.gz	XUIPKFHSTARLBC-UHFFFAOYSA-N	1	0	286.383	1.900	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCCN1C(=O)c1ccnc(C2CC2)n1	ZINC000408519105	359911931	/nfs/dbraw/zinc/91/19/31/359911931.db2.gz	LJWJSOSXNMJTPQ-GXFFZTMASA-N	1	0	274.368	1.696	50	0		CDAARO
CCOC[C@@H]1CCN(C(=O)CC[NH+](CC)CC)C1	ZINC000408522255	359922064	/nfs/dbraw/zinc/92/20/64/359922064.db2.gz	GGYFTRMSAKKERP-CYBMUJFWSA-N	1	0	256.390	1.603	50	0		CDAARO
C[C@@H]1CN(C(=O)Cc2cn3ccsc3n2)C[C@H]1[NH+](C)C	ZINC000089937166	360197334	/nfs/dbraw/zinc/19/73/34/360197334.db2.gz	VWPJXNHSOYSCFF-ZYHUDNBSSA-N	1	0	292.408	1.347	50	0		CDAARO
O=C(c1ccccc1)N1CCC[N@H+](C[C@H]2CCOC2)CC1	ZINC000089822959	360191994	/nfs/dbraw/zinc/19/19/94/360191994.db2.gz	GBRBIDHPESMHCP-OAHLLOKOSA-N	1	0	288.391	1.871	50	0		CDAARO
CO[C@H](C)CC(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1C	ZINC000248157272	360416484	/nfs/dbraw/zinc/41/64/84/360416484.db2.gz	WAKQZSROWCVAAJ-JHJVBQTASA-N	1	0	254.374	1.497	50	0		CDAARO
COCCOc1ccc(C(=O)N2CCC[C@H]([NH3+])C2)cc1	ZINC000178325399	189107392	/nfs/dbraw/zinc/10/73/92/189107392.db2.gz	BJRPFPAHVVLNGX-ZDUSSCGKSA-N	1	0	278.352	1.275	50	0		CDAARO
CC[C@@H](O)CSc1nnc(C[NH3+])n1Cc1ccccc1	ZINC000426503484	360677592	/nfs/dbraw/zinc/67/75/92/360677592.db2.gz	JUDXQHANOLGIRN-GFCCVEGCSA-N	1	0	292.408	1.648	50	0		CDAARO
O=C(NCCCCc1ccccc1)NC[C@@H]1C[NH2+]CCO1	ZINC000426538261	360680734	/nfs/dbraw/zinc/68/07/34/360680734.db2.gz	BZJVSYIYPMTWJB-HNNXBMFYSA-N	1	0	291.395	1.297	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)NCc2c(F)cccc2F)C1	ZINC000426407490	360665799	/nfs/dbraw/zinc/66/57/99/360665799.db2.gz	FYVKGGQKSCCUIK-SECBINFHSA-N	1	0	269.295	1.455	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2nc(C(C)C)no2)n1C	ZINC000426420006	360668172	/nfs/dbraw/zinc/66/81/72/360668172.db2.gz	RMTJIURJHXABHO-UHFFFAOYSA-N	1	0	282.373	1.333	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2coc(C)n2)n1C	ZINC000426691175	360696851	/nfs/dbraw/zinc/69/68/51/360696851.db2.gz	LERFMRUAJUFTBS-UHFFFAOYSA-N	1	0	253.331	1.123	50	0		CDAARO
Cc1ncsc1CSc1nnc(CC[NH3+])n1C	ZINC000426715914	360699026	/nfs/dbraw/zinc/69/90/26/360699026.db2.gz	MDPBWVDQIUDJOJ-UHFFFAOYSA-N	1	0	269.399	1.374	50	0		CDAARO
O=C(Cc1ccccc1Br)NC[C@H]1CCC[NH2+]1	ZINC000178764947	189144242	/nfs/dbraw/zinc/14/42/42/189144242.db2.gz	PJOMGKKRMCNSKO-LLVKDONJSA-N	1	0	297.196	1.860	50	0		CDAARO
COc1cc(C)sc1C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179114921	189170299	/nfs/dbraw/zinc/17/02/99/189170299.db2.gz	UTUJHAZFBPEQJO-SECBINFHSA-N	1	0	254.355	1.499	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccc3ncsc3c2)CC[NH2+]1	ZINC000179182174	189175934	/nfs/dbraw/zinc/17/59/34/189175934.db2.gz	ZUGDRPYPEQSFFX-SECBINFHSA-N	1	0	261.350	1.730	50	0		CDAARO
COc1ccc(OC)c(COC[C@@H](O)C[NH2+]C(C)C)c1	ZINC000012382633	361226807	/nfs/dbraw/zinc/22/68/07/361226807.db2.gz	HIABGQVTNPYOQX-ZDUSSCGKSA-N	1	0	283.368	1.579	50	0		CDAARO
Cc1cnc(C(=O)N2CC[C@@H](Oc3ccncc3)C2)cn1	ZINC000121170871	361285107	/nfs/dbraw/zinc/28/51/07/361285107.db2.gz	ITNCSLJWTOIJSI-CYBMUJFWSA-N	1	0	284.319	1.474	50	0		CDAARO
COC(=O)[C@@H]1CCN(Cc2ncc(C)o2)C[C@H]1C	ZINC000191799513	361321161	/nfs/dbraw/zinc/32/11/61/361321161.db2.gz	QXPDCAIHWBUQQB-MWLCHTKSSA-N	1	0	252.314	1.614	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2nc(C)sc2C)n1C	ZINC000426634362	361338850	/nfs/dbraw/zinc/33/88/50/361338850.db2.gz	XQYUTOUUHWOWRQ-UHFFFAOYSA-N	1	0	283.426	1.900	50	0		CDAARO
[NH3+][C@H]1CCCN(S(=O)(=O)c2cc(F)cc(F)c2)C1	ZINC000036297290	361462399	/nfs/dbraw/zinc/46/23/99/361462399.db2.gz	GSBDZIQHVSWWEA-JTQLQIEISA-N	1	0	276.308	1.077	50	0		CDAARO
O=C(NCCc1cn[nH]c1)N1CC[C@@H]([NH+]2CCCCC2)C1	ZINC000290858569	361600278	/nfs/dbraw/zinc/60/02/78/361600278.db2.gz	BHEFDMWEWRTDDB-CQSZACIVSA-N	1	0	291.399	1.222	50	0		CDAARO
CC(=O)c1cccc(OC[C@H](O)C[N@@H+]2CCC[C@H](O)C2)c1	ZINC000036316616	361604157	/nfs/dbraw/zinc/60/41/57/361604157.db2.gz	FPNOPAJNRCQVRK-LSDHHAIUSA-N	1	0	293.363	1.086	50	0		CDAARO
CN(C(=O)c1cccc(F)c1)C1CC[NH+](C)CC1	ZINC000012976326	364739303	/nfs/dbraw/zinc/73/93/03/364739303.db2.gz	CBXBACQDFPJNSP-UHFFFAOYSA-N	1	0	250.317	1.992	50	0		CDAARO
CCOC(=O)C1CCN(CC[C@@H]2CCC[N@@H+]2C)CC1	ZINC000089983611	367002280	/nfs/dbraw/zinc/00/22/80/367002280.db2.gz	GTEGMCWFKAZKCU-AWEZNQCLSA-N	1	0	268.401	1.746	50	0		CDAARO
CCn1ccnc1C[NH2+][C@H]1CCCN(c2ncccn2)C1	ZINC000012306157	367664050	/nfs/dbraw/zinc/66/40/50/367664050.db2.gz	AQJOIGFNJKMMNU-ZDUSSCGKSA-N	1	0	286.383	1.452	50	0		CDAARO
O=C(NCc1cc[nH]n1)N1CC[C@H]([NH+]2CCCCC2)C1	ZINC000336240132	284004414	/nfs/dbraw/zinc/00/44/14/284004414.db2.gz	QMSMHHWKJABDKM-ZDUSSCGKSA-N	1	0	277.372	1.180	50	0		CDAARO
c1coc(CN2CCN(c3ncnc4n[nH]cc43)CC2)c1	ZINC000012556528	369422181	/nfs/dbraw/zinc/42/21/81/369422181.db2.gz	XLTTXOMCRGIRSE-UHFFFAOYSA-N	1	0	284.323	1.268	50	0		CDAARO
CCO[C@H]1C[N@H+](CC)C[C@@H]1Nc1ncnc2oc(C)nc21	ZINC000063848378	370121895	/nfs/dbraw/zinc/12/18/95/370121895.db2.gz	XFQBZWMYXKNARD-QWRGUYRKSA-N	1	0	291.355	1.447	50	0		CDAARO
CC1(C)NC(=[NH2+])NC(=N)N1c1ccccc1Cl	ZINC000001666575	370505100	/nfs/dbraw/zinc/50/51/00/370505100.db2.gz	UKZMOMDQRPCKFB-UHFFFAOYSA-N	1	0	251.721	1.526	50	0		CDAARO
S=c1nc2ccccc2c(NCC[NH+]2CCCC2)[nH]1	ZINC000575614978	371509845	/nfs/dbraw/zinc/50/98/45/371509845.db2.gz	CZAULDMFEQCMIK-UHFFFAOYSA-N	1	0	274.393	1.848	50	0		CDAARO
O=C(NCC1CC[NH+]([C@H]2CCOC2)CC1)C1CC1	ZINC000575616576	371708996	/nfs/dbraw/zinc/70/89/96/371708996.db2.gz	QMJQWALRNNNIFG-ZDUSSCGKSA-N	1	0	252.358	1.014	50	0		CDAARO
c1nc(CN2CC[NH+]([C@H]3CCc4ccccc4C3)CC2)no1	ZINC000299785465	372761542	/nfs/dbraw/zinc/76/15/42/372761542.db2.gz	RNHMXWWIHRQDKG-INIZCTEOSA-N	1	0	298.390	1.745	50	0		CDAARO
Cc1noc([C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2CO)n1	ZINC000253400680	373689010	/nfs/dbraw/zinc/68/90/10/373689010.db2.gz	FCKXPRDRYPVUSP-UONOGXRCSA-N	1	0	273.336	1.586	50	0		CDAARO
CCOC(CN1CC[C@@H]2CC[N@H+](C)C[C@@H]21)OCC	ZINC000253417107	373725828	/nfs/dbraw/zinc/72/58/28/373725828.db2.gz	QBFKFYOKDYAHRC-STQMWFEESA-N	1	0	256.390	1.412	50	0		CDAARO
O=c1cc(C[NH+]2CCCCCCC2)nc2nc[nH]n21	ZINC000334159654	206119317	/nfs/dbraw/zinc/11/93/17/206119317.db2.gz	LKWYCXAGCOXCRJ-UHFFFAOYSA-N	1	0	261.329	1.184	50	0		CDAARO
CC[NH+](CC)CCN(CCOC)[C@H]1CCSC1	ZINC000095442075	374936004	/nfs/dbraw/zinc/93/60/04/374936004.db2.gz	LNARSRUFSBXUIG-ZDUSSCGKSA-N	1	0	260.447	1.782	50	0		CDAARO
O=C(OCCCn1cccn1)c1ccn2c[nH+]cc2c1	ZINC000095463437	374959778	/nfs/dbraw/zinc/95/97/78/374959778.db2.gz	DEIWEPRXJFYQBT-UHFFFAOYSA-N	1	0	270.292	1.778	50	0		CDAARO
C[C@@H]([NH2+]CCSCC(C)(C)O)C1CCOCC1	ZINC000096477827	375104942	/nfs/dbraw/zinc/10/49/42/375104942.db2.gz	XKONSQQHVDAPHT-LLVKDONJSA-N	1	0	261.431	1.895	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1Nc1nc2c(s1)c(C)nn2C	ZINC000096165204	375059086	/nfs/dbraw/zinc/05/90/86/375059086.db2.gz	GLFMPTVFPGTBLZ-UWVGGRQHSA-N	1	0	295.412	1.469	50	0		CDAARO
Cc1c2ccccc2oc1[C@H](C)NC(=O)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000299741682	375201703	/nfs/dbraw/zinc/20/17/03/375201703.db2.gz	ADFQOFHVPPJFCW-GVXVVHGQSA-N	1	0	288.347	1.641	50	0		CDAARO
CO[C@@H]1CC[C@@H]2OCC[N@H+](C[C@@H]3CCCCO3)[C@H]2C1	ZINC000246596536	376953909	/nfs/dbraw/zinc/95/39/09/376953909.db2.gz	MPHNQPNMJZTTOF-QPSCCSFWSA-N	1	0	269.385	1.824	50	0		CDAARO
CC(C)Cc1nc(CN(C)[C@H]2CCC[NH2+]C2)no1	ZINC000067743422	377234716	/nfs/dbraw/zinc/23/47/16/377234716.db2.gz	GYTUIBSKLNOYSV-NSHDSACASA-N	1	0	252.362	1.452	50	0		CDAARO
CCNc1cc(C)[nH+]c(N2CCN(C(=O)CC)CC2)n1	ZINC000009620242	379455982	/nfs/dbraw/zinc/45/59/82/379455982.db2.gz	NUTRXICBKAACEH-UHFFFAOYSA-N	1	0	277.372	1.275	50	0		CDAARO
O=c1c2c3c(sc2ncn1[C@@H]1CC[NH2+]C1)CCC3	ZINC000032565342	285208816	/nfs/dbraw/zinc/20/88/16/285208816.db2.gz	DYRRECNFICSZCP-MRVPVSSYSA-N	1	0	261.350	1.481	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@H]1CC[NH2+]C[C@H]1C	ZINC000094345634	184786119	/nfs/dbraw/zinc/78/61/19/184786119.db2.gz	ROVYWRQYKMMRLT-PWSUYJOCSA-N	1	0	286.372	1.410	50	0		CDAARO
Cc1cc(S(=O)(=O)N[C@H](C[NH3+])C2CC2)cnc1Cl	ZINC000095432122	184981617	/nfs/dbraw/zinc/98/16/17/184981617.db2.gz	MXULREVMJCTAKP-SNVBAGLBSA-N	1	0	289.788	1.059	50	0		CDAARO
CCCCC[N@@H+]1CCC[C@H](Cn2cc(CO)nn2)C1	ZINC000055108874	390488261	/nfs/dbraw/zinc/48/82/61/390488261.db2.gz	FCQCNIPHIDAIJP-ZDUSSCGKSA-N	1	0	266.389	1.673	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1C(=O)N1CCC(OCCOC)CC1	ZINC000096408534	390507613	/nfs/dbraw/zinc/50/76/13/390507613.db2.gz	ANEVWAROXGZGIE-HNNXBMFYSA-N	1	0	298.427	1.515	50	0		CDAARO
C[C@H](C(=O)NC1CC1)[NH+]1CCC(OC2CCOCC2)CC1	ZINC000096417442	390512217	/nfs/dbraw/zinc/51/22/17/390512217.db2.gz	CCBOCPRRXVMZOF-GFCCVEGCSA-N	1	0	296.411	1.314	50	0		CDAARO
CC[N@@H+]1CC[C@@H]2[C@H](C1)OCCN2C(=O)CC(F)(F)F	ZINC000253416358	285381546	/nfs/dbraw/zinc/38/15/46/285381546.db2.gz	IIEQZEFGDMADIB-ZJUUUORDSA-N	1	0	280.290	1.260	50	0		CDAARO
CC(C)(C)OC(=O)N1CCCC2(CC[NH2+]CC2)C1=O	ZINC000072194165	390626518	/nfs/dbraw/zinc/62/65/18/390626518.db2.gz	BQHIYBZAICVGIF-UHFFFAOYSA-N	1	0	268.357	1.914	50	0		CDAARO
F[C@@H]1CN[C@H](C[NH2+]C2CSCCSC2)C1	ZINC000082137213	390838122	/nfs/dbraw/zinc/83/81/22/390838122.db2.gz	BXHRGIDLDHTYJW-IUCAKERBSA-N	1	0	250.408	1.125	50	0		CDAARO
CCCNc1ncc(CN2CC([NH+]3CCCCC3)C2)cn1	ZINC000215957482	391003108	/nfs/dbraw/zinc/00/31/08/391003108.db2.gz	JHWDVVUSDGOCIM-UHFFFAOYSA-N	1	0	289.427	1.969	50	0		CDAARO
CS(=O)(=O)CC1(C[NH2+]Cc2cccc(O)c2)CC1	ZINC000096449362	533330914	/nfs/dbraw/zinc/33/09/14/533330914.db2.gz	OLKCZCWAOOWYMF-UHFFFAOYSA-N	1	0	269.366	1.307	50	0		CDAARO
C[C@H](CC(=O)N1[C@H](C)COC[C@H]1C)[C@@H]1CCC[NH2+]C1	ZINC000262641643	391335079	/nfs/dbraw/zinc/33/50/79/391335079.db2.gz	RXRQCYLJONXAON-AAVRWANBSA-N	1	0	268.401	1.648	50	0		CDAARO
CCOC[C@H](O)C[N@@H+]1C[C@@H](O)C[C@H]1c1cccc(F)c1	ZINC000281939406	391430958	/nfs/dbraw/zinc/43/09/58/391430958.db2.gz	TWBVNBWULSYDPO-ZNMIVQPWSA-N	1	0	283.343	1.331	50	0		CDAARO
CC(C)NC(=O)C[N@H+](C[C@H]1CCCO1)[C@@H]1CCSC1	ZINC000089952644	392530964	/nfs/dbraw/zinc/53/09/64/392530964.db2.gz	WEXALBPGUMGZGR-CHWSQXEVSA-N	1	0	286.441	1.498	50	0		CDAARO
Cc1cc(N2CCCCC2)nc(N2CC[NH2+]CC2)n1	ZINC000084625184	135033520	/nfs/dbraw/zinc/03/35/20/135033520.db2.gz	FECISBKWOMSXPY-UHFFFAOYSA-N	1	0	261.373	1.185	50	0		CDAARO
CN(C)c1ccccc1C[N@H+](C)C1(CO)CCOCC1	ZINC000191029050	140132191	/nfs/dbraw/zinc/13/21/91/140132191.db2.gz	YSMIMJMHXPUXFR-UHFFFAOYSA-N	1	0	278.396	1.726	50	0		CDAARO
CN1CC[N@H+](CCCC2CCCC2)C[C@H]1CCO	ZINC000104386130	397942044	/nfs/dbraw/zinc/94/20/44/397942044.db2.gz	IEAVKJMXPCCZFU-OAHLLOKOSA-N	1	0	254.418	1.955	50	0		CDAARO
CC(C)CC1(C(=O)N2CCN([C@@H]3CC[NH2+]C3)CC2)CCC1	ZINC000377529984	160560412	/nfs/dbraw/zinc/56/04/12/160560412.db2.gz	KNKIOOKBSQMPRU-OAHLLOKOSA-N	1	0	293.455	1.709	50	0		CDAARO
O=S1(=O)CC[C@H]([NH2+]Cc2cccc(Cl)c2)C1	ZINC000006480397	170204352	/nfs/dbraw/zinc/20/43/52/170204352.db2.gz	HQVWWFTXVGIJNO-NSHDSACASA-N	1	0	259.758	1.617	50	0		CDAARO
C[C@@H](C(=O)NC(=O)NC1CCCC1)[N@@H+]1CCC[C@@H](C)C1	ZINC000008142769	170321019	/nfs/dbraw/zinc/32/10/19/170321019.db2.gz	DLPYQIMDWHNFQY-NEPJUHHUSA-N	1	0	281.400	1.875	50	0		CDAARO
COc1ccc(S(=O)(=O)NCCC[NH+](C)C)cc1C	ZINC000010111428	170397731	/nfs/dbraw/zinc/39/77/31/170397731.db2.gz	ADUDCZRNLSLGOL-UHFFFAOYSA-N	1	0	286.397	1.234	50	0		CDAARO
C[NH+](C)CCCNC1=CC(=O)OC12CCCCC2	ZINC000018213124	170748306	/nfs/dbraw/zinc/74/83/06/170748306.db2.gz	AWEAKJNWRZRJLH-UHFFFAOYSA-N	1	0	252.358	1.671	50	0		CDAARO
OCC[C@H]1CN(Cc2ccccn2)CC[N@@H+]1C1CCCC1	ZINC000020537451	171241067	/nfs/dbraw/zinc/24/10/67/171241067.db2.gz	MFVBAWRAVLFEAD-KRWDZBQOSA-N	1	0	289.423	1.893	50	0		CDAARO
CCC(=O)c1ccc(OCCN2CC[NH2+][C@H](C)C2)cc1	ZINC000033359730	171786176	/nfs/dbraw/zinc/78/61/76/171786176.db2.gz	DGTWDTJYFDFSEZ-CYBMUJFWSA-N	1	0	276.380	1.952	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CCN(C)CCc1cn[nH]c1	ZINC000244659520	287268712	/nfs/dbraw/zinc/26/87/12/287268712.db2.gz	HEDIPLGJQCILGV-CYBMUJFWSA-N	1	0	250.390	1.758	50	0		CDAARO
Cc1cc(N2CCc3[nH+]ccc(N)c3C2)nc(C)n1	ZINC000657208390	414033866	/nfs/dbraw/zinc/03/38/66/414033866.db2.gz	KBKVKTULSIOGDO-UHFFFAOYSA-N	1	0	255.325	1.633	50	0		CDAARO
Cc1noc(C)c1CN(C)C(=O)CC1CC[NH2+]CC1	ZINC000038075941	174086333	/nfs/dbraw/zinc/08/63/33/174086333.db2.gz	PXNPJVRHIDUQIK-UHFFFAOYSA-N	1	0	265.357	1.640	50	0		CDAARO
[NH3+]CCOc1ccc2nnc(-c3ccccc3Cl)n2n1	ZINC000038478037	174142086	/nfs/dbraw/zinc/14/20/86/174142086.db2.gz	FXEBMPGJLLCBTB-UHFFFAOYSA-N	1	0	289.726	1.782	50	0		CDAARO
O=C(CC[N@H+]1CCC[C@H]1CO)NC1CCCCCC1	ZINC000065373300	175723906	/nfs/dbraw/zinc/72/39/06/175723906.db2.gz	YCXSQOAEGVQLAN-AWEZNQCLSA-N	1	0	268.401	1.672	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(NC[C@@H]2CCS(=O)(=O)C2)c1C	ZINC000065374551	175724137	/nfs/dbraw/zinc/72/41/37/175724137.db2.gz	FRQALKKOBIWGNO-NSHDSACASA-N	1	0	298.412	1.006	50	0		CDAARO
O=C(c1ccc(OC[C@H]2CCC[NH2+]2)cc1)N1CCOCC1	ZINC000066323504	175756944	/nfs/dbraw/zinc/75/69/44/175756944.db2.gz	AXQVRZVSUITRTF-CQSZACIVSA-N	1	0	290.363	1.290	50	0		CDAARO
Cc1cccc(-n2cc(CN3CCO[C@H](C[NH3+])C3)cn2)c1	ZINC000067855134	175797543	/nfs/dbraw/zinc/79/75/43/175797543.db2.gz	RKZLLXQUBBBGCN-MRXNPFEDSA-N	1	0	286.379	1.340	50	0		CDAARO
FC(F)(F)c1csc(CN2CC[NH2+]CC2)n1	ZINC000070993638	176020278	/nfs/dbraw/zinc/02/02/78/176020278.db2.gz	UGZUITLNODVGHC-UHFFFAOYSA-N	1	0	251.277	1.567	50	0		CDAARO
C[NH2+]CC(=O)N1CCC[C@H]1c1nc2c(cccc2C)[nH]1	ZINC000071639467	176238523	/nfs/dbraw/zinc/23/85/23/176238523.db2.gz	BHINWJAEAOYNMD-LBPRGKRZSA-N	1	0	272.352	1.754	50	0		CDAARO
O=C(OCc1ccccc1)N1CCC[C@@H]([NH2+]C2COC2)C1	ZINC000071792081	176263217	/nfs/dbraw/zinc/26/32/17/176263217.db2.gz	YPMHVYCSHCRJAT-CQSZACIVSA-N	1	0	290.363	1.776	50	0		CDAARO
CC(C)(C)OC(=O)NCC1CC[NH+](C2COC2)CC1	ZINC000071792063	176263283	/nfs/dbraw/zinc/26/32/83/176263283.db2.gz	LKAYDNPZSDOMOB-UHFFFAOYSA-N	1	0	270.373	1.622	50	0		CDAARO
COC(=O)[C@@H](C[NH+]1CCCCC1)NC(=O)OC(C)(C)C	ZINC000071873609	176284374	/nfs/dbraw/zinc/28/43/74/176284374.db2.gz	WQQPQIUEXHEAKU-LLVKDONJSA-N	1	0	286.372	1.539	50	0		CDAARO
O=C(NC[C@@]1(O)CCC[NH2+]CC1)c1ccc2ncccc2c1	ZINC000072128440	176321369	/nfs/dbraw/zinc/32/13/69/176321369.db2.gz	UCVMKGNJOQWRMU-QGZVFWFLSA-N	1	0	299.374	1.469	50	0		CDAARO
O=C1NC[C@@]2(CCC[N@H+](Cc3ccncc3)CC2)O1	ZINC000072166542	176331674	/nfs/dbraw/zinc/33/16/74/176331674.db2.gz	WULXJEXDKPUCJU-AWEZNQCLSA-N	1	0	261.325	1.546	50	0		CDAARO
COc1cc(C)ccc1OCC[N@@H+]1CCOC[C@H](CO)C1	ZINC000077341122	177254625	/nfs/dbraw/zinc/25/46/25/177254625.db2.gz	XLJGUSVHFWOQHP-AWEZNQCLSA-N	1	0	295.379	1.323	50	0		CDAARO
O=C1NC2(CC[NH2+]CC2)C(=O)N1Cc1cc2ccccc2o1	ZINC000077390483	177262424	/nfs/dbraw/zinc/26/24/24/177262424.db2.gz	LVDXCCLGIIHXAJ-UHFFFAOYSA-N	1	0	299.330	1.607	50	0		CDAARO
NC(=O)C[N@@H+]1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000097086453	424622826	/nfs/dbraw/zinc/62/28/26/424622826.db2.gz	RUVQNFLIBGSIKU-SNVBAGLBSA-N	1	0	272.270	1.980	50	0		CDAARO
CCC[C@@H]1CCC[N@@H+]([C@H](C)C(=O)NC(N)=O)CC1	ZINC000106516909	276274044	/nfs/dbraw/zinc/27/40/44/276274044.db2.gz	ABTJWSUDQXKBNP-GHMZBOCLSA-N	1	0	255.362	1.472	50	0		CDAARO
C[NH+](C)CC[C@@H]1CCCCN1S(=O)(=O)c1cccnc1	ZINC000077489878	276763891	/nfs/dbraw/zinc/76/38/91/276763891.db2.gz	AFAUEHSCJMNFBI-ZDUSSCGKSA-N	1	0	297.424	1.577	50	0		CDAARO
C[N@@H+]1CCC[C@H]1Cc1nc2c([nH]1)C(=O)NCC(C)(C)C2	ZINC000065408928	277081800	/nfs/dbraw/zinc/08/18/00/277081800.db2.gz	BGFPYGABZHEARM-JTQLQIEISA-N	1	0	276.384	1.359	50	0		CDAARO
COC(=O)[C@@H]1[C@@H](O)CCC[N@@H+]1C[C@H]1CC=CCC1	ZINC000188782197	277373348	/nfs/dbraw/zinc/37/33/48/277373348.db2.gz	QRDSPMVLVNJYBD-AVGNSLFASA-N	1	0	253.342	1.341	50	0		CDAARO
CC(C)N1CC[C@@H]([N@@H+]2CCC[C@@H]([C@H](C)O)C2)C1=O	ZINC000245338720	280203695	/nfs/dbraw/zinc/20/36/95/280203695.db2.gz	OAGOMHUBNQAPDY-YNEHKIRRSA-N	1	0	254.374	1.089	50	0		CDAARO
CC[NH+]1C[C@H](C)N(C(=O)c2ccc(C(N)=O)cc2)[C@@H](C)C1	ZINC000562697303	293176944	/nfs/dbraw/zinc/17/69/44/293176944.db2.gz	VBVZNCOLCQGKRD-RYUDHWBXSA-N	1	0	289.379	1.340	50	0		CDAARO
COc1cccc([C@@]2(O)CC[S@](=O)C[C@H]2C[NH+](C)C)c1	ZINC000004128812	295322544	/nfs/dbraw/zinc/32/25/44/295322544.db2.gz	SMRSCUYCLLYTCF-IAMHBRQHSA-N	1	0	297.420	1.213	50	0		CDAARO
CS(=O)(=O)N1CC[NH+](C23CC4CC(CC(C4)C2)C3)CC1	ZINC000017024664	295522173	/nfs/dbraw/zinc/52/21/73/295522173.db2.gz	IDTBWYLJPDMZAA-UHFFFAOYSA-N	1	0	298.452	1.532	50	0		CDAARO
COc1cccc(-c2cc(CNC(=O)[C@@H]3C=CC[NH2+]3)no2)c1	ZINC000534645492	328330787	/nfs/dbraw/zinc/33/07/87/328330787.db2.gz	YYCMBCIMSBXXTP-AWEZNQCLSA-N	1	0	299.330	1.494	50	0		CDAARO
COCC(C)(C)CNC(=O)CC[C@@H](C)[NH+]1CCN(C)CC1	ZINC000534649975	328336505	/nfs/dbraw/zinc/33/65/05/328336505.db2.gz	ALUXVEPPHCBEPU-CQSZACIVSA-N	1	0	299.459	1.191	50	0		CDAARO
Cc1nc2sccc2c(N[C@H]2C[NH2+]CC[C@H]2O)n1	ZINC000534647966	328343006	/nfs/dbraw/zinc/34/30/06/328343006.db2.gz	MYOHFXXRQIIQNU-VHSXEESVSA-N	1	0	264.354	1.134	50	0		CDAARO
O=C(NCCCc1ccccn1)[C@H]1CCC[NH2+]CC1	ZINC000534647859	328343151	/nfs/dbraw/zinc/34/31/51/328343151.db2.gz	JYUROLKJYFSUFA-ZDUSSCGKSA-N	1	0	261.369	1.520	50	0		CDAARO
CCc1ccc(C(=O)NC[C@H](C(C)C)[NH+](C)C)[nH]1	ZINC000534648286	328343321	/nfs/dbraw/zinc/34/33/21/328343321.db2.gz	XLPMJYONGLDBAE-CYBMUJFWSA-N	1	0	251.374	1.893	50	0		CDAARO
O=C(NCC[C@H]1CCOC1)C1([NH+]2CCCC2)CCCC1	ZINC000534658120	328341143	/nfs/dbraw/zinc/34/11/43/328341143.db2.gz	YOIGRCDHLPBHTP-AWEZNQCLSA-N	1	0	280.412	1.938	50	0		CDAARO
Cn1c(C[NH3+])nnc1Sc1ncccc1Cl	ZINC000534670901	328347541	/nfs/dbraw/zinc/34/75/41/328347541.db2.gz	ROZWFSBBIPWMPZ-UHFFFAOYSA-N	1	0	255.734	1.473	50	0		CDAARO
CN(Cc1ccon1)C(=O)NCC(C)(C)[NH+](C)C	ZINC000534672315	328348074	/nfs/dbraw/zinc/34/80/74/328348074.db2.gz	OVAURSKDPSENJS-UHFFFAOYSA-N	1	0	254.334	1.156	50	0		CDAARO
[NH3+]C[C@H]1CCN(S(=O)(=O)c2cc3ccccc3s2)C1	ZINC000534676286	328351675	/nfs/dbraw/zinc/35/16/75/328351675.db2.gz	OULWJBHGMMLTLE-SNVBAGLBSA-N	1	0	296.417	1.871	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C[C@H](C(C)C)N1CCOCC1	ZINC000097159211	482458996	/nfs/dbraw/zinc/45/89/96/482458996.db2.gz	OWAFPRJPLHXOST-OAHLLOKOSA-N	1	0	280.416	1.473	50	0		CDAARO
CCOC(C[N@@H+]1CC[C@H]2OCCC[C@@H]2C1)OCC	ZINC000097161670	482459201	/nfs/dbraw/zinc/45/92/01/482459201.db2.gz	IZBKIDGVBJQLPA-CHWSQXEVSA-N	1	0	257.374	1.886	50	0		CDAARO
COC(=O)N1CC[C@@H]([NH2+]Cc2ccc([S@](C)=O)cc2)C1	ZINC000085329586	482575702	/nfs/dbraw/zinc/57/57/02/482575702.db2.gz	PWXZVSREIKPBLO-MPBGBICISA-N	1	0	296.392	1.354	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN(C(=O)c2ccc(Cl)cn2)C1	ZINC000670444732	482991484	/nfs/dbraw/zinc/99/14/84/482991484.db2.gz	BKAQJFJQSVFWSI-NSHDSACASA-N	1	0	297.786	1.385	50	0		CDAARO
O=C(NCCCc1nc2cc(Cl)ccc2[nH]1)[C@H]1CC[NH2+]1	ZINC000670453894	483023613	/nfs/dbraw/zinc/02/36/13/483023613.db2.gz	LTDKYZLYQPPANU-LLVKDONJSA-N	1	0	292.770	1.627	50	0		CDAARO
Cc1ccoc1C(=O)N1CC[C@H](N2CC[NH+](C)CC2)C1	ZINC000670456429	483035119	/nfs/dbraw/zinc/03/51/19/483035119.db2.gz	BXVMEMJZOWVODB-ZDUSSCGKSA-N	1	0	277.368	1.050	50	0		CDAARO
C[N@H+](CCCOc1ccc(C(N)=O)cc1)C[C@H]1CCCO1	ZINC000670459838	483043656	/nfs/dbraw/zinc/04/36/56/483043656.db2.gz	KZYPWMYTUNYKTK-OAHLLOKOSA-N	1	0	292.379	1.665	50	0		CDAARO
O[C@H](COC[C@@H]1CCCO1)C[N@@H+]1CCO[C@H]2CCCC[C@H]21	ZINC000084544026	483286703	/nfs/dbraw/zinc/28/67/03/483286703.db2.gz	JOZHAXHLVOTTSN-JONQDZQNSA-N	1	0	299.411	1.186	50	0		CDAARO
CCC[NH+]1CCN(Cn2nccc2-c2ccncc2)CC1	ZINC000084755327	483324115	/nfs/dbraw/zinc/32/41/15/483324115.db2.gz	KVWBFAIVCXWQHP-UHFFFAOYSA-N	1	0	285.395	1.930	50	0		CDAARO
CCNC(=O)N1CCC([NH2+]C[C@@](C)(O)[C@@H](C)CC)CC1	ZINC000096492711	528125823	/nfs/dbraw/zinc/12/58/23/528125823.db2.gz	NRCVVNFRXIFIPG-SWLSCSKDSA-N	1	0	285.432	1.567	50	0		CDAARO
CCN(CC[NH+]1CCCCCC1)C(=O)c1cnc[nH]c1=O	ZINC000220599932	528477150	/nfs/dbraw/zinc/47/71/50/528477150.db2.gz	VQDANHDTZQLJCZ-UHFFFAOYSA-N	1	0	292.383	1.108	50	0		CDAARO
CCOC(=O)N1CCC([NH2+][C@H](C)CSC)CC1	ZINC000096494299	528958400	/nfs/dbraw/zinc/95/84/00/528958400.db2.gz	AGVHPBIXGDRULH-SNVBAGLBSA-N	1	0	260.403	1.948	50	0		CDAARO
Cc1nc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)cs1	ZINC000073987626	538353792	/nfs/dbraw/zinc/35/37/92/538353792.db2.gz	LZLHVISIAUUZQH-MNOVXSKESA-N	1	0	265.382	1.760	50	0		CDAARO
C[C@@H]1CCN[C@H]([C@@H]2CC[C@H](C(F)(F)F)NC2)[C@H]1[NH3+]	ZINC000757216302	574908220	/nfs/dbraw/zinc/90/82/20/574908220.db2.gz	ZLMYRHUJGGZDCW-MVCUBJFGSA-N	1	0	265.323	1.242	50	0		CDAARO
C[C@H]1CC[NH2+]C[C@@H]1c1ccc(NS(C)(=O)=O)cc1	ZINC000757213910	577036150	/nfs/dbraw/zinc/03/61/50/577036150.db2.gz	RZIZQCUAZLZPGL-GWCFXTLKSA-N	1	0	268.382	1.771	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](Nc2nc(OC)cc(OC)n2)C1	ZINC000952977810	614658761	/nfs/dbraw/zinc/65/87/61/614658761.db2.gz	DAMGSMJHRGHRSS-LLVKDONJSA-N	1	0	280.372	1.780	50	0		CDAARO
CCOc1ccc(CN(CC)C(=O)[C@@H]2CC[NH2+]2)cc1	ZINC000952964271	615509976	/nfs/dbraw/zinc/50/99/76/615509976.db2.gz	PAWGKNMMUXDALL-AWEZNQCLSA-N	1	0	262.353	1.796	50	0		CDAARO
CCn1ccc(CNC[C@@H]2CCC[N@H+](CCOC)C2)n1	ZINC000952968716	616031608	/nfs/dbraw/zinc/03/16/08/616031608.db2.gz	FOIYWFBMNLMQGP-AWEZNQCLSA-N	1	0	280.416	1.351	50	0		CDAARO
C[C@H]([NH2+]CCCNc1ccccc1)[C@@H]1CN(C)CCN1C	ZINC000888098458	617761698	/nfs/dbraw/zinc/76/16/98/617761698.db2.gz	IZRWISSKDWSCMR-RDJZCZTQSA-N	1	0	290.455	1.713	50	0		CDAARO
[NH3+]CCCCc1nnc(N[C@@H]2C[C@@H]3CC[C@H]2C3)o1	ZINC001772706960	1159441645	/nfs/dbraw/zinc/44/16/45/1159441645.db2.gz	QCNOBKHNETVXDP-OUAUKWLOSA-N	1	0	250.346	1.952	50	0		CDAARO
C[C@@H](COC[C@H](O)C[NH+]1CCN(C)CC1)c1ccccc1	ZINC000020638940	705381122	/nfs/dbraw/zinc/38/11/22/705381122.db2.gz	NOFWBZNOYUENPG-DOTOQJQBSA-N	1	0	292.423	1.415	50	0		CDAARO
Cc1nc(C2CC[NH+]([C@H]3CCSC3)CC2)cc(=O)[nH]1	ZINC000023543096	705445556	/nfs/dbraw/zinc/44/55/56/705445556.db2.gz	WEJSECZUIVCAEM-LBPRGKRZSA-N	1	0	279.409	1.763	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)N[C@@H](CO)c1ccc(F)cc1	ZINC000952965099	706001204	/nfs/dbraw/zinc/00/12/04/706001204.db2.gz	BRGFIWFCINBKAG-HNNXBMFYSA-N	1	0	294.370	1.851	50	0		CDAARO
COc1ccnc(C[N@@H+]2C[C@@H](C)[C@](O)(C3CC3)C2)c1	ZINC000091645154	706191720	/nfs/dbraw/zinc/19/17/20/706191720.db2.gz	FDEKCBGDSBQGAH-ABAIWWIYSA-N	1	0	262.353	1.683	50	0		CDAARO
OC[C@H]1CCCCN1CC[NH2+]Cc1cccc2nonc21	ZINC000952970982	709496410	/nfs/dbraw/zinc/49/64/10/709496410.db2.gz	CSWHROIOEMOOCS-CYBMUJFWSA-N	1	0	290.367	1.159	50	0		CDAARO
c1cn(-c2ccccc2C[NH2+]Cc2cnc[nH]2)cn1	ZINC000952990711	709889697	/nfs/dbraw/zinc/88/96/97/709889697.db2.gz	SKBRDBHSWZISCQ-UHFFFAOYSA-N	1	0	253.309	1.885	50	0		CDAARO
Cc1cccnc1C[C@H](C)N(C)c1cc(CC[NH3+])ncn1	ZINC000067678365	711786887	/nfs/dbraw/zinc/78/68/87/711786887.db2.gz	WEHJGWDDEUSUFD-ZDUSSCGKSA-N	1	0	285.395	1.749	50	0		CDAARO
C[C@H](NCc1ccc(C[NH+]2CCCCC2)s1)C(N)=O	ZINC000032529823	711815275	/nfs/dbraw/zinc/81/52/75/711815275.db2.gz	JDXDTPUVFYAWKE-NSHDSACASA-N	1	0	281.425	1.697	50	0		CDAARO
CCN(Cc1cccc2c1OCO2)[C@H]1CC[N@H+](C)C1	ZINC000584908347	900356868	/nfs/dbraw/zinc/35/68/68/900356868.db2.gz	XPLIALLOOSKVDD-ZDUSSCGKSA-N	1	0	262.353	1.941	50	0		CDAARO
CCCC1(O)CC[NH+](Cc2cn(C)nc2C)CC1	ZINC000952846153	910404477	/nfs/dbraw/zinc/40/44/77/910404477.db2.gz	LPTOISWFGQYUQJ-UHFFFAOYSA-N	1	0	251.374	1.856	50	0		CDAARO
C[C@@H](Cn1cccn1)C(=O)NCC1(C[NH+]2CCCC2)CC1	ZINC000952861822	910416354	/nfs/dbraw/zinc/41/63/54/910416354.db2.gz	LARHXTUEAOGBPI-AWEZNQCLSA-N	1	0	290.411	1.511	50	0		CDAARO
C[C@H]([NH2+][C@@H]1C(=O)NCC1(C)C)C1(Br)CC1	ZINC000952876869	910435243	/nfs/dbraw/zinc/43/52/43/910435243.db2.gz	GXRXZSWZCUYMLJ-JGVFFNPUSA-N	1	0	275.190	1.417	50	0		CDAARO
CC(C)[C@H](CNc1ncccc1C(N)=O)[NH+]1CCCC1	ZINC000820696273	925544483	/nfs/dbraw/zinc/54/44/83/925544483.db2.gz	FCWSNVPWLYFVAK-ZDUSSCGKSA-N	1	0	276.384	1.713	50	0		CDAARO
CC(C)[C@H](CNC(=O)c1ccnnc1)[NH+]1CCCC1	ZINC000820696462	925545136	/nfs/dbraw/zinc/54/51/36/925545136.db2.gz	XLSWRAKMDXRFSR-ZDUSSCGKSA-N	1	0	262.357	1.327	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)NCc1ccc2c(c1)OCO2	ZINC000823778670	925730433	/nfs/dbraw/zinc/73/04/33/925730433.db2.gz	UIYZGWQGKPQMEG-ZDUSSCGKSA-N	1	0	290.363	1.906	50	0		CDAARO
COCC(=O)Nc1cccc(-c2nc(C[NH3+])c(C)o2)c1	ZINC000824312835	925815790	/nfs/dbraw/zinc/81/57/90/925815790.db2.gz	AKLSFBVZHAEGMA-UHFFFAOYSA-N	1	0	275.308	1.694	50	0		CDAARO
Cc1ccc2[nH]c(CNC(=O)N3CC[C@H]([NH3+])C3)nc2c1C	ZINC000826951625	925926604	/nfs/dbraw/zinc/92/66/04/925926604.db2.gz	QQRGEZZKVDIWNW-NSHDSACASA-N	1	0	287.367	1.422	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)NC[C@@H]1CCCOC1	ZINC000827832308	925973991	/nfs/dbraw/zinc/97/39/91/925973991.db2.gz	XJEYSSILSKUCPW-ZDUSSCGKSA-N	1	0	254.374	1.405	50	0		CDAARO
CC(C)N1CCC[N@@H+]([C@@H]2CCNC(=O)CC2)CC1	ZINC000828305658	926100225	/nfs/dbraw/zinc/10/02/25/926100225.db2.gz	RDRNRRMGKXQTCH-ZDUSSCGKSA-N	1	0	253.390	1.071	50	0		CDAARO
C/C(=C\C(=O)N(C)CC[N@H+](C)C1CC1)c1cnccn1	ZINC000585086771	930890047	/nfs/dbraw/zinc/89/00/47/930890047.db2.gz	FXMZDKPLPZQDQU-ZRDIBKRKSA-N	1	0	274.368	1.433	50	0		CDAARO
C[C@H](COCC(=O)NCCc1ccccn1)[NH+]1CCCC1	ZINC000585121482	930987396	/nfs/dbraw/zinc/98/73/96/930987396.db2.gz	QLNNRAWKDLONDP-CQSZACIVSA-N	1	0	291.395	1.241	50	0		CDAARO
CC[N@H+](CCN1CCOCC1)C[C@@H]1CCCOC1	ZINC001207471831	940203748	/nfs/dbraw/zinc/20/37/48/940203748.db2.gz	UWOVMDZVJAYMOS-AWEZNQCLSA-N	1	0	256.390	1.067	50	0		CDAARO
CN(C(=O)c1ccon1)[C@@H]1C[C@@H]2C[C@H]([NH+](C)C)C[C@@H]2C1	ZINC001529120018	968986594	/nfs/dbraw/zinc/98/65/94/968986594.db2.gz	QQVOLYLSMRWFPM-MPZDIEGVSA-N	1	0	277.368	1.865	50	0		CDAARO
O[C@@H]1C[N@H+](Cc2ccoc2)C[C@H]1Cc1cnccn1	ZINC001529152848	968997841	/nfs/dbraw/zinc/99/78/41/968997841.db2.gz	ZQXIRUHCVDEQRT-TZMCWYRMSA-N	1	0	259.309	1.105	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CN1CCC2(COC(=O)O2)CC1	ZINC001529192546	969010270	/nfs/dbraw/zinc/01/02/70/969010270.db2.gz	XDFRJRPSWQEMBH-LBPRGKRZSA-N	1	0	268.357	1.472	50	0		CDAARO
Cc1c[nH+]ccc1NCCNc1nc(N)nc(C)c1Cl	ZINC001529196125	969011272	/nfs/dbraw/zinc/01/12/72/969011272.db2.gz	VMLRYRSPNQMQEK-UHFFFAOYSA-N	1	0	292.774	1.670	50	0		CDAARO
O=C(CC[NH2+][C@@H]1CCN(c2ccccc2)C1)N1CCCC1	ZINC001506399420	975149177	/nfs/dbraw/zinc/14/91/77/975149177.db2.gz	NLOUOQHGAXDLJO-OAHLLOKOSA-N	1	0	287.407	1.867	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]CCCn1ccnc1	ZINC001506413757	975154467	/nfs/dbraw/zinc/15/44/67/975154467.db2.gz	KKWRHICEODDXPV-ZDUSSCGKSA-N	1	0	261.373	1.710	50	0		CDAARO
C[C@H](CN(C)CCO)[NH2+]CCn1ccc2ccccc21	ZINC001506412296	975154727	/nfs/dbraw/zinc/15/47/27/975154727.db2.gz	BACUWQAYXAUVOD-CQSZACIVSA-N	1	0	275.396	1.544	50	0		CDAARO
Cc1cc(=O)c(C(=O)NCC[C@@H](C)[NH+]2CCCC2)c[nH]1	ZINC001506425640	975160637	/nfs/dbraw/zinc/16/06/37/975160637.db2.gz	BZNMRGAENIUNLM-GFCCVEGCSA-N	1	0	277.368	1.288	50	0		CDAARO
Cn1ccnc1CC[NH+]1CCC(c2ccnc(N)n2)CC1	ZINC001506429343	975161730	/nfs/dbraw/zinc/16/17/30/975161730.db2.gz	TVVBDYAUILCDJG-UHFFFAOYSA-N	1	0	286.383	1.214	50	0		CDAARO
C[C@H]1CC(C)(C)C[C@@](CO)([NH2+]CCn2cncn2)C1	ZINC000096452928	230376397	/nfs/dbraw/zinc/37/63/97/230376397.db2.gz	YRPHQYGUKHQZEE-JSGCOSHPSA-N	1	0	266.389	1.445	50	0		CDAARO
C[C@H](C[NH3+])N(C)C(=O)c1ccccc1Br	ZINC000096482550	230380550	/nfs/dbraw/zinc/38/05/50/230380550.db2.gz	IFUWVMOYEYAWJF-MRVPVSSYSA-N	1	0	271.158	1.868	50	0		CDAARO
c1cn(C[C@@H]2CCC[N@@H+](CCc3ccncc3)C2)nn1	ZINC000096483691	230380973	/nfs/dbraw/zinc/38/09/73/230380973.db2.gz	LLSSHFLUHJQYKW-OAHLLOKOSA-N	1	0	271.368	1.628	50	0		CDAARO
Cn1c(C(=O)OCC[NH+](C)C)cc(=O)c2ccccc21	ZINC000096027964	341986121	/nfs/dbraw/zinc/98/61/21/341986121.db2.gz	XBFKAZFHYZQAEU-UHFFFAOYSA-N	1	0	274.320	1.257	50	0		CDAARO
O=C(N[C@H]1C[NH2+]CCC1(F)F)OCc1ccccc1	ZINC000110916123	342561586	/nfs/dbraw/zinc/56/15/86/342561586.db2.gz	CYAZBXNRJGQQSC-NSHDSACASA-N	1	0	270.279	1.910	50	0		CDAARO
CCOC(=O)[C@](C)(O)C[N@H+](C)[C@@H]1CC[C@H](SCC)C1	ZINC000095943818	185036960	/nfs/dbraw/zinc/03/69/60/185036960.db2.gz	NFUOPTAWQCUYHU-MBNYWOFBSA-N	1	0	289.441	1.907	50	0		CDAARO
[NH3+]C1CCN(C(=O)C2(Cc3ccccc3)CC2)CC1	ZINC000095971444	185048699	/nfs/dbraw/zinc/04/86/99/185048699.db2.gz	DCFBOBNRDDXNCT-UHFFFAOYSA-N	1	0	258.365	1.959	50	0		CDAARO
Cc1cccc(OC2CC[NH+](CCCO)CC2)n1	ZINC000096007827	185063688	/nfs/dbraw/zinc/06/36/88/185063688.db2.gz	VJBYTLWXTNWPRF-UHFFFAOYSA-N	1	0	250.342	1.616	50	0		CDAARO
CCN(C)c1ccc(C[NH+]2CCC(C(=O)NC)CC2)cn1	ZINC000240886223	361751088	/nfs/dbraw/zinc/75/10/88/361751088.db2.gz	INWXSERNEBLVSF-UHFFFAOYSA-N	1	0	290.411	1.496	50	0		CDAARO
CC[N@H+](C)CCNC(=O)c1c[nH]c(=O)c2ccccc12	ZINC000241644172	361752852	/nfs/dbraw/zinc/75/28/52/361752852.db2.gz	POWKVVQMEYUZAJ-UHFFFAOYSA-N	1	0	273.336	1.622	50	0		CDAARO
C[C@H](CNC(=O)OC(C)(C)C)[N@H+](C)CCn1cncn1	ZINC000242292583	361756000	/nfs/dbraw/zinc/75/60/00/361756000.db2.gz	YNLNNMQHZBOXHK-LLVKDONJSA-N	1	0	283.376	1.123	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@@H](O)C2)c(OC)c1C	ZINC000004977597	342089133	/nfs/dbraw/zinc/08/91/33/342089133.db2.gz	WGPVDNSATDVAPK-CYBMUJFWSA-N	1	0	265.353	1.969	50	0		CDAARO
CCOCC1CCN(C(=O)C[C@H]([NH3+])C2CC2)CC1	ZINC000195559555	342628464	/nfs/dbraw/zinc/62/84/64/342628464.db2.gz	ZLBVVXIAFMDJFW-ZDUSSCGKSA-N	1	0	254.374	1.389	50	0		CDAARO
CCc1nnc(NC(=O)CC[N@@H+]2CCCO[C@@H](C)C2)s1	ZINC000244633228	361854765	/nfs/dbraw/zinc/85/47/65/361854765.db2.gz	FZJDHFHHEJQUTR-JTQLQIEISA-N	1	0	298.412	1.540	50	0		CDAARO
CSCC1CC[NH+](CCn2cc[nH]c2=O)CC1	ZINC000244866429	361866445	/nfs/dbraw/zinc/86/64/45/361866445.db2.gz	VWCCLBKWAIBQJI-UHFFFAOYSA-N	1	0	255.387	1.251	50	0		CDAARO
CC(C)c1cc(C(=O)N2CC[C@@H]([NH3+])C2)nn1C(C)(C)C	ZINC000097019407	185152815	/nfs/dbraw/zinc/15/28/15/185152815.db2.gz	FEDJCMBDSWURJS-LLVKDONJSA-N	1	0	278.400	1.935	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@@H]2CCC[C@H](C(N)=O)C2)cc1	ZINC000097034917	185156839	/nfs/dbraw/zinc/15/68/39/185156839.db2.gz	DYLDOWJPAVZMJG-UONOGXRCSA-N	1	0	290.363	1.607	50	0		CDAARO
COC(=O)c1cc(C[NH2+][C@@H](C)[C@@H]2CCOC2)oc1C	ZINC000097034930	185157289	/nfs/dbraw/zinc/15/72/89/185157289.db2.gz	FYZSMVYYYOBMEO-GXSJLCMTSA-N	1	0	267.325	1.889	50	0		CDAARO
CCn1cc(O[C@@H]2CCC[C@@H]2[NH2+][C@H]2CCOC2)cn1	ZINC000685941397	539045938	/nfs/dbraw/zinc/04/59/38/539045938.db2.gz	WHXWLVOMPXXZAA-FPMFFAJLSA-N	1	0	265.357	1.581	50	0		CDAARO
CC[C@H](C(=O)N1CC[C@H](Oc2ccccn2)C1)[NH+](C)C	ZINC000096477441	529601172	/nfs/dbraw/zinc/60/11/72/529601172.db2.gz	PIGIQYZJKMFLRA-QWHCGFSZSA-N	1	0	277.368	1.402	50	0		CDAARO
Cc1ncc(CN2CC[N@@H+](CC(C)(C)O)C[C@@H]2C)o1	ZINC000585120800	362040320	/nfs/dbraw/zinc/04/03/20/362040320.db2.gz	LTVCTQSLZIBLJC-NSHDSACASA-N	1	0	267.373	1.260	50	0		CDAARO
Cc1cnccc1CC[NH2+]CCCc1cnn(C)c1	ZINC000585117110	362045300	/nfs/dbraw/zinc/04/53/00/362045300.db2.gz	QYWJRJDQQDENDX-UHFFFAOYSA-N	1	0	258.369	1.888	50	0		CDAARO
NC(=O)[C@@H]1CC[N@H+](Cc2ccccc2OCCCCO)C1	ZINC000585117789	362046231	/nfs/dbraw/zinc/04/62/31/362046231.db2.gz	XDBQOMBCCFWCJD-CQSZACIVSA-N	1	0	292.379	1.145	50	0		CDAARO
COC(C[N@@H+]1CC[C@H](Oc2cccc(F)c2)C1)OC	ZINC000189183683	342357912	/nfs/dbraw/zinc/35/79/12/342357912.db2.gz	GEEMNBIJBAQMNL-ZDUSSCGKSA-N	1	0	269.316	1.898	50	0		CDAARO
CCn1c(C)nnc1CN1CC[C@@H](C[NH+]2CCCCC2)C1	ZINC000083836899	362254679	/nfs/dbraw/zinc/25/46/79/362254679.db2.gz	AIIUMBZFKYBXPU-HNNXBMFYSA-N	1	0	291.443	1.914	50	0		CDAARO
CN(C[C@H]1CCC[N@H+](C)C1)c1nc2ccccc2c(=O)[nH]1	ZINC000083877713	362255445	/nfs/dbraw/zinc/25/54/45/362255445.db2.gz	FQNKZYMEOLPWDP-LBPRGKRZSA-N	1	0	286.379	1.701	50	0		CDAARO
Cc1ncnc(N2CCN(CC[NH+]3CCCC3)CC2)c1C	ZINC000095359608	136516070	/nfs/dbraw/zinc/51/60/70/136516070.db2.gz	HECKCHKSQMRUCP-UHFFFAOYSA-N	1	0	289.427	1.311	50	0		CDAARO
Cn1cc([C@@H]2OCC[C@@H]2C[NH2+]C2CCSCC2)cn1	ZINC000089755283	347612096	/nfs/dbraw/zinc/61/20/96/347612096.db2.gz	CDPJRLBBJYIPRA-BXUZGUMPSA-N	1	0	281.425	1.983	50	0		CDAARO
C[NH2+][C@@H](C)c1nc2ccccc2c(=O)n1CCOC	ZINC000019927548	348746157	/nfs/dbraw/zinc/74/61/57/348746157.db2.gz	KHTIJJLXANRNJH-JTQLQIEISA-N	1	0	261.325	1.323	50	0		CDAARO
c1cc(C[NH2+][C@H]2CCCSC2)cc(-c2nn[nH]n2)c1	ZINC000095143878	348748674	/nfs/dbraw/zinc/74/86/74/348748674.db2.gz	ZHOBKYMNVWOTOF-LBPRGKRZSA-N	1	0	275.381	1.852	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1Cn1cnc2ncccc2c1=O	ZINC000584885234	349343421	/nfs/dbraw/zinc/34/34/21/349343421.db2.gz	HIRROSNIINLSTP-NSHDSACASA-N	1	0	258.325	1.276	50	0		CDAARO
O=C([C@@H]1CCOC1)N1CCC[N@@H+](C2CCCCC2)CC1	ZINC000584886686	349344834	/nfs/dbraw/zinc/34/48/34/349344834.db2.gz	XAYDRIDEVNRAJH-CQSZACIVSA-N	1	0	280.412	1.890	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H]1CN(C(=O)c1cnc(N)s1)C2	ZINC000584895458	349356048	/nfs/dbraw/zinc/35/60/48/349356048.db2.gz	ZGQOYLJEHRDOFJ-UWVGGRQHSA-N	1	0	280.397	1.112	50	0		CDAARO
C[C@@H](CN1CCCCCC1)[NH2+]CCc1cnn(C)c1	ZINC000584898418	349359992	/nfs/dbraw/zinc/35/99/92/349359992.db2.gz	WYFXWDFKOBZBQN-AWEZNQCLSA-N	1	0	264.417	1.817	50	0		CDAARO
C[C@H]1CCCN(C(=O)c2csc(CC[NH3+])n2)[C@H]1C	ZINC000090953605	180073956	/nfs/dbraw/zinc/07/39/56/180073956.db2.gz	JLHLPFLQXGVFJT-UWVGGRQHSA-N	1	0	267.398	1.905	50	0		CDAARO
Cc1cc(CC(=O)N2C[C@H]([NH3+])[C@@H](c3ccccc3)C2)on1	ZINC000091433942	180154201	/nfs/dbraw/zinc/15/42/01/180154201.db2.gz	WKMMVOFNLQYQST-CABCVRRESA-N	1	0	285.347	1.479	50	0		CDAARO
COc1ccc(S(=O)(=O)N[C@@H]2CCC[NH2+][C@@H]2C)cc1	ZINC000091496952	180172708	/nfs/dbraw/zinc/17/27/08/180172708.db2.gz	ZDCITDQMJRNFNM-ZWNOBZJWSA-N	1	0	284.381	1.114	50	0		CDAARO
O=C1CCC2(CC[NH2+]CC2)CN1Cc1nnc2ccccn21	ZINC000091595425	180201242	/nfs/dbraw/zinc/20/12/42/180201242.db2.gz	ZUHCGYGZQODOQI-UHFFFAOYSA-N	1	0	299.378	1.222	50	0		CDAARO
CCn1nc(CC(C)C)cc1C(=O)N1CC[C@@H]([NH3+])C1	ZINC000091603078	180202887	/nfs/dbraw/zinc/20/28/87/180202887.db2.gz	AAEMAQBPCTZYPA-LLVKDONJSA-N	1	0	264.373	1.275	50	0		CDAARO
Cc1ccc2[nH]c(C[NH2+]C[C@@H]3CCOC3)cc(=O)c2c1	ZINC000091535160	180182294	/nfs/dbraw/zinc/18/22/94/180182294.db2.gz	JUDMMXBRNRSVGZ-LBPRGKRZSA-N	1	0	272.348	1.963	50	0		CDAARO
CN(Cc1cc(=O)c2cccc(F)c2[nH]1)C1CC[NH2+]CC1	ZINC000091636395	180211262	/nfs/dbraw/zinc/21/12/62/180211262.db2.gz	RLKFESHZHMVZKM-UHFFFAOYSA-N	1	0	289.354	1.851	50	0		CDAARO
CCOc1ccc(C[NH2+]C[C@H]2CN(C)CCO2)cc1OC	ZINC000105472197	186059021	/nfs/dbraw/zinc/05/90/21/186059021.db2.gz	HAUIERFBXGNZTE-AWEZNQCLSA-N	1	0	294.395	1.514	50	0		CDAARO
Cc1[nH+]c(N)nc(N(C)CCN2CCCCC2=O)c1C	ZINC000092019508	180307584	/nfs/dbraw/zinc/30/75/84/180307584.db2.gz	ZXVSZYRYODMPGS-UHFFFAOYSA-N	1	0	277.372	1.124	50	0		CDAARO
CCOCCN1C[C@H]([NH3+])[C@@H](c2cccc(OC)c2)C1	ZINC000092037470	180310484	/nfs/dbraw/zinc/31/04/84/180310484.db2.gz	RWYZWTYWEBPFCL-CABCVRRESA-N	1	0	264.369	1.458	50	0		CDAARO
C[C@@H]1C[N@H+](CC(=O)NCC2CCCCC2)C[C@]1(C)O	ZINC000092077255	180317649	/nfs/dbraw/zinc/31/76/49/180317649.db2.gz	SBKRUPIEUFTNLO-DOMZBBRYSA-N	1	0	268.401	1.386	50	0		CDAARO
CSc1ccccc1C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000092232072	180348604	/nfs/dbraw/zinc/34/86/04/180348604.db2.gz	WWICQALOFUCNSX-JTQLQIEISA-N	1	0	250.367	1.842	50	0		CDAARO
C[C@H](CNC(=S)NC1CC1)[N@@H+]1CCCC[C@@H]1C	ZINC000106067947	186100182	/nfs/dbraw/zinc/10/01/82/186100182.db2.gz	QIXTWBPORUQHCJ-WDEREUQCSA-N	1	0	255.431	1.876	50	0		CDAARO
CC(=O)N1CCN([C@@H]2C[N@@H+](CC3CCC3)C[C@H]2C)CC1	ZINC000257365969	350963956	/nfs/dbraw/zinc/96/39/56/350963956.db2.gz	DLZPENQESHEACN-CZUORRHYSA-N	1	0	279.428	1.271	50	0		CDAARO
CC[C@H](C)CS(=O)(=O)NC[C@H]([NH3+])c1ccccc1	ZINC000123794968	351286827	/nfs/dbraw/zinc/28/68/27/351286827.db2.gz	RHFAFYFXLURTRJ-AAEUAGOBSA-N	1	0	270.398	1.652	50	0		CDAARO
C[C@H](CCn1cccn1)[NH2+][C@@H]1CCCC[C@@H]1C(N)=O	ZINC000124110439	351324373	/nfs/dbraw/zinc/32/43/73/351324373.db2.gz	FODIDOQZNWPCBU-FRRDWIJNSA-N	1	0	264.373	1.295	50	0		CDAARO
CC(C)=CC[NH2+][C@@H]1CCC(=O)N(C)[C@H]1c1ccnn1C	ZINC000284556960	351594569	/nfs/dbraw/zinc/59/45/69/351594569.db2.gz	OAYLHGVXHGXBIW-IUODEOHRSA-N	1	0	276.384	1.638	50	0		CDAARO
CN(CC(=O)NC1CCCCCC1)Cc1cnn(C)c1	ZINC000014191821	366131655	/nfs/dbraw/zinc/13/16/55/366131655.db2.gz	XNDMDSAKGVRKNW-UHFFFAOYSA-N	1	0	278.400	1.691	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1CC(OC(=O)[C@H](O)c1ccccc1)C2	ZINC000000000367	355879295	/nfs/dbraw/zinc/87/92/95/355879295.db2.gz	ZTVIKZXZYLEVOL-IZGVIRRGSA-N	1	0	275.348	1.888	50	0	in-vitro	CDAARO
CS(=O)(=O)NC1CC[NH+](Cc2ccccc2)CC1	ZINC000000029517	355879624	/nfs/dbraw/zinc/87/96/24/355879624.db2.gz	XULOBRVEVUMRRD-UHFFFAOYSA-N	1	0	268.382	1.200	50	0		CDAARO
CC1(C)NC(=[NH2+])NC(=N)N1c1ccccc1Br	ZINC000000183513	355894467	/nfs/dbraw/zinc/89/44/67/355894467.db2.gz	KUOQECBJRJUUOV-UHFFFAOYSA-N	1	0	296.172	1.635	50	0		CDAARO
CC(C)OC[C@H](O)C[NH+]1C(C)(C)CC(O)CC1(C)C	ZINC000002841832	355984250	/nfs/dbraw/zinc/98/42/50/355984250.db2.gz	ZQXIPLZTOPFMPD-CYBMUJFWSA-N	1	0	273.417	1.786	50	0		CDAARO
O=c1c2nccnc2ncn1C[C@@H]1CC[N@@H+](C2CCCC2)C1	ZINC000584901790	355956440	/nfs/dbraw/zinc/95/64/40/355956440.db2.gz	YCTMMVACWVOHHO-GFCCVEGCSA-N	1	0	299.378	1.451	50	0		CDAARO
CCOc1ccc(C[NH2+]CCOCCO)cc1Cl	ZINC000010436449	356258561	/nfs/dbraw/zinc/25/85/61/356258561.db2.gz	KUTLDEFEADBJDE-UHFFFAOYSA-N	1	0	273.760	1.837	50	0		CDAARO
Cc1ccc(C)c(O[C@@H](C)C(=O)N2CCN(C)CC2)c1	ZINC000013710660	356353985	/nfs/dbraw/zinc/35/39/85/356353985.db2.gz	KLCKVASULLWZDI-AWEZNQCLSA-N	1	0	276.380	1.845	50	0		CDAARO
OC[C@H]1CCC[N@H+](Cc2cc(F)cc3c2OCOC3)C1	ZINC000016047122	356430414	/nfs/dbraw/zinc/43/04/14/356430414.db2.gz	PFJHBDFPOOKYCC-NSHDSACASA-N	1	0	281.327	1.897	50	0		CDAARO
CCOc1ccc(Cl)cc1CNCC[NH2+]C[C@H](C)O	ZINC000019370694	356483158	/nfs/dbraw/zinc/48/31/58/356483158.db2.gz	KLNGOBWTMLNDJK-NSHDSACASA-N	1	0	286.803	1.799	50	0		CDAARO
Cc1cc(C)cc(NC(=O)CC[NH+]2CCN(C)CC2)c1	ZINC000019569636	356492265	/nfs/dbraw/zinc/49/22/65/356492265.db2.gz	SFMWVYCGUMXQOC-UHFFFAOYSA-N	1	0	275.396	1.879	50	0		CDAARO
C[NH+]1CCN(c2ccc(NC(=O)c3ccco3)cn2)CC1	ZINC000020371997	356539366	/nfs/dbraw/zinc/53/93/66/356539366.db2.gz	YSOQTWAQOVIQTM-UHFFFAOYSA-N	1	0	286.335	1.679	50	0		CDAARO
C[C@H](Cn1cccn1)[NH2+]Cc1cccc2c1OCCO2	ZINC000037154732	363492038	/nfs/dbraw/zinc/49/20/38/363492038.db2.gz	HEOZPMXUXPEZNN-GFCCVEGCSA-N	1	0	273.336	1.833	50	0		CDAARO
O=S(=O)(NCC1(C(F)(F)F)CC[NH2+]CC1)C1CC1	ZINC000725264707	538455693	/nfs/dbraw/zinc/45/56/93/538455693.db2.gz	LPYFHLIJOHIWEH-UHFFFAOYSA-N	1	0	286.319	1.000	50	0		CDAARO
CCCC(=O)N1CCC(C[NH3+])(C(F)(F)F)CC1	ZINC000725264748	538455781	/nfs/dbraw/zinc/45/57/81/538455781.db2.gz	UISDDMGKZVQMOO-UHFFFAOYSA-N	1	0	252.280	1.916	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COCc2ccc(C)cc2)CC1	ZINC000023114583	356627917	/nfs/dbraw/zinc/62/79/17/356627917.db2.gz	XSMDWQCZZRUWPK-QGZVFWFLSA-N	1	0	292.423	1.510	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)Nc2cccnc2Cl)CC1	ZINC000023095797	356627975	/nfs/dbraw/zinc/62/79/75/356627975.db2.gz	QRDNAVIDRQZIJZ-UHFFFAOYSA-N	1	0	296.802	1.701	50	0		CDAARO
Cc1ccc(Nc2cc(N3CC[NH2+]CC3)ncn2)cc1	ZINC000026442138	356693420	/nfs/dbraw/zinc/69/34/20/356693420.db2.gz	YHXJPXOZKJPOHL-UHFFFAOYSA-N	1	0	269.352	1.938	50	0		CDAARO
Cc1cc(NC(=O)NC[C@@H]2C[N@H+](CC(C)C)CCO2)no1	ZINC000029077256	356729968	/nfs/dbraw/zinc/72/99/68/356729968.db2.gz	VCOBUPNLGBVRQG-GFCCVEGCSA-N	1	0	296.371	1.461	50	0		CDAARO
COCCCNC(=O)C[N@H+](C)[C@H]1CCc2ccccc21	ZINC000029810660	356743386	/nfs/dbraw/zinc/74/33/86/356743386.db2.gz	QETGXWXLGUOWJW-HNNXBMFYSA-N	1	0	276.380	1.758	50	0		CDAARO
O=C(COc1ccc(Br)cc1)N1CC[NH2+]CC1	ZINC000032066559	356773364	/nfs/dbraw/zinc/77/33/64/356773364.db2.gz	DTXZJPBYINJULD-UHFFFAOYSA-N	1	0	299.168	1.260	50	0		CDAARO
C[NH+]1CCC(OC(=O)[C@@]23CC[C@@](C)(C(=O)O2)C3(C)C)CC1	ZINC000004197187	356816080	/nfs/dbraw/zinc/81/60/80/356816080.db2.gz	AYCGEVZSNNICMM-JKSUJKDBSA-N	1	0	295.379	1.746	50	0		CDAARO
Cc1cc(NCc2nnc3n2CCCC3)nc(N(C)C)[nH+]1	ZINC000032519476	356781562	/nfs/dbraw/zinc/78/15/62/356781562.db2.gz	PLRKZMTWTQSXBX-UHFFFAOYSA-N	1	0	287.371	1.391	50	0		CDAARO
CCN(C/C=C/c1ccccc1)C(=O)C[C@@H]1C[NH2+]CCO1	ZINC000055060775	357328376	/nfs/dbraw/zinc/32/83/76/357328376.db2.gz	WQMDMGWCRFPOME-YXMGTMDOSA-N	1	0	288.391	1.927	50	0		CDAARO
CCOC(=O)CN(C)[C@@H](C)Cc1cc(C)ccn1	ZINC000055309950	357332158	/nfs/dbraw/zinc/33/21/58/357332158.db2.gz	QDZWVXNIYCYMEI-LBPRGKRZSA-N	1	0	250.342	1.816	50	0		CDAARO
C[C@@H](CC(=O)N(C)c1ccccc1)[NH2+]Cc1ccnn1C	ZINC000095420188	357335403	/nfs/dbraw/zinc/33/54/03/357335403.db2.gz	MVILBONRASZRFR-ZDUSSCGKSA-N	1	0	286.379	1.951	50	0		CDAARO
C[C@@H](C(=O)N1CCCn2cncc2C1)[N@@H+]1CCC[C@H](C)C1	ZINC000072172991	357515688	/nfs/dbraw/zinc/51/56/88/357515688.db2.gz	WRVXAEMEHRWOKH-KBPBESRZSA-N	1	0	290.411	1.736	50	0		CDAARO
Cc1cnc(C[NH2+]CCC(=O)Nc2cccnc2)cn1	ZINC000065410776	357539320	/nfs/dbraw/zinc/53/93/20/357539320.db2.gz	ZCUHYSUPRWUWRP-UHFFFAOYSA-N	1	0	271.324	1.298	50	0		CDAARO
Cc1cc(N2CC[C@@H]([NH+](C)C)C2)nc(-c2cccnc2)n1	ZINC000065507621	357546851	/nfs/dbraw/zinc/54/68/51/357546851.db2.gz	BLWOWQQBTNBGTF-CQSZACIVSA-N	1	0	283.379	1.987	50	0		CDAARO
O=C(Cn1cc(Cl)cn1)N1CC[C@@]2(C1)CCC[NH2+]C2	ZINC000067784341	357626018	/nfs/dbraw/zinc/62/60/18/357626018.db2.gz	NCUSLLUQMOPUQK-ZDUSSCGKSA-N	1	0	282.775	1.139	50	0		CDAARO
CCCCc1nc(Cl)c(CN2CCO[C@H](C[NH3+])C2)[nH]1	ZINC000067675621	357618213	/nfs/dbraw/zinc/61/82/13/357618213.db2.gz	LYXSTHQJABHYQD-SNVBAGLBSA-N	1	0	286.807	1.565	50	0		CDAARO
CCOc1c(CN[C@H]2CCC[NH2+]C2)cccc1OC	ZINC000067841688	357631677	/nfs/dbraw/zinc/63/16/77/357631677.db2.gz	UBNGIDBNTKDDJB-ZDUSSCGKSA-N	1	0	264.369	1.936	50	0		CDAARO
Cn1nc([C@H]2CCC[N@H+](C)C2)n(-c2ccccc2)c1=O	ZINC000067854769	357632860	/nfs/dbraw/zinc/63/28/60/357632860.db2.gz	DSSQIKPALBILRJ-LBPRGKRZSA-N	1	0	272.352	1.380	50	0		CDAARO
NC(=O)C1CC[NH+](C[C@@H]2CCOc3ccccc3C2)CC1	ZINC000095507521	283282760	/nfs/dbraw/zinc/28/27/60/283282760.db2.gz	AOCXBGPUKJCENR-CYBMUJFWSA-N	1	0	288.391	1.825	50	0		CDAARO
Cn1cc(C[N@H+](C)CC[C@@H](O)c2ccccc2)cn1	ZINC000053933418	357807808	/nfs/dbraw/zinc/80/78/08/357807808.db2.gz	LRXNKAIQTMXHSO-OAHLLOKOSA-N	1	0	259.353	1.976	50	0		CDAARO
Cn1c(CN2CCCCC2)nnc1[C@@H]1CCC[N@H+](C)C1	ZINC000072436300	357835524	/nfs/dbraw/zinc/83/55/24/357835524.db2.gz	SLHAOCNIJZVKKP-CYBMUJFWSA-N	1	0	277.416	1.610	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)Nc2ccc3c(c2)C(=O)OC3)C1	ZINC000072435902	357835562	/nfs/dbraw/zinc/83/55/62/357835562.db2.gz	VFHAGCJITLESHV-WCBMZHEXSA-N	1	0	260.293	1.423	50	0		CDAARO
CCCC(=O)N1CCN(c2cc(N(C)C)[nH+]c(C)n2)CC1	ZINC000072437949	357836185	/nfs/dbraw/zinc/83/61/85/357836185.db2.gz	SABWSMVABQVJAQ-UHFFFAOYSA-N	1	0	291.399	1.300	50	0		CDAARO
c1cc2c(s1)CCN(c1ncnc3c1CC[NH2+]CC3)C2	ZINC000072435788	357836232	/nfs/dbraw/zinc/83/62/32/357836232.db2.gz	XVGMICLMNWYNCA-UHFFFAOYSA-N	1	0	286.404	1.789	50	0		CDAARO
OC[C@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1O)c1ccccc1	ZINC000097234818	358050500	/nfs/dbraw/zinc/05/05/00/358050500.db2.gz	MNGSIXOJRACXGG-IKGGRYGDSA-N	1	0	269.344	1.968	50	0		CDAARO
Cc1nc(CC(=O)N2CCCC[C@H]([NH+](C)C)C2)cs1	ZINC000082115012	358148035	/nfs/dbraw/zinc/14/80/35/358148035.db2.gz	BEPPSEALHAMRMF-ZDUSSCGKSA-N	1	0	281.425	1.937	50	0		CDAARO
Cc1cccc(-n2ncc3c2CCC[C@H]3NC(=O)C[NH3+])c1C	ZINC000091847290	358529989	/nfs/dbraw/zinc/52/99/89/358529989.db2.gz	XRFBORDNYDAPEG-CQSZACIVSA-N	1	0	298.390	1.941	50	0		CDAARO
C[C@@H]1C[N@@H+](CCC(=O)N2CC(C)(C)[C@@](C)(O)C2)C[C@H](C)O1	ZINC000091907177	358532771	/nfs/dbraw/zinc/53/27/71/358532771.db2.gz	PHJYSNNYEGXUHP-ZENOOKHLSA-N	1	0	298.427	1.105	50	0		CDAARO
CC(C)[NH2+]C[C@]1(O)CCCN(CC2CCCCC2)C1=O	ZINC000012090406	358538318	/nfs/dbraw/zinc/53/83/18/358538318.db2.gz	KWXQLIJPPGRXGV-MRXNPFEDSA-N	1	0	282.428	1.918	50	0		CDAARO
CC(C)(C)c1nnc(NCc2cc3n(n2)CC[NH2+]C3)o1	ZINC000095375721	358688606	/nfs/dbraw/zinc/68/86/06/358688606.db2.gz	HLHNICZOATTWJW-UHFFFAOYSA-N	1	0	276.344	1.279	50	0		CDAARO
O=C(CCC[NH+]1CCCCC1)N[C@@H]1CCc2n[nH]cc2C1	ZINC000095381145	358690463	/nfs/dbraw/zinc/69/04/63/358690463.db2.gz	BPPZWNDFTKXGPR-CQSZACIVSA-N	1	0	290.411	1.649	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CCC(=O)NCCn1cccc1	ZINC000095390390	358692272	/nfs/dbraw/zinc/69/22/72/358692272.db2.gz	MWTMLHMFQSLGDO-CQSZACIVSA-N	1	0	263.385	1.869	50	0		CDAARO
CC(C)Oc1ccccc1NC(=O)N[C@@H]1CC[NH2+]C1	ZINC000097294609	358765165	/nfs/dbraw/zinc/76/51/65/358765165.db2.gz	OJDLJQXMEUFFMU-LLVKDONJSA-N	1	0	263.341	1.957	50	0		CDAARO
CCc1[nH]nc(C(=O)N2CC[C@@H]([NH+](CC)CC)C2)c1C	ZINC000097347045	358768857	/nfs/dbraw/zinc/76/88/57/358768857.db2.gz	TUFBLPDVPFTSHD-GFCCVEGCSA-N	1	0	278.400	1.837	50	0		CDAARO
CC(C)(C)OC(=O)[C@@H](c1ccccc1)N1CC[C@H]([NH3+])C1=O	ZINC000096300612	358731845	/nfs/dbraw/zinc/73/18/45/358731845.db2.gz	XDUUTRYCHAVIAF-QWHCGFSZSA-N	1	0	290.363	1.629	50	0		CDAARO
C[C@@H](NC(=O)C1(O)CC[NH+](C)CC1)c1cc(F)cc(F)c1	ZINC000097475064	358778969	/nfs/dbraw/zinc/77/89/69/358778969.db2.gz	RBPSMCLMVAONRD-SNVBAGLBSA-N	1	0	298.333	1.599	50	0		CDAARO
O=C(NCc1ccon1)c1ccc(C[NH+]2CCCC2)o1	ZINC000097636587	358789471	/nfs/dbraw/zinc/78/94/71/358789471.db2.gz	PXCYBFVIOIPFGM-UHFFFAOYSA-N	1	0	275.308	1.793	50	0		CDAARO
CCn1nc(C)c(CCNC(=O)C[C@H]2CCC[N@@H+]2C)c1C	ZINC000097744593	358795200	/nfs/dbraw/zinc/79/52/00/358795200.db2.gz	HLZKOLATUGTLNR-CQSZACIVSA-N	1	0	292.427	1.663	50	0		CDAARO
O=C(C[C@@H]1COCCN1CCCO)c1cccs1	ZINC000119624890	358912583	/nfs/dbraw/zinc/91/25/83/358912583.db2.gz	PLTDIMHHCHJCGY-LLVKDONJSA-N	1	0	269.366	1.404	50	0		CDAARO
Nc1cccc(C(=O)NC[C@@H]2CCC[N@@H+]3CCCC[C@H]23)n1	ZINC000215104169	358875262	/nfs/dbraw/zinc/87/52/62/358875262.db2.gz	ZWCMFBPDUZEOSZ-GXTWGEPZSA-N	1	0	288.395	1.658	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CC(=O)NCCc1ccc(O)cc1	ZINC000215593776	358895379	/nfs/dbraw/zinc/89/53/79/358895379.db2.gz	PLRMAQQWPOZBRY-CQSZACIVSA-N	1	0	276.380	1.925	50	0		CDAARO
Cc1nc(CN(CC[NH+](C)C)C[C@@H]2CCCO2)co1	ZINC000216205484	358930975	/nfs/dbraw/zinc/93/09/75/358930975.db2.gz	YPDUYMPJJXZUKY-AWEZNQCLSA-N	1	0	267.373	1.526	50	0		CDAARO
C[NH+](C)[C@H]1[C@@H]2OCC[C@@H]2[C@@H]1NC(=O)CC1=CCCC1	ZINC000219509032	359102030	/nfs/dbraw/zinc/10/20/30/359102030.db2.gz	KKSRYDLAEUDZIJ-FAAHXZRKSA-N	1	0	264.369	1.321	50	0		CDAARO
CC[N@H+](C1CN(C(=O)c2ccco2)C1)C1CCOCC1	ZINC000257180408	359207350	/nfs/dbraw/zinc/20/73/50/359207350.db2.gz	KSQTUBIBZCFKOU-UHFFFAOYSA-N	1	0	278.352	1.605	50	0		CDAARO
O=C(C[NH+]1CCCC1)NCCCn1cc(Cl)cn1	ZINC000222435049	359342748	/nfs/dbraw/zinc/34/27/48/359342748.db2.gz	TZYYDKAUQAYCHF-UHFFFAOYSA-N	1	0	270.764	1.139	50	0		CDAARO
Cc1ccc(C[N@@H+]2CCOCCNC(=O)CC2)s1	ZINC000257181628	359399289	/nfs/dbraw/zinc/39/92/89/359399289.db2.gz	FTCMHHWNBJJBGD-UHFFFAOYSA-N	1	0	268.382	1.395	50	0		CDAARO
C[C@H](c1ccncn1)N(C)C(=O)C[N@H+](C)C1CCCC1	ZINC000223153536	359403937	/nfs/dbraw/zinc/40/39/37/359403937.db2.gz	UILDBPJOLLNSJG-GFCCVEGCSA-N	1	0	276.384	1.870	50	0		CDAARO
C[N@H+]1C[C@H]2CN(C(=O)CCc3cccnc3)C[C@H]2C1	ZINC000223637477	359441782	/nfs/dbraw/zinc/44/17/82/359441782.db2.gz	LIHJQIOQJFDGTA-OKILXGFUSA-N	1	0	259.353	1.034	50	0		CDAARO
NC(=[NH2+])c1ccc(-n2cccn2)cc1Br	ZINC000228248223	359608410	/nfs/dbraw/zinc/60/84/10/359608410.db2.gz	AVALEBWYRGHUFD-UHFFFAOYSA-N	1	0	265.114	1.919	50	0		CDAARO
C[NH+](C)CCNC(=O)c1nc(-c2ccc3cc[nH]c3c2)no1	ZINC000012389344	359640752	/nfs/dbraw/zinc/64/07/52/359640752.db2.gz	SFJSCZQQXIXNFD-UHFFFAOYSA-N	1	0	299.334	1.509	50	0		CDAARO
Cc1nn(C)cc1C(=O)N1CCN(C)Cc2ccccc21	ZINC000084044385	360101575	/nfs/dbraw/zinc/10/15/75/360101575.db2.gz	CLBTZKUSNKLGDO-UHFFFAOYSA-N	1	0	284.363	1.821	50	0		CDAARO
C[C@H]1CN(C)CCN1C(=O)c1ccc(C[NH+](C)C)cc1	ZINC000089938499	360198485	/nfs/dbraw/zinc/19/84/85/360198485.db2.gz	UHOGYVZICJGKTI-ZDUSSCGKSA-N	1	0	275.396	1.524	50	0		CDAARO
CCn1cc(CN2CC(=O)NCC23CCCC3)c(C)n1	ZINC000409420217	360222851	/nfs/dbraw/zinc/22/28/51/360222851.db2.gz	ULZOMZRZQYAVAD-UHFFFAOYSA-N	1	0	276.384	1.456	50	0		CDAARO
Cc1cc(CN2CC[C@@H]([NH+]3CCCCCC3)[C@H](O)C2)[nH]n1	ZINC000011935244	360458722	/nfs/dbraw/zinc/45/87/22/360458722.db2.gz	IPYHBUTYCAWDCK-HZPDHXFCSA-N	1	0	292.427	1.529	50	0		CDAARO
Cc1cc(F)ccc1C[NH2+]CC1(C(N)=O)CCOCC1	ZINC000089587664	360500393	/nfs/dbraw/zinc/50/03/93/360500393.db2.gz	VDBDPIJKSOEIOW-UHFFFAOYSA-N	1	0	280.343	1.506	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)c2cnc(-c3ccncc3)s2)C1	ZINC000178320960	189106678	/nfs/dbraw/zinc/10/66/78/189106678.db2.gz	HDPGZBDNZHYSCD-NSHDSACASA-N	1	0	288.376	1.768	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2ccccc2Cn2cccn2)C1	ZINC000426511834	360679056	/nfs/dbraw/zinc/67/90/56/360679056.db2.gz	WIEPQGLZTNGIRD-OAHLLOKOSA-N	1	0	256.353	1.464	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)[C@H](C)n2ccnc2C)CC1	ZINC000426511570	360679101	/nfs/dbraw/zinc/67/91/01/360679101.db2.gz	FEQUVORSKVQMEI-LBPRGKRZSA-N	1	0	278.400	1.743	50	0		CDAARO
C[C@@H](C(=O)NCc1cnc2cnccn12)[NH+]1CCCCC1	ZINC000426383727	360661288	/nfs/dbraw/zinc/66/12/88/360661288.db2.gz	CVAHVKAOSGTTKC-LBPRGKRZSA-N	1	0	287.367	1.220	50	0		CDAARO
COc1cc(/C=C/C(=O)N2CC[C@H](C[NH3+])C2)cc(OC)c1	ZINC000178566561	189127790	/nfs/dbraw/zinc/12/77/90/189127790.db2.gz	DYCQKMJYVXRNEM-ITDFMYJTSA-N	1	0	290.363	1.524	50	0		CDAARO
CC1CCN(C(=O)CCSc2nnc(C[NH3+])n2C)CC1	ZINC000426727371	360700192	/nfs/dbraw/zinc/70/01/92/360700192.db2.gz	GVLQTBKJUQYENA-UHFFFAOYSA-N	1	0	297.428	1.015	50	0		CDAARO
Cc1c(C(=O)N2CC[C@@H](C[NH3+])C2)cnn1-c1ccccc1C	ZINC000178527823	189124598	/nfs/dbraw/zinc/12/45/98/189124598.db2.gz	QTTFKGLCWMDSIK-AWEZNQCLSA-N	1	0	298.390	1.910	50	0		CDAARO
CCOc1ccc(S(=O)(=O)NCC[C@H](C)[NH3+])c(C)c1	ZINC000178911819	189154229	/nfs/dbraw/zinc/15/42/29/189154229.db2.gz	KVQRJWAVAZDCDJ-NSHDSACASA-N	1	0	286.397	1.409	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cnn(C(C)(C)C)c2)C1	ZINC000178965359	189157620	/nfs/dbraw/zinc/15/76/20/189157620.db2.gz	MTMZERCHVKLJLK-NSHDSACASA-N	1	0	264.373	1.320	50	0		CDAARO
Cc1cc(C(=O)N2CC[N@@H+]3CCC[C@H]3C2)cc(=O)[nH]1	ZINC000180285318	189248244	/nfs/dbraw/zinc/24/82/44/189248244.db2.gz	ZSHVJXATQYMCPJ-LBPRGKRZSA-N	1	0	261.325	1.016	50	0		CDAARO
CC(C)[N@H+](C)CCC(=O)NCCc1noc(C2CC2)n1	ZINC000299774180	200867602	/nfs/dbraw/zinc/86/76/02/200867602.db2.gz	BWSHXEDODZOUTI-UHFFFAOYSA-N	1	0	280.372	1.336	50	0		CDAARO
C[C@H](C[N@@H+]1CCC[C@H](C)C1)NS(=O)(=O)C1CC1	ZINC000189150293	361257737	/nfs/dbraw/zinc/25/77/37/361257737.db2.gz	RCRFTSJBSAQOJU-WDEREUQCSA-N	1	0	260.403	1.189	50	0		CDAARO
C[C@@H](CCc1cccc(F)c1)[NH+]1CCN(CC(N)=O)CC1	ZINC000183007672	189342574	/nfs/dbraw/zinc/34/25/74/189342574.db2.gz	KGAPVVOAWXCZDU-ZDUSSCGKSA-N	1	0	293.386	1.250	50	0		CDAARO
O=S(=O)(NC1CC[NH2+]CC1)c1ccc(Cl)cc1F	ZINC000036286283	361426150	/nfs/dbraw/zinc/42/61/50/361426150.db2.gz	HEPNRVUXBYSUBB-UHFFFAOYSA-N	1	0	292.763	1.509	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000183835691	189369360	/nfs/dbraw/zinc/36/93/60/189369360.db2.gz	INYCXPNRCBDPPO-TUAOUCFPSA-N	1	0	268.401	1.552	50	0		CDAARO
CCOC(=O)C[C@]1([NH3+])CCN(C(=O)OC(C)(C)C)C1	ZINC000238256134	361581718	/nfs/dbraw/zinc/58/17/18/361581718.db2.gz	BIENJLIIUBFKDP-CYBMUJFWSA-N	1	0	272.345	1.278	50	0		CDAARO
CN(CC1([NH+](C)C)CCC1)C(=O)N[C@@H]1CCCOCC1	ZINC000187358853	364754113	/nfs/dbraw/zinc/75/41/13/364754113.db2.gz	DNMBHQVUZXDNPR-CYBMUJFWSA-N	1	0	283.416	1.681	50	0		CDAARO
C[C@@H]1CCCN(C(=O)COCc2ccccc2)[C@@H]1C[NH3+]	ZINC000179223980	364988464	/nfs/dbraw/zinc/98/84/64/364988464.db2.gz	UHCUIRKGARCZSB-UKRRQHHQSA-N	1	0	276.380	1.789	50	0		CDAARO
O=C([C@H]1CC=CCC1)N1CC[NH+](C[C@@H]2CCOC2)CC1	ZINC000098018729	364972552	/nfs/dbraw/zinc/97/25/52/364972552.db2.gz	JUZYFJBEPNTDDF-GJZGRUSLSA-N	1	0	278.396	1.523	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@@H]1CCCN1C(=O)[C@H]1CCOC1	ZINC000249693590	365191761	/nfs/dbraw/zinc/19/17/61/365191761.db2.gz	ODFDPLPWLPUJLF-MJBXVCDLSA-N	1	0	266.385	1.498	50	0		CDAARO
CCC(=O)N1CC[C@@H]([NH2+]Cc2nccn2C)[C@H](CC)C1	ZINC000089949197	366979177	/nfs/dbraw/zinc/97/91/77/366979177.db2.gz	VIDJXJXJSZPSAM-CHWSQXEVSA-N	1	0	278.400	1.547	50	0		CDAARO
CCCCOCC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@@H]21	ZINC000089954802	366982596	/nfs/dbraw/zinc/98/25/96/366982596.db2.gz	RTYOFXOCISMPOK-KBPBESRZSA-N	1	0	268.401	1.746	50	0		CDAARO
O=C(CNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2[NH2+]1)N1CCCCC1	ZINC000252487397	367576632	/nfs/dbraw/zinc/57/66/32/367576632.db2.gz	WLNFUCYBFSGRBD-MCIONIFRSA-N	1	0	293.411	1.036	50	0		CDAARO
Cc1c[nH+]c(C)n1CCNC(=O)Cc1c(C)noc1C	ZINC000575555081	369130395	/nfs/dbraw/zinc/13/03/95/369130395.db2.gz	KZIYRJOHOXCIOX-UHFFFAOYSA-N	1	0	276.340	1.464	50	0		CDAARO
OCCC[NH+]1CCN(c2ccc(Cl)cc2)CC1	ZINC000001665574	370505509	/nfs/dbraw/zinc/50/55/09/370505509.db2.gz	KHPVELZEDOSNEM-UHFFFAOYSA-N	1	0	254.761	1.844	50	0		CDAARO
C[NH+](C)Cc1ccccc1CNC(=O)CCc1cn[nH]c1	ZINC000299773597	372751864	/nfs/dbraw/zinc/75/18/64/372751864.db2.gz	DJNMFZACOMRHEC-UHFFFAOYSA-N	1	0	286.379	1.720	50	0		CDAARO
O=C(NCCn1cnnc1)C1CC[NH+](C2CCCC2)CC1	ZINC000299777366	372755582	/nfs/dbraw/zinc/75/55/82/372755582.db2.gz	PWEUZGYYIWICFG-UHFFFAOYSA-N	1	0	291.399	1.049	50	0		CDAARO
Cc1nccn1CCN(C)CC[N@@H+]1C[C@H]2CC[C@@H]1C2	ZINC000299782238	372758757	/nfs/dbraw/zinc/75/87/57/372758757.db2.gz	XKFZUCOCUZQMAJ-LSDHHAIUSA-N	1	0	262.401	1.608	50	0		CDAARO
CCNC(=O)c1cc(C[NH3+])cc(NC(=O)c2ccccn2)c1	ZINC000299793276	372766788	/nfs/dbraw/zinc/76/67/88/372766788.db2.gz	IGWXMRBEEJONDL-UHFFFAOYSA-N	1	0	298.346	1.542	50	0		CDAARO
CC(C)N1CC[C@H]([NH2+][C@@H]2[C@H]3CCO[C@@H]3C2(C)C)C1	ZINC000253371002	373679409	/nfs/dbraw/zinc/67/94/09/373679409.db2.gz	ZIRKEUWASJAMDP-DGAVXFQQSA-N	1	0	252.402	1.872	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@@H]1NC(=O)Cc1ccc(F)cc1F	ZINC000095066533	373706730	/nfs/dbraw/zinc/70/67/30/373706730.db2.gz	FNGZTJNRLRFTOO-RNCFNFMXSA-N	1	0	268.307	1.764	50	0		CDAARO
C[C@H]1CCC[C@H](C)[NH+]1CCCNC(=O)CN1CCCC1=O	ZINC000027748953	374280734	/nfs/dbraw/zinc/28/07/34/374280734.db2.gz	SKQJXFIFVWTIIF-KBPBESRZSA-N	1	0	295.427	1.378	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCCC2	ZINC000248488885	189948153	/nfs/dbraw/zinc/94/81/53/189948153.db2.gz	MPZYGQRISHGQGJ-YNEHKIRRSA-N	1	0	280.412	1.696	50	0		CDAARO
C1=CC[C@H](C[NH+]2CCN(C[C@@H]3CCOC3)CC2)CC1	ZINC000093817401	374786343	/nfs/dbraw/zinc/78/63/43/374786343.db2.gz	KWJQEXKWAWKWLI-HOTGVXAUSA-N	1	0	264.413	1.997	50	0		CDAARO
COc1ccc([C@H](C)[C@@H](C)[NH2+]CCS(C)(=O)=O)cc1	ZINC000095421221	374923658	/nfs/dbraw/zinc/92/36/58/374923658.db2.gz	NJTVEEXVJZRKER-VXGBXAGGSA-N	1	0	285.409	1.821	50	0		CDAARO
C[C@@H](CNC(=O)c1ccn2ccnc2c1)Cn1cccn1	ZINC000095430618	374932723	/nfs/dbraw/zinc/93/27/23/374932723.db2.gz	OWMIOLDTEBFWFT-LBPRGKRZSA-N	1	0	283.335	1.597	50	0		CDAARO
CC[C@@H](C(=O)Nc1ccc(OC)c(CO)c1)[NH+](C)C	ZINC000095447847	374947323	/nfs/dbraw/zinc/94/73/23/374947323.db2.gz	VAGMJCRJAHOZQB-LBPRGKRZSA-N	1	0	266.341	1.466	50	0		CDAARO
COc1ccc(/C=C\C(=O)N(C)[C@H]2CC[NH2+]C2)cc1F	ZINC000606441321	375823248	/nfs/dbraw/zinc/82/32/48/375823248.db2.gz	HVRCAGYCUWIHJA-RNZFLTOJSA-N	1	0	278.327	1.668	50	0		CDAARO
COCC1(C(=O)NCC[C@@H]2CCC[N@H+](C)C2)CCC1	ZINC000067432954	377073697	/nfs/dbraw/zinc/07/36/97/377073697.db2.gz	ZBOWUFHWBFRXKZ-ZDUSSCGKSA-N	1	0	268.401	1.651	50	0		CDAARO
Cc1nn(C)c(Cl)c1CN1CC[C@]2(C1)CCC[NH2+]C2	ZINC000067742643	377235290	/nfs/dbraw/zinc/23/52/90/377235290.db2.gz	MKSLQIWQPSVLOB-CQSZACIVSA-N	1	0	282.819	1.957	50	0		CDAARO
C[C@@H]1CCCC[C@@H]1OCC(=O)N1CC[C@@H]([NH3+])C[C@H]1C	ZINC000408519237	296341219	/nfs/dbraw/zinc/34/12/19/296341219.db2.gz	ZSWFHFLWXXYNAK-SYQHCUMBSA-N	1	0	268.401	1.920	50	0		CDAARO
C[C@H](OC[C@@H]1CCCCO1)C(=O)N1C[C@@H](C)[C@@H]([NH+](C)C)C1	ZINC000107057373	299557277	/nfs/dbraw/zinc/55/72/77/299557277.db2.gz	VENIEMXADHKUCK-QPSCCSFWSA-N	1	0	298.427	1.369	50	0		CDAARO
OC[C@H]([NH2+][C@H]1Cc2ccccc2[C@@H]1O)c1ccccc1	ZINC000097234821	285288761	/nfs/dbraw/zinc/28/87/61/285288761.db2.gz	MNGSIXOJRACXGG-ULQDDVLXSA-N	1	0	269.344	1.968	50	0		CDAARO
C[NH2+]Cc1cn(Cc2ncc(C)c(OC)c2C)nn1	ZINC000090295631	483220016	/nfs/dbraw/zinc/22/00/16/483220016.db2.gz	BASLWIVYASHVSJ-UHFFFAOYSA-N	1	0	261.329	1.066	50	0		CDAARO
COC[C@@H]1[C@H]([NH2+]C2Cc3ccccc3C2)[C@@H]2CCO[C@H]12	ZINC000222289829	285313489	/nfs/dbraw/zinc/31/34/89/285313489.db2.gz	PYHMYSJRYVGRGV-HZMVEIRTSA-N	1	0	273.376	1.793	50	0		CDAARO
[NH3+][C@@H](C(=O)NCC1(Cn2ccnc2)CC1)c1ccccc1	ZINC000071753949	256878740	/nfs/dbraw/zinc/87/87/40/256878740.db2.gz	SQOIOPOEIXANFA-CQSZACIVSA-N	1	0	284.363	1.480	50	0		CDAARO
C[NH2+]C[C@H](O)Cn1c2ccccc2nc1C(F)(F)F	ZINC000000818926	169680547	/nfs/dbraw/zinc/68/05/47/169680547.db2.gz	YZDOPYVGAQAWIW-QMMMGPOBSA-N	1	0	273.258	1.635	50	0		CDAARO
c1nnc2c(N[C@@H]3CC[N@@H+](C4CCCC4)C3)nccn12	ZINC000095404341	184967638	/nfs/dbraw/zinc/96/76/38/184967638.db2.gz	KYGWGHVMFQFRMP-LLVKDONJSA-N	1	0	272.356	1.553	50	0		CDAARO
C[C@H](CC(=O)N1CCCCCC1)[NH2+]CCc1cnn(C)c1	ZINC000095420640	184976136	/nfs/dbraw/zinc/97/61/36/184976136.db2.gz	LIRBXQMMQSFRAA-CQSZACIVSA-N	1	0	292.427	1.733	50	0		CDAARO
CC(=O)Nc1ccc(C[N@@H+]2CCCC[C@]2(C)C(N)=O)cc1	ZINC000097113963	390796293	/nfs/dbraw/zinc/79/62/93/390796293.db2.gz	ZZDIYPAQGILOKW-MRXNPFEDSA-N	1	0	289.379	1.875	50	0		CDAARO
C[NH+](C)CCCC(C)(C)NC(=O)[C@@H]1CCCCC(=O)N1	ZINC000408520404	390848925	/nfs/dbraw/zinc/84/89/25/390848925.db2.gz	CFZKQZOXFLVYQA-LBPRGKRZSA-N	1	0	283.416	1.282	50	0		CDAARO
CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@H+](Cc2cnc[nH]2)C1	ZINC000092400534	390920509	/nfs/dbraw/zinc/92/05/09/390920509.db2.gz	UIFUJGYWAHLGKQ-CHWSQXEVSA-N	1	0	278.400	1.927	50	0		CDAARO
COCCCNC(=O)C[N@@H+]1CCS[C@@H]2CCCC[C@H]21	ZINC000245910216	390924902	/nfs/dbraw/zinc/92/49/02/390924902.db2.gz	VWAYERBHOGOFSH-CHWSQXEVSA-N	1	0	286.441	1.499	50	0		CDAARO
COC[C@@H](Cc1ccccc1)N(C)CC(=O)NCC1CC1	ZINC000239722338	391328543	/nfs/dbraw/zinc/32/85/43/391328543.db2.gz	CCFTYFPUTZRWPJ-MRXNPFEDSA-N	1	0	290.407	1.702	50	0		CDAARO
COc1ccc2c(c1)OC[C@H](C(=O)N1CC[NH2+]C[C@@H]1C)C2	ZINC000125454070	391466844	/nfs/dbraw/zinc/46/68/44/391466844.db2.gz	FRMNMSCSAONGJC-WCQYABFASA-N	1	0	290.363	1.067	50	0		CDAARO
COc1ccc2c(c1)c1c3n2CCN(C)C3=[NH+]CC1	ZINC000100011469	391746653	/nfs/dbraw/zinc/74/66/53/391746653.db2.gz	GVXBHSBKKJRBMS-UHFFFAOYSA-N	1	0	255.321	1.898	50	0	biogenic,in-man	CDAARO
CC1(C)NC(=[NH2+])NC(=N)N1c1cccc(Cl)c1	ZINC000001666576	391857454	/nfs/dbraw/zinc/85/74/54/391857454.db2.gz	AXIUXECRTOGILY-UHFFFAOYSA-N	1	0	251.721	1.526	50	0		CDAARO
COCC[N@@H+]1CCN([C@H](C)c2cccnc2)C[C@H]1C	ZINC000252474735	131135319	/nfs/dbraw/zinc/13/53/19/131135319.db2.gz	LDTSZYQBPFAAQB-ZIAGYGMSSA-N	1	0	263.385	1.795	50	0		CDAARO
C[C@H]1CN(C(=O)c2cnc(-c3ccncc3)s2)CC[NH2+]1	ZINC000262649268	131246844	/nfs/dbraw/zinc/24/68/44/131246844.db2.gz	WODZLFCLCYKZFN-JTQLQIEISA-N	1	0	288.376	1.639	50	0		CDAARO
CC(C)OCCCNC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@@H]21	ZINC000095996139	393157114	/nfs/dbraw/zinc/15/71/14/393157114.db2.gz	QHTCHXFIBBHPMS-CABCVRRESA-N	1	0	297.443	1.927	50	0		CDAARO
CN1C(=O)COc2ccc(C(=O)C3CC[NH2+]CC3)cc21	ZINC000036244089	134815830	/nfs/dbraw/zinc/81/58/30/134815830.db2.gz	WPVQIJMMSQCBDY-UHFFFAOYSA-N	1	0	274.320	1.224	50	0		CDAARO
O=C(N[C@@H]1C=C[C@H](CO)C1)[C@@H]1CC[N@@H+](C2CCCCC2)C1	ZINC000178296150	140003955	/nfs/dbraw/zinc/00/39/55/140003955.db2.gz	LOMRIGMMSSFTBF-RRFJBIMHSA-N	1	0	292.423	1.694	50	0		CDAARO
CCc1nc(NC(=O)CN2CC[N@H+](C)C[C@@H]2C)sc1C	ZINC000089282648	397670959	/nfs/dbraw/zinc/67/09/59/397670959.db2.gz	ZRMILZBGPIXCJG-JTQLQIEISA-N	1	0	296.440	1.588	50	0		CDAARO
C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)CCC(F)(F)F	ZINC000095440457	147113783	/nfs/dbraw/zinc/11/37/83/147113783.db2.gz	PDHJRNLSIOXPIL-DTORHVGOSA-N	1	0	252.280	1.880	50	0		CDAARO
COc1cc2cc(C(=O)NCC[NH+](C)C)[nH]c2cc1OC	ZINC000005243375	170078977	/nfs/dbraw/zinc/07/89/77/170078977.db2.gz	OUZVTKGJVAKALP-UHFFFAOYSA-N	1	0	291.351	1.477	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@@H]2CO)c(OC)c1	ZINC000005526760	170108443	/nfs/dbraw/zinc/10/84/43/170108443.db2.gz	NNOLFIOQMYOVJX-GFCCVEGCSA-N	1	0	251.326	1.661	50	0		CDAARO
CC[NH+]1CCC(NC(=O)COc2ccccc2)CC1	ZINC000016580651	170703442	/nfs/dbraw/zinc/70/34/42/170703442.db2.gz	WDJWOXNTGUSQMY-UHFFFAOYSA-N	1	0	262.353	1.666	50	0		CDAARO
COc1cccc(C[NH2+]CCNC(=O)C(C)C)c1OC	ZINC000020125360	171008455	/nfs/dbraw/zinc/00/84/55/171008455.db2.gz	PCTCDPWIIAIVCM-UHFFFAOYSA-N	1	0	280.368	1.566	50	0		CDAARO
Cc1cc(C)c(OCCOCCNCC[NH3+])c(Cl)c1	ZINC000022079114	171352608	/nfs/dbraw/zinc/35/26/08/171352608.db2.gz	AOBBPBABUIROGU-UHFFFAOYSA-N	1	0	286.803	1.901	50	0		CDAARO
COCCNC(=O)C1CC[NH+](Cc2ccccc2C)CC1	ZINC000025815725	171466395	/nfs/dbraw/zinc/46/63/95/171466395.db2.gz	KAUCEYZBARPXPQ-UHFFFAOYSA-N	1	0	290.407	1.970	50	0		CDAARO
C[C@H](NC(=O)[C@@H]1Cc2ccccc2C[NH2+]1)[C@@H]1CCCO1	ZINC000035734936	172386658	/nfs/dbraw/zinc/38/66/58/172386658.db2.gz	AMTYGMXBAPDJML-CQDKDKBSSA-N	1	0	274.364	1.385	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)NC[C@@H]1Cc2ccccc21	ZINC000038075568	174085595	/nfs/dbraw/zinc/08/55/95/174085595.db2.gz	IJRMHTMZKKSDKE-AWEZNQCLSA-N	1	0	258.365	1.832	50	0		CDAARO
COc1cccc([C@@H]2C[C@H]2C(=O)N2CC[NH2+]CC2)c1	ZINC000038478367	174141779	/nfs/dbraw/zinc/14/17/79/174141779.db2.gz	RYLRSJOYKZNHBE-UONOGXRCSA-N	1	0	260.337	1.231	50	0		CDAARO
C[C@H](NC(=O)[C@H]1Cc2ccccc2C[NH2+]1)[C@@H]1CCCO1	ZINC000040460071	174269853	/nfs/dbraw/zinc/26/98/53/174269853.db2.gz	AMTYGMXBAPDJML-GLQYFDAESA-N	1	0	274.364	1.385	50	0		CDAARO
Cc1cccc(-n2cc(CN3CCO[C@@H](C[NH3+])C3)cn2)c1	ZINC000067855135	175797546	/nfs/dbraw/zinc/79/75/46/175797546.db2.gz	RKZLLXQUBBBGCN-INIZCTEOSA-N	1	0	286.379	1.340	50	0		CDAARO
COc1ccccc1CNc1cc(CC[NH3+])nc(C)n1	ZINC000067895315	175800512	/nfs/dbraw/zinc/80/05/12/175800512.db2.gz	OUOKCEHVCCDTFD-UHFFFAOYSA-N	1	0	272.352	1.907	50	0		CDAARO
Cn1c(C[NH3+])nnc1SCCOc1ccc(F)cc1	ZINC000071374088	176139073	/nfs/dbraw/zinc/13/90/73/176139073.db2.gz	MJKPNDATSZTLRO-UHFFFAOYSA-N	1	0	282.344	1.584	50	0		CDAARO
COc1ccc(NCC2(O)CC[NH2+]CC2)cc1OC	ZINC000071598529	176222661	/nfs/dbraw/zinc/22/26/61/176222661.db2.gz	WBLBTNJLRSTNFA-UHFFFAOYSA-N	1	0	266.341	1.230	50	0		CDAARO
C[NH2+]CC(=O)N[C@H](C)c1nc2c(s1)CCCC2	ZINC000071738856	176258288	/nfs/dbraw/zinc/25/82/88/176258288.db2.gz	LMHVWBHSHYSIIN-MRVPVSSYSA-N	1	0	253.371	1.419	50	0		CDAARO
Cc1nc(C(C)C)sc1C(=O)NC[C@@H]1CC[NH2+]C[C@H]1O	ZINC000072125340	176320711	/nfs/dbraw/zinc/32/07/11/176320711.db2.gz	JAPGCOAPIMVWCV-WDEREUQCSA-N	1	0	297.424	1.275	50	0		CDAARO
CN1C[C@]2(CCC[N@H+](Cc3cccnc3N)CC2)OC1=O	ZINC000072141665	176323647	/nfs/dbraw/zinc/32/36/47/176323647.db2.gz	IIJDVPWREHGHAO-OAHLLOKOSA-N	1	0	290.367	1.471	50	0		CDAARO
CCCOC[C@@H]1CCN(Cc2cc3n(n2)CCC[NH2+]C3)C1	ZINC000072146254	176324650	/nfs/dbraw/zinc/32/46/50/176324650.db2.gz	GACIHZMKKKFYTL-CQSZACIVSA-N	1	0	292.427	1.625	50	0		CDAARO
CN(Cc1cc2n(n1)CC[NH2+]C2)Cc1nccs1	ZINC000072154181	176327813	/nfs/dbraw/zinc/32/78/13/176327813.db2.gz	IBHZJARWNSANHB-UHFFFAOYSA-N	1	0	263.370	1.075	50	0		CDAARO
Cc1n[nH]c(C)c1CCC(=O)N1CCC[C@H]([NH+](C)C)CC1	ZINC000072157796	176329602	/nfs/dbraw/zinc/32/96/02/176329602.db2.gz	CVSZLPIEASINCV-AWEZNQCLSA-N	1	0	292.427	1.902	50	0		CDAARO
CCn1cc(C[N@H+]2C[C@@H](C(C)C)[C@H](NC(C)=O)C2)cn1	ZINC000077536791	177278640	/nfs/dbraw/zinc/27/86/40/177278640.db2.gz	INHBYKSGVOPMGW-LSDHHAIUSA-N	1	0	278.400	1.496	50	0		CDAARO
CCc1nccn1CC(=O)N1CCC[C@H](c2ccncn2)C1	ZINC000218951665	262348183	/nfs/dbraw/zinc/34/81/83/262348183.db2.gz	FCYDYYULCHSUFE-ZDUSSCGKSA-N	1	0	299.378	1.642	50	0		CDAARO
OC1(C(F)(F)F)CC[NH+](C[C@H]2CCOC2)CC1	ZINC000095442031	262493280	/nfs/dbraw/zinc/49/32/80/262493280.db2.gz	DIVBDZXVQGCBRJ-SECBINFHSA-N	1	0	253.264	1.412	50	0		CDAARO
CC(C)([NH3+])c1cn(C2CCN(C(=O)CC3CC3)CC2)nn1	ZINC000048159159	424113528	/nfs/dbraw/zinc/11/35/28/424113528.db2.gz	JBUNPVQWNADFNP-UHFFFAOYSA-N	1	0	291.399	1.436	50	0		CDAARO
CC1(C(=O)N2C[C@H](CO)[C@H](C[NH+]3CCCCCC3)C2)CC1	ZINC000091288841	276097638	/nfs/dbraw/zinc/09/76/38/276097638.db2.gz	SSWWDHWEJYOXEK-HUUCEWRRSA-N	1	0	294.439	1.729	50	0		CDAARO
CNC(=O)c1nc(-c2ccc([C@@H](C)[NH+](C)C)cc2)n[nH]1	ZINC000426523308	277019539	/nfs/dbraw/zinc/01/95/39/277019539.db2.gz	BHGPASKKOGWOBW-SECBINFHSA-N	1	0	273.340	1.454	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)Cc1cccc(F)c1F	ZINC000122626678	277032096	/nfs/dbraw/zinc/03/20/96/277032096.db2.gz	WJVGWWGADXSPDU-LLVKDONJSA-N	1	0	268.307	1.718	50	0		CDAARO
C[NH+]1CCN(c2ccc(Br)cn2)CC1	ZINC000004208955	277112633	/nfs/dbraw/zinc/11/26/33/277112633.db2.gz	QMRHAZARKSZMCF-UHFFFAOYSA-N	1	0	256.147	1.596	50	0		CDAARO
CNC(=O)C[N@H+](C)C[C@@H]1CCOc2ccccc2C1	ZINC000095529294	277228306	/nfs/dbraw/zinc/22/83/06/277228306.db2.gz	BPGRSNBIAKZDEA-GFCCVEGCSA-N	1	0	262.353	1.306	50	0		CDAARO
CS(=O)(=O)CC[NH2+]Cc1ccccc1C(F)(F)F	ZINC000037740369	278105852	/nfs/dbraw/zinc/10/58/52/278105852.db2.gz	DDOBGOWADBQXPR-UHFFFAOYSA-N	1	0	281.299	1.840	50	0		CDAARO
NC(=O)C1([NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)CC1	ZINC000191488188	279558602	/nfs/dbraw/zinc/55/86/02/279558602.db2.gz	OUWFZWYPIFMUAG-YUMQZZPRSA-N	1	0	250.264	1.715	50	0		CDAARO
CC(C)[C@H]([NH2+][C@@H]1CCCC[C@H]1C)C(=O)NC(N)=O	ZINC000006085214	280332915	/nfs/dbraw/zinc/33/29/15/280332915.db2.gz	FZFSRBWGDBJSTF-MXWKQRLJSA-N	1	0	255.362	1.374	50	0		CDAARO
O=S1(=O)CCC([NH2+][C@@H]2CCc3ccccc3C2)CC1	ZINC000037269951	280343004	/nfs/dbraw/zinc/34/30/04/280343004.db2.gz	TZWVVKWLRCMFGW-OAHLLOKOSA-N	1	0	279.405	1.711	50	0		CDAARO
CC[C@H]1CN(C)c2ccccc2C[N@@H+]1C[C@H](O)COC	ZINC000088615026	281160235	/nfs/dbraw/zinc/16/02/35/281160235.db2.gz	KKWUYLCGNDRLEO-GJZGRUSLSA-N	1	0	278.396	1.724	50	0		CDAARO
CN(C)C(=O)CC1CC[NH+](C[C@H]2CCCOC2)CC1	ZINC000358076038	281904005	/nfs/dbraw/zinc/90/40/05/281904005.db2.gz	RIKROCRGCCMJCM-CQSZACIVSA-N	1	0	268.401	1.603	50	0		CDAARO
C[NH+](C)[C@H]1CCCC[C@H]1NS(=O)(=O)c1ccccc1	ZINC000000858963	289367555	/nfs/dbraw/zinc/36/75/55/289367555.db2.gz	VLEJSVXWQQVRQO-KGLIPLIRSA-N	1	0	282.409	1.838	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN([C@@H](C)c2cccnc2)C[C@H]1C	ZINC000252475109	290116210	/nfs/dbraw/zinc/11/62/10/290116210.db2.gz	SRZSJHATCWPYQU-RDBSUJKOSA-N	1	0	263.385	1.530	50	0		CDAARO
CCn1nncc1C[NH2+][C@H](C)c1ccc2c(c1)OCO2	ZINC000571143088	294375502	/nfs/dbraw/zinc/37/55/02/294375502.db2.gz	YPIGOFYGMLNHCP-SNVBAGLBSA-N	1	0	274.324	1.878	50	0		CDAARO
[NH2+]=C1N[C@@H](C(=O)c2ccccc2)[C@@H](c2ccccc2)N1	ZINC000000173760	295210702	/nfs/dbraw/zinc/21/07/02/295210702.db2.gz	HVZBMAKCDGCFLE-ZIAGYGMSSA-N	1	0	265.316	1.897	50	0		CDAARO
COc1ccc2c3c1O[C@@H]1C[C@H](O)C=C[C@]31CC[N@@H+](C)C2	ZINC000000487871	295278482	/nfs/dbraw/zinc/27/84/82/295278482.db2.gz	ASUTZQLVASHGKV-SUYBPPKGSA-N	1	0	287.359	1.850	50	0	biogenic,in-vitro	CDAARO
OCC(CO)[NH2+][C@H]1CCCSc2ccccc21	ZINC000095423362	304822209	/nfs/dbraw/zinc/82/22/09/304822209.db2.gz	BEDBQOJUHIBEME-LBPRGKRZSA-N	1	0	253.367	1.556	50	0		CDAARO
C[C@H](Cn1ccnc1)[NH2+]CC1(N(C)C)CCCC1	ZINC000534587354	328315983	/nfs/dbraw/zinc/31/59/83/328315983.db2.gz	BFNPRFHZHYENNN-CYBMUJFWSA-N	1	0	250.390	1.736	50	0		CDAARO
CCCc1ncncc1C(=O)N[C@H](C)C1CC[NH+](C)CC1	ZINC000534588985	328317026	/nfs/dbraw/zinc/31/70/26/328317026.db2.gz	JVIBCMZYVYHAAZ-GFCCVEGCSA-N	1	0	290.411	1.889	50	0		CDAARO
C[NH+](C)CC[C@H](NC(=O)c1cnc[nH]1)c1ccccc1	ZINC000534643581	328329541	/nfs/dbraw/zinc/32/95/41/328329541.db2.gz	FJYZWXMLVQVHFS-ZDUSSCGKSA-N	1	0	272.352	1.833	50	0		CDAARO
CO[C@H]1C[N@H+](C)C[C@@H]1Nc1nnc(C)c2ccccc21	ZINC000534646669	328330546	/nfs/dbraw/zinc/33/05/46/328330546.db2.gz	PXVXPEHVSPMHOK-KBPBESRZSA-N	1	0	272.352	1.101	50	0		CDAARO
Cc1nccn1-c1ccc(CNC(=O)[C@H]2C=CC[NH2+]2)cc1	ZINC000534640767	328336016	/nfs/dbraw/zinc/33/60/16/328336016.db2.gz	OXZPWVBLDJLNTR-OAHLLOKOSA-N	1	0	282.347	1.325	50	0		CDAARO
Cc1cc(C(N)=O)c(N(C)C[C@@H]2CCC[NH2+]C2)nc1C	ZINC000534670145	328346936	/nfs/dbraw/zinc/34/69/36/328346936.db2.gz	JYWMKXNTTXTSAJ-GFCCVEGCSA-N	1	0	276.384	1.233	50	0		CDAARO
CN(CC[C@H]1CCCCO1)C(=O)C1CC[NH2+]CC1	ZINC000534670123	328347063	/nfs/dbraw/zinc/34/70/63/328347063.db2.gz	NZIYOWHOVWPZBT-CYBMUJFWSA-N	1	0	254.374	1.404	50	0		CDAARO
CN(CCC[C@H]1CCCO1)C(=O)CN(C)C1CC[NH2+]CC1	ZINC000534675296	328356079	/nfs/dbraw/zinc/35/60/79/328356079.db2.gz	JVMGJPPIOSLDFD-HNNXBMFYSA-N	1	0	297.443	1.088	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@H](C)c1cc(C)sc1C	ZINC000097373720	323207804	/nfs/dbraw/zinc/20/78/04/323207804.db2.gz	UVAZJSVYMXCSRW-SNVBAGLBSA-N	1	0	290.454	1.955	50	0		CDAARO
C[C@]1(C(=O)NCC2(CO)CCCC2)CCC[NH2+]C1	ZINC000135096321	328449183	/nfs/dbraw/zinc/44/91/83/328449183.db2.gz	OCEGXQQOFCIEIE-ZDUSSCGKSA-N	1	0	254.374	1.045	50	0		CDAARO
CCc1nc(C)c(CN2C[C@H]3COC[C@@H]2C[N@H+](C)C3)[nH]1	ZINC001772704173	1159439863	/nfs/dbraw/zinc/43/98/63/1159439863.db2.gz	GLRCJGSUZKTNRV-STQMWFEESA-N	1	0	278.400	1.043	50	0		CDAARO
Cc1ncc(Cl)c(NC[C@@H]2C[N@@H+](C)CCN2C)n1	ZINC001772710367	1159444055	/nfs/dbraw/zinc/44/40/55/1159444055.db2.gz	QENMHLVGFMNHQV-SNVBAGLBSA-N	1	0	269.780	1.096	50	0		CDAARO
Cn1ccnc1CC[N@@H+]1CC[C@@H](O)CC(C)(C)C1	ZINC000395364871	1159633374	/nfs/dbraw/zinc/63/33/74/1159633374.db2.gz	YPCXKSDYQDOKOW-GFCCVEGCSA-N	1	0	251.374	1.446	50	0		CDAARO
C[C@H](C(=O)N1CC[NH2+][C@H](C)C1)n1cnc2ccccc21	ZINC000188411110	482445625	/nfs/dbraw/zinc/44/56/25/482445625.db2.gz	ZAWNMQXZXYRXCW-VXGBXAGGSA-N	1	0	272.352	1.418	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@@H]2SCCc3ccccc32)CC[NH2+]1	ZINC000188458012	482447481	/nfs/dbraw/zinc/44/74/81/482447481.db2.gz	AGPBSNXADRLMBO-BXUZGUMPSA-N	1	0	276.405	1.837	50	0		CDAARO
Cc1cc(=O)[nH]c(CC[NH2+][C@@H]2CCN(c3ccccc3)C2)n1	ZINC000670439307	482981755	/nfs/dbraw/zinc/98/17/55/482981755.db2.gz	RAZACIMDTXJAAC-CQSZACIVSA-N	1	0	298.390	1.902	50	0		CDAARO
CC(C)CC(=O)N1CC[NH+](C[C@@H]2CCCOC2)CC1	ZINC000670439137	482983578	/nfs/dbraw/zinc/98/35/78/482983578.db2.gz	JTAYOUQJWVUZCC-AWEZNQCLSA-N	1	0	268.401	1.603	50	0		CDAARO
CC(=O)NCCC1CC[NH+](Cc2nc(C)c(C)n2C)CC1	ZINC000670454827	483029440	/nfs/dbraw/zinc/02/94/40/483029440.db2.gz	XLKAGDJDCNUEMQ-UHFFFAOYSA-N	1	0	292.427	1.775	50	0		CDAARO
CCn1cc([C@@H]2OCC[C@@H]2C[NH2+]Cc2cnn(C)c2)cn1	ZINC000083843563	483204453	/nfs/dbraw/zinc/20/44/53/483204453.db2.gz	RHVHFZGIUTZSEO-UKRRQHHQSA-N	1	0	289.383	1.504	50	0		CDAARO
CCOc1c(F)cccc1C(=O)N1CC[C@H](C[NH2+]C)C1	ZINC000178968554	520602196	/nfs/dbraw/zinc/60/21/96/520602196.db2.gz	HVQOMXFLSOYUIE-LLVKDONJSA-N	1	0	280.343	1.906	50	0		CDAARO
C[C@H](NC(=O)N[C@H]1CCCC[C@H]1CO)C(C)(C)C[NH+](C)C	ZINC000246340537	525100989	/nfs/dbraw/zinc/10/09/89/525100989.db2.gz	OKKCTEDQBMDOSK-IHRRRGAJSA-N	1	0	299.459	1.813	50	0		CDAARO
Cc1ccc(OCCCC(=O)NCC[NH+](C)C)cc1	ZINC000013671025	525407001	/nfs/dbraw/zinc/40/70/01/525407001.db2.gz	TYKWSADWEHAVSQ-UHFFFAOYSA-N	1	0	264.369	1.832	50	0		CDAARO
CC[N@H+](CCN1C(=O)CCC1=O)[C@@H](C)c1cccc(O)c1	ZINC000096455323	528475033	/nfs/dbraw/zinc/47/50/33/528475033.db2.gz	ZWYOMCRDLIGTSY-LBPRGKRZSA-N	1	0	290.363	1.924	50	0		CDAARO
CC[C@@]1(O)CC[N@H+](Cc2cnc(N(C)C)s2)C1	ZINC000428437972	536086623	/nfs/dbraw/zinc/08/66/23/536086623.db2.gz	MRWGHCZELTZVRD-GFCCVEGCSA-N	1	0	255.387	1.556	50	0		CDAARO
C[NH2+][C@@H]1CCN(Cc2cnc(-c3cnccn3)s2)C1	ZINC000097162616	545522421	/nfs/dbraw/zinc/52/24/21/545522421.db2.gz	OBLIMPZGKXZHQZ-SNVBAGLBSA-N	1	0	275.381	1.394	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+]Cc1cnc2nc(C)cc(C)n12	ZINC000097081548	538434349	/nfs/dbraw/zinc/43/43/49/538434349.db2.gz	LEDNUEHXJQYXRB-UHFFFAOYSA-N	1	0	290.367	1.635	50	0		CDAARO
COc1ccc(NC(=O)[C@@H]2CCC[NH2+]2)cc1C(=O)N(C)C	ZINC000952991782	617270427	/nfs/dbraw/zinc/27/04/27/617270427.db2.gz	SKFALIGRRKDGEV-LBPRGKRZSA-N	1	0	291.351	1.088	50	0		CDAARO
CCc1nnc(CN(C)[C@@H]2C[C@@H]3CC(=O)N(C)C[C@@H]3C2)[nH]1	ZINC001704303460	1177680801	/nfs/dbraw/zinc/68/08/01/1177680801.db2.gz	ZOPJJPATRJZFRF-GRYCIOLGSA-N	1	0	291.399	1.056	50	0		CDAARO
CN(C)c1ccnc(C(=O)N[C@@H]2C[C@@H]([NH3+])C2(C)C)c1	ZINC000864091920	712215709	/nfs/dbraw/zinc/21/57/09/712215709.db2.gz	JJPURZDWXFGCHD-VXGBXAGGSA-N	1	0	262.357	1.003	50	0		CDAARO
Cc1nc2ccc(C(=O)N[C@H]3CC[C@H]3[NH3+])cc2nc1C	ZINC000072161068	712310754	/nfs/dbraw/zinc/31/07/54/712310754.db2.gz	BVXFBQDVFIKJCV-NEPJUHHUSA-N	1	0	270.336	1.466	50	0		CDAARO
Cc1n[nH]c(C)c1CCC[N@@H+](C)C[C@H]1COCCO1	ZINC000252483473	712416852	/nfs/dbraw/zinc/41/68/52/712416852.db2.gz	FCEOBDAYPZRPRZ-ZDUSSCGKSA-N	1	0	267.373	1.306	50	0		CDAARO
CCC(CC)[C@H]([NH3+])C1(O)CCC2(CC1)OCCO2	ZINC000958528772	712799675	/nfs/dbraw/zinc/79/96/75/712799675.db2.gz	USKOXGZHDSLFJE-LBPRGKRZSA-N	1	0	257.374	1.798	50	0		CDAARO
Cc1nc(-c2nc([C@H]3CCC[NH2+]C3)cc(=O)[nH]2)cs1	ZINC000023192727	897194254	/nfs/dbraw/zinc/19/42/54/897194254.db2.gz	WTLUBTZAUXHNID-VIFPVBQESA-N	1	0	276.365	1.669	50	0		CDAARO
C[C@H](c1cccs1)N(C)C(=O)c1[nH]nc2c1C[NH2+]CC2	ZINC000188375337	898059250	/nfs/dbraw/zinc/05/92/50/898059250.db2.gz	DGLCHOZRHPJUIS-SECBINFHSA-N	1	0	290.392	1.950	50	0		CDAARO
CN1CCN([C@@H]2CC[N@H+](CC3CCCCC3)C[C@H]2O)CC1	ZINC000019742828	899215142	/nfs/dbraw/zinc/21/51/42/899215142.db2.gz	ZQMJXSOYDJMNPX-IAGOWNOFSA-N	1	0	295.471	1.249	50	0		CDAARO
Cc1cnc(N2CCO[C@@H](CC[NH+](C)C)C2)nc1N(C)C	ZINC000012762647	921513476	/nfs/dbraw/zinc/51/34/76/921513476.db2.gz	YRTUMDWUQYTBHY-ZDUSSCGKSA-N	1	0	293.415	1.008	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](Nc2ncc(F)c(OC)n2)C1	ZINC000952862163	910417207	/nfs/dbraw/zinc/41/72/07/910417207.db2.gz	MVBUQUCIJOWYRA-JTQLQIEISA-N	1	0	268.336	1.911	50	0		CDAARO
Cc1ccc2ncc(C[NH2+][C@@]3(CO)CCOC3)cc2c1	ZINC000952877661	910436026	/nfs/dbraw/zinc/43/60/26/910436026.db2.gz	SVYMNWFALYOFIC-MRXNPFEDSA-N	1	0	272.348	1.784	50	0		CDAARO
Cc1nnc(CN2CC[N@H+](C3CCCC3)[C@H](C)C2)o1	ZINC000952994633	910540952	/nfs/dbraw/zinc/54/09/52/910540952.db2.gz	SFUWEELMKKUFJK-LLVKDONJSA-N	1	0	264.373	1.827	50	0		CDAARO
CC(C)(CN1CCOCC1)C[N@@H+]1CC[C@@H](C(C)(C)O)C1	ZINC000821285359	925576967	/nfs/dbraw/zinc/57/69/67/925576967.db2.gz	HWIWONUZPCYGEJ-CQSZACIVSA-N	1	0	284.444	1.438	50	0		CDAARO
C[C@@H](C1CCN(C(=O)C2(C)COC2)CC1)[NH+]1CCCC1	ZINC000821746064	925594593	/nfs/dbraw/zinc/59/45/93/925594593.db2.gz	QMPKSUYNTCWQLI-ZDUSSCGKSA-N	1	0	280.412	1.746	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H]1CN(C(=O)CCCc1cn[nH]c1)C2	ZINC000823806711	925729367	/nfs/dbraw/zinc/72/93/67/925729367.db2.gz	IEIXKRBUAKMGLQ-GJZGRUSLSA-N	1	0	290.411	1.675	50	0		CDAARO
COCCC[N@@H+]1CC[C@H](CNC(=O)c2cncc(F)c2)C1	ZINC000824390218	925817068	/nfs/dbraw/zinc/81/70/68/925817068.db2.gz	VLKZVLBJZJCBBS-GFCCVEGCSA-N	1	0	295.358	1.309	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CN1CCC(OCCOC)CC1	ZINC000824445039	925822410	/nfs/dbraw/zinc/82/24/10/925822410.db2.gz	JFEBEMNFJNZWKN-AWEZNQCLSA-N	1	0	270.417	1.598	50	0		CDAARO
Cc1nc([C@@H]([NH3+])Cc2c[nH]cn2)n(Cc2ccccc2C)n1	ZINC000825292010	925862822	/nfs/dbraw/zinc/86/28/22/925862822.db2.gz	KCVQVOWYLHYGRP-HNNXBMFYSA-N	1	0	296.378	1.909	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1CCCNc1ccncc1F	ZINC000828710958	926169319	/nfs/dbraw/zinc/16/93/19/926169319.db2.gz	RHYCFMJWYUEHTG-LBPRGKRZSA-N	1	0	267.348	1.291	50	0		CDAARO
Cn1ccc(C(=O)N[C@H]2C[C@H]([NH+](C)C)C23CCC3)n1	ZINC000585127619	931011039	/nfs/dbraw/zinc/01/10/39/931011039.db2.gz	FMEVUGRAGYXFMJ-RYUDHWBXSA-N	1	0	262.357	1.023	50	0		CDAARO
C[NH2+][C@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000864097324	934606756	/nfs/dbraw/zinc/60/67/56/934606756.db2.gz	STKOQDUZSWJHSA-UONOGXRCSA-N	1	0	264.369	1.110	50	0		CDAARO
COc1nc(N(C)CC[N@H+](C)C2CCCC2)ncc1F	ZINC001529171845	969003275	/nfs/dbraw/zinc/00/32/75/969003275.db2.gz	DSRLAXZBXFPRDO-UHFFFAOYSA-N	1	0	282.363	1.935	50	0		CDAARO
C[NH+]1CCC(n2nccc2NC(=O)Cc2cccnc2)CC1	ZINC001506405419	975151838	/nfs/dbraw/zinc/15/18/38/975151838.db2.gz	DLXRMFHSMXVCCT-UHFFFAOYSA-N	1	0	299.378	1.726	50	0		CDAARO
CCc1ncnc(NC[C@@H]2CCC[N@H+](CCOC)C2)c1F	ZINC001506405601	975152024	/nfs/dbraw/zinc/15/20/24/975152024.db2.gz	VQAOMWWDBXEWBJ-LBPRGKRZSA-N	1	0	296.390	1.948	50	0		CDAARO
CCN(Cc1nc(C(C)C)no1)C(=O)[C@@H]1C=CC[NH2+]1	ZINC001506411762	975154718	/nfs/dbraw/zinc/15/47/18/975154718.db2.gz	UPKITMKJZINQOR-JTQLQIEISA-N	1	0	264.329	1.070	50	0		CDAARO
O=C(NCC[NH2+]C1CSCCSC1)c1cccnc1	ZINC001506415623	975155976	/nfs/dbraw/zinc/15/59/76/975155976.db2.gz	FECBKDIWNKMPSY-UHFFFAOYSA-N	1	0	297.449	1.250	50	0		CDAARO
c1cn(C[C@H]2CCC[N@@H+](CCc3ccncc3)C2)nn1	ZINC000096483690	230380926	/nfs/dbraw/zinc/38/09/26/230380926.db2.gz	LLSSHFLUHJQYKW-HNNXBMFYSA-N	1	0	271.368	1.628	50	0		CDAARO
COc1ccc(C[NH2+][C@H](CO)c2ccccc2)cn1	ZINC000096499734	230384345	/nfs/dbraw/zinc/38/43/45/230384345.db2.gz	HXWDKJXCLAHLLC-CQSZACIVSA-N	1	0	258.321	1.913	50	0		CDAARO
OCC1(C[NH2+]C2CSCCSC2)CCOCC1	ZINC000584903440	341987209	/nfs/dbraw/zinc/98/72/09/341987209.db2.gz	AASIBZKWKUUMAV-UHFFFAOYSA-N	1	0	277.455	1.214	50	0		CDAARO
CCc1nc(CC[NH2+]C2CSCCSC2)no1	ZINC000584888436	341999103	/nfs/dbraw/zinc/99/91/03/341999103.db2.gz	AJLZAUZUDYULEH-UHFFFAOYSA-N	1	0	273.427	1.613	50	0		CDAARO
O=C1CCC(=O)N1C1CCC([NH2+][C@H]2CCCSC2)CC1	ZINC000097370904	342002185	/nfs/dbraw/zinc/00/21/85/342002185.db2.gz	XDSZMRARQXKXKB-CPCZMJQVSA-N	1	0	296.436	1.932	50	0		CDAARO
COCCN1CCC[C@H]1C[NH2+][C@H](C)c1cncc(F)c1	ZINC000095967645	185047062	/nfs/dbraw/zinc/04/70/62/185047062.db2.gz	UREMEBPFEBQKGD-DOMZBBRYSA-N	1	0	281.375	1.982	50	0		CDAARO
CC[N@H+](CC(C)(C)O)[C@H](C(N)=O)c1ccccc1	ZINC000095978704	185053215	/nfs/dbraw/zinc/05/32/15/185053215.db2.gz	PRWBNFPARUFYCS-LBPRGKRZSA-N	1	0	250.342	1.306	50	0		CDAARO
COc1ccc(C[N@@H+]2C[C@@H](C(N)=O)CC[C@@H]2C)c(OC)c1	ZINC000095982665	185054065	/nfs/dbraw/zinc/05/40/65/185054065.db2.gz	DBPIUQSOSNEJGU-AAEUAGOBSA-N	1	0	292.379	1.790	50	0		CDAARO
CCc1nccn1CC(=O)N(CC)C[C@@H]1CC[N@H+](C)C1	ZINC000240517204	361748045	/nfs/dbraw/zinc/74/80/45/361748045.db2.gz	NWOHSVVCTDQYIH-CYBMUJFWSA-N	1	0	278.400	1.246	50	0		CDAARO
CN1C(=O)N[C@@](C)([C@H]2CCC[N@H+](CC3CCCC3)C2)C1=O	ZINC000089914244	539087669	/nfs/dbraw/zinc/08/76/69/539087669.db2.gz	YSPBOWPVBMNVAE-BBRMVZONSA-N	1	0	293.411	1.829	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)CCC(C)(C)c1ccccc1	ZINC000195554013	342625814	/nfs/dbraw/zinc/62/58/14/342625814.db2.gz	VKXFKJLRRCAKBV-CABCVRRESA-N	1	0	290.407	1.847	50	0		CDAARO
[NH3+][C@H](C(=O)N1CC[C@@H]2OCCC[C@@H]2C1)c1ccccc1	ZINC000195554477	342625925	/nfs/dbraw/zinc/62/59/25/342625925.db2.gz	NGQVWZPTWQUYRU-ILXRZTDVSA-N	1	0	274.364	1.714	50	0		CDAARO
[NH3+][C@@H](C(=O)N1CC[C@@H](Oc2cccnc2)C1)c1ccccc1	ZINC000195554349	342625987	/nfs/dbraw/zinc/62/59/87/342625987.db2.gz	KGKJWSXOONSLGA-HZPDHXFCSA-N	1	0	297.358	1.761	50	0		CDAARO
CCn1nccc1C[NH2+][C@@H]1CCCN(c2cccnc2)C1=O	ZINC000195559924	342628514	/nfs/dbraw/zinc/62/85/14/342628514.db2.gz	YZZJYFQCAGZUDA-OAHLLOKOSA-N	1	0	299.378	1.583	50	0		CDAARO
[NH3+][C@@H](CC(=O)N1CCCC1)c1c(F)cccc1F	ZINC000096663736	185109759	/nfs/dbraw/zinc/10/97/59/185109759.db2.gz	ZZCYDNRGTCYQIR-NSHDSACASA-N	1	0	254.280	1.977	50	0		CDAARO
C[N@H+](CCC(=O)Nc1nccs1)C[C@H]1CCCCO1	ZINC000243893855	361828636	/nfs/dbraw/zinc/82/86/36/361828636.db2.gz	AUTCPUHZSBXRRC-LLVKDONJSA-N	1	0	283.397	1.973	50	0		CDAARO
C[NH2+][C@@H](C)C(=O)NCCCc1nc(C)c(C)s1	ZINC000244633413	361855449	/nfs/dbraw/zinc/85/54/49/361855449.db2.gz	GCNMEUVXORWALF-VIFPVBQESA-N	1	0	255.387	1.417	50	0		CDAARO
C[C@H]1C[N@H+](CCC(=O)Nc2cccnc2)CCCO1	ZINC000244724382	361859702	/nfs/dbraw/zinc/85/97/02/361859702.db2.gz	MSURDZLHXSMUEE-LBPRGKRZSA-N	1	0	263.341	1.521	50	0		CDAARO
C[N@H+](CC(=O)NCC1CCCCC1)CC1(C)COC1	ZINC000625788099	342199769	/nfs/dbraw/zinc/19/97/69/342199769.db2.gz	MHQMPECBLCJNBA-UHFFFAOYSA-N	1	0	268.401	1.651	50	0		CDAARO
CC(C)N(C)C(=O)[C@@H](C)[NH+]1CCC(n2ccnn2)CC1	ZINC000097233207	342205507	/nfs/dbraw/zinc/20/55/07/342205507.db2.gz	LSBZWFLESAVUPQ-GFCCVEGCSA-N	1	0	279.388	1.170	50	0		CDAARO
C[C@H]1C[N@@H+]2CCCC[C@H]2CN1C(=O)COCC1CC1	ZINC000253390635	361930174	/nfs/dbraw/zinc/93/01/74/361930174.db2.gz	QLQPAYDDKVQPOX-JSGCOSHPSA-N	1	0	266.385	1.498	50	0		CDAARO
CC1(C)CNC(=O)[C@H]1[NH2+]C[C@@H](c1ccco1)N1CCCC1	ZINC000585134637	342215525	/nfs/dbraw/zinc/21/55/25/342215525.db2.gz	DFVZVXRBZFVQHQ-GXTWGEPZSA-N	1	0	291.395	1.531	50	0		CDAARO
C[C@@H](c1ccncc1)[NH+]1CCC(c2ncc(C(N)=O)[nH]2)CC1	ZINC000685941595	539045981	/nfs/dbraw/zinc/04/59/81/539045981.db2.gz	ZNPIJICEHKWBLT-NSHDSACASA-N	1	0	299.378	1.844	50	0		CDAARO
CCOc1ccc2c(c1)C(=O)NC1(CC[NH2+]CC1)O2	ZINC000261494844	539051935	/nfs/dbraw/zinc/05/19/35/539051935.db2.gz	LQEMQQMGEBUIEQ-UHFFFAOYSA-N	1	0	262.309	1.287	50	0		CDAARO
CNC(=O)C[C@@H]1CC[N@H+](Cc2cccc(OC)c2F)C1	ZINC000670446863	539114304	/nfs/dbraw/zinc/11/43/04/539114304.db2.gz	ITJHXSCDOMZCGN-NSHDSACASA-N	1	0	280.343	1.792	50	0		CDAARO
O=C1N(CCc2c[nH]c3ccccc23)C[C@H]2C[NH2+]CCN12	ZINC000072233609	342273244	/nfs/dbraw/zinc/27/32/44/342273244.db2.gz	CSBYAAJNDCNBRV-CYBMUJFWSA-N	1	0	284.363	1.420	50	0		CDAARO
C[C@@H](C(=O)N1CC[C@@H](C[NH3+])C1)c1ccccc1F	ZINC000178581291	362246928	/nfs/dbraw/zinc/24/69/28/362246928.db2.gz	HKPLZQSDMFZEHQ-MNOVXSKESA-N	1	0	250.317	1.736	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2c(Cl)n(C)nc2C(C)C)C1	ZINC000179009890	362251354	/nfs/dbraw/zinc/25/13/54/362251354.db2.gz	SVAAQZHIWHZYBH-SNVBAGLBSA-N	1	0	298.818	1.878	50	0		CDAARO
CN(CCOCC1CC1)C(=O)N[C@@H]1CC[N@@H+]2CCCC[C@H]12	ZINC000083860990	362254962	/nfs/dbraw/zinc/25/49/62/362254962.db2.gz	RTQRPPDXLYBYRV-HUUCEWRRSA-N	1	0	295.427	1.681	50	0		CDAARO
CC[C@@H](C(=O)[O-])[N@@H+]1CC[C@H](CNc2cccc(C)[nH+]2)C1	ZINC000191438976	362435271	/nfs/dbraw/zinc/43/52/71/362435271.db2.gz	NELRWQPZGWPYAU-OLZOCXBDSA-N	1	0	277.368	1.987	50	0		CDAARO
CNC(=O)[C@H]1CCCC[C@H]1[NH2+]CCCCCOC	ZINC000097165605	185554147	/nfs/dbraw/zinc/55/41/47/185554147.db2.gz	MXPQGYVWEFYRFN-QWHCGFSZSA-N	1	0	256.390	1.698	50	0		CDAARO
CN1CCN(C(=O)[C@H]2CCCC[N@@H+]2C)Cc2ccccc21	ZINC000089382829	346764452	/nfs/dbraw/zinc/76/44/52/346764452.db2.gz	WLKMRCQMHJZMGA-MRXNPFEDSA-N	1	0	287.407	1.949	50	0		CDAARO
CCn1cc([C@@H]2OCC[C@@H]2C[NH2+]Cc2ncc[nH]2)cn1	ZINC000089305974	346755820	/nfs/dbraw/zinc/75/58/20/346755820.db2.gz	QOHIVJOZJNBKFQ-BXUZGUMPSA-N	1	0	275.356	1.494	50	0		CDAARO
O=C(CC[NH+]1CCC(O)CC1)Nc1cccc(F)c1	ZINC000036643877	362813486	/nfs/dbraw/zinc/81/34/86/362813486.db2.gz	QWIMBXXTXMYHNB-UHFFFAOYSA-N	1	0	266.316	1.611	50	0		CDAARO
COc1cc(C)c(S(=O)(=O)N[C@H]2CCC[NH2+]C2)cc1C	ZINC000193352366	362906970	/nfs/dbraw/zinc/90/69/70/362906970.db2.gz	WRWYZUIFLDHDJO-LBPRGKRZSA-N	1	0	298.408	1.342	50	0		CDAARO
C[C@@H]1[C@H]([N@H+](C)CCO)CCN1C(=O)c1ccnc(Cl)c1	ZINC000293665970	362910549	/nfs/dbraw/zinc/91/05/49/362910549.db2.gz	LVMGIUFIIJCHAF-ZYHUDNBSSA-N	1	0	297.786	1.262	50	0		CDAARO
Nc1ccc2c(c1)CCC[C@@H]2NC(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000263097174	362914815	/nfs/dbraw/zinc/91/48/15/362914815.db2.gz	NRZSMYVWLJKDBD-ZOWXZIJZSA-N	1	0	273.380	1.890	50	0		CDAARO
CCOC(=O)[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1O	ZINC000143139611	348752595	/nfs/dbraw/zinc/75/25/95/348752595.db2.gz	MUPAPEDKCKNYLY-UONOGXRCSA-N	1	0	263.337	1.433	50	0		CDAARO
O=C(C1CCC1)N1CCC[N@@H+]([C@H]2CCSC2)CC1	ZINC000584885306	349343354	/nfs/dbraw/zinc/34/33/54/349343354.db2.gz	IDBNLVVYBJFEBY-ZDUSSCGKSA-N	1	0	268.426	1.826	50	0		CDAARO
C[C@H](Cn1ccnc1)[NH2+]CC(C)(C)N1CCCC1	ZINC000584896517	349358202	/nfs/dbraw/zinc/35/82/02/349358202.db2.gz	LBXAKDMITGSSEB-CYBMUJFWSA-N	1	0	250.390	1.736	50	0		CDAARO
C[NH+](C)CC(C)(C)Cn1cnc2ccncc2c1=O	ZINC000584889567	349348952	/nfs/dbraw/zinc/34/89/52/349348952.db2.gz	SRDJHEVLILEXFY-UHFFFAOYSA-N	1	0	260.341	1.379	50	0		CDAARO
C[C@@H](CNS(=O)(=O)C1CC1)[NH2+]C1(c2ccccc2)CC1	ZINC000584898822	349360877	/nfs/dbraw/zinc/36/08/77/349360877.db2.gz	CLVRSJNGVIOZSN-LBPRGKRZSA-N	1	0	294.420	1.736	50	0		CDAARO
Cc1cc(C)c2[nH]c(C[NH2+]CC(=O)NC3CC3)cc(=O)c2c1	ZINC000091270356	180118056	/nfs/dbraw/zinc/11/80/56/180118056.db2.gz	RUWRHTYHAMIMKB-UHFFFAOYSA-N	1	0	299.374	1.513	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@H]1NC(=O)Cc1ccccc1F	ZINC000091496333	180171771	/nfs/dbraw/zinc/17/17/71/180171771.db2.gz	SCCIZZOGZJVCDA-GXFFZTMASA-N	1	0	250.317	1.625	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@H]1CCC[NH2+][C@@H]1C	ZINC000091496925	180172591	/nfs/dbraw/zinc/17/25/91/180172591.db2.gz	QDJCZGJAGSHCQR-PWSUYJOCSA-N	1	0	286.372	1.553	50	0		CDAARO
Cc1ncnc(NCCC[N@@H+]2CCCC[C@H]2CO)c1C	ZINC000091781036	180253814	/nfs/dbraw/zinc/25/38/14/180253814.db2.gz	YJBRXXQFSCNQRV-AWEZNQCLSA-N	1	0	278.400	1.742	50	0		CDAARO
CCn1nc(CC(C)C)cc1C(=O)NC[C@H]1CCC[NH2+]1	ZINC000091859477	180275266	/nfs/dbraw/zinc/27/52/66/180275266.db2.gz	NQMHLZYFVAKUFN-GFCCVEGCSA-N	1	0	278.400	1.583	50	0		CDAARO
O=C(CCc1ccccc1)N1CC[C@@]2(O)CC[NH2+]C[C@H]2C1	ZINC000092046576	180311166	/nfs/dbraw/zinc/31/11/66/180311166.db2.gz	AFOCTUQZKYBJNT-RDJZCZTQSA-N	1	0	288.391	1.192	50	0		CDAARO
CN(C)[C@H](C(=O)NC[C@H]1CCC[N@@H+]1C)c1ccccc1	ZINC000106158163	186104094	/nfs/dbraw/zinc/10/40/94/186104094.db2.gz	SDYDSPXRLDXMIA-CABCVRRESA-N	1	0	275.396	1.500	50	0		CDAARO
CS[C@@H]1CCC[C@@H]1[N@H+](C)CC(=O)NCc1cccnc1	ZINC000110642444	186308547	/nfs/dbraw/zinc/30/85/47/186308547.db2.gz	DWXKTPNKHXATGG-UONOGXRCSA-N	1	0	293.436	1.914	50	0		CDAARO
CC(C)[NH+]1CCC(Nc2ncnc3c2cnn3C)CC1	ZINC000012486353	366001649	/nfs/dbraw/zinc/00/16/49/366001649.db2.gz	CHVUJAJGNABIQT-UHFFFAOYSA-N	1	0	274.372	1.648	50	0		CDAARO
COCc1noc(C[NH2+][C@@H]2CCCCC[C@H]2CO)n1	ZINC000126145302	351570166	/nfs/dbraw/zinc/57/01/66/351570166.db2.gz	DMWKTTWWVPWLSO-WDEREUQCSA-N	1	0	269.345	1.247	50	0		CDAARO
CC(C)OCCC(=O)N1CCC([N@@H+]2CCO[C@@H](C)C2)CC1	ZINC000124251341	187128727	/nfs/dbraw/zinc/12/87/27/187128727.db2.gz	GAHBQAOUOYKABP-AWEZNQCLSA-N	1	0	298.427	1.513	50	0		CDAARO
C[C@H]([NH3+])CCNS(=O)(=O)c1cccc2ccccc21	ZINC000123899416	187114268	/nfs/dbraw/zinc/11/42/68/187114268.db2.gz	MIASWSQLPOORFV-NSHDSACASA-N	1	0	278.377	1.855	50	0		CDAARO
O=C(NC[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cn[nH]c1	ZINC000194752993	363116908	/nfs/dbraw/zinc/11/69/08/363116908.db2.gz	LSTNZWMAXCFYEY-CQSZACIVSA-N	1	0	284.363	1.662	50	0		CDAARO
COc1cccc(CNc2ncnc3c2cnn3C)c1	ZINC000014211467	366133578	/nfs/dbraw/zinc/13/35/78/366133578.db2.gz	QORNSVIUIIEPEQ-UHFFFAOYSA-N	1	0	269.308	1.984	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC[NH2+]CC2)c(Cl)c1	ZINC000036983622	363311088	/nfs/dbraw/zinc/31/10/88/363311088.db2.gz	JLDFNWVIJNVINS-UHFFFAOYSA-N	1	0	288.800	1.632	50	0		CDAARO
C[NH2+][C@@H]1CCN(c2cc(OC)cc(OC)c2)C1=O	ZINC000049647309	538350339	/nfs/dbraw/zinc/35/03/39/538350339.db2.gz	JGVSFHUTYMOAEV-GFCCVEGCSA-N	1	0	250.298	1.029	50	0		CDAARO
O=C(C[NH+]1CCCC1)N1CCN(c2ccccc2)CC1	ZINC000000535692	355916213	/nfs/dbraw/zinc/91/62/13/355916213.db2.gz	LRIQDFJZPDXRLG-UHFFFAOYSA-N	1	0	273.380	1.431	50	0		CDAARO
CCCC[NH2+]Cc1ccc(OC)c(OCC(N)=O)c1	ZINC000002863699	355985695	/nfs/dbraw/zinc/98/56/95/355985695.db2.gz	YTKZVUWOKNMFFO-UHFFFAOYSA-N	1	0	266.341	1.449	50	0		CDAARO
COc1ccc(OCCCCC[NH2+]CCO)cc1	ZINC000002902904	355987209	/nfs/dbraw/zinc/98/72/09/355987209.db2.gz	ROXPOPSHKHQBLF-UHFFFAOYSA-N	1	0	253.342	1.826	50	0		CDAARO
Cc1ccccc1-c1cc(N2CC[NH2+]CC2)ncn1	ZINC000004239253	356024212	/nfs/dbraw/zinc/02/42/12/356024212.db2.gz	CTURYNZJBQEQRI-UHFFFAOYSA-N	1	0	254.337	1.862	50	0		CDAARO
CC[C@H](CNC(=O)Cc1c(C)noc1C)[NH+]1CCCC1	ZINC000032654043	356330909	/nfs/dbraw/zinc/33/09/09/356330909.db2.gz	ZSZOYLPKEXXUCM-CYBMUJFWSA-N	1	0	279.384	1.825	50	0		CDAARO
COc1ccc(CCC(=O)NC2CC[NH+](C)CC2)cc1	ZINC000016606051	356443099	/nfs/dbraw/zinc/44/30/99/356443099.db2.gz	PDYANRPCUASJCI-UHFFFAOYSA-N	1	0	276.380	1.838	50	0		CDAARO
COc1cccc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c1OC	ZINC000016662909	356444540	/nfs/dbraw/zinc/44/45/40/356444540.db2.gz	GFIMNBNCNRKENT-LBPRGKRZSA-N	1	0	278.352	1.401	50	0		CDAARO
CCc1ccc(O[C@@H](C)C(=O)N2CC[NH2+]CC2)cc1	ZINC000019510445	356488536	/nfs/dbraw/zinc/48/85/36/356488536.db2.gz	ZJSXWPUTGNHGRN-LBPRGKRZSA-N	1	0	262.353	1.448	50	0		CDAARO
CC[NH+]1CCN(Cc2cc(OC)c(OC)c(OC)c2)CC1	ZINC000019537501	356491063	/nfs/dbraw/zinc/49/10/63/356491063.db2.gz	SIKYVZPABJRSRY-UHFFFAOYSA-N	1	0	294.395	1.850	50	0		CDAARO
Cc1nc(-c2cccc(NC(=O)[C@@H]3CCC[NH2+]3)c2)n[nH]1	ZINC000037769034	356531379	/nfs/dbraw/zinc/53/13/79/356531379.db2.gz	MKYLDJHWWOGJIT-LBPRGKRZSA-N	1	0	271.324	1.471	50	0		CDAARO
CC(C)(CNC(=O)NCc1ccccc1)N1CCOCC1	ZINC000023043286	356626027	/nfs/dbraw/zinc/62/60/27/356626027.db2.gz	MVCGSMMDUDXWAS-UHFFFAOYSA-N	1	0	291.395	1.597	50	0		CDAARO
OC[C@]12CCC[NH2+][C@@H]1CCN(c1nccc3occc31)C2	ZINC000072165953	356639446	/nfs/dbraw/zinc/63/94/46/356639446.db2.gz	ZHGHYZKVZFWVBJ-GDBMZVCRSA-N	1	0	287.363	1.769	50	0		CDAARO
Fc1ccc(C[NH2+]CCN2CCOCC2)c(F)c1	ZINC000019953856	363548578	/nfs/dbraw/zinc/54/85/78/363548578.db2.gz	CPUUXKRZCKRQMZ-UHFFFAOYSA-N	1	0	256.296	1.387	50	0		CDAARO
CCOC(=O)C1=C(C[NH+]2C[C@@H](C)C[C@H](C)C2)NC(=O)NC1	ZINC000025785350	356683601	/nfs/dbraw/zinc/68/36/01/356683601.db2.gz	GJEPAFXAYMWDHL-QWRGUYRKSA-N	1	0	295.383	1.094	50	0		CDAARO
C[C@H]1CCCC[C@@H]1NC(=O)CN1CCC2(CC1)OCCO2	ZINC000026933592	356701533	/nfs/dbraw/zinc/70/15/33/356701533.db2.gz	MPKVAKHQQUZQHR-KBPBESRZSA-N	1	0	296.411	1.520	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)/C=C\c2ccc(-n3ccnc3)cc2)C1	ZINC000255602091	356758876	/nfs/dbraw/zinc/75/88/76/356758876.db2.gz	MLWYFTSHBBNXSJ-OMVNSRBRSA-N	1	0	296.374	1.693	50	0		CDAARO
CN(CC1CC[NH+](C)CC1)C(=O)C[C@H]1CCOC1	ZINC000352082777	356824929	/nfs/dbraw/zinc/82/49/29/356824929.db2.gz	KBHDNAJWDCOUAA-CYBMUJFWSA-N	1	0	254.374	1.213	50	0		CDAARO
C[C@H]1CCC[N@H+](CCNc2ncnc3c2cnn3C)C1	ZINC000048560088	356906867	/nfs/dbraw/zinc/90/68/67/356906867.db2.gz	YMMCHFRWRQYHSW-NSHDSACASA-N	1	0	274.372	1.507	50	0		CDAARO
CC[C@@H]1CCCCN1C(=O)c1[nH]nc2c1C[NH2+]CC2	ZINC000042783807	357080635	/nfs/dbraw/zinc/08/06/35/357080635.db2.gz	UFHLKCVEWSZITR-SNVBAGLBSA-N	1	0	262.357	1.460	50	0		CDAARO
C[C@H](C1CCN(c2nccnc2N(C)C)CC1)[NH+](C)C	ZINC000096140842	357172188	/nfs/dbraw/zinc/17/21/88/357172188.db2.gz	ATVGLRMCINFPLR-GFCCVEGCSA-N	1	0	277.416	1.709	50	0		CDAARO
CC[C@@H](CO)N(Cc1cc(C)n[nH]1)Cc1ccccn1	ZINC000055242265	357331169	/nfs/dbraw/zinc/33/11/69/357331169.db2.gz	RWALCCNZFPGQTR-HNNXBMFYSA-N	1	0	274.368	1.886	50	0		CDAARO
Cc1cc2oc(=O)cc(C)c2cc1NC(=O)[C@H]1CC[NH2+]C1	ZINC000055413929	357333475	/nfs/dbraw/zinc/33/34/75/357333475.db2.gz	IAIPZJFUYHGRNY-NSHDSACASA-N	1	0	286.331	1.958	50	0		CDAARO
CCCC(=O)N1CCN(c2cc(NCC)[nH+]c(C)n2)CC1	ZINC000065363456	357531088	/nfs/dbraw/zinc/53/10/88/357531088.db2.gz	JUGKGCVWXGUCQE-UHFFFAOYSA-N	1	0	291.399	1.666	50	0		CDAARO
CCCn1nccc1C(=O)N1CCC2(CC[N@H+](C)C2)CC1	ZINC000065493593	357544747	/nfs/dbraw/zinc/54/47/47/357544747.db2.gz	AWNCSWZKQZTARY-UHFFFAOYSA-N	1	0	290.411	1.851	50	0		CDAARO
CS(=O)(=O)N[C@@H]1CC[N@H+](CCCCC(F)(F)F)C1	ZINC000095433791	357624686	/nfs/dbraw/zinc/62/46/86/357624686.db2.gz	FELBFDLHPSZHBU-SECBINFHSA-N	1	0	288.335	1.343	50	0		CDAARO
Cc1nonc1[C@H]1CCCN1c1cc(CC[NH3+])nc(C)n1	ZINC000067691150	357619236	/nfs/dbraw/zinc/61/92/36/357619236.db2.gz	BLURMRHVLROWLO-GFCCVEGCSA-N	1	0	288.355	1.319	50	0		CDAARO
COc1ccc(C(=O)NC[C@H]2CC[N@H+](C)C2)cc1F	ZINC000067712785	357620120	/nfs/dbraw/zinc/62/01/20/357620120.db2.gz	WYDNCFWFTOPPFI-SNVBAGLBSA-N	1	0	266.316	1.516	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)Nc2cc(CC[NH3+])nc(C)n2)n1	ZINC000067947833	357638866	/nfs/dbraw/zinc/63/88/66/357638866.db2.gz	VSOBMHYCNHMNTQ-NSHDSACASA-N	1	0	288.399	1.600	50	0		CDAARO
C(C[NH+]1CCCCC1)N1CCC2(CC1)OCCO2	ZINC000096999264	357907703	/nfs/dbraw/zinc/90/77/03/357907703.db2.gz	PWJVZQXJRAGIMI-UHFFFAOYSA-N	1	0	254.374	1.311	50	0		CDAARO
COc1c(C[N@H+](C)CCc2ccncc2)c(C)nn1C	ZINC000097113785	357982737	/nfs/dbraw/zinc/98/27/37/357982737.db2.gz	UHCGCAAJYYCMDR-UHFFFAOYSA-N	1	0	274.368	1.807	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C[C@H](O)COc1ccccc1	ZINC000097159274	357998929	/nfs/dbraw/zinc/99/89/29/357998929.db2.gz	HWYAHDLRAUKGEP-ZDUSSCGKSA-N	1	0	261.325	1.248	50	0		CDAARO
CCC[C@@H](C)C[N@@H+]1CC[C@H](S(=O)(=O)NCC)C1	ZINC000097235512	358050426	/nfs/dbraw/zinc/05/04/26/358050426.db2.gz	ZJXKONBRHZRZMI-NEPJUHHUSA-N	1	0	262.419	1.436	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1C1CN(C(=O)c2ccncc2)C1	ZINC000082161114	358149728	/nfs/dbraw/zinc/14/97/28/358149728.db2.gz	IBDJUHPPUMYNAW-GFCCVEGCSA-N	1	0	259.353	1.780	50	0		CDAARO
COc1ccc(O[C@@H](C)C(=O)N2CCN(C)CC2)cc1	ZINC000019877152	358207799	/nfs/dbraw/zinc/20/77/99/358207799.db2.gz	SOEXULQZCXKZQS-LBPRGKRZSA-N	1	0	278.352	1.237	50	0		CDAARO
[NH3+][C@@H]1CCS(=O)(=O)c2ccc(Br)cc21	ZINC000089222704	358397520	/nfs/dbraw/zinc/39/75/20/358397520.db2.gz	KJUYFPJSIRWYOW-MRVPVSSYSA-N	1	0	276.155	1.626	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCN(C(=O)[C@H](C)Oc2cccnc2)C1	ZINC000247114930	358403812	/nfs/dbraw/zinc/40/38/12/358403812.db2.gz	LYTVFLHLPODGPA-AGIUHOORSA-N	1	0	277.368	1.435	50	0		CDAARO
O=C(c1ccc([C@@H]2CCC[NH2+]C2)cc1)N1CCOCC1	ZINC000095353494	358682304	/nfs/dbraw/zinc/68/23/04/358682304.db2.gz	JZYYBNFHEBQXKX-OAHLLOKOSA-N	1	0	274.364	1.626	50	0		CDAARO
C[N@@H+]1CCC[C@@H](Cn2ncc(N3CCCCC3)cc2=O)C1	ZINC000095366335	358686310	/nfs/dbraw/zinc/68/63/10/358686310.db2.gz	LBYSVVVPLIVWIB-CQSZACIVSA-N	1	0	290.411	1.575	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1NCCc1noc(C2CC2)n1	ZINC000095386334	358691500	/nfs/dbraw/zinc/69/15/00/358691500.db2.gz	ZEPLPUINQJJFCP-UHFFFAOYSA-N	1	0	288.355	1.845	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)[C@H]1CCOc2ccccc2C1	ZINC000096161482	358711049	/nfs/dbraw/zinc/71/10/49/358711049.db2.gz	UCAOXTAOIFVIFD-HNNXBMFYSA-N	1	0	288.391	1.840	50	0		CDAARO
Cc1nn(C)c2nc(N3C[C@@H]4C[C@H]3C[N@@H+]4C)sc12	ZINC000096164852	358712373	/nfs/dbraw/zinc/71/23/73/358712373.db2.gz	YRZOOVPFDYHXRA-IUCAKERBSA-N	1	0	263.370	1.231	50	0		CDAARO
OCCN1CCc2nc(-c3ccc(F)cc3F)[nH]c2C1	ZINC000097475412	358779185	/nfs/dbraw/zinc/77/91/85/358779185.db2.gz	ARXMSKBVPCNUTM-UHFFFAOYSA-N	1	0	279.290	1.705	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](c2nnc(C3CCOCC3)[nH]2)C1	ZINC000097694610	358793920	/nfs/dbraw/zinc/79/39/20/358793920.db2.gz	FJKZAPYBQSTJGE-CYBMUJFWSA-N	1	0	294.399	1.525	50	0		CDAARO
Cn1nccc1CCC(=O)NCc1ccc(C[NH3+])cc1	ZINC000097745115	358796522	/nfs/dbraw/zinc/79/65/22/358796522.db2.gz	UNRNAHPKCLABCK-UHFFFAOYSA-N	1	0	272.352	1.128	50	0		CDAARO
COCCN(Cc1ccccc1F)C(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000215857111	358906565	/nfs/dbraw/zinc/90/65/65/358906565.db2.gz	HCOBYBFBYAGGPF-GXTWGEPZSA-N	1	0	294.370	1.928	50	0		CDAARO
CCO[C@@H]1C[C@@H]([N@H+](C)CC(=O)NC[C@@H]2CCCO2)C1(C)C	ZINC000084800690	359004439	/nfs/dbraw/zinc/00/44/39/359004439.db2.gz	WBPCDOZWOBPXHX-BFHYXJOUSA-N	1	0	298.427	1.417	50	0		CDAARO
COC(C)(C)CNc1cc(C2CC([NH3+])C2)ncn1	ZINC000218999667	359075080	/nfs/dbraw/zinc/07/50/80/359075080.db2.gz	XBPRIOGASMGHIK-UHFFFAOYSA-N	1	0	250.346	1.518	50	0		CDAARO
Cc1cnccc1CNC(=O)CN(C)C1CC[NH+](C)CC1	ZINC000219323432	359088362	/nfs/dbraw/zinc/08/83/62/359088362.db2.gz	FSENUSCQVQIXPV-UHFFFAOYSA-N	1	0	290.411	1.032	50	0		CDAARO
C[N@H+](CC[C@H](O)c1ccccc1)CCn1cncn1	ZINC000219580586	359107268	/nfs/dbraw/zinc/10/72/68/359107268.db2.gz	QMOVZMPDMVMFSN-AWEZNQCLSA-N	1	0	260.341	1.334	50	0		CDAARO
CCc1ccc(C(=O)N(C)C[C@H]2CC[N@H+](CCOC)C2)[nH]1	ZINC000220664182	359190324	/nfs/dbraw/zinc/19/03/24/359190324.db2.gz	XFLWQPYORNSHFR-CYBMUJFWSA-N	1	0	293.411	1.617	50	0		CDAARO
OCCC[C@H]1CCC[N@@H+]1CCOC[C@H]1CCCO1	ZINC000247862421	359192989	/nfs/dbraw/zinc/19/29/89/359192989.db2.gz	NCIBJVVAJGTZMR-ZIAGYGMSSA-N	1	0	257.374	1.419	50	0		CDAARO
CC[C@H](NC(=O)CN(C)Cc1ccccc1)[C@H]1C[C@@H](O)C1	ZINC000220077602	359148894	/nfs/dbraw/zinc/14/88/94/359148894.db2.gz	PJVFTEYOIJLICX-JYJNAYRXSA-N	1	0	290.407	1.784	50	0		CDAARO
O=C(c1cc(C(F)F)n[nH]1)N1CC[N@@H+]2CCC[C@@H]2C1	ZINC000221452353	359250687	/nfs/dbraw/zinc/25/06/87/359250687.db2.gz	UCUFUFMLOXKGSP-MRVPVSSYSA-N	1	0	270.283	1.268	50	0		CDAARO
CCNC(=O)N1CCCCC[C@H]1CN1CCOCC1	ZINC000257180566	359221969	/nfs/dbraw/zinc/22/19/69/359221969.db2.gz	LDYVQAKGNQZKGC-ZDUSSCGKSA-N	1	0	269.389	1.293	50	0		CDAARO
CN(C)[C@@H]1C[N@@H+](C2CCCCCC2)CC[C@@H]1CO	ZINC000257182080	359439224	/nfs/dbraw/zinc/43/92/24/359439224.db2.gz	OMRXRXGCEBZRTB-UKRRQHHQSA-N	1	0	254.418	1.954	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)Nc1ccc(F)cn1	ZINC000296811527	200005376	/nfs/dbraw/zinc/00/53/76/200005376.db2.gz	MBMSWYUHKJSCAH-NSHDSACASA-N	1	0	266.320	1.827	50	0		CDAARO
C[NH+]1CCN(c2ncnnc2-c2ccc(Cl)cc2)CC1	ZINC000033941954	359755148	/nfs/dbraw/zinc/75/51/48/359755148.db2.gz	HNJVZASOZHCOPS-UHFFFAOYSA-N	1	0	289.770	1.944	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)O[C@H]1CCN(C(C)C)C1=O	ZINC000408525667	359935934	/nfs/dbraw/zinc/93/59/34/359935934.db2.gz	PKYIREJUIILWPS-STQMWFEESA-N	1	0	284.400	1.550	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)COCC1CC1	ZINC000257365719	359946388	/nfs/dbraw/zinc/94/63/88/359946388.db2.gz	IDJGFAUGPQHLFI-LSDHHAIUSA-N	1	0	280.412	1.888	50	0		CDAARO
C[NH+](C)Cc1ccnc(NC(=O)CC[C@@H]2CCOC2)c1	ZINC000177542569	189055783	/nfs/dbraw/zinc/05/57/83/189055783.db2.gz	CSOUXTWHPLUZMO-GFCCVEGCSA-N	1	0	277.368	1.898	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2cncs2)n1C	ZINC000426651463	360692035	/nfs/dbraw/zinc/69/20/35/360692035.db2.gz	YYKGFZSIZZUMQF-UHFFFAOYSA-N	1	0	255.372	1.283	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)CCc2cccc(F)c2F)C1	ZINC000178519648	189123111	/nfs/dbraw/zinc/12/31/11/189123111.db2.gz	KWVOFGRKIDLPQU-JTQLQIEISA-N	1	0	268.307	1.705	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](NC(=O)c2ccc(-c3ncccn3)cc2)C1	ZINC000426470470	360672549	/nfs/dbraw/zinc/67/25/49/360672549.db2.gz	AZWWNKCSAVVDPN-KGLIPLIRSA-N	1	0	282.347	1.753	50	0		CDAARO
Cc1cc(Cl)ccc1S(=O)(=O)NCC(C)(C)[NH3+]	ZINC000129647464	361198355	/nfs/dbraw/zinc/19/83/55/361198355.db2.gz	OPPKKMWAMLJNKW-UHFFFAOYSA-N	1	0	276.789	1.664	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)[C@@H]3OCCc4ccccc43)C[C@H]12	ZINC000248562001	361210936	/nfs/dbraw/zinc/21/09/36/361210936.db2.gz	BAHQJLDGROLBCA-SLBVQIDZSA-N	1	0	286.375	1.496	50	0		CDAARO
Cn1cncc1C(=O)NC(C)(C)C[NH+]1CCCC1	ZINC000457051679	363883687	/nfs/dbraw/zinc/88/36/87/363883687.db2.gz	NIFIZXHPKLUJMG-UHFFFAOYSA-N	1	0	250.346	1.024	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1CC(=O)NCc1ccccc1F	ZINC000089939095	366973138	/nfs/dbraw/zinc/97/31/38/366973138.db2.gz	RDWSYWSDMDXUJV-LBPRGKRZSA-N	1	0	279.359	1.078	50	0		CDAARO
COCCOCCOC(=O)C[C@@H](C[NH3+])CC(C)C	ZINC000125886837	367267054	/nfs/dbraw/zinc/26/70/54/367267054.db2.gz	GTROGTSTCDECMC-LBPRGKRZSA-N	1	0	261.362	1.204	50	0		CDAARO
CC[C@H]1CN(S(C)(=O)=O)CC[C@H]1[NH2+]Cc1cccn1C	ZINC000252517838	367742348	/nfs/dbraw/zinc/74/23/48/367742348.db2.gz	SRJCUJJWDMOGNA-GXTWGEPZSA-N	1	0	299.440	1.175	50	0		CDAARO
C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)N1C(=O)CC[NH3+]	ZINC000377144655	367967984	/nfs/dbraw/zinc/96/79/84/367967984.db2.gz	HXKYDJLKEGFEEP-XUJVJEKNSA-N	1	0	262.353	1.712	50	0		CDAARO
Cc1cc(N2CCC[C@@H](CN(C)S(C)(=O)=O)C2)cc[nH+]1	ZINC000286569089	368888769	/nfs/dbraw/zinc/88/87/69/368888769.db2.gz	LKWNSWLKZDKQTG-ZDUSSCGKSA-N	1	0	297.424	1.498	50	0		CDAARO
Cc1n[nH]cc1C[NH2+][C@@H](C)C(=O)N1CCCCC1	ZINC000037784492	371441029	/nfs/dbraw/zinc/44/10/29/371441029.db2.gz	IVQTVKFSGNVCAJ-NSHDSACASA-N	1	0	250.346	1.209	50	0		CDAARO
C[C@@H]1C[C@H](C)CN(S(=O)(=O)N2CC[C@@H]([NH3+])C[C@H]2C)C1	ZINC000252688202	372350377	/nfs/dbraw/zinc/35/03/77/372350377.db2.gz	NNQWSCJHIQOSQY-YVECIDJPSA-N	1	0	289.445	1.021	50	0		CDAARO
O=C1CCC2(CC[NH2+]CC2)N1OCc1ccccc1	ZINC000299790827	372764764	/nfs/dbraw/zinc/76/47/64/372764764.db2.gz	CQIPPLOMCFOFRF-UHFFFAOYSA-N	1	0	260.337	1.863	50	0		CDAARO
O[C@H](c1cccnc1)c1ccc2c(c1)C[NH2+]CCO2	ZINC000299761184	372746814	/nfs/dbraw/zinc/74/68/14/372746814.db2.gz	WAAABGQHUSHHSL-HNNXBMFYSA-N	1	0	256.305	1.645	50	0		CDAARO
CC[N@@H+]1CCC[C@H](CN(C)C(=O)c2cncnc2)C1	ZINC000299775521	372752979	/nfs/dbraw/zinc/75/29/79/372752979.db2.gz	KFKTYCGOGMTUIG-GFCCVEGCSA-N	1	0	262.357	1.281	50	0		CDAARO
Cc1nn[nH]c1C(=O)NCC1CC[NH+](CC(C)C)CC1	ZINC000299778320	372754097	/nfs/dbraw/zinc/75/40/97/372754097.db2.gz	PGOKDAMNOYTCNR-UHFFFAOYSA-N	1	0	279.388	1.211	50	0		CDAARO
[NH3+]CCCOc1ccc(C(=O)NC[C@@H]2CCOC2)cc1	ZINC000299777579	372754325	/nfs/dbraw/zinc/75/43/25/372754325.db2.gz	LHUSZKNQFGKIFA-LBPRGKRZSA-N	1	0	278.352	1.181	50	0		CDAARO
Cc1ccc2nc(CNC(=O)[C@@H]3CCC[NH2+]CC3)cn2c1	ZINC000299785783	372761988	/nfs/dbraw/zinc/76/19/88/372761988.db2.gz	NWJPAMYZANYOGZ-CYBMUJFWSA-N	1	0	286.379	1.649	50	0		CDAARO
Cc1nnc(CN2CCC([NH+]3CCSCC3)CC2)s1	ZINC000299787872	372762309	/nfs/dbraw/zinc/76/23/09/372762309.db2.gz	YJUBEBRJPHYZAZ-UHFFFAOYSA-N	1	0	298.481	1.860	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)Nc2ccc3n[nH]cc3c2)C1	ZINC000299789499	372764079	/nfs/dbraw/zinc/76/40/79/372764079.db2.gz	YPJGZMHDHXIJOY-JTQLQIEISA-N	1	0	259.313	1.518	50	0		CDAARO
CCC1=NO[C@@H](C[NH+]2CCC(Oc3ncccn3)CC2)C1	ZINC000244852905	189913010	/nfs/dbraw/zinc/91/30/10/189913010.db2.gz	VBJNHJUVIQCONO-CQSZACIVSA-N	1	0	290.367	1.875	50	0		CDAARO
Nc1c(=O)oc2ccccc2c1NCC[NH+]1CCCC1	ZINC000000198777	373465324	/nfs/dbraw/zinc/46/53/24/373465324.db2.gz	GRGALROFWPMNNK-UHFFFAOYSA-N	1	0	273.336	1.883	50	0		CDAARO
COCCOC1CC[NH+]([C@H](C)C(=O)N2CCCC2)CC1	ZINC000670452006	483014487	/nfs/dbraw/zinc/01/44/87/483014487.db2.gz	GNQNMINSOSRFRN-CYBMUJFWSA-N	1	0	284.400	1.125	50	0		CDAARO
COC[C@@H]1CCCC[N@H+](CCN2CCO[C@H](C)C2)C1	ZINC000253397246	373685695	/nfs/dbraw/zinc/68/56/95/373685695.db2.gz	LRMVODRVXHRKCK-HUUCEWRRSA-N	1	0	270.417	1.456	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@H]1CCC[C@@H]([NH3+])C1	ZINC000111668881	374199926	/nfs/dbraw/zinc/19/99/26/374199926.db2.gz	COFVBRSMGXOXRA-WDEREUQCSA-N	1	0	267.398	1.927	50	0		CDAARO
C[C@@H](C(=O)NC(N)=O)[N@H+](C)CC12CC3CC(CC(C3)C1)C2	ZINC000027782548	374328449	/nfs/dbraw/zinc/32/84/49/374328449.db2.gz	HYRKWBSUVRHYAF-HXTFMFRQSA-N	1	0	293.411	1.718	50	0		CDAARO
CO[C@H]1C[N@H+](Cc2ccc(OC(F)F)cc2)C[C@@H]1O	ZINC000670457428	483037267	/nfs/dbraw/zinc/03/72/67/483037267.db2.gz	MFMMXOMGOFXMTE-RYUDHWBXSA-N	1	0	273.279	1.480	50	0		CDAARO
CC[C@@H](C(=O)[O-])[N@@H+]1CC[C@@H](CNc2cccc(C)[nH+]2)C1	ZINC000248963038	374649404	/nfs/dbraw/zinc/64/94/04/374649404.db2.gz	NELRWQPZGWPYAU-STQMWFEESA-N	1	0	277.368	1.987	50	0		CDAARO
Cc1cc(C(=O)N2CCC(OCCC[NH3+])CC2)c(C)o1	ZINC000094070754	374810293	/nfs/dbraw/zinc/81/02/93/374810293.db2.gz	VPRPJFMVSXDSJX-UHFFFAOYSA-N	1	0	280.368	1.866	50	0		CDAARO
CCOc1cc(C[NH2+][C@@H]2CCN(C3CC3)C2)ccn1	ZINC000095420330	374921088	/nfs/dbraw/zinc/92/10/88/374921088.db2.gz	VRAOTXYZFHBTLF-CYBMUJFWSA-N	1	0	261.369	1.807	50	0		CDAARO
CCn1cnnc1C[NH2+][C@@H]1CCc2ccccc2C1	ZINC000095420373	374921721	/nfs/dbraw/zinc/92/17/21/374921721.db2.gz	FIGKBZODYVTUSH-CQSZACIVSA-N	1	0	256.353	1.945	50	0		CDAARO
Cc1ccsc1[C@@H](C)[NH2+]CC1(C(N)=O)CCOCC1	ZINC000095420232	374922071	/nfs/dbraw/zinc/92/20/71/374922071.db2.gz	RGFSIZUMMLLOEA-LLVKDONJSA-N	1	0	282.409	1.989	50	0		CDAARO
CNC(=O)C[N@H+](C)C1CCN(c2ccc(Cl)cc2)CC1	ZINC000095432213	374932361	/nfs/dbraw/zinc/93/23/61/374932361.db2.gz	IWXBUPRHTPWOHL-UHFFFAOYSA-N	1	0	295.814	1.987	50	0		CDAARO
c1ccc(-n2nnnc2N2CC[C@@H]([NH+]3CCCC3)C2)cc1	ZINC000095469698	374966163	/nfs/dbraw/zinc/96/61/63/374966163.db2.gz	YJLDJWGRDSEPFU-CQSZACIVSA-N	1	0	284.367	1.337	50	0		CDAARO
CN1CCC([N@H+](C)C[C@H](O)COc2ccccc2)CC1	ZINC000003418304	375688064	/nfs/dbraw/zinc/68/80/64/375688064.db2.gz	LBWUCHVKOIBUER-HNNXBMFYSA-N	1	0	278.396	1.452	50	0		CDAARO
C[C@]1(C(=O)NCCCOC2CCCC2)CCC[NH2+]C1	ZINC000119091281	375826737	/nfs/dbraw/zinc/82/67/37/375826737.db2.gz	NODIXEXRCFSCGU-HNNXBMFYSA-N	1	0	268.401	1.842	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CC[C@@H]([NH3+])C2)cc1F	ZINC000606441038	375821876	/nfs/dbraw/zinc/82/18/76/375821876.db2.gz	AFJHPTCAIMMPBA-USEMIUTHSA-N	1	0	264.300	1.407	50	0		CDAARO
C[NH+]1CCN(c2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000008720858	377240789	/nfs/dbraw/zinc/24/07/89/377240789.db2.gz	MMZCLTYQPORPJY-UHFFFAOYSA-N	1	0	259.353	1.787	50	0		CDAARO
O=C1N(C2Cc3ccccc3C2)CC[C@]12CCC[NH2+]2	ZINC000035287477	284853186	/nfs/dbraw/zinc/85/31/86/284853186.db2.gz	JGUZBPLJWNYHDL-MRXNPFEDSA-N	1	0	256.349	1.508	50	0		CDAARO
C[NH+]1CCC(C)(C(=O)NCc2ncc(Cl)cn2)CC1	ZINC000426433672	256860466	/nfs/dbraw/zinc/86/04/66/256860466.db2.gz	PGZLDCZYHQJRJN-UHFFFAOYSA-N	1	0	282.775	1.478	50	0		CDAARO
[NH3+]CCCOC1CCN(C(=O)c2cc(F)cc(F)c2)CC1	ZINC000094071179	184754114	/nfs/dbraw/zinc/75/41/14/184754114.db2.gz	QDOZLGIDGDKCHR-UHFFFAOYSA-N	1	0	298.333	1.935	50	0		CDAARO
CCC(CC)(CO)[NH2+][C@@H]1CCN(CC(F)(F)F)C1=O	ZINC000096424683	390516099	/nfs/dbraw/zinc/51/60/99/390516099.db2.gz	BUZAZXUBFJWBGD-SECBINFHSA-N	1	0	282.306	1.290	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)COCc2ccccc2Cl)C1	ZINC000178518294	390524368	/nfs/dbraw/zinc/52/43/68/390524368.db2.gz	YCVCHFQSXGLXNH-NSHDSACASA-N	1	0	282.771	1.664	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]Cc1cccc(C(=O)N(C)C)c1	ZINC000097159455	390800942	/nfs/dbraw/zinc/80/09/42/390800942.db2.gz	CWOAIBRXVNFPED-UHFFFAOYSA-N	1	0	272.352	1.710	50	0		CDAARO
Cc1cc(F)c(C(=O)N2CCC[NH2+]CC2)cc1F	ZINC000178356568	390878486	/nfs/dbraw/zinc/87/84/86/390878486.db2.gz	QQSYSBYEPDNHFO-UHFFFAOYSA-N	1	0	254.280	1.709	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cnc(-c3ccccc3)nc2)C1	ZINC000179026458	390934887	/nfs/dbraw/zinc/93/48/87/390934887.db2.gz	UMCPMPCQHCSFEN-CYBMUJFWSA-N	1	0	296.374	1.825	50	0		CDAARO
C[C@H](O)[C@H]1CCCC[N@@H+]1CC(=O)N1CCCC[C@H]1C	ZINC000248057740	390912875	/nfs/dbraw/zinc/91/28/75/390912875.db2.gz	CFWSDSLZPMVERL-HZSPNIEDSA-N	1	0	268.401	1.623	50	0		CDAARO
C[C@@H](C(=O)NC[C@@H](O)C1CCOCC1)[NH+]1CCCCCC1	ZINC000096436968	533269405	/nfs/dbraw/zinc/26/94/05/533269405.db2.gz	ZQNLNZHNAYVBTF-DZGCQCFKSA-N	1	0	298.427	1.155	50	0		CDAARO
O=C(C[C@H]1COCC[NH2+]1)N1CCC[C@@H]1c1ccccc1	ZINC000097815496	391230051	/nfs/dbraw/zinc/23/00/51/391230051.db2.gz	QJBVKOUKYUFYLF-LSDHHAIUSA-N	1	0	274.364	1.729	50	0		CDAARO
COC(=O)[C@@H]1CC12CC[NH+](C[C@](C)(O)C(F)(F)F)CC2	ZINC000241171040	391332867	/nfs/dbraw/zinc/33/28/67/391332867.db2.gz	KDULBBBZOYIWAJ-ONGXEEELSA-N	1	0	295.301	1.575	50	0		CDAARO
CC(C)n1cnnc1CN(C)C[C@@H]1CCC[N@@H+]1C	ZINC000252502611	391608784	/nfs/dbraw/zinc/60/87/84/391608784.db2.gz	UROYRUUVFRFIIX-LBPRGKRZSA-N	1	0	251.378	1.385	50	0		CDAARO
COC(=O)CC(C)(C)CC(=O)N1CC[N@H+](C)CC1(C)C	ZINC000095986927	393156035	/nfs/dbraw/zinc/15/60/35/393156035.db2.gz	HYFSFWGMLOIJJD-UHFFFAOYSA-N	1	0	284.400	1.518	50	0		CDAARO
CCN1CC[NH+](C[C@@H](C)CNc2cncc(C)n2)CC1	ZINC000195575062	393304980	/nfs/dbraw/zinc/30/49/80/393304980.db2.gz	AINGXCDZXHOCFO-ZDUSSCGKSA-N	1	0	277.416	1.471	50	0		CDAARO
CS(=O)(=O)Nc1ccc(N2CC[NH+](C3CC3)CC2)cc1	ZINC000036111757	134805925	/nfs/dbraw/zinc/80/59/25/134805925.db2.gz	BBRPRLVWDZSYFF-UHFFFAOYSA-N	1	0	295.408	1.343	50	0		CDAARO
O=S(=O)([C@@H]1CC[N@H+](C[C@@H]2CC=CCC2)C1)N1CCCC1	ZINC000245689678	140276271	/nfs/dbraw/zinc/27/62/71/140276271.db2.gz	APUHFHMEHYJPQZ-HUUCEWRRSA-N	1	0	298.452	1.843	50	0		CDAARO
Cc1cc2c(cc1C)O[C@H](C(=O)N[C@@H]1CCCC[C@H]1[NH3+])C2	ZINC000128929014	397886550	/nfs/dbraw/zinc/88/65/50/397886550.db2.gz	VXNZCFAFBPFMCS-FMKPAKJESA-N	1	0	288.391	1.993	50	0		CDAARO
CO[C@H](C[NH2+][C@H]1CCC(=O)NC1(C)C)C1CCCC1	ZINC000658317407	413367838	/nfs/dbraw/zinc/36/78/38/413367838.db2.gz	VSZIMXMVLJCXAK-OLZOCXBDSA-N	1	0	268.401	1.838	50	0		CDAARO
COc1ccc2c(C[NH+]3CCC(O)CC3)cc(=O)oc2c1	ZINC000008204315	170324542	/nfs/dbraw/zinc/32/45/42/170324542.db2.gz	KMLPZIDOMCKJLR-UHFFFAOYSA-N	1	0	289.331	1.758	50	0		CDAARO
COCCN1CCC[C@](O)(C[NH2+]C2CCCCCC2)C1=O	ZINC000012315862	170475056	/nfs/dbraw/zinc/47/50/56/170475056.db2.gz	IBCCJAVMIJFAQM-INIZCTEOSA-N	1	0	298.427	1.299	50	0		CDAARO
COc1ccc([N+]2=C3CCCCN3C[C@]2(C)O)cc1	ZINC000013152691	170537448	/nfs/dbraw/zinc/53/74/48/170537448.db2.gz	LLSHJOHYVPCTPY-HNNXBMFYSA-N	1	0	261.345	1.819	50	0		CDAARO
CCC(CC)C[NH+]1CCC(Cn2cc(CO)nn2)CC1	ZINC000019758647	170855141	/nfs/dbraw/zinc/85/51/41/170855141.db2.gz	KYKDYUOBPSNSNN-UHFFFAOYSA-N	1	0	280.416	1.919	50	0		CDAARO
[NH2+]=C(NS(=O)(=O)c1cccs1)N1CCCCC1	ZINC000020857081	171276214	/nfs/dbraw/zinc/27/62/14/171276214.db2.gz	YTWCUKDMWIULOR-UHFFFAOYSA-N	1	0	273.383	1.447	50	0		CDAARO
Cc1nnc(CN(C)C(=O)CC[N@H+]2CCC[C@H](C)C2)o1	ZINC000020862037	171276330	/nfs/dbraw/zinc/27/63/30/171276330.db2.gz	JHHICFDDYBTDCX-NSHDSACASA-N	1	0	280.372	1.458	50	0		CDAARO
NC(=O)C[NH2+]Cc1ccc(OCc2ccccc2)cc1	ZINC000021956233	171341646	/nfs/dbraw/zinc/34/16/46/171341646.db2.gz	QPCKNQVICWJWJF-UHFFFAOYSA-N	1	0	270.332	1.841	50	0	in-vivo	CDAARO
O=c1c2sccc2ncn1CC1CC[NH+](CCO)CC1	ZINC000032519444	171731208	/nfs/dbraw/zinc/73/12/08/171731208.db2.gz	IQMNVCNVLHSXAG-UHFFFAOYSA-N	1	0	293.392	1.162	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C1CCN(C(=O)C(C)C)CC1	ZINC000037142673	172981620	/nfs/dbraw/zinc/98/16/20/172981620.db2.gz	OPZUDHXWVIEOLC-UHFFFAOYSA-N	1	0	278.400	1.763	50	0		CDAARO
Cc1cccc(OCC(=O)NCC2CC[NH2+]CC2)c1	ZINC000072328573	176369637	/nfs/dbraw/zinc/36/96/37/176369637.db2.gz	RUXCYJNYGAZENR-UHFFFAOYSA-N	1	0	262.353	1.490	50	0		CDAARO
NC(=O)NC(=O)C[NH+]1CCC(c2ccc(Cl)cc2)CC1	ZINC000185798527	274935549	/nfs/dbraw/zinc/93/55/49/274935549.db2.gz	DYSWMDGHCAPHTH-UHFFFAOYSA-N	1	0	295.770	1.714	50	0		CDAARO
CCC1(CC)[C@H]([NH2+][C@@H]2CCC(=O)N(C)C2)C[C@H]1OC	ZINC000095987933	276218244	/nfs/dbraw/zinc/21/82/44/276218244.db2.gz	MJPZETJOKATEON-JHJVBQTASA-N	1	0	268.401	1.791	50	0		CDAARO
CN1C(=O)N[C@](Cc2ccccc2)(C2CC[NH2+]CC2)C1=O	ZINC000067883627	277018644	/nfs/dbraw/zinc/01/86/44/277018644.db2.gz	GRMLZSWAEWMJPX-MRXNPFEDSA-N	1	0	287.363	1.149	50	0		CDAARO
CC(=O)NCC1=CCCN(CC[N@@H+]2C[C@H]3CC[C@@H]2C3)C1	ZINC000065385617	277029369	/nfs/dbraw/zinc/02/93/69/277029369.db2.gz	DZVWEFLMSNUKJA-GOEBONIOSA-N	1	0	277.412	1.239	50	0		CDAARO
C[NH+]1CCC(O)(C(=O)N2CCC[C@@H]2c2ccco2)CC1	ZINC000097402295	277031788	/nfs/dbraw/zinc/03/17/88/277031788.db2.gz	ZRGMIZNSFYJQSI-GFCCVEGCSA-N	1	0	278.352	1.400	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)[C@H]2CCOc3ccccc32)C1	ZINC000111189061	277033320	/nfs/dbraw/zinc/03/33/20/277033320.db2.gz	MNBQZSURIZHWTP-OCCSQVGLSA-N	1	0	274.364	1.621	50	0		CDAARO
COc1cc2[nH]c3c(nc[nH+]c3NN)c2cc1OC	ZINC000061715010	277841201	/nfs/dbraw/zinc/84/12/01/277841201.db2.gz	HBALNPXAQGTIKT-UHFFFAOYSA-N	1	0	259.269	1.414	50	0		CDAARO
C[C@@H]1CN(C(=O)C[NH2+][C@@H]2CCCC2(C)C)C[C@H](C)O1	ZINC000191291448	278645631	/nfs/dbraw/zinc/64/56/31/278645631.db2.gz	GOZRDELVDNYOGS-FRRDWIJNSA-N	1	0	268.401	1.791	50	0		CDAARO
NC(=O)C1CC[NH+](Cc2cccc3cccnc32)CC1	ZINC000012944787	279135792	/nfs/dbraw/zinc/13/57/92/279135792.db2.gz	JSEXBAARZDHCDS-UHFFFAOYSA-N	1	0	269.348	1.932	50	0		CDAARO
Cn1cc(C(=O)N2CCC[C@H]2C[NH+]2CCCC2)ccc1=O	ZINC000194678413	280048014	/nfs/dbraw/zinc/04/80/14/280048014.db2.gz	ZSOLFAGQIXDRQM-AWEZNQCLSA-N	1	0	289.379	1.086	50	0		CDAARO
Cc1cc(NC(=O)[C@H](C)[NH2+][C@@H](C)[C@@H]2CCCO2)on1	ZINC000097374271	280615752	/nfs/dbraw/zinc/61/57/52/280615752.db2.gz	IWXGZJSLNAVWTI-DCAQKATOSA-N	1	0	267.329	1.467	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)/C=C\c2cncc(F)c2)C1	ZINC000255089196	289355476	/nfs/dbraw/zinc/35/54/76/289355476.db2.gz	FHGZPJYYNHICLM-DSYXLKISSA-N	1	0	263.316	1.444	50	0		CDAARO
C[C@H](c1ccccc1Cl)N1CC[NH+](CCC(N)=O)CC1	ZINC000029690539	290263644	/nfs/dbraw/zinc/26/36/44/290263644.db2.gz	ATQXCDMPOLNUDO-GFCCVEGCSA-N	1	0	295.814	1.894	50	0		CDAARO
O[C@]1(CNc2cccc(C(F)(F)F)n2)CCC[NH2+]C1	ZINC000534582595	328312539	/nfs/dbraw/zinc/31/25/39/328312539.db2.gz	BCUULGFYDKHTFO-LLVKDONJSA-N	1	0	275.274	1.627	50	0		CDAARO
O=C([C@H]1CC[C@@H](O)CC1)N1CCC[C@]2(CC[NH2+]C2)C1	ZINC000534589628	328317653	/nfs/dbraw/zinc/31/76/53/328317653.db2.gz	ZGDBMAWECNBMDR-VNHYZAJKSA-N	1	0	266.385	1.140	50	0		CDAARO
OCC1(C[NH2+]C2CSCCSC2)CCCC1	ZINC000534637743	328334556	/nfs/dbraw/zinc/33/45/56/328334556.db2.gz	ZAFNSGIITSSXIB-UHFFFAOYSA-N	1	0	261.456	1.977	50	0		CDAARO
O=C(C[C@H]1CCOC1)N1CCCC2(CC[NH2+]CC2)C1	ZINC000534659639	328342303	/nfs/dbraw/zinc/34/23/03/328342303.db2.gz	OAHQDFKGMGAHTM-CYBMUJFWSA-N	1	0	266.385	1.405	50	0		CDAARO
Cc1cc(C)c(C(=O)NC[C@@H]2CC[NH2+]C[C@H]2O)cc1C	ZINC000534659694	328342455	/nfs/dbraw/zinc/34/24/55/328342455.db2.gz	KUFUIBSIPLOIBQ-DZGCQCFKSA-N	1	0	276.380	1.312	50	0		CDAARO
CCc1nc(C)sc1CNC(=O)[C@@H]1C=CC[NH2+]1	ZINC000534675377	328356022	/nfs/dbraw/zinc/35/60/22/328356022.db2.gz	ANMMXBNDMLIXPC-JTQLQIEISA-N	1	0	251.355	1.158	50	0		CDAARO
C[N@H+](CC(=O)NCC[C@@H]1CCCOC1)C1CCCC1	ZINC000534676120	328356258	/nfs/dbraw/zinc/35/62/58/328356258.db2.gz	CVOLYVLNBAWOBJ-ZDUSSCGKSA-N	1	0	268.401	1.794	50	0		CDAARO
CO[C@H]1CCN(C(=O)CCc2ccsc2)[C@H](C[NH3+])C1	ZINC000195557569	323571601	/nfs/dbraw/zinc/57/16/01/323571601.db2.gz	WAAWANDTJORIIL-STQMWFEESA-N	1	0	282.409	1.645	50	0		CDAARO
CC1(C(=O)NCc2ccc3c(c2)OCO3)CC[NH2+]CC1	ZINC000032919286	326898485	/nfs/dbraw/zinc/89/84/85/326898485.db2.gz	UQYJNTQIRUXRSR-UHFFFAOYSA-N	1	0	276.336	1.421	50	0		CDAARO
C[C@H]([NH2+]C[C@@H]1CCCC[C@@H]1O)C(=O)NC1CCCC1	ZINC000085986680	482682226	/nfs/dbraw/zinc/68/22/26/482682226.db2.gz	GXSYBPZPJKRURR-OBJOEFQTSA-N	1	0	268.401	1.574	50	0		CDAARO
O=C(NCc1nc2cc(Cl)ccc2[nH]1)[C@@H]1CCC[NH2+]1	ZINC000670433937	482967425	/nfs/dbraw/zinc/96/74/25/482967425.db2.gz	WVLKPOTZBAEBAO-JTQLQIEISA-N	1	0	278.743	1.585	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](c2ncnn2CC(F)(F)F)C1	ZINC000670444987	482994756	/nfs/dbraw/zinc/99/47/56/482994756.db2.gz	HLHWCAVAIXUAFH-SNVBAGLBSA-N	1	0	292.305	1.666	50	0		CDAARO
Cc1nc(CN(C)CC2CC[NH+](CCO)CC2)n(C)c1C	ZINC000670449488	483008559	/nfs/dbraw/zinc/00/85/59/483008559.db2.gz	GYAXSIVCHIZWLV-UHFFFAOYSA-N	1	0	294.443	1.173	50	0		CDAARO
C[C@@H](NC(=O)CCC[NH+]1CCCCCC1)c1ncnn1C	ZINC000670453651	483027926	/nfs/dbraw/zinc/02/79/26/483027926.db2.gz	KWOCNCJBXCYVQI-CYBMUJFWSA-N	1	0	293.415	1.649	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N2CCO[C@H](C3CC3)C2)c1C	ZINC000670456205	483035693	/nfs/dbraw/zinc/03/56/93/483035693.db2.gz	JTMUDDLOJRCQPJ-ZDUSSCGKSA-N	1	0	276.384	1.775	50	0		CDAARO
Cc1cc(=O)c(C(=O)N2CCC(C[NH+](C)C)CC2)cn1C	ZINC000670473069	483082620	/nfs/dbraw/zinc/08/26/20/483082620.db2.gz	RMTWTQNBBGBLNX-UHFFFAOYSA-N	1	0	291.395	1.108	50	0		CDAARO
COC[C@H](NC(=O)NC[C@H]1CCC[N@H+](C)C1)c1ccco1	ZINC000083877727	483216404	/nfs/dbraw/zinc/21/64/04/483216404.db2.gz	RVKWNRGNOKZRIT-OLZOCXBDSA-N	1	0	295.383	1.608	50	0		CDAARO
CCc1c(C(=O)N2CC[C@@H](C[NH3+])C2)cnn1C(C)(C)C	ZINC000269176700	536038407	/nfs/dbraw/zinc/03/84/07/536038407.db2.gz	YOPWOKGOCYSRCH-NSHDSACASA-N	1	0	278.400	1.621	50	0		CDAARO
CCC(CC)[NH2+]CCNc1nc2c(cnn2C)c(=O)[nH]1	ZINC000521398675	545101394	/nfs/dbraw/zinc/10/13/94/545101394.db2.gz	YLPMXYHCPCTDLO-UHFFFAOYSA-N	1	0	278.360	1.259	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)O[C@@H]1CCN(C(C)C)C1=O	ZINC000408525666	528502646	/nfs/dbraw/zinc/50/26/46/528502646.db2.gz	PKYIREJUIILWPS-QWHCGFSZSA-N	1	0	284.400	1.550	50	0		CDAARO
CCNC(=O)CN1C[C@@H]2C[N@H+](C)[C@@H](c3ccccc3)[C@H]2C1	ZINC000252485900	570270578	/nfs/dbraw/zinc/27/05/78/570270578.db2.gz	BXXHIUKYTMFACF-ZOBUZTSGSA-N	1	0	287.407	1.357	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(NS(C)(=O)=O)cc1	ZINC000757207500	577035929	/nfs/dbraw/zinc/03/59/29/577035929.db2.gz	BJGHMSCCGWMMEG-MFKMUULPSA-N	1	0	268.382	1.771	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@](O)([C@H]([NH3+])C2CCCC2)C1	ZINC000958528825	613980893	/nfs/dbraw/zinc/98/08/93/613980893.db2.gz	WBHHXFZINGEEKD-IUODEOHRSA-N	1	0	284.400	1.876	50	0		CDAARO
CC[C@@H](C(=O)N1CCC2(CCC(=O)N2C)CC1)[N@H+](C)CC	ZINC000952967659	615368921	/nfs/dbraw/zinc/36/89/21/615368921.db2.gz	KRKNXCIKFSVXOS-ZDUSSCGKSA-N	1	0	295.427	1.330	50	0		CDAARO
CC[C@H](C(=O)N1CCC2(CCC(=O)N2C)CC1)[N@H+](C)CC	ZINC000952967656	615600727	/nfs/dbraw/zinc/60/07/27/615600727.db2.gz	KRKNXCIKFSVXOS-CYBMUJFWSA-N	1	0	295.427	1.330	50	0		CDAARO
CCc1ccc(C[NH2+]CCN2CCCC[C@H]2CO)nc1	ZINC000952965404	615674059	/nfs/dbraw/zinc/67/40/59/615674059.db2.gz	DFMUBEUVBVKQCA-INIZCTEOSA-N	1	0	277.412	1.580	50	0		CDAARO
CCc1ncnc(N2CC(N3CC[NH+](CC)CC3)C2)c1F	ZINC000952995200	615780276	/nfs/dbraw/zinc/78/02/76/615780276.db2.gz	DHQVZMGFYFDKEM-UHFFFAOYSA-N	1	0	293.390	1.004	50	0		CDAARO
Cn1cncc1/C=C\C(=O)NCc1ccc2c(c1)C[NH2+]C2	ZINC000888096415	617758340	/nfs/dbraw/zinc/75/83/40/617758340.db2.gz	FYYIGYINJOFYKR-PLNGDYQASA-N	1	0	282.347	1.353	50	0		CDAARO
[NH3+]C[C@@H](NC(=O)CCc1ccon1)C1CCCC1	ZINC000888096354	617758626	/nfs/dbraw/zinc/75/86/26/617758626.db2.gz	CLJHMDUSWSNEDF-GFCCVEGCSA-N	1	0	251.330	1.241	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](CNC(=O)C2CCC2)C1	ZINC000952978953	616349268	/nfs/dbraw/zinc/34/92/68/616349268.db2.gz	GIIGTZUKLYRPKA-GFCCVEGCSA-N	1	0	254.374	1.261	50	0		CDAARO
COCCCCN(C)C(=O)[C@@H]1CC[C@@H]2C[C@@H](C)C[N@@H+]2C1	ZINC000952995800	616862501	/nfs/dbraw/zinc/86/25/01/616862501.db2.gz	ZFNHYCKCPNNLIC-RBSFLKMASA-N	1	0	282.428	1.992	50	0		CDAARO
Cc1c(CNC(=O)[C@@H]2CCN(c3cc[nH+]cc3)C2)cnn1C	ZINC000888098055	617759671	/nfs/dbraw/zinc/75/96/71/617759671.db2.gz	BDCQROHZROUYDG-CYBMUJFWSA-N	1	0	299.378	1.266	50	0		CDAARO
OC[C@@H](O)C1CC[NH+](Cc2ccc3c(c2)CCO3)CC1	ZINC001772704685	1159439126	/nfs/dbraw/zinc/43/91/26/1159439126.db2.gz	GMODFYSWMNGORP-OAHLLOKOSA-N	1	0	277.364	1.187	50	0		CDAARO
CCOc1cc(N(C)CC2CC[NH+](C)CC2)ncn1	ZINC000123769843	721936715	/nfs/dbraw/zinc/93/67/15/721936715.db2.gz	IPGHINUNMDYALP-UHFFFAOYSA-N	1	0	264.373	1.653	50	0		CDAARO
C[C@H]([NH3+])CNC(=O)c1csc(-c2ccccn2)n1	ZINC000194896859	898168339	/nfs/dbraw/zinc/16/83/39/898168339.db2.gz	PMGVNFDHRPLLQP-QMMMGPOBSA-N	1	0	262.338	1.282	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@H](C[N@@H+]2CC[C@@H](C(N)=O)C2)C1	ZINC000584907099	898696707	/nfs/dbraw/zinc/69/67/07/898696707.db2.gz	PQTKIJUOLFCAEZ-NWDGAFQWSA-N	1	0	297.399	1.051	50	0		CDAARO
C[C@@H](C(=O)N(C)CC[NH+]1CCCCCC1)n1ccnc1	ZINC000426646956	902879817	/nfs/dbraw/zinc/87/98/17/902879817.db2.gz	BYWUNKXEZRWRDL-AWEZNQCLSA-N	1	0	278.400	1.779	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@H]1NC(=O)Cc1cccc(O)c1	ZINC000387947182	936641010	/nfs/dbraw/zinc/64/10/10/936641010.db2.gz	ALZIEVRDPMWTDR-HFAKWTLXSA-N	1	0	262.353	1.437	50	0		CDAARO
Cc1nn(CC[NH2+]C2CCN(C)CC2)c(C)c1C	ZINC000823765110	925728493	/nfs/dbraw/zinc/72/84/93/925728493.db2.gz	VVVOPIXGPIUIDB-UHFFFAOYSA-N	1	0	250.390	1.492	50	0		CDAARO
CNC(=O)[C@H]1CC[C@H](CNc2cc[nH+]c(N)n2)CC1	ZINC000823830725	925736410	/nfs/dbraw/zinc/73/64/10/925736410.db2.gz	XEHQYESBFYQHDQ-MGCOHNPYSA-N	1	0	263.345	1.023	50	0		CDAARO
CN(CC1(CO)CCCC1)C(=O)[C@@]1(C)CCC[NH2+]C1	ZINC000828686784	926164151	/nfs/dbraw/zinc/16/41/51/926164151.db2.gz	VWEQMSORCFGVOA-AWEZNQCLSA-N	1	0	268.401	1.387	50	0		CDAARO
O[C@H]1C[N@H+](CCC2CCCCCC2)C[C@@H]1N1CCOCC1	ZINC000828896810	926209113	/nfs/dbraw/zinc/20/91/13/926209113.db2.gz	UTMDFLGCZOCMAB-IRXDYDNUSA-N	1	0	296.455	1.724	50	0		CDAARO
COCCNC(=O)c1ccc(CC2CC[NH+](C)CC2)cc1	ZINC000581805716	927201712	/nfs/dbraw/zinc/20/17/12/927201712.db2.gz	VOFQPWFKVBQKQZ-UHFFFAOYSA-N	1	0	290.407	1.947	50	0		CDAARO
Cc1ccc(N2CCC([N@@H+]3CCC[C@@H](O)C3)CC2)nc1	ZINC000200514436	929253942	/nfs/dbraw/zinc/25/39/42/929253942.db2.gz	FUVKTZLGOASCRJ-OAHLLOKOSA-N	1	0	275.396	1.816	50	0		CDAARO
C[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)N(CC(N)=O)[C@@H]1C	ZINC000585116129	930967650	/nfs/dbraw/zinc/96/76/50/930967650.db2.gz	ICRCBPNGRCYHQT-IJLUTSLNSA-N	1	0	299.415	1.485	50	0		CDAARO
O=[S@](CC[NH2+]Cc1cccc2c1OCO2)C(F)(F)F	ZINC000585116752	930970186	/nfs/dbraw/zinc/97/01/86/930970186.db2.gz	HHVKLJHUEUAEQT-LJQANCHMSA-N	1	0	295.282	1.773	50	0		CDAARO
CCN1CCC[C@H]([N@@H+]2CCC[C@H](CN3CCCC3=O)C2)C1	ZINC000042987517	932213792	/nfs/dbraw/zinc/21/37/92/932213792.db2.gz	MSEIUFLSRDEAKW-HOTGVXAUSA-N	1	0	293.455	1.805	50	0		CDAARO
CCC[NH+]1CCC(Cc2nc3c([nH]2)C(=O)NCCC3)CC1	ZINC000095363216	934971857	/nfs/dbraw/zinc/97/18/57/934971857.db2.gz	ZFRGBUQFWFKVCE-UHFFFAOYSA-N	1	0	290.411	1.750	50	0		CDAARO
COc1ccc(C(=O)N(C)C[C@H]2CCCC[N@@H+]2C)o1	ZINC000019840679	935722039	/nfs/dbraw/zinc/72/20/39/935722039.db2.gz	MMYXTTWXVFCTAG-LLVKDONJSA-N	1	0	266.341	1.845	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3ccncc3)C[C@H]2O)[nH]n1	ZINC001529161803	968999911	/nfs/dbraw/zinc/99/99/11/968999911.db2.gz	QNCWSQJNVBZVFV-UKRRQHHQSA-N	1	0	272.352	1.149	50	0		CDAARO
Cn1ccnc1CC[NH+]1CCC(O)(c2ccccc2)CC1	ZINC001506402977	975150251	/nfs/dbraw/zinc/15/02/51/975150251.db2.gz	MXVXEKHXBQCASP-UHFFFAOYSA-N	1	0	285.391	1.946	50	0		CDAARO
Cc1ccnn1CC[N@@H+]1CC[C@H](O)CC(C)(C)C1	ZINC001506429643	975161832	/nfs/dbraw/zinc/16/18/32/975161832.db2.gz	WCXNUSDZAOPYJS-ZDUSSCGKSA-N	1	0	251.374	1.674	50	0		CDAARO
CN(C[C@@H]1CC[N@H+](C)C1(C)C)C(=O)c1cncc(O)c1	ZINC000584903128	341986618	/nfs/dbraw/zinc/98/66/18/341986618.db2.gz	FASGUCHWKFAAGV-LBPRGKRZSA-N	1	0	277.368	1.590	50	0		CDAARO
CCS(=O)(=O)NC[C@@H](C)[NH2+]C1(c2ccccc2C)CC1	ZINC000584902140	341986766	/nfs/dbraw/zinc/98/67/66/341986766.db2.gz	SLVJGHIBPFUECX-CYBMUJFWSA-N	1	0	296.436	1.902	50	0		CDAARO
C[C@@H](CCNc1nncc2ccccc21)[NH+]1CCN(C)CC1	ZINC000584903701	341987142	/nfs/dbraw/zinc/98/71/42/341987142.db2.gz	KLJRWSLDFIYSPG-AWEZNQCLSA-N	1	0	299.422	1.490	50	0		CDAARO
Cc1cnn(C[C@H]2CCC[N@@H+]2[C@@H](C(N)=O)c2ccccc2)c1	ZINC000106784534	349489750	/nfs/dbraw/zinc/48/97/50/349489750.db2.gz	KWVLQIABBMIEBN-HZPDHXFCSA-N	1	0	298.390	1.883	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)CCc1nncn1-c1ccccc1	ZINC000124606215	187145539	/nfs/dbraw/zinc/14/55/39/187145539.db2.gz	RNWJGQBSAAYEBS-CYBMUJFWSA-N	1	0	299.378	1.020	50	0		CDAARO
O=C(COC(=O)c1ccn2c[nH+]cc2c1)NC1CCCC1	ZINC000095982247	185054413	/nfs/dbraw/zinc/05/44/13/185054413.db2.gz	FMSMNDIPQAHGLT-UHFFFAOYSA-N	1	0	287.319	1.550	50	0		CDAARO
COC(=O)c1cc(C[N@@H+]2CCC[C@@H]([C@@H](C)O)C2)n(C)c1C	ZINC000242302205	361755931	/nfs/dbraw/zinc/75/59/31/361755931.db2.gz	YQMFSWGTFMJDKR-CHWSQXEVSA-N	1	0	294.395	1.713	50	0		CDAARO
O=C(C[C@H]1CCCO1)N1CCC[C@@H]1C1CC[NH2+]CC1	ZINC000087212162	539087005	/nfs/dbraw/zinc/08/70/05/539087005.db2.gz	ILRKOBGDQHCLNE-ZIAGYGMSSA-N	1	0	266.385	1.546	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1cc(-c2ccncc2)on1	ZINC000124865547	187158610	/nfs/dbraw/zinc/15/86/10/187158610.db2.gz	KZSXORZRLMOCQF-SNVBAGLBSA-N	1	0	272.308	1.171	50	0		CDAARO
C[C@H](CS(C)(=O)=O)N(CCC[NH3+])c1cccc(F)c1	ZINC000194624775	342598122	/nfs/dbraw/zinc/59/81/22/342598122.db2.gz	YELDBEBNOMPRSL-LLVKDONJSA-N	1	0	288.388	1.414	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CN1CCN(c2ccc(O)cc2)CC1	ZINC000244626789	361854944	/nfs/dbraw/zinc/85/49/44/361854944.db2.gz	FSVMOSNTZYVOKD-MRXNPFEDSA-N	1	0	289.423	1.999	50	0		CDAARO
Cc1cc(C)n(C2CN(C(=O)[C@@H]([NH3+])Cc3ccccc3)C2)n1	ZINC000244659536	361855837	/nfs/dbraw/zinc/85/58/37/361855837.db2.gz	HEJOZEPRHKTURD-INIZCTEOSA-N	1	0	298.390	1.453	50	0		CDAARO
Cc1ccccc1[C@@]1(O)CC[N@H+](CCn2cncn2)C1	ZINC000244718887	361858889	/nfs/dbraw/zinc/85/88/89/361858889.db2.gz	LSSUBFMFACMUEO-OAHLLOKOSA-N	1	0	272.352	1.180	50	0		CDAARO
CN1CCO[C@H](CNc2ncnc3ccsc32)C1	ZINC000065554057	361915574	/nfs/dbraw/zinc/91/55/74/361915574.db2.gz	VOVUBZZEAKVMPL-SECBINFHSA-N	1	0	264.354	1.434	50	0		CDAARO
Cc1ccc(NC[C@@H]2CCN([C@@H]3C[C@H](C)OC3=O)C2)nc1	ZINC000097200821	342217027	/nfs/dbraw/zinc/21/70/27/342217027.db2.gz	VSASMZSSGSEMJL-MELADBBJSA-N	1	0	289.379	1.828	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1ccccc1S(N)(=O)=O	ZINC000585141924	342219184	/nfs/dbraw/zinc/21/91/84/342219184.db2.gz	INZRQACNOXQHEV-LBPRGKRZSA-N	1	0	297.424	1.620	50	0		CDAARO
NC(=O)[C@@H]1CCN(Cc2ccncc2Br)C1	ZINC000585140567	342218727	/nfs/dbraw/zinc/21/87/27/342218727.db2.gz	HCVKVFFCVNJBAP-SECBINFHSA-N	1	0	284.157	1.151	50	0		CDAARO
CCCS(=O)(=O)CC[NH2+][C@H]1CC(C)(C)OC1(C)C	ZINC000119793206	342269992	/nfs/dbraw/zinc/26/99/92/342269992.db2.gz	ATIRWVPUNWPQKK-NSHDSACASA-N	1	0	277.430	1.747	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)COc1ccccc1F	ZINC000125705663	187197322	/nfs/dbraw/zinc/19/73/22/187197322.db2.gz	FHBXZYYBDWVEKZ-JTQLQIEISA-N	1	0	252.289	1.025	50	0		CDAARO
O=C([C@H]1CCCCO1)N1CCC[C@H]1C1CC[NH2+]CC1	ZINC000050960579	539160362	/nfs/dbraw/zinc/16/03/62/539160362.db2.gz	VHSOTTABVGCWHU-UONOGXRCSA-N	1	0	266.385	1.546	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)c2ccccc2N2CCOCC2)C1	ZINC000178329146	362242331	/nfs/dbraw/zinc/24/23/31/362242331.db2.gz	YUZQIOBNUKWUIV-ZDUSSCGKSA-N	1	0	289.379	1.087	50	0		CDAARO
CC[N@H+](C[C@@H](O)COC)[C@H]1CCN(c2ccccc2)C1=O	ZINC000126917181	187270289	/nfs/dbraw/zinc/27/02/89/187270289.db2.gz	ZMDFTMCWVHVLQY-CABCVRRESA-N	1	0	292.379	1.121	50	0		CDAARO
C[C@H]([NH2+]Cc1nncn1-c1ccccc1)[C@H]1CCCO1	ZINC000273186147	192069108	/nfs/dbraw/zinc/06/91/08/192069108.db2.gz	PCOKWTZMPIWHCM-GXTWGEPZSA-N	1	0	272.352	1.924	50	0		CDAARO
Cc1nccn1CC1CC[NH+](CCc2cn[nH]c2)CC1	ZINC000252503731	362390480	/nfs/dbraw/zinc/39/04/80/362390480.db2.gz	VGIGDUGUOLDRCS-UHFFFAOYSA-N	1	0	273.384	1.869	50	0		CDAARO
C[NH+]1CCC(C)(C(=O)NCc2cnc3c(c2)CCC3)CC1	ZINC000426484817	530048089	/nfs/dbraw/zinc/04/80/89/530048089.db2.gz	OYHHXEZVRKCEOU-UHFFFAOYSA-N	1	0	287.407	1.918	50	0		CDAARO
CN(Cc1nc2ccccc2s1)C(=O)[C@H]1C=CC[NH2+]1	ZINC000534584469	345506611	/nfs/dbraw/zinc/50/66/11/345506611.db2.gz	BYXNIWHWOFAHKB-LLVKDONJSA-N	1	0	273.361	1.783	50	0		CDAARO
Cn1cc(C[NH2+]Cc2ccc(Cn3cncn3)cc2)cn1	ZINC000097197999	185560216	/nfs/dbraw/zinc/56/02/16/185560216.db2.gz	VUDWBGIWURGAEZ-UHFFFAOYSA-N	1	0	282.351	1.350	50	0		CDAARO
Cc1cccc(OCCN(C)C(=O)[C@H]2CCC[C@H]2[NH3+])c1	ZINC000085368785	179038447	/nfs/dbraw/zinc/03/84/47/179038447.db2.gz	CWFWINFXTVDBBD-LSDHHAIUSA-N	1	0	276.380	1.960	50	0		CDAARO
O=C(Cc1ccccc1)N1CC[NH+](C[C@H](O)C2CC2)CC1	ZINC000085436653	179063164	/nfs/dbraw/zinc/06/31/64/179063164.db2.gz	DDJKGYYLWJAEQL-INIZCTEOSA-N	1	0	288.391	1.144	50	0		CDAARO
Cc1nc(N2CCCC2)cc(NCCNC(=O)C(C)C)[nH+]1	ZINC000036708048	362836063	/nfs/dbraw/zinc/83/60/63/362836063.db2.gz	QITQPBUCYGXTIH-UHFFFAOYSA-N	1	0	291.399	1.569	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@@H]2CC(=O)N(C(C)C)C2)C[C@@H]1[NH+](C)C	ZINC000089948345	347627812	/nfs/dbraw/zinc/62/78/12/347627812.db2.gz	HGQKWBCUMCHDEJ-MCIONIFRSA-N	1	0	295.427	1.042	50	0		CDAARO
c1[nH]nc(-c2cccnc2)c1C[NH2+][C@@H]1CCCOC1	ZINC000103961233	185869139	/nfs/dbraw/zinc/86/91/39/185869139.db2.gz	USNPTJFZTUCZAL-CYBMUJFWSA-N	1	0	258.325	1.740	50	0		CDAARO
COc1ccc(-c2cn(C3CC[NH2+]CC3)c(=O)[nH]2)cc1	ZINC000142569852	348752156	/nfs/dbraw/zinc/75/21/56/348752156.db2.gz	BPCKFCRHZOTOSD-UHFFFAOYSA-N	1	0	273.336	1.777	50	0		CDAARO
O=C(CC1CCC1)N1CCN([C@@H]2C[NH+]3CCC2CC3)CC1	ZINC000584888165	349346348	/nfs/dbraw/zinc/34/63/48/349346348.db2.gz	LMZSGNRWTOVHCL-MRXNPFEDSA-N	1	0	291.439	1.415	50	0		CDAARO
CCOC(=O)N1CC[C@H]([NH2+]Cc2cc(C3CC3)n[nH]2)C1	ZINC000584895923	349356676	/nfs/dbraw/zinc/35/66/76/349356676.db2.gz	OEIGVMAGPTWDJP-NSHDSACASA-N	1	0	278.356	1.608	50	0		CDAARO
O[C@]1(C[NH2+][C@@H]2CCSc3ccccc32)CCOC1	ZINC000090848011	180044335	/nfs/dbraw/zinc/04/43/35/180044335.db2.gz	PWWOPMHLPUYEJZ-OCCSQVGLSA-N	1	0	265.378	1.965	50	0		CDAARO
CC[C@@H](C(=O)NCCNc1cc(C)cc[nH+]1)n1cccn1	ZINC000091621030	180208815	/nfs/dbraw/zinc/20/88/15/180208815.db2.gz	SCDVNLPZXIDZPK-ZDUSSCGKSA-N	1	0	287.367	1.766	50	0		CDAARO
CC[C@H](O)C[N@@H+]1CCC[C@H](c2nncn2C2CC2)C1	ZINC000091630028	180209985	/nfs/dbraw/zinc/20/99/85/180209985.db2.gz	JWIPMRAUTBYEJN-AAEUAGOBSA-N	1	0	264.373	1.563	50	0		CDAARO
c1cn(C2CCC2)c(-c2cn(C3CC[NH2+]CC3)nn2)n1	ZINC000091644494	180214977	/nfs/dbraw/zinc/21/49/77/180214977.db2.gz	JOTHSYZRCWGBHC-UHFFFAOYSA-N	1	0	272.356	1.791	50	0		CDAARO
CN1CCO[C@@H](C[NH2+]Cc2cccc(Cl)c2)C1	ZINC000105472193	186059094	/nfs/dbraw/zinc/05/90/94/186059094.db2.gz	ACMLBZFJGAGMEW-ZDUSSCGKSA-N	1	0	254.761	1.760	50	0		CDAARO
CN1CCO[C@@H](C[NH2+]Cc2ccc(F)cc2F)C1	ZINC000105472153	186059582	/nfs/dbraw/zinc/05/95/82/186059582.db2.gz	JSUKQWSLGLHRGC-LBPRGKRZSA-N	1	0	256.296	1.385	50	0		CDAARO
CCc1ccc(C(=O)NC[C@H]2C[N@@H+]3CCC[C@H]3CO2)cc1	ZINC000106517087	186122911	/nfs/dbraw/zinc/12/29/11/186122911.db2.gz	SVGDPSYXMMZITC-HOTGVXAUSA-N	1	0	288.391	1.842	50	0		CDAARO
CC[C@H]1CN(C(=O)[C@@H]([NH3+])Cc2ccccc2)CCO1	ZINC000036770029	362966454	/nfs/dbraw/zinc/96/64/54/362966454.db2.gz	OCPOSFUIUZNKOX-KBPBESRZSA-N	1	0	262.353	1.194	50	0		CDAARO
COC(=O)c1ccc([C@H](C)[N@@H+]2CC[C@H](C)[C@H](O)C2)o1	ZINC000108329124	186212839	/nfs/dbraw/zinc/21/28/39/186212839.db2.gz	AMLHDQJIXRPLBT-GARJFASQSA-N	1	0	267.325	1.830	50	0		CDAARO
O[C@H]([C@@H]1CCC[N@@H+]1CCOC[C@@H]1CCCO1)C(F)(F)F	ZINC000110617860	186305323	/nfs/dbraw/zinc/30/53/23/186305323.db2.gz	AEMRESOZUGYQLY-SDDRHHMPSA-N	1	0	297.317	1.570	50	0		CDAARO
Cn1cncc1C[NH2+]C[C@@H]1CCN(CC(F)(F)F)C1	ZINC000112341441	365999253	/nfs/dbraw/zinc/99/92/53/365999253.db2.gz	RZNZANXJDSJDJA-JTQLQIEISA-N	1	0	276.306	1.394	50	0		CDAARO
O=C(CCn1cnc2ccccc21)N[C@H]1CCC[NH2+]C1	ZINC000124124398	187123486	/nfs/dbraw/zinc/12/34/86/187123486.db2.gz	JJWDIRCHVMHAOZ-LBPRGKRZSA-N	1	0	272.352	1.295	50	0		CDAARO
Cc1cc(CN(C)C(=O)CC[C@@H]2CCCC[N@@H+]2C)[nH]n1	ZINC000065434313	363270043	/nfs/dbraw/zinc/27/00/43/363270043.db2.gz	LGVYLRIWASXJSP-AWEZNQCLSA-N	1	0	278.400	1.941	50	0		CDAARO
C[C@H]1CCCN(C(=O)CCN2CC([NH+]3CCCCC3)C2)C1	ZINC000065499553	363289872	/nfs/dbraw/zinc/28/98/72/363289872.db2.gz	AWSIYZRJNAPBNU-HNNXBMFYSA-N	1	0	293.455	1.805	50	0		CDAARO
CC(C)[NH2+]C1(C(N)=O)CCN(Cc2ccccc2)CC1	ZINC000000393552	355908512	/nfs/dbraw/zinc/90/85/12/355908512.db2.gz	MSWWMXGLWBQMNG-UHFFFAOYSA-N	1	0	275.396	1.505	50	0	in-vitro	CDAARO
C[C@@H](C(=O)N1C[C@@H](C)OC[C@@H]1C)[C@@H]([NH3+])c1ccccc1	ZINC000195538859	363456901	/nfs/dbraw/zinc/45/69/01/363456901.db2.gz	LLEMMCFEIVBBHL-KYEXWDHISA-N	1	0	276.380	1.958	50	0		CDAARO
COc1cccc(CSc2nc(N)cc(N)[nH+]2)c1	ZINC000000054657	355882417	/nfs/dbraw/zinc/88/24/17/355882417.db2.gz	NSRFTCMSGJLFQI-UHFFFAOYSA-N	1	0	262.338	1.942	50	0		CDAARO
C[NH+](C)CCOC(=O)COc1ccc(Cl)cc1	ZINC000001531029	355938901	/nfs/dbraw/zinc/93/89/01/355938901.db2.gz	XZTYGFHCIAKPGJ-UHFFFAOYSA-N	1	0	257.717	1.824	50	0	world	CDAARO
C[C@@H](CNC(=O)[C@H](C)Oc1ccccc1)C[NH+](C)C	ZINC000002881516	355986542	/nfs/dbraw/zinc/98/65/42/355986542.db2.gz	POVREMZLKFLXJK-STQMWFEESA-N	1	0	264.369	1.768	50	0		CDAARO
CC[NH+](CC)CCNS(=O)(=O)c1ccc(C)cc1C	ZINC000003370081	356000851	/nfs/dbraw/zinc/00/08/51/356000851.db2.gz	YGMMVQSRONRRCV-UHFFFAOYSA-N	1	0	284.425	1.924	50	0		CDAARO
C[N@H+](CCSc1nc(N)n[nH]1)Cc1ccc(F)cc1	ZINC000097377167	356101158	/nfs/dbraw/zinc/10/11/58/356101158.db2.gz	SEOUEJQBMSJWPO-UHFFFAOYSA-N	1	0	281.360	1.750	50	0		CDAARO
Cc1ccc(F)cc1C[NH2+]C1CCN(CC(N)=O)CC1	ZINC000195552827	363460952	/nfs/dbraw/zinc/46/09/52/363460952.db2.gz	FJOYFFZTGYMGCR-UHFFFAOYSA-N	1	0	279.359	1.173	50	0		CDAARO
CCC[NH2+]C[C@@]1(O)CCCN(Cc2ccccc2F)C1=O	ZINC000012714986	356320527	/nfs/dbraw/zinc/32/05/27/356320527.db2.gz	WJSJBBPDBUORSF-INIZCTEOSA-N	1	0	294.370	1.679	50	0		CDAARO
CN(C)c1ncccc1CNC(=O)c1cccnc1	ZINC000032686799	356334457	/nfs/dbraw/zinc/33/44/57/356334457.db2.gz	JQVOSMFBGOCZMI-UHFFFAOYSA-N	1	0	256.309	1.473	50	0		CDAARO
CC(C)C[N@H+](CC(=O)NC(=O)NC(C)(C)C)C1CC1	ZINC000032777921	356363924	/nfs/dbraw/zinc/36/39/24/356363924.db2.gz	DGBDKBLAGCYAQZ-UHFFFAOYSA-N	1	0	269.389	1.731	50	0		CDAARO
COc1cc(C[C@H]2CC(C[NH3+])=NO2)c(OC)c2c1OCO2	ZINC000015081276	356406360	/nfs/dbraw/zinc/40/63/60/356406360.db2.gz	ZOPXUQFOIQVMSK-JTQLQIEISA-N	1	0	294.307	1.079	50	0		CDAARO
OCCOc1ccc(C[NH2+]Cc2cccnc2)cc1	ZINC000015082301	356406390	/nfs/dbraw/zinc/40/63/90/356406390.db2.gz	FKZPCHZVVHPULJ-UHFFFAOYSA-N	1	0	258.321	1.743	50	0		CDAARO
C[NH+]1CCC(NC(=O)c2c(F)cccc2F)CC1	ZINC000016580680	356442090	/nfs/dbraw/zinc/44/20/90/356442090.db2.gz	YSZZIMSUTUAKPW-UHFFFAOYSA-N	1	0	254.280	1.789	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1C(=O)NCc1cccnc1N(C)C	ZINC000019147963	356476499	/nfs/dbraw/zinc/47/64/99/356476499.db2.gz	OSJDPBSAWVMZTQ-CQSZACIVSA-N	1	0	290.411	1.638	50	0		CDAARO
OCC[NH+]1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000019607223	356493398	/nfs/dbraw/zinc/49/33/98/356493398.db2.gz	XSWJBDCPYRNBIG-UHFFFAOYSA-N	1	0	254.761	1.450	50	0		CDAARO
C[C@@H](CC[NH+]1CCN(CCO)CC1)c1ccccc1	ZINC000019633346	356494247	/nfs/dbraw/zinc/49/42/47/356494247.db2.gz	OAESXBMHRFBBKS-HNNXBMFYSA-N	1	0	262.397	1.790	50	0		CDAARO
CC(C)Oc1ccccc1OCCOCCNCC[NH3+]	ZINC000019772471	356501105	/nfs/dbraw/zinc/50/11/05/356501105.db2.gz	YNYNXQAJGISMBW-UHFFFAOYSA-N	1	0	282.384	1.418	50	0		CDAARO
COCC(=O)N[C@@H]1CCC[N@H+](Cc2cccc(OC)c2)C1	ZINC000019789172	356504192	/nfs/dbraw/zinc/50/41/92/356504192.db2.gz	KCYQISWMFHAONJ-CQSZACIVSA-N	1	0	292.379	1.422	50	0		CDAARO
CC(C)(C)[C@H](O)C[NH2+][C@@H]1CCN(CC(F)(F)F)C1	ZINC000088720942	366292138	/nfs/dbraw/zinc/29/21/38/366292138.db2.gz	LENAEGRRZFUAMQ-NXEZZACHSA-N	1	0	268.323	1.620	50	0		CDAARO
CNc1nc(N2CCC[C@@H]([NH+](C)C)C2)ncc1F	ZINC000725272736	538463496	/nfs/dbraw/zinc/46/34/96/538463496.db2.gz	UKQGPBLESOYXMB-SECBINFHSA-N	1	0	253.325	1.188	50	0		CDAARO
CCc1nnsc1C(=O)NC1CC[NH+](C(C)C)CC1	ZINC000022989621	356626346	/nfs/dbraw/zinc/62/63/46/356626346.db2.gz	LNCSGMIDOGVYCM-UHFFFAOYSA-N	1	0	282.413	1.703	50	0		CDAARO
OCC[NH+](CCO)Cc1ccccc1C(F)(F)F	ZINC000023282628	356638976	/nfs/dbraw/zinc/63/89/76/356638976.db2.gz	ZOKZZOZIKGTYFR-UHFFFAOYSA-N	1	0	263.259	1.492	50	0		CDAARO
O=C(NCCc1ccccc1)[C@H]1CC12CC[NH2+]CC2	ZINC000070251976	363559086	/nfs/dbraw/zinc/55/90/86/363559086.db2.gz	AFQHXDGOPDUSIE-CQSZACIVSA-N	1	0	258.365	1.735	50	0		CDAARO
NC(=O)CC[N@@H+]1CCCN(Cc2cccs2)CC1	ZINC000030536873	356749810	/nfs/dbraw/zinc/74/98/10/356749810.db2.gz	YRCRWUDHAFEQCZ-UHFFFAOYSA-N	1	0	267.398	1.131	50	0		CDAARO
Cc1ccc(-c2cc(N3CC[NH2+]CC3)ncn2)cc1	ZINC000032918549	356790345	/nfs/dbraw/zinc/79/03/45/356790345.db2.gz	LLMUVUCRJZWSTN-UHFFFAOYSA-N	1	0	254.337	1.862	50	0		CDAARO
COc1ccc(/C=C/C(=O)N2CC[C@@]3(CC[NH2+]C3)C2)cc1	ZINC000033426353	356802626	/nfs/dbraw/zinc/80/26/26/356802626.db2.gz	LRTCUQOTDFGGLP-BBOMDTFKSA-N	1	0	286.375	1.920	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)N2CCC(Cc3cccnc3)CC2)C1	ZINC000335567947	356822585	/nfs/dbraw/zinc/82/25/85/356822585.db2.gz	IYQABHRPQKLBLQ-JKSUJKDBSA-N	1	0	287.407	1.990	50	0		CDAARO
CCN1CCC[C@@H]([N@@H+]2CCC[C@H](CCCO)C2)C1	ZINC000042496517	357070068	/nfs/dbraw/zinc/07/00/68/357070068.db2.gz	IWFICYUSBZVCBY-HUUCEWRRSA-N	1	0	254.418	1.955	50	0		CDAARO
COc1ccc(NC(=O)c2n[nH]c3c2C[NH2+]CC3)cc1	ZINC000042784056	357080319	/nfs/dbraw/zinc/08/03/19/357080319.db2.gz	KOBLZJLNOMLECT-UHFFFAOYSA-N	1	0	272.308	1.316	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)c2ccc(Cl)cc2O)C1	ZINC000050246024	357233134	/nfs/dbraw/zinc/23/31/34/357233134.db2.gz	JCFBYPOFCXWISP-MRVPVSSYSA-N	1	0	254.717	1.466	50	0		CDAARO
C[C@H](CCn1cncn1)[NH2+]C[C@@H]1COc2ccccc2O1	ZINC000095419261	357320839	/nfs/dbraw/zinc/32/08/39/357320839.db2.gz	UOIJTRKIQGUMGO-CHWSQXEVSA-N	1	0	288.351	1.486	50	0		CDAARO
C[C@H](CSC(C)(C)C)[NH2+]C[C@H]1CCS(=O)(=O)C1	ZINC000095419614	357334211	/nfs/dbraw/zinc/33/42/11/357334211.db2.gz	MYZKRBHRNFAQKZ-GHMZBOCLSA-N	1	0	279.471	1.931	50	0		CDAARO
CN1C(=O)[C@H](Cc2c[nH]c3ccccc23)NC1(C)C	ZINC000060285702	357440124	/nfs/dbraw/zinc/44/01/24/357440124.db2.gz	LNFZLZSNGMJITN-ZDUSSCGKSA-N	1	0	257.337	1.877	50	0		CDAARO
C[C@@H]1CN(C)CCN1C(=O)c1ccc2cc[nH]c2c1	ZINC000089938628	357504369	/nfs/dbraw/zinc/50/43/69/357504369.db2.gz	VMUPJBRBQWOTGO-LLVKDONJSA-N	1	0	257.337	1.944	50	0		CDAARO
CC(C)OCC[C@H]1CCCC[N@@H+]1CCN1C(=O)CCC1=O	ZINC000095431958	357507382	/nfs/dbraw/zinc/50/73/82/357507382.db2.gz	XZSDENVGJWGKCG-CQSZACIVSA-N	1	0	296.411	1.805	50	0		CDAARO
OCc1ccccc1CN1CC[NH+](C[C@@H]2CCOC2)CC1	ZINC000063833526	357517741	/nfs/dbraw/zinc/51/77/41/357517741.db2.gz	QFNPDDQUQBFPKE-HNNXBMFYSA-N	1	0	290.407	1.333	50	0		CDAARO
CC(C)[N@@H+]1CCN(Cc2ccccc2OCCO)C[C@@H]1C	ZINC000065491521	357544582	/nfs/dbraw/zinc/54/45/82/357544582.db2.gz	CQPLKXRYQXGYLM-HNNXBMFYSA-N	1	0	292.423	1.972	50	0		CDAARO
CN(Cc1ccccc1)c1ncccc1CNC(=O)C[NH3+]	ZINC000067742671	357623239	/nfs/dbraw/zinc/62/32/39/357623239.db2.gz	GMARADAPMYODLG-UHFFFAOYSA-N	1	0	284.363	1.293	50	0		CDAARO
CC(C)[NH+]1CCC(CNC(=O)CN2CCCCC2=O)CC1	ZINC000067773212	357626490	/nfs/dbraw/zinc/62/64/90/357626490.db2.gz	HCEBCRNJKAVKCQ-UHFFFAOYSA-N	1	0	295.427	1.236	50	0		CDAARO
C[N@@H+]1CC[C@H](CNC(=O)C(=O)Nc2ccccc2Cl)C1	ZINC000067675161	357618203	/nfs/dbraw/zinc/61/82/03/357618203.db2.gz	UXZLAYJKDYAFEO-SNVBAGLBSA-N	1	0	295.770	1.346	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)CC[NH2+]1	ZINC000188469604	357694013	/nfs/dbraw/zinc/69/40/13/357694013.db2.gz	DYNRUPVTTGUAIY-GFCCVEGCSA-N	1	0	297.358	1.680	50	0		CDAARO
COc1ccc(N2CC3(CC[NH2+]CC3)OC2=O)cc1OC	ZINC000071789033	357782118	/nfs/dbraw/zinc/78/21/18/357782118.db2.gz	IGUPZHNAAXMRJJ-UHFFFAOYSA-N	1	0	292.335	1.783	50	0		CDAARO
Cc1ccc(-c2cnc(N3CC[NH2+]CC3)nc2)cc1	ZINC000071575869	363589810	/nfs/dbraw/zinc/58/98/10/363589810.db2.gz	LBHOUIKGUUAGQT-UHFFFAOYSA-N	1	0	254.337	1.862	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]C[C@](C)(O)CN2CCOCC2)[C@H](C)C1	ZINC000097108781	357984334	/nfs/dbraw/zinc/98/43/34/357984334.db2.gz	LUGRNEHMSOUNKL-WCVJEAGWSA-N	1	0	284.444	1.484	50	0		CDAARO
CCS(=O)(=O)NCCC[NH2+]C1C[C@@H](C)C[C@H](C)C1	ZINC000097229305	358043301	/nfs/dbraw/zinc/04/33/01/358043301.db2.gz	HZYAOINMQVEPOC-RYUDHWBXSA-N	1	0	276.446	1.730	50	0		CDAARO
CC[C@H](C)C(=O)NCc1ccccc1C[N@@H+]1CC[C@H](O)C1	ZINC000097081791	358165189	/nfs/dbraw/zinc/16/51/89/358165189.db2.gz	CADNHSZFMDAXMG-BBRMVZONSA-N	1	0	290.407	1.916	50	0		CDAARO
COCc1cccc(S(=O)(=O)N[C@H]2CCC[NH2+][C@H]2C)c1	ZINC000193455675	358294893	/nfs/dbraw/zinc/29/48/93/358294893.db2.gz	SWRZQDYROQAWKE-FZMZJTMJSA-N	1	0	298.408	1.252	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)N1C[C@H](C)C[C@@H](C)C1	ZINC000130051735	358297194	/nfs/dbraw/zinc/29/71/94/358297194.db2.gz	KPDXNTGDERSZJA-VXGBXAGGSA-N	1	0	291.461	1.316	50	0		CDAARO
Cc1noc(C)c1C[NH+]1CCC2(CC1)OCCC[C@@H]2O	ZINC000091793462	358528029	/nfs/dbraw/zinc/52/80/29/358528029.db2.gz	VLPWPODFJKUEKN-AWEZNQCLSA-N	1	0	280.368	1.797	50	0		CDAARO
CC(C)[NH2+]C[C@@]1(O)CCCN(CC2CCCCC2)C1=O	ZINC000012090402	358537635	/nfs/dbraw/zinc/53/76/35/358537635.db2.gz	KWXQLIJPPGRXGV-INIZCTEOSA-N	1	0	282.428	1.918	50	0		CDAARO
C[NH2+]CCCNC(=O)[C@H](c1ccccc1F)N(C)C	ZINC000095356004	358683284	/nfs/dbraw/zinc/68/32/84/358683284.db2.gz	BJGRQKPLQWTFLN-ZDUSSCGKSA-N	1	0	267.348	1.154	50	0		CDAARO
CC(C)c1cc(NCCCN2CC[NH+](C)CC2)ncn1	ZINC000095354137	358684059	/nfs/dbraw/zinc/68/40/59/358684059.db2.gz	XOQVDJFJGYCTLU-UHFFFAOYSA-N	1	0	277.416	1.649	50	0		CDAARO
Cc1cnc(NCCC[N@@H+]2CCCC[C@H]2CO)nc1	ZINC000095369959	358687767	/nfs/dbraw/zinc/68/77/67/358687767.db2.gz	MOHNPOBHKVXDEO-ZDUSSCGKSA-N	1	0	264.373	1.434	50	0		CDAARO
COc1ccc(C[NH2+]C[C@@H]2COC(C)(C)O2)cc1	ZINC000098210152	358816435	/nfs/dbraw/zinc/81/64/35/358816435.db2.gz	ATGSXACUMXKXAL-CYBMUJFWSA-N	1	0	251.326	1.936	50	0		CDAARO
Cc1nc[nH]c1CN1CCCO[C@H](C[NH+]2CCCC2)C1	ZINC000097480390	358780233	/nfs/dbraw/zinc/78/02/33/358780233.db2.gz	XAAFQBKDNDOPEW-CQSZACIVSA-N	1	0	278.400	1.405	50	0		CDAARO
CCn1ccnc1C1CCN(C(=O)[C@H]2[C@@H]3C[NH2+]C[C@@H]32)CC1	ZINC000102327727	358874792	/nfs/dbraw/zinc/87/47/92/358874792.db2.gz	LRZCICJOXANPID-WDNDVIMCSA-N	1	0	288.395	1.074	50	0		CDAARO
O=C(NCCCC[NH+]1CCCCCC1)c1cn[nH]c1	ZINC000215399090	358887015	/nfs/dbraw/zinc/88/70/15/358887015.db2.gz	MLRPJSVULWAJCI-UHFFFAOYSA-N	1	0	264.373	1.796	50	0		CDAARO
O[C@@H]1CC[N@H+](Cc2cnn(-c3ccc(F)cc3)c2)C1	ZINC000216261454	358934453	/nfs/dbraw/zinc/93/44/53/358934453.db2.gz	GCPVMWBFTODUCG-CQSZACIVSA-N	1	0	261.300	1.578	50	0		CDAARO
CN1CCC2(CC[NH+](Cc3ncc[nH]3)CC2)CCC1=O	ZINC000216330096	358937468	/nfs/dbraw/zinc/93/74/68/358937468.db2.gz	JMHIAMARQLCEDM-UHFFFAOYSA-N	1	0	276.384	1.634	50	0		CDAARO
Cn1cc(CC[N@H+](C)CC(C)(C)CN2CCOCC2)cn1	ZINC000216512685	358948248	/nfs/dbraw/zinc/94/82/48/358948248.db2.gz	FWFHCLDIUUXOTR-UHFFFAOYSA-N	1	0	294.443	1.253	50	0		CDAARO
CC[C@@H](NC(=O)CN(C)Cc1ccccc1)[C@H]1C[C@@H](O)C1	ZINC000220077511	359148461	/nfs/dbraw/zinc/14/84/61/359148461.db2.gz	PJVFTEYOIJLICX-BZUAXINKSA-N	1	0	290.407	1.784	50	0		CDAARO
COC[C@@H]1CCN(C(=O)CN(C)Cc2cccnc2)C1	ZINC000221397687	359244922	/nfs/dbraw/zinc/24/49/22/359244922.db2.gz	ZCDJHBAQXFNKQD-CQSZACIVSA-N	1	0	277.368	1.008	50	0		CDAARO
Cc1ncn(CC(=O)N2CCC[C@@H]([NH+](C)C)CC2)c1C	ZINC000221189335	359215919	/nfs/dbraw/zinc/21/59/19/359215919.db2.gz	WKLFJDMHOGUZFC-CQSZACIVSA-N	1	0	278.400	1.443	50	0		CDAARO
Nc1nc(NC2Cc3ccccc3C2)cc(C2CC(O)C2)[nH+]1	ZINC000223387605	359421779	/nfs/dbraw/zinc/42/17/79/359421779.db2.gz	XHHPMRNMWJCLLU-UHFFFAOYSA-N	1	0	296.374	1.876	50	0		CDAARO
CS(=O)(=O)c1ccc(-c2noc([C@H]3CC[NH2+]3)n2)cc1	ZINC000261606779	359541967	/nfs/dbraw/zinc/54/19/67/359541967.db2.gz	AFUAOVMIRCNMFU-SNVBAGLBSA-N	1	0	279.321	1.175	50	0		CDAARO
O=C(OC1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H](CO)c1ccccc1	ZINC000002020510	360117639	/nfs/dbraw/zinc/11/76/39/360117639.db2.gz	ATKYNAZQGVYHIB-IXXDHKBRSA-N	1	0	275.348	1.589	50	0	biogenic,in-vitro	CDAARO
[NH3+][C@@H]1CCN(Cc2ccc(-c3ccccc3F)o2)C[C@H]1O	ZINC000426475559	360569704	/nfs/dbraw/zinc/56/97/04/360569704.db2.gz	RDUBEZHMWLMHOV-HUUCEWRRSA-N	1	0	290.338	1.980	50	0		CDAARO
[NH3+]CCCC(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1	ZINC000178085927	189090262	/nfs/dbraw/zinc/09/02/62/189090262.db2.gz	CHKCZTKGIWQVIF-DZGCQCFKSA-N	1	0	262.353	1.762	50	0		CDAARO
CC[C@@H](Sc1nnc(C[NH3+])n1CC(C)C)C(=O)N(C)C	ZINC000426501774	360677921	/nfs/dbraw/zinc/67/79/21/360677921.db2.gz	NQNUBVSBBGGETE-SNVBAGLBSA-N	1	0	299.444	1.352	50	0		CDAARO
Cc1nc(NCC[NH+]2CCCC2)cc([C@@H]2CCOC2)n1	ZINC000426549139	360683524	/nfs/dbraw/zinc/68/35/24/360683524.db2.gz	KKDYBHGNJVCXJT-CYBMUJFWSA-N	1	0	276.384	1.219	50	0		CDAARO
Cc1ccc(OCC[NH3+])c(C(=O)N2CCC(F)CC2)c1	ZINC000426383382	360661469	/nfs/dbraw/zinc/66/14/69/360661469.db2.gz	VCTZRUGCDSONMT-UHFFFAOYSA-N	1	0	280.343	1.907	50	0		CDAARO
Cn1c(CC[NH3+])nnc1SCc1ccc2cc[nH]c2n1	ZINC000426386508	360662405	/nfs/dbraw/zinc/66/24/05/360662405.db2.gz	ZAVXPKCIANNNJF-UHFFFAOYSA-N	1	0	288.380	1.485	50	0		CDAARO
CN(C(=O)CCc1cc(F)ccc1F)[C@H]1CC[NH2+]C1	ZINC000179102227	189169763	/nfs/dbraw/zinc/16/97/63/189169763.db2.gz	MYRHQOUICGPSHU-LBPRGKRZSA-N	1	0	268.307	1.718	50	0		CDAARO
Cc1c2cc(F)ccc2[nH]c1C(=O)N[C@H]1C[NH2+]CC[C@H]1O	ZINC000426503562	360933592	/nfs/dbraw/zinc/93/35/92/360933592.db2.gz	RFMZJBQDOICZPB-QWHCGFSZSA-N	1	0	291.326	1.068	50	0		CDAARO
C[N@@H+]1CCN(Cc2cccc(F)c2)C[C@H]1CCO	ZINC000104394914	361587378	/nfs/dbraw/zinc/58/73/78/361587378.db2.gz	MCEYKJRSBANTCZ-CQSZACIVSA-N	1	0	252.333	1.324	50	0		CDAARO
CC[C@@H](CO)[NH2+]C[C@H](O)COc1cccc2ccccc21	ZINC000017269046	364016780	/nfs/dbraw/zinc/01/67/80/364016780.db2.gz	OWASUJBWCYEWTB-GJZGRUSLSA-N	1	0	289.375	1.940	50	0		CDAARO
CSc1ccc(C[N@H+](C)[C@H]2COC[C@@H]2O)cc1	ZINC000216474836	189704468	/nfs/dbraw/zinc/70/44/68/189704468.db2.gz	IKWOCALOEJOFDI-STQMWFEESA-N	1	0	253.367	1.600	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2ccc(C)o2)CC1	ZINC000089652374	366900621	/nfs/dbraw/zinc/90/06/21/366900621.db2.gz	ANWXSDDDFPBQOH-UHFFFAOYSA-N	1	0	280.368	1.676	50	0		CDAARO
CC[N@H+](C)C[C@H]1CCN(c2nc3ccccc3c(=O)[nH]2)C1	ZINC000089960858	366985978	/nfs/dbraw/zinc/98/59/78/366985978.db2.gz	PYPWNTAGPJYAQE-GFCCVEGCSA-N	1	0	286.379	1.701	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@H]1CC[NH2+]C[C@@H]1C	ZINC000094345738	367519871	/nfs/dbraw/zinc/51/98/71/367519871.db2.gz	WSOQPGKUWNUNFQ-JQWIXIFHSA-N	1	0	286.372	1.410	50	0		CDAARO
Cc1ccc(C(=O)N2C[C@@H](C)[NH2+][C@@H](C)C2)c(F)c1	ZINC000094919099	367681648	/nfs/dbraw/zinc/68/16/48/367681648.db2.gz	GHQABJQSMJBXGT-PHIMTYICSA-N	1	0	250.317	1.957	50	0		CDAARO
Cc1ccc(C(=O)N2C[C@@H](C)[NH2+][C@H](C)C2)c(F)c1	ZINC000094919100	367682513	/nfs/dbraw/zinc/68/25/13/367682513.db2.gz	GHQABJQSMJBXGT-GHMZBOCLSA-N	1	0	250.317	1.957	50	0		CDAARO
CCOC(=O)[C@](C)(O)C[N@H+](C)[C@H]1CC[C@H](SCC)C1	ZINC000252512148	367683088	/nfs/dbraw/zinc/68/30/88/367683088.db2.gz	NFUOPTAWQCUYHU-SGMGOOAPSA-N	1	0	289.441	1.907	50	0		CDAARO
Cc1c[nH+]c(C)n1CCNC(=O)c1cnc(C)cn1	ZINC000575555059	369131354	/nfs/dbraw/zinc/13/13/54/369131354.db2.gz	KHEFXIIHZNVVCM-UHFFFAOYSA-N	1	0	259.313	1.028	50	0		CDAARO
O=C1OC[C@@H]2CN(CCCOc3ccc(F)cc3)CCN12	ZINC000370559190	370091006	/nfs/dbraw/zinc/09/10/06/370091006.db2.gz	SYYQKWOSCZMDLM-ZDUSSCGKSA-N	1	0	294.326	1.731	50	0		CDAARO
COCc1nnc2n1CCC1(CC[NH2+]CC1)CC2	ZINC000575449060	370179724	/nfs/dbraw/zinc/17/97/24/370179724.db2.gz	MXUNLXYDCHOXHD-UHFFFAOYSA-N	1	0	250.346	1.131	50	0		CDAARO
CO[C@]1(C)C[C@H](NC(=O)[C@]2(C)CC[NH2+]C2)C1(C)C	ZINC000430070100	371117891	/nfs/dbraw/zinc/11/78/91/371117891.db2.gz	WTPORTZLMROTLY-ZLKJLUDKSA-N	1	0	254.374	1.306	50	0		CDAARO
CS[C@H]1C[N@H+](CCc2ccncc2C)C[C@H]1N(C)C	ZINC000573840008	371678172	/nfs/dbraw/zinc/67/81/72/371678172.db2.gz	KKXQVLSEONDSJO-CABCVRRESA-N	1	0	279.453	1.910	50	0		CDAARO
COC(=O)[C@H](C)N1C[C@@H]2C[N@H+](C)[C@@H](c3ccccc3)[C@H]2C1	ZINC000252673681	371692969	/nfs/dbraw/zinc/69/29/69/371692969.db2.gz	RJVMIGKQMVHTQG-TUUVXOQKSA-N	1	0	288.391	1.783	50	0		CDAARO
Cc1ccc2ccccc2c1NC(=O)NC[C@]1(O)CC[NH2+]C1	ZINC000299768919	372750937	/nfs/dbraw/zinc/75/09/37/372750937.db2.gz	ZYPQZJVXFASKNW-KRWDZBQOSA-N	1	0	299.374	1.994	50	0		CDAARO
[NH3+]CCCOc1ccc(F)cc1C(=O)NC1CCOCC1	ZINC000299775260	372752775	/nfs/dbraw/zinc/75/27/75/372752775.db2.gz	JGQJIJIPELZWIQ-UHFFFAOYSA-N	1	0	296.342	1.462	50	0		CDAARO
CC1=CC[C@@H]2C[N@@H+](Cc3nc4c(cnn4C)c(=O)[nH]3)C[C@@H]2C1	ZINC000299794596	372766397	/nfs/dbraw/zinc/76/63/97/372766397.db2.gz	LCESCXVEIPSJBG-NEPJUHHUSA-N	1	0	299.378	1.857	50	0		CDAARO
Cc1ccc(C)c(C[N@@H+]2C[C@@H](CO)[C@H](C(=O)N(C)C)C2)c1	ZINC000253409462	373719405	/nfs/dbraw/zinc/71/94/05/373719405.db2.gz	LWHZEGBYBZPQIC-JKSUJKDBSA-N	1	0	290.407	1.432	50	0		CDAARO
CC[N@@H+]1CC[C@H]2[C@H](C1)OCCN2C(=O)Cc1ccsc1	ZINC000253416418	373726521	/nfs/dbraw/zinc/72/65/21/373726521.db2.gz	VXQYEWILSPELCL-KBPBESRZSA-N	1	0	294.420	1.612	50	0		CDAARO
Cc1cccc(C(=O)N2CCO[C@@H]3CC[N@@H+](C)C[C@H]32)c1O	ZINC000253425311	373731518	/nfs/dbraw/zinc/73/15/18/373731518.db2.gz	CHQWMCINHAMFCM-ZIAGYGMSSA-N	1	0	290.363	1.246	50	0		CDAARO
c1ccc2c(c1)CCO[C@@H]2C[NH2+]CCN1CCCC1	ZINC000019367170	374730050	/nfs/dbraw/zinc/73/00/50/374730050.db2.gz	QTKLXCLCMLIESY-MRXNPFEDSA-N	1	0	260.381	1.986	50	0	biogenic	CDAARO
CN1CCC([NH2+]C[C@@H](O)c2cccc(F)c2)CC1	ZINC000037887393	374820398	/nfs/dbraw/zinc/82/03/98/374820398.db2.gz	PTSKDJMDPNHXBI-CQSZACIVSA-N	1	0	252.333	1.543	50	0		CDAARO
CC(C)c1cc(NCCCn2ccnn2)nc(N)[nH+]1	ZINC000095376195	374892993	/nfs/dbraw/zinc/89/29/93/374892993.db2.gz	LLHFOQXEMCPVKT-UHFFFAOYSA-N	1	0	261.333	1.276	50	0		CDAARO
C[C@H]1CCN(C[C@H](O)CN2CCOCC2)c2ccccc21	ZINC000095431541	374932112	/nfs/dbraw/zinc/93/21/12/374932112.db2.gz	LUYMOSFZUQQJHF-LSDHHAIUSA-N	1	0	290.407	1.693	50	0		CDAARO
CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1[NH2+]Cc1cc[nH]c1	ZINC000095435719	374935561	/nfs/dbraw/zinc/93/55/61/374935561.db2.gz	FYOKMSWZZSEFHM-STQMWFEESA-N	1	0	295.383	1.739	50	0		CDAARO
CCC(=O)NCc1ccccc1C[N@@H+]1CCC[C@H]1CO	ZINC000097238407	375159202	/nfs/dbraw/zinc/15/92/02/375159202.db2.gz	GDFXCEZQILFABP-HNNXBMFYSA-N	1	0	276.380	1.670	50	0		CDAARO
CCOc1ccccc1-n1nnnc1SCC[NH3+]	ZINC000003327292	375647365	/nfs/dbraw/zinc/64/73/65/375647365.db2.gz	XJVCHZAWMSAYIF-UHFFFAOYSA-N	1	0	265.342	1.112	50	0		CDAARO
COc1ccc(C)cc1/C=C\C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000606441646	375823273	/nfs/dbraw/zinc/82/32/73/375823273.db2.gz	IIGQIOXOXQSWLK-AGLBCWCQSA-N	1	0	274.364	1.824	50	0		CDAARO
C[C@@H]1C[C@H](C)C[N@@H+](CC(=O)Nc2ccc(C(N)=O)cc2)C1	ZINC000012693952	375824668	/nfs/dbraw/zinc/82/46/68/375824668.db2.gz	XOZPKJRIOBNNHI-TXEJJXNPSA-N	1	0	289.379	1.702	50	0		CDAARO
CCc1noc([C@H](C)[NH2+][C@@H]2CCN(C(C)=O)C[C@H]2CC)n1	ZINC000241126023	376017365	/nfs/dbraw/zinc/01/73/65/376017365.db2.gz	JIZOCQKXXIGVTL-CYZMBNFOSA-N	1	0	294.399	1.930	50	0		CDAARO
[NH3+][C@H]1CC[C@@H](NC(=O)CCCc2cn[nH]c2)CC1	ZINC000244795173	376023619	/nfs/dbraw/zinc/02/36/19/376023619.db2.gz	RAWNIPSNZASSTC-TXEJJXNPSA-N	1	0	250.346	1.119	50	0		CDAARO
Cc1ccc(CN2C[C@H]([C@H](C)O)[NH2+]C[C@@H]2[C@H](C)O)cc1F	ZINC000585657556	376360095	/nfs/dbraw/zinc/36/00/95/376360095.db2.gz	LOAGMTIBSYNWDE-YXAMBPQSSA-N	1	0	296.386	1.038	50	0		CDAARO
CC[C@@H](C(=O)N1CCC[C@H](C(C)(C)C(=O)OC)C1)[NH+](C)C	ZINC000089367532	377838554	/nfs/dbraw/zinc/83/85/54/377838554.db2.gz	PXXBVYUGBWZVCS-STQMWFEESA-N	1	0	298.427	1.764	50	0		CDAARO
COC(=O)CCN1CCN(C(=O)[C@@H]2C[C@H]2C2CC2)[C@H](C)C1	ZINC000245338771	378070358	/nfs/dbraw/zinc/07/03/58/378070358.db2.gz	OLUHTICFPQSSKX-KWCYVHTRSA-N	1	0	294.395	1.128	50	0		CDAARO
CC[C@H](C)OCC(=O)N(C)[C@H]1CC[N@H+](CC)C[C@H]1C	ZINC000246748786	379645501	/nfs/dbraw/zinc/64/55/01/379645501.db2.gz	PZEIRGNHXSZMQJ-RDBSUJKOSA-N	1	0	270.417	1.990	50	0		CDAARO
COCC[N@@H+]1CCN([C@H](C)c2cccnc2)C[C@@H]1C	ZINC000106776764	532971938	/nfs/dbraw/zinc/97/19/38/532971938.db2.gz	LDTSZYQBPFAAQB-UONOGXRCSA-N	1	0	263.385	1.795	50	0		CDAARO
[NH3+]C1CCN([C@@H]2CCc3ccccc3NC2=O)CC1	ZINC000030714516	390278038	/nfs/dbraw/zinc/27/80/38/390278038.db2.gz	KYJCXQATHSBDPJ-CQSZACIVSA-N	1	0	259.353	1.363	50	0		CDAARO
CC(C)C(=O)N[C@H]1CCC[N@H+](CCOC[C@@H]2CCCO2)C1	ZINC000096421099	390513895	/nfs/dbraw/zinc/51/38/95/390513895.db2.gz	DSVMEOMJTYDWEQ-GJZGRUSLSA-N	1	0	298.427	1.419	50	0		CDAARO
Cc1nc(CC(=O)N2CC[C@@H]3CC[C@H](C2)[N@@H+]3C)cs1	ZINC000072425778	390643201	/nfs/dbraw/zinc/64/32/01/390643201.db2.gz	WRICOGZHUIPULW-QWHCGFSZSA-N	1	0	279.409	1.689	50	0		CDAARO
C[C@@H]1CN(C(=O)CCc2ccc(F)cc2)CC[NH2+]1	ZINC000188420218	390958079	/nfs/dbraw/zinc/95/80/79/390958079.db2.gz	WCAPMDMPAPFNIK-LLVKDONJSA-N	1	0	250.317	1.579	50	0		CDAARO
CCSc1nccnc1C(=O)N(C)C1CC[NH+](C)CC1	ZINC000430392296	391940949	/nfs/dbraw/zinc/94/09/49/391940949.db2.gz	IWJDDWFZMCFURK-UHFFFAOYSA-N	1	0	294.424	1.755	50	0		CDAARO
CCN(Cc1ccccc1)C(=O)[C@@H](C)[N@@H+]1CC[C@](C)(O)C1	ZINC000252485848	131135166	/nfs/dbraw/zinc/13/51/66/131135166.db2.gz	BCKSAFNNSDBULF-PBHICJAKSA-N	1	0	290.407	1.880	50	0		CDAARO
Cn1nccc1C(=O)N1CCNC[C@H]1c1cccc(F)c1	ZINC000261989032	131181091	/nfs/dbraw/zinc/18/10/91/131181091.db2.gz	OUTCMLHZTISSNH-AWEZNQCLSA-N	1	0	288.326	1.346	50	0		CDAARO
CO[C@@H](C[NH3+])CC(=O)N(C)[C@@H]1CCc2ccccc2C1	ZINC000262745779	131258046	/nfs/dbraw/zinc/25/80/46/131258046.db2.gz	AFHIAOASWQBIIR-HUUCEWRRSA-N	1	0	276.380	1.366	50	0		CDAARO
CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1[NH2+]Cc1c[nH]nc1C	ZINC000089948806	392523538	/nfs/dbraw/zinc/52/35/38/392523538.db2.gz	MTGFFYDXOHGZJP-WFASDCNBSA-N	1	0	290.411	1.845	50	0		CDAARO
C[C@H]1CN(C(=O)C[N@@H+]2CCCSCC2)C[C@H](C)O1	ZINC000089985532	392547979	/nfs/dbraw/zinc/54/79/79/392547979.db2.gz	ULPMFOHNGQBPMS-RYUDHWBXSA-N	1	0	272.414	1.061	50	0		CDAARO
OCC[NH+]1CCN(c2ccc3ccccc3n2)CC1	ZINC000025392302	134746866	/nfs/dbraw/zinc/74/68/66/134746866.db2.gz	NHMNQIYTHLYCNQ-UHFFFAOYSA-N	1	0	257.337	1.349	50	0		CDAARO
Cn1cccc1C(=O)C(=O)NC(C)(C)C[NH+]1CCCC1	ZINC000457067220	397824848	/nfs/dbraw/zinc/82/48/48/397824848.db2.gz	HBEPALRPASESGH-UHFFFAOYSA-N	1	0	277.368	1.198	50	0		CDAARO
Cn1cc(CCC[NH2+][C@@H]2CCCC[C@@H]2S(C)(=O)=O)cn1	ZINC000182767959	148265793	/nfs/dbraw/zinc/26/57/93/148265793.db2.gz	WLNSXVGBLRFKGU-KGLIPLIRSA-N	1	0	299.440	1.298	50	0		CDAARO
C[C@H]1C[C@H](C[NH3+])CN1C(=O)c1cccc2cn[nH]c21	ZINC000262070637	149009318	/nfs/dbraw/zinc/00/93/18/149009318.db2.gz	WUXBFPXEJRFMIB-VHSXEESVSA-N	1	0	258.325	1.372	50	0		CDAARO
C[C@@]1([NH3+])CCCC[C@H]1C(=O)NCc1ccc(F)cn1	ZINC000263222612	149123958	/nfs/dbraw/zinc/12/39/58/149123958.db2.gz	MERXFJOGQNIJHV-GXTWGEPZSA-N	1	0	265.332	1.745	50	0		CDAARO
CC[C@@H]1CN(C)c2ccccc2C[N@@H+]1C[C@@H](O)COC	ZINC000127470094	287185858	/nfs/dbraw/zinc/18/58/58/287185858.db2.gz	KKWUYLCGNDRLEO-HUUCEWRRSA-N	1	0	278.396	1.724	50	0		CDAARO
COc1ccc(C(=O)NC[C@@H](C)C[NH+](C)C)cc1OC	ZINC000002828072	169835359	/nfs/dbraw/zinc/83/53/59/169835359.db2.gz	YBTQAPGSPRIBGT-LLVKDONJSA-N	1	0	280.368	1.631	50	0		CDAARO
COc1ccccc1CNC(=O)C[NH2+]C[C@H]1CCCO1	ZINC000004166682	169940044	/nfs/dbraw/zinc/94/00/44/169940044.db2.gz	NJNPCSBEIRIBRZ-CYBMUJFWSA-N	1	0	278.352	1.080	50	0		CDAARO
CCOc1ccc(C[NH2+][C@H](CC)CO)cc1OC	ZINC000004840594	170027737	/nfs/dbraw/zinc/02/77/37/170027737.db2.gz	GAWWZMNWLLDFME-GFCCVEGCSA-N	1	0	253.342	1.954	50	0		CDAARO
COn1c(=O)c2ccccc2nc1SCC[NH+](C)C	ZINC000005157302	170071939	/nfs/dbraw/zinc/07/19/39/170071939.db2.gz	ROFAVHWFVJTIPW-UHFFFAOYSA-N	1	0	279.365	1.109	50	0		CDAARO
COc1ccccc1CC(=O)NCC[NH+]1CCCCC1	ZINC000006730469	170235309	/nfs/dbraw/zinc/23/53/09/170235309.db2.gz	QZFCSEJGFVYKNH-UHFFFAOYSA-N	1	0	276.380	1.840	50	0		CDAARO
CCc1cc(NCCn2cncn2)nc(N2CCCC2)[nH+]1	ZINC000534651777	411829021	/nfs/dbraw/zinc/82/90/21/411829021.db2.gz	ZAFJXKFOKWBVFJ-UHFFFAOYSA-N	1	0	287.371	1.343	50	0		CDAARO
O[C@@H](COc1cccc2ccccc21)CN1CC[NH2+]CC1	ZINC000019229530	170755880	/nfs/dbraw/zinc/75/58/80/170755880.db2.gz	PODKTVHURWLQLF-OAHLLOKOSA-N	1	0	286.375	1.485	50	0		CDAARO
OCC[C@H]1CN(C2CCC2)CC[N@@H+]1C1CCCC1	ZINC000020321743	171149417	/nfs/dbraw/zinc/14/94/17/171149417.db2.gz	LSSNGKNXBRBBHC-HNNXBMFYSA-N	1	0	252.402	1.850	50	0		CDAARO
c1nnnn1-c1ccc(N[C@@H]2C[NH+]3CCC2CC3)cc1	ZINC000020441232	171204115	/nfs/dbraw/zinc/20/41/15/171204115.db2.gz	UGWSBBOJQCXYMW-CQSZACIVSA-N	1	0	270.340	1.168	50	0		CDAARO
CC(C)(O)c1cn(CC2CC[NH+](C3CCC3)CC2)nn1	ZINC000020513774	171231538	/nfs/dbraw/zinc/23/15/38/171231538.db2.gz	WZOHDMXLBIAPBF-UHFFFAOYSA-N	1	0	278.400	1.770	50	0		CDAARO
Cc1ccc(OC[C@H](O)CN2CC[NH+](C)CC2)cc1C	ZINC000021487180	171304493	/nfs/dbraw/zinc/30/44/93/171304493.db2.gz	QMRUCCSMFYERRP-OAHLLOKOSA-N	1	0	278.396	1.291	50	0		CDAARO
CCc1ccccc1OCCOCCN1CC[NH+](C)CC1	ZINC000021548805	171316822	/nfs/dbraw/zinc/31/68/22/171316822.db2.gz	YSXMKNCDPAHIQJ-UHFFFAOYSA-N	1	0	292.423	1.892	50	0		CDAARO
CCn1nc(C[NH2+]C[C@H](C)O)c(-c2ccccc2)n1	ZINC000035287289	172105392	/nfs/dbraw/zinc/10/53/92/172105392.db2.gz	WIXVIZCYDMCFNB-NSHDSACASA-N	1	0	260.341	1.435	50	0		CDAARO
Cc1noc(C)c1CCC(=O)NCC(C)(C)C[NH+](C)C	ZINC000044515467	175189999	/nfs/dbraw/zinc/18/99/99/175189999.db2.gz	PXLGBPWNJDWZDJ-UHFFFAOYSA-N	1	0	281.400	1.928	50	0		CDAARO
CCNc1ncc(-c2nccn2CC[NH+](C)C)cn1	ZINC000067692347	175784534	/nfs/dbraw/zinc/78/45/34/175784534.db2.gz	SHQKYQCEDFTIHF-UHFFFAOYSA-N	1	0	260.345	1.334	50	0		CDAARO
CCN(CC[NH+]1CCCC1)C(=O)c1cn(C)nc1C	ZINC000071745363	176257964	/nfs/dbraw/zinc/25/79/64/176257964.db2.gz	HTUONFQUMXVIMC-UHFFFAOYSA-N	1	0	264.373	1.286	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(C(=O)Cc2ccccc2O)CC1	ZINC000072144233	176324122	/nfs/dbraw/zinc/32/41/22/176324122.db2.gz	NVGJZWOLHUTJDI-AWEZNQCLSA-N	1	0	276.380	1.877	50	0		CDAARO
CCCn1ccnc1CN1CCC[C@@](O)(C[NH+](C)C)CC1	ZINC000072144888	176324939	/nfs/dbraw/zinc/32/49/39/176324939.db2.gz	XWRIMQIRYIMFAM-INIZCTEOSA-N	1	0	294.443	1.572	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(C(=O)CCc2csc(N)n2)CC1	ZINC000072152747	176327367	/nfs/dbraw/zinc/32/73/67/176327367.db2.gz	GPUSZHZJKNKFFG-LBPRGKRZSA-N	1	0	296.440	1.601	50	0		CDAARO
Cc1n[nH]c(CCC(=O)N2CCC[C@H]([NH+](C)C)CC2)c1C	ZINC000072173773	176333694	/nfs/dbraw/zinc/33/36/94/176333694.db2.gz	LYMUFHQRFWUWJM-AWEZNQCLSA-N	1	0	292.427	1.902	50	0		CDAARO
c1nc2c(c(NCC[C@H]3CCOC3)n1)CC[NH2+]CC2	ZINC000072429901	176402147	/nfs/dbraw/zinc/40/21/47/176402147.db2.gz	LQVFPJGAJBDNKH-NSHDSACASA-N	1	0	262.357	1.003	50	0		CDAARO
O[C@@H]1COCC[N@H+](Cc2cccc(-n3cccn3)c2)C1	ZINC000077407244	177263995	/nfs/dbraw/zinc/26/39/95/177263995.db2.gz	WYCDOIKTTPJVQX-HNNXBMFYSA-N	1	0	273.336	1.065	50	0		CDAARO
C[C@@H](Cc1ccccc1)N1C(=O)NC2(CC[NH2+]CC2)C1=O	ZINC000077516555	177277243	/nfs/dbraw/zinc/27/72/43/177277243.db2.gz	RATVVACKQCOBPZ-LBPRGKRZSA-N	1	0	287.363	1.292	50	0		CDAARO
COc1cccc(OC)c1OCC[NH2+]C[C@@H]1CCCO1	ZINC000002286891	261266924	/nfs/dbraw/zinc/26/69/24/261266924.db2.gz	OWOYOFVRHLEQJX-LBPRGKRZSA-N	1	0	281.352	1.851	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cnc(-c3ccccc3)nc2)C1	ZINC000179026444	261413415	/nfs/dbraw/zinc/41/34/15/261413415.db2.gz	UMCPMPCQHCSFEN-ZDUSSCGKSA-N	1	0	296.374	1.825	50	0		CDAARO
Cc1nnc2c(N3CC[NH+](C)CC3)nc3ccccc3n12	ZINC000000236466	274871512	/nfs/dbraw/zinc/87/15/12/274871512.db2.gz	BYJIHFVEVDMDII-UHFFFAOYSA-N	1	0	282.351	1.338	50	0		CDAARO
c1cc(C[NH2+][C@H]2CCCN(c3ncccn3)C2)co1	ZINC000012705353	275064598	/nfs/dbraw/zinc/06/45/98/275064598.db2.gz	JIRGDOKGEWRMID-ZDUSSCGKSA-N	1	0	258.325	1.828	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)c1cccc(C)c1F	ZINC000122649588	277028102	/nfs/dbraw/zinc/02/81/02/277028102.db2.gz	UVOQNJPLRAKOQJ-NSHDSACASA-N	1	0	250.317	1.958	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)c2cncnc2C(C)C)C1	ZINC000269100404	277031752	/nfs/dbraw/zinc/03/17/52/277031752.db2.gz	BJTOOCSOMKNRPL-GFCCVEGCSA-N	1	0	276.384	1.672	50	0		CDAARO
C[NH+]1CCN(c2ncnc(-c3ccc(F)cc3)c2N)CC1	ZINC000096282100	277115403	/nfs/dbraw/zinc/11/54/03/277115403.db2.gz	MNIZIVPCBQHMBE-UHFFFAOYSA-N	1	0	287.342	1.617	50	0		CDAARO
CC(C)(C)CN1CCC[C@@](O)(C[N@@H+]2CCCOCC2)C1=O	ZINC000014981402	277144367	/nfs/dbraw/zinc/14/43/67/277144367.db2.gz	KHGFQFCKUVGJJM-MRXNPFEDSA-N	1	0	298.427	1.108	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@H](N2CCC([NH3+])CC2)C1	ZINC000026896588	277192743	/nfs/dbraw/zinc/19/27/43/277192743.db2.gz	UMWHGGWSANLOKM-LBPRGKRZSA-N	1	0	269.389	1.419	50	0		CDAARO
CC(=O)NC1(C(=O)N2C[C@@H](C)[C@@H]([NH+](C)C)C2)CCCCC1	ZINC000089937148	278081506	/nfs/dbraw/zinc/08/15/06/278081506.db2.gz	WCOWEQKCLIFFPR-OCCSQVGLSA-N	1	0	295.427	1.234	50	0		CDAARO
CC(C)(C)OC(=O)N1CC2(C1)C[C@@H](CC[NH3+])CO2	ZINC000306145414	278380460	/nfs/dbraw/zinc/38/04/60/278380460.db2.gz	DVYBWRVXYPMBFP-SNVBAGLBSA-N	1	0	256.346	1.361	50	0		CDAARO
CCCC[C@H]([NH2+][C@@H]1CCN(C(=O)CC)C[C@H]1C)C(N)=O	ZINC000240555654	278739302	/nfs/dbraw/zinc/73/93/02/278739302.db2.gz	GWXLRQAGFHGNNW-UPJWGTAASA-N	1	0	283.416	1.267	50	0		CDAARO
C[C@H](C(=O)NC1CCC(O)CC1)[NH+]1CCCCCC1	ZINC000072794218	279220969	/nfs/dbraw/zinc/22/09/69/279220969.db2.gz	ZSKNGPANAGBTPZ-IYXRBSQSSA-N	1	0	268.401	1.671	50	0		CDAARO
Cc1ccc([C@H]2C[N@@H+](C3CCOCC3)C[C@@H]2N)o1	ZINC000091636286	281001984	/nfs/dbraw/zinc/00/19/84/281001984.db2.gz	CURWNNDVKNPJAQ-STQMWFEESA-N	1	0	250.342	1.494	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1ccc2c(c1)OCCCO2	ZINC000178498262	288318940	/nfs/dbraw/zinc/31/89/40/288318940.db2.gz	XQICARFPYOMTHM-LLVKDONJSA-N	1	0	276.336	1.282	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN1C(=O)c1cccc(Cl)c1	ZINC000085469877	289218825	/nfs/dbraw/zinc/21/88/25/289218825.db2.gz	ILILBYMKUHCPOA-ZDUSSCGKSA-N	1	0	282.771	1.743	50	0		CDAARO
C[C@H](C(=O)N(C)CC[NH+](C)C)n1cnc2ccccc21	ZINC000267089497	289250903	/nfs/dbraw/zinc/25/09/03/289250903.db2.gz	ICKSFZTUEQGUQL-GFCCVEGCSA-N	1	0	274.368	1.617	50	0		CDAARO
C[C@H]1C[N@@H+]2CCC[C@H]2CN1S(=O)(=O)C1CCCCC1	ZINC000257365404	300319637	/nfs/dbraw/zinc/31/96/37/300319637.db2.gz	CALABSORWRZEEB-STQMWFEESA-N	1	0	286.441	1.817	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)Cc2cc(C)no2)CC1	ZINC000534576183	328309723	/nfs/dbraw/zinc/30/97/23/328309723.db2.gz	KRWKUFVDBWJRBS-UHFFFAOYSA-N	1	0	265.357	1.516	50	0		CDAARO
C[C@H](CN1CCOCC1)[NH2+]CCCOC1CCCC1	ZINC000534576173	328309804	/nfs/dbraw/zinc/30/98/04/328309804.db2.gz	XONIFXAMMKOTEJ-CQSZACIVSA-N	1	0	270.417	1.646	50	0		CDAARO
Cc1cccnc1CC(=O)NCC1([NH+](C)C)CCCC1	ZINC000534589484	328317246	/nfs/dbraw/zinc/31/72/46/328317246.db2.gz	XHAGSZITZRUMDP-UHFFFAOYSA-N	1	0	275.396	1.923	50	0		CDAARO
C[C@H](Cn1cncn1)[NH2+]CCCc1nc2ccccc2n1C	ZINC000534642754	328329178	/nfs/dbraw/zinc/32/91/78/328329178.db2.gz	FIMBPDPPORDROO-CYBMUJFWSA-N	1	0	298.394	1.776	50	0		CDAARO
CC(C)c1nc(N2CCC3(C2)CC[NH2+]CC3)no1	ZINC000534653654	328338466	/nfs/dbraw/zinc/33/84/66/328338466.db2.gz	BLRVBZGRYBTPEA-UHFFFAOYSA-N	1	0	250.346	1.773	50	0		CDAARO
Cc1ccc2[nH]c(CCCNC(=O)[C@@H]3C=CC[NH2+]3)nc2c1C	ZINC000534663425	328351264	/nfs/dbraw/zinc/35/12/64/328351264.db2.gz	MHSYKGDLGIQTDF-AWEZNQCLSA-N	1	0	298.390	1.757	50	0		CDAARO
CC1(C)CCCC[C@H]1[NH2+]CCCN1C(=O)CNC1=O	ZINC000119984449	323208628	/nfs/dbraw/zinc/20/86/28/323208628.db2.gz	CEQZUVWTCGZTGX-LLVKDONJSA-N	1	0	267.373	1.487	50	0		CDAARO
CCS(=O)(=O)N1CC(C[NH2+][C@H]2CC(C)(C)C[C@@H]2C)C1	ZINC000193149878	323527265	/nfs/dbraw/zinc/52/72/65/323527265.db2.gz	IWEPSYGBGODEHS-AAEUAGOBSA-N	1	0	288.457	1.682	50	0		CDAARO
CC[NH+]1CCC(CNC(=O)c2cn(C)c(C)cc2=O)CC1	ZINC000579018748	324085147	/nfs/dbraw/zinc/08/51/47/324085147.db2.gz	QGUQLQVHZKCVLU-UHFFFAOYSA-N	1	0	291.395	1.155	50	0		CDAARO
C[NH+](C)CCNC(=O)c1cccc(Oc2ncccn2)c1	ZINC000072437955	327110650	/nfs/dbraw/zinc/11/06/50/327110650.db2.gz	WSMNYLDGZLTQHQ-UHFFFAOYSA-N	1	0	286.335	1.560	50	0		CDAARO
CC[C@H]1COCCN1C(=O)C[NH+]1CCCCCCC1	ZINC000077421149	327132175	/nfs/dbraw/zinc/13/21/75/327132175.db2.gz	HGECYFWDZQMJEI-AWEZNQCLSA-N	1	0	268.401	1.890	50	0		CDAARO
COCc1nnc(NCC[NH+](C(C)C)C(C)C)o1	ZINC001772703332	1159438100	/nfs/dbraw/zinc/43/81/00/1159438100.db2.gz	WRRJZSIHQXBEIY-UHFFFAOYSA-N	1	0	256.350	1.747	50	0		CDAARO
Cc1nc(CN2CCOC[C@H](C[NH+](C)C)C2)n(C)c1C	ZINC000670441055	482985339	/nfs/dbraw/zinc/98/53/39/482985339.db2.gz	IKSZUGMYKCTNJA-CQSZACIVSA-N	1	0	280.416	1.047	50	0		CDAARO
CCCc1cnc(N2CC[C@H](N3CC[NH+](C)CC3)C2)nc1	ZINC000670446932	483000373	/nfs/dbraw/zinc/00/03/73/483000373.db2.gz	VPISEDIRDWXCLY-HNNXBMFYSA-N	1	0	289.427	1.255	50	0		CDAARO
COCCC(=O)NCC1([NH+]2CCCCC2)CCCC1	ZINC000670450778	483016673	/nfs/dbraw/zinc/01/66/73/483016673.db2.gz	UPPNKBJMSQEEPC-UHFFFAOYSA-N	1	0	268.401	1.938	50	0		CDAARO
COCc1cc(C[N@@H+]2C[C@H](O)[C@@H](OC)C2)ccc1OC	ZINC000670451102	483017233	/nfs/dbraw/zinc/01/72/33/483017233.db2.gz	ZZECWIUDDRNSFS-ZFWWWQNUSA-N	1	0	281.352	1.033	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CN(C)c2nnc(C)s2)C1	ZINC000670459509	483042057	/nfs/dbraw/zinc/04/20/57/483042057.db2.gz	YLJZEHXAEMGFDT-NSHDSACASA-N	1	0	270.402	1.251	50	0		CDAARO
C[NH+]1CCC(C2CCN(C(=O)C[C@@H]3CCOC3)CC2)CC1	ZINC000670460412	483043408	/nfs/dbraw/zinc/04/34/08/483043408.db2.gz	GBDYCEYLMLZJOL-AWEZNQCLSA-N	1	0	294.439	1.993	50	0		CDAARO
CCCOC[C@@H]1CC[N@@H+](C2CCN(C(C)=O)CC2)C1	ZINC000670463635	483054619	/nfs/dbraw/zinc/05/46/19/483054619.db2.gz	MXTOBDVPRBOYRK-CQSZACIVSA-N	1	0	268.401	1.746	50	0		CDAARO
Cc1ncn(CC[NH2+]C2CSCCSC2)c1C	ZINC000670472620	483081872	/nfs/dbraw/zinc/08/18/72/483081872.db2.gz	HHCXJANQBPBQBG-UHFFFAOYSA-N	1	0	271.455	1.938	50	0		CDAARO
C[N@@H+]1CC[C@](C)(C(=O)NC2(C(N)=O)CCCCCC2)C1	ZINC000670472791	483081733	/nfs/dbraw/zinc/08/17/33/483081733.db2.gz	UUHCUFPQWBUVQA-AWEZNQCLSA-N	1	0	281.400	1.023	50	0		CDAARO
CCOc1cc(C(=O)N2CC[C@H](C[NH3+])C2)ccc1C	ZINC000178543693	520661416	/nfs/dbraw/zinc/66/14/16/520661416.db2.gz	KCFUFQRLFHEOPQ-GFCCVEGCSA-N	1	0	262.353	1.815	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN(c2cc(C[NH3+])ccn2)CC1	ZINC000012370438	534839100	/nfs/dbraw/zinc/83/91/00/534839100.db2.gz	FOCCRLWIOGAIGE-UHFFFAOYSA-N	1	0	292.383	1.597	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](C(=O)NC[C@H](O)c2c(F)cccc2F)C1	ZINC000299738999	527365504	/nfs/dbraw/zinc/36/55/04/527365504.db2.gz	JJOVYCXLAFKXDC-LNLATYFQSA-N	1	0	284.306	1.242	50	0		CDAARO
CCOC(=O)c1cc(NC(=O)C[N@H+](C)C(C)C)c[nH]1	ZINC000096441134	528181326	/nfs/dbraw/zinc/18/13/26/528181326.db2.gz	PILUDFXVFXJEMH-UHFFFAOYSA-N	1	0	267.329	1.470	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@](C)(O)c1cccs1	ZINC000096450327	528222405	/nfs/dbraw/zinc/22/24/05/528222405.db2.gz	JGBWQIIYDUQEED-DOMZBBRYSA-N	1	0	296.436	1.946	50	0		CDAARO
CCCCc1c(C)[nH+]c(N)nc1N1CCC[C@H](CO)C1	ZINC000091943647	535077401	/nfs/dbraw/zinc/07/74/01/535077401.db2.gz	OKVVDSWLFONOEU-LBPRGKRZSA-N	1	0	278.400	1.919	50	0		CDAARO
CCOC1CCN(Cc2nnc([C@H]3C[C@H]([NH3+])C3)n2C)CC1	ZINC000243885756	535399239	/nfs/dbraw/zinc/39/92/39/535399239.db2.gz	ABYPMTYCJBTXEO-HAQNSBGRSA-N	1	0	293.415	1.021	50	0		CDAARO
Fc1ccc(CC[NH2+][C@H]2CCc3ncnn3C2)cc1F	ZINC000768534165	576294464	/nfs/dbraw/zinc/29/44/64/576294464.db2.gz	QYLZYKMSGOGPLN-NSHDSACASA-N	1	0	278.306	1.703	50	0		CDAARO
CC(C)=CCC[N@@H+]1CCCN(C(=O)[C@H]2CCC(=O)N2)CC1	ZINC001772709921	1159444165	/nfs/dbraw/zinc/44/41/65/1159444165.db2.gz	KRFJRHPYFRYSJL-CQSZACIVSA-N	1	0	293.411	1.156	50	0		CDAARO
CC[NH+](CC)CCNC(=O)CC1=C2CCCC[C@H]2NC1=O	ZINC000581793658	1161981258	/nfs/dbraw/zinc/98/12/58/1161981258.db2.gz	OIAIHUITLRXION-CQSZACIVSA-N	1	0	293.411	1.204	50	0		CDAARO
[NH3+]C1(C(=O)N[C@H]2COC[C@H]2Cc2ccncc2)CCCC1	ZINC001704351055	1177697310	/nfs/dbraw/zinc/69/73/10/1177697310.db2.gz	DWHSGJGNMJQYGO-KGLIPLIRSA-N	1	0	289.379	1.027	50	0		CDAARO
[NH3+]CCC(=O)N[C@H]1COC[C@H]1Cc1ccnc2ccccc12	ZINC001704353513	1177698661	/nfs/dbraw/zinc/69/86/61/1177698661.db2.gz	ZCSCDPQGXBWZLK-CJNGLKHVSA-N	1	0	299.374	1.257	50	0		CDAARO
CC[N@H+](C)CCC(=O)N[C@@H]1COC[C@H]1Cc1ccncc1	ZINC001704351337	1177699575	/nfs/dbraw/zinc/69/95/75/1177699575.db2.gz	HICHAVCSLXFVHU-HUUCEWRRSA-N	1	0	291.395	1.097	50	0		CDAARO
CCOC(=O)N1CCC([NH+]2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000023282402	898132343	/nfs/dbraw/zinc/13/23/43/898132343.db2.gz	HLABMGJVARLIJR-VXGBXAGGSA-N	1	0	270.373	1.717	50	0		CDAARO
C[N@@H+]1CCC[C@H](Nc2ncccc2C(=O)N2CCCC2)C1	ZINC000823771467	925728353	/nfs/dbraw/zinc/72/83/53/925728353.db2.gz	OINDYGNZFCRATG-ZDUSSCGKSA-N	1	0	288.395	1.824	50	0		CDAARO
O=C(NCCc1cn[nH]c1)c1ccc(C[NH+]2CCCC2)o1	ZINC000828166420	926056801	/nfs/dbraw/zinc/05/68/01/926056801.db2.gz	GSPRUOAMZGYZLS-UHFFFAOYSA-N	1	0	288.351	1.571	50	0		CDAARO
OC[C@H]1CCC[N@H+](CCCNc2ccncc2F)C1	ZINC000828711233	926169301	/nfs/dbraw/zinc/16/93/01/926169301.db2.gz	TUNMYTQNDYRSMX-LBPRGKRZSA-N	1	0	267.348	1.149	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)Cc2cccc(F)c2)CC[C@@H]1CO	ZINC000581798035	927199908	/nfs/dbraw/zinc/19/99/08/927199908.db2.gz	DNZKNBXWOLZULC-UKRRQHHQSA-N	1	0	294.370	1.139	50	0		CDAARO
COC[C@@H]1[C@H](C(=O)NCc2ccccn2)CCC[N@@H+]1C	ZINC000581813119	927202930	/nfs/dbraw/zinc/20/29/30/927202930.db2.gz	CACUVYOLIQZOJM-ZIAGYGMSSA-N	1	0	277.368	1.055	50	0		CDAARO
CS(=O)(=O)CC[N@@H+]1CC[C@H](Cc2cccc(CO)c2)C1	ZINC000219577244	930882179	/nfs/dbraw/zinc/88/21/79/930882179.db2.gz	IOSQFZMOYQPWIO-CQSZACIVSA-N	1	0	297.420	1.088	50	0		CDAARO
C=CC(=O)N1CC[C@H](C[N@@H+](C)Cc2scnc2C)C1	ZINC000585086851	930890106	/nfs/dbraw/zinc/89/01/06/930890106.db2.gz	DQZIHGVCQNLTGA-GFCCVEGCSA-N	1	0	279.409	1.918	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1nc(SC)ncc1CO	ZINC000585092500	930922315	/nfs/dbraw/zinc/92/23/15/930922315.db2.gz	AXTRESMNYFTWPN-LBPRGKRZSA-N	1	0	296.440	1.399	50	0		CDAARO
C[C@@H]1OC[C@H]([NH2+]Cc2nncn2-c2ccccc2)[C@@H]1C	ZINC000585117586	930984315	/nfs/dbraw/zinc/98/43/15/930984315.db2.gz	MBONKBOJZTUFAQ-DYEKYZERSA-N	1	0	272.352	1.780	50	0		CDAARO
C[N@@H+]1CCC[C@H]1CCC(=O)NC1(CO)CCSCC1	ZINC000585121863	930989177	/nfs/dbraw/zinc/98/91/77/930989177.db2.gz	CUKUWYXVIISLRS-LBPRGKRZSA-N	1	0	286.441	1.235	50	0		CDAARO
CCCCS(=O)(=O)N(CC)CC[NH+]1CCCC1	ZINC000586108511	932857450	/nfs/dbraw/zinc/85/74/50/932857450.db2.gz	DHJQKBYEPNNTGO-UHFFFAOYSA-N	1	0	262.419	1.534	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CCN(C)c1nc(C(N)=O)cs1	ZINC001529159240	968996646	/nfs/dbraw/zinc/99/66/46/968996646.db2.gz	QTSKOSLSDUDGAK-JTQLQIEISA-N	1	0	282.413	1.553	50	0		CDAARO
Cc1cc(C[C@@H]2CN(Cc3cc(C)no3)C[C@@H]2O)on1	ZINC001529179088	969003927	/nfs/dbraw/zinc/00/39/27/969003927.db2.gz	VCVXUXXWALITBH-RISCZKNCSA-N	1	0	277.324	1.315	50	0		CDAARO
CCc1ccc(C[N@H+]2C[C@@H](Cc3cnccn3)[C@H](O)C2)nc1	ZINC001529173594	969004432	/nfs/dbraw/zinc/00/44/32/969004432.db2.gz	MWWOPYDWAMWVMU-RHSMWYFYSA-N	1	0	298.390	1.469	50	0		CDAARO
Cc1cnc(C)c(N2CCOC[C@H](C[NH+](C)C)C2)n1	ZINC001506419040	975156662	/nfs/dbraw/zinc/15/66/62/975156662.db2.gz	MKCGDUKKQDTXIT-CYBMUJFWSA-N	1	0	264.373	1.108	50	0		CDAARO
CC(=O)NC(C)(C)C[C@H](C)[NH2+]CCCn1nc(C)nc1C	ZINC001506417867	975157347	/nfs/dbraw/zinc/15/73/47/975157347.db2.gz	BZBDRSYINDTKML-NSHDSACASA-N	1	0	295.431	1.568	50	0		CDAARO
CC(C)(C)NC(=O)CN1CC[NH+](C2CCSCC2)CC1	ZINC001506426559	975160832	/nfs/dbraw/zinc/16/08/32/975160832.db2.gz	TUXUDGDVONMUAH-UHFFFAOYSA-N	1	0	299.484	1.414	50	0		CDAARO
Cn1cccc1C[NH2+][C@H](CC(N)=O)C1CCCCC1	ZINC000096494762	230383793	/nfs/dbraw/zinc/38/37/93/230383793.db2.gz	YQLRTUWEESCHNE-CQSZACIVSA-N	1	0	263.385	1.939	50	0		CDAARO
O=C(NCC[N@H+]1CCC[C@@H](CO)C1)c1ccncc1Cl	ZINC000584902504	341986963	/nfs/dbraw/zinc/98/69/63/341986963.db2.gz	MNEOOOZNAPCHGN-LLVKDONJSA-N	1	0	297.786	1.169	50	0		CDAARO
O=C(N[C@H]1COC[C@@H]1O)C1([NH+]2CCCCC2)CCCCC1	ZINC000584903637	341987222	/nfs/dbraw/zinc/98/72/22/341987222.db2.gz	NFYHPHZOQMSDRN-KBPBESRZSA-N	1	0	296.411	1.051	50	0		CDAARO
Cc1cc(S(=O)(=O)NCC(C)(C)[NH3+])c(F)cc1F	ZINC000095972649	185049173	/nfs/dbraw/zinc/04/91/73/185049173.db2.gz	WUXNPBVQTRPFIT-UHFFFAOYSA-N	1	0	278.324	1.289	50	0		CDAARO
CNC(=O)c1ccc(C[N@H+](C)[C@H]2CCCC[C@@H]2O)o1	ZINC000095976559	185050594	/nfs/dbraw/zinc/05/05/94/185050594.db2.gz	AVYSPKCBHCKFIZ-RYUDHWBXSA-N	1	0	266.341	1.375	50	0		CDAARO
CC(C)=CC[NH2+][C@H](C(=O)N1CCOCC1)C(C)C	ZINC000095985501	185055630	/nfs/dbraw/zinc/05/56/30/185055630.db2.gz	GYBKKTNVZWKKOO-ZDUSSCGKSA-N	1	0	254.374	1.426	50	0		CDAARO
CC(C)OCCCNC(=O)N1CCC[C@@H]2C[N@H+](C)CC[C@H]21	ZINC000095996141	185060756	/nfs/dbraw/zinc/06/07/56/185060756.db2.gz	QHTCHXFIBBHPMS-HUUCEWRRSA-N	1	0	297.443	1.927	50	0		CDAARO
CC(C)C(=O)NCCC[NH2+][C@@H](C)CCn1cccn1	ZINC000095996916	185061202	/nfs/dbraw/zinc/06/12/02/185061202.db2.gz	JBRVIISOQSLLCY-ZDUSSCGKSA-N	1	0	266.389	1.414	50	0		CDAARO
CCCC(=O)NC[C@@H]1CCC[N@H+](CC[C@@H](C)O)C1	ZINC000241439878	361752493	/nfs/dbraw/zinc/75/24/93/361752493.db2.gz	NNBBLDHKMRJCGM-OLZOCXBDSA-N	1	0	256.390	1.386	50	0		CDAARO
CCOP(=O)(C[C@@H]([NH3+])[S@@](=O)CC)OCC	ZINC000242495705	361758751	/nfs/dbraw/zinc/75/87/51/361758751.db2.gz	GMZBZXWOSQIQKN-AYVTZFPOSA-N	1	0	257.292	1.306	50	0		CDAARO
CN1C(=O)N[C@](C)([C@@H]2CCC[N@H+](CC3CCC3)C2)C1=O	ZINC000089914239	539087684	/nfs/dbraw/zinc/08/76/84/539087684.db2.gz	HBFDGHIIUWZJHV-IUODEOHRSA-N	1	0	279.384	1.439	50	0		CDAARO
CC1(C(=O)NC[C@H](CO)Cc2cccs2)CC[NH2+]CC1	ZINC000096141025	185106681	/nfs/dbraw/zinc/10/66/81/185106681.db2.gz	BBGZQYHVODLKDW-GFCCVEGCSA-N	1	0	296.436	1.405	50	0		CDAARO
CC(C)(C)[C@H]([NH2+]Cc1cnn(C(C)(C)C)c1)C(N)=O	ZINC000195573615	342628848	/nfs/dbraw/zinc/62/88/48/342628848.db2.gz	MQPOELQSGZLIGT-LLVKDONJSA-N	1	0	266.389	1.628	50	0		CDAARO
c1coc(CCC[NH+]2CCN(c3nc[nH]n3)CC2)c1	ZINC000244788098	361863217	/nfs/dbraw/zinc/86/32/17/361863217.db2.gz	QJIOQEYSTNCIQG-UHFFFAOYSA-N	1	0	261.329	1.153	50	0		CDAARO
CSCc1noc(CN2CC([NH+]3CCCCC3)C2)n1	ZINC000244873045	361866544	/nfs/dbraw/zinc/86/65/44/361866544.db2.gz	WJFDUVHCGRSOAS-UHFFFAOYSA-N	1	0	282.413	1.603	50	0		CDAARO
CN1C[C@@]2(CCC[N@H+](CCCc3cccnc3)C2)OC1=O	ZINC000244715842	361858924	/nfs/dbraw/zinc/85/89/24/361858924.db2.gz	LDJMOHBDPOYYGX-MRXNPFEDSA-N	1	0	289.379	1.931	50	0		CDAARO
CC1(C)CNC(=O)[C@@H]1[NH2+]C[C@@H](c1ccco1)N1CCCC1	ZINC000585134638	342215669	/nfs/dbraw/zinc/21/56/69/342215669.db2.gz	DFVZVXRBZFVQHQ-JSGCOSHPSA-N	1	0	291.395	1.531	50	0		CDAARO
CCCS(=O)(=O)N1C[C@@H]2C[N@@H+]3CCCC[C@H]3[C@@H]2C1	ZINC000249695592	539069318	/nfs/dbraw/zinc/06/93/18/539069318.db2.gz	RFNYQIDRRWCEMC-XQQFMLRXSA-N	1	0	272.414	1.142	50	0		CDAARO
CC[C@H]1CN(S(C)(=O)=O)CC[C@@H]1[NH2+]Cc1ccncc1	ZINC000084736399	342268395	/nfs/dbraw/zinc/26/83/95/342268395.db2.gz	YOHJKTFFEVJTDV-KBPBESRZSA-N	1	0	297.424	1.231	50	0		CDAARO
Cc1ncc(/C=C/C(=O)N2CC[NH2+]C[C@@H]2C)s1	ZINC000125972004	187207810	/nfs/dbraw/zinc/20/78/10/187207810.db2.gz	KMMVKFCGOHLEEC-NWALNABHSA-N	1	0	251.355	1.285	50	0		CDAARO
Cc1cc(C(=O)N2CC[NH2+]C[C@@H]2C)nc2ccccc12	ZINC000126252058	187228088	/nfs/dbraw/zinc/22/80/88/187228088.db2.gz	SECXCJMTDXCHOX-LBPRGKRZSA-N	1	0	269.348	1.977	50	0		CDAARO
COc1ccc(S(=O)(=O)N2CCC[C@@H]([C@H](C)[NH3+])C2)cc1	ZINC000111713142	365719918	/nfs/dbraw/zinc/71/99/18/365719918.db2.gz	DQMSATPTOWMMNV-NWDGAFQWSA-N	1	0	298.408	1.443	50	0		CDAARO
C[C@@H](Oc1ccccc1Cl)C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178546978	362247234	/nfs/dbraw/zinc/24/72/34/362247234.db2.gz	AHHAHBNKYVELPQ-MNOVXSKESA-N	1	0	282.771	1.915	50	0		CDAARO
CNC(=O)C[N@@H+]1CC[C@@H](OCCCc2ccccc2)C1	ZINC000096456551	529863321	/nfs/dbraw/zinc/86/33/21/529863321.db2.gz	LNBFYCBMXCQPLE-OAHLLOKOSA-N	1	0	276.380	1.456	50	0		CDAARO
O=C(C[NH+]1CCCC1)N[C@H](c1ccccc1)[C@H]1C[C@@H](O)C1	ZINC000252539657	362392072	/nfs/dbraw/zinc/39/20/72/362392072.db2.gz	OGSIZTUPJDVCSW-HLLBOEOZSA-N	1	0	288.391	1.711	50	0		CDAARO
C[NH+](C)[C@H]1CC[C@@H](NC(=O)N[C@H](CO)c2ccccc2)C1	ZINC000097048343	185514173	/nfs/dbraw/zinc/51/41/73/185514173.db2.gz	WQJPIECQLNSZCE-QLFBSQMISA-N	1	0	291.395	1.502	50	0		CDAARO
c1cnc(N2CCC([NH2+]CCC[C@H]3CCOC3)CC2)nc1	ZINC000096165715	136519242	/nfs/dbraw/zinc/51/92/42/136519242.db2.gz	FHDHPHXMSCGTFQ-AWEZNQCLSA-N	1	0	290.411	1.852	50	0		CDAARO
O[C@H](C[NH+]1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000085436856	179063111	/nfs/dbraw/zinc/06/31/11/179063111.db2.gz	MKRHJWXRSNTBKF-MRXNPFEDSA-N	1	0	260.381	1.575	50	0		CDAARO
C[C@@H]1C[NH+](CCCCNC(=O)[C@@H]2CCCOC2)C[C@@H](C)O1	ZINC000085456235	179067753	/nfs/dbraw/zinc/06/77/53/179067753.db2.gz	JOEOGIXRYNCBEB-RBSFLKMASA-N	1	0	298.427	1.419	50	0		CDAARO
CC(C)CC[N@@H+]1CCO[C@H](CNc2cccnn2)C1	ZINC000089821151	347616286	/nfs/dbraw/zinc/61/62/86/347616286.db2.gz	SYONUQXRRVKAAX-CYBMUJFWSA-N	1	0	264.373	1.635	50	0		CDAARO
C[C@H](CNC(=O)N1CCc2n[nH]cc2C1)[NH+]1CCCCC1	ZINC000584885134	349343399	/nfs/dbraw/zinc/34/33/99/349343399.db2.gz	PWQVZFNURALTSZ-GFCCVEGCSA-N	1	0	291.399	1.352	50	0		CDAARO
Cc1cnc(NCC[C@@H]2CCC[N@H+](C)C2)nc1N(C)C	ZINC000584888602	349346940	/nfs/dbraw/zinc/34/69/40/349346940.db2.gz	ZEXKPBAMOPTDGA-ZDUSSCGKSA-N	1	0	277.416	1.417	50	0		CDAARO
C[NH+](C)CC[C@H](NC(=O)NC(C)(C)CO)c1ccccc1	ZINC000584889753	349348710	/nfs/dbraw/zinc/34/87/10/349348710.db2.gz	WRTMKTSPWAXRGP-AWEZNQCLSA-N	1	0	293.411	1.750	50	0		CDAARO
CN(CC(=O)N1C[C@@H]2CCC[C@@H](C2)C1)C1CC[NH2+]CC1	ZINC000584895179	349355016	/nfs/dbraw/zinc/35/50/16/349355016.db2.gz	GKOSXSANFCFCOW-OKILXGFUSA-N	1	0	279.428	1.319	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)c2ccncc2Cl)C1	ZINC000091456813	180160331	/nfs/dbraw/zinc/16/03/31/180160331.db2.gz	FAZVBBAPJRHNBM-SNVBAGLBSA-N	1	0	267.760	1.807	50	0		CDAARO
Cn1ccc2cc(CN3CC[C@@]4(O)CC[NH2+]C[C@H]4C3)ccc21	ZINC000091643755	180214080	/nfs/dbraw/zinc/21/40/80/180214080.db2.gz	OMAINJGCCZAWOV-WMZOPIPTSA-N	1	0	299.418	1.725	50	0		CDAARO
CSCc1noc(CN2C[C@H]([NH3+])[C@@H](C3CC3)C2)n1	ZINC000091678641	180225493	/nfs/dbraw/zinc/22/54/93/180225493.db2.gz	OBBGTECWWCIOHC-ZJUUUORDSA-N	1	0	268.386	1.102	50	0		CDAARO
Cc1cc(F)ccc1CN1C[C@H](CO)[C@H](C[NH+](C)C)C1	ZINC000091626005	180209268	/nfs/dbraw/zinc/20/92/68/180209268.db2.gz	CWNGEOVUHGJSSH-HUUCEWRRSA-N	1	0	280.387	1.736	50	0		CDAARO
CC1(C)C[N@H+](CC(=O)NCc2ccccc2F)C[C@]1(C)O	ZINC000091745481	180244267	/nfs/dbraw/zinc/24/42/67/180244267.db2.gz	QWZJQZMZLADRHR-INIZCTEOSA-N	1	0	294.370	1.535	50	0		CDAARO
CCCC[C@@H]1C=CCN1C(=O)C[NH+]1CCC(C(N)=O)CC1	ZINC000092077136	180317899	/nfs/dbraw/zinc/31/78/99/180317899.db2.gz	PFQJZJLMYVEPFS-CQSZACIVSA-N	1	0	293.411	1.141	50	0		CDAARO
Cc1cnc(C(=O)NC[C@@H](C)[N@@H+]2CCC[C@@H](C)C2)cn1	ZINC000106078709	186101127	/nfs/dbraw/zinc/10/11/27/186101127.db2.gz	QOSXUPHMDVVXKP-DGCLKSJQSA-N	1	0	276.384	1.635	50	0		CDAARO
O=C(c1cccnc1)N1CC(N2CCc3ccccc3C2)C1	ZINC000390825999	351372319	/nfs/dbraw/zinc/37/23/19/351372319.db2.gz	XEQUOIARVPZDHK-UHFFFAOYSA-N	1	0	293.370	1.964	50	0		CDAARO
CS(=O)(=O)N1C[C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1	ZINC000390827628	351373387	/nfs/dbraw/zinc/37/33/87/351373387.db2.gz	ZVSCAUDOIDGARS-ZIAGYGMSSA-N	1	0	280.393	1.010	50	0		CDAARO
COC(=O)c1cc(N2CC[NH+](C)CC2)ccc1Cl	ZINC000096027750	351475711	/nfs/dbraw/zinc/47/57/11/351475711.db2.gz	LUYLXNKQDPBHNQ-UHFFFAOYSA-N	1	0	268.744	1.878	50	0		CDAARO
[NH3+]CCNS(=O)(=O)c1ccc(F)c(C(F)(F)F)c1	ZINC000122473173	187033992	/nfs/dbraw/zinc/03/39/92/187033992.db2.gz	ULWHVOKZNXGENO-UHFFFAOYSA-N	1	0	286.250	1.082	50	0		CDAARO
COCC[NH2+]CC(=O)Nc1ccccc1C(F)(F)F	ZINC000002633242	355977704	/nfs/dbraw/zinc/97/77/04/355977704.db2.gz	LODCVIJZXAQTOB-UHFFFAOYSA-N	1	0	276.258	1.880	50	0		CDAARO
Nc1nc(Cn2cncn2)nc(N)c1Cc1ccccc1F	ZINC000002243943	355964332	/nfs/dbraw/zinc/96/43/32/355964332.db2.gz	OIYHGPHUQRQKMN-UHFFFAOYSA-N	1	0	299.313	1.011	50	0		CDAARO
C[NH+](C)CC[C@H]1CN(C(=O)C2CCCCC2)CCO1	ZINC000012468781	356301619	/nfs/dbraw/zinc/30/16/19/356301619.db2.gz	CJPVCSHJAPLOIW-AWEZNQCLSA-N	1	0	268.401	1.746	50	0		CDAARO
C[NH+](C)CCNC(=O)c1ccc(N2CCCCC2)cc1	ZINC000013669915	356353221	/nfs/dbraw/zinc/35/32/21/356353221.db2.gz	KROQZRRSIZBGRW-UHFFFAOYSA-N	1	0	275.396	1.968	50	0		CDAARO
C[C@@H]1C[C@@H](N(C)Cc2ccc3c(c2)OCO3)C(=O)O1	ZINC000032860210	356397542	/nfs/dbraw/zinc/39/75/42/356397542.db2.gz	PPMUJXFSSJKPAP-MWLCHTKSSA-N	1	0	263.293	1.551	50	0		CDAARO
C[C@@H](O)CN1CCN(C(=O)c2cc(F)ccc2O)[C@H](C)C1	ZINC000194028056	358504122	/nfs/dbraw/zinc/50/41/22/358504122.db2.gz	ICEYBNKSRGRAGH-GHMZBOCLSA-N	1	0	296.342	1.058	50	0		CDAARO
CCc1noc(C)c1C(=O)NC1CC[NH+](C)CC1	ZINC000016605609	356442968	/nfs/dbraw/zinc/44/29/68/356442968.db2.gz	YDTHZVPUKSHZIB-UHFFFAOYSA-N	1	0	251.330	1.369	50	0		CDAARO
Cc1nn(-c2ccccc2)c(C)c1CN1CC[NH2+]CC1	ZINC000020045702	356522939	/nfs/dbraw/zinc/52/29/39/356522939.db2.gz	XFMSMEUOOYXMCK-UHFFFAOYSA-N	1	0	270.380	1.894	50	0		CDAARO
C[NH+]1CCN(c2ccc(NC(=O)c3ccoc3)cn2)CC1	ZINC000022509356	356615325	/nfs/dbraw/zinc/61/53/25/356615325.db2.gz	IQSFWIVDKIXJRR-UHFFFAOYSA-N	1	0	286.335	1.679	50	0		CDAARO
Cc1nn(C)cc1CN1CCN(Cc2ccncc2)CC1	ZINC000022931345	356624602	/nfs/dbraw/zinc/62/46/02/356624602.db2.gz	RUSBRTQVTDPXRJ-UHFFFAOYSA-N	1	0	285.395	1.441	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1c1ccc(C(=O)N2CCOCC2)s1	ZINC000023541883	356645231	/nfs/dbraw/zinc/64/52/31/356645231.db2.gz	BXNBHHKLWIRUBG-LLVKDONJSA-N	1	0	280.393	1.987	50	0		CDAARO
Cc1ccc(C)c(C(=O)NCCN2CCOCC2)c1	ZINC000048090323	357171980	/nfs/dbraw/zinc/17/19/80/357171980.db2.gz	ZQYNMTGHYLCZKX-UHFFFAOYSA-N	1	0	262.353	1.365	50	0		CDAARO
CCOC(=O)c1cnc(SC)nc1SC(N)=[NH2+]	ZINC000005718131	357246312	/nfs/dbraw/zinc/24/63/12/357246312.db2.gz	LSPABRSZMCGMCP-UHFFFAOYSA-N	1	0	272.355	1.361	50	0		CDAARO
COc1cccc(N2CC[NH+](CCCO)CC2)c1	ZINC000034590397	357497310	/nfs/dbraw/zinc/49/73/10/357497310.db2.gz	DGSWVEFXJNJPNK-UHFFFAOYSA-N	1	0	250.342	1.200	50	0		CDAARO
c1cncc(-c2noc(CC[NH2+][C@@H]3CCSC3)n2)c1	ZINC000065395292	357537128	/nfs/dbraw/zinc/53/71/28/357537128.db2.gz	LBIZWTNUXFCZKQ-LLVKDONJSA-N	1	0	276.365	1.769	50	0		CDAARO
CCOC(=O)N1CCC([NH2+][C@@H](C)c2ncnn2CC)CC1	ZINC000065405644	357539025	/nfs/dbraw/zinc/53/90/25/357539025.db2.gz	FXMFTDAQOPUMIF-NSHDSACASA-N	1	0	295.387	1.570	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)c2ccc3cccc(F)c3n2)C1	ZINC000065420779	357540472	/nfs/dbraw/zinc/54/04/72/357540472.db2.gz	FWSNKRNFUHLQDA-NSHDSACASA-N	1	0	273.311	1.937	50	0		CDAARO
Cc1nnc(SCCCNC(=O)[C@H]2CC[NH2+]C2)s1	ZINC000065417880	357540611	/nfs/dbraw/zinc/54/06/11/357540611.db2.gz	SMHYDEWXVBWOPO-VIFPVBQESA-N	1	0	286.426	1.054	50	0		CDAARO
CC(=O)c1cc(CC(=O)N2CC[C@H](C[NH3+])C2)cs1	ZINC000067784248	357626681	/nfs/dbraw/zinc/62/66/81/357626681.db2.gz	SWRRTVNDJZQPJZ-SNVBAGLBSA-N	1	0	266.366	1.300	50	0		CDAARO
COCC(=O)NC[C@@H]1CCC[N@H+](Cc2ccccc2F)C1	ZINC000067833993	357629928	/nfs/dbraw/zinc/62/99/28/357629928.db2.gz	WJBPSIURKSOSSZ-ZDUSSCGKSA-N	1	0	294.370	1.800	50	0		CDAARO
CCc1nnsc1C(=O)NC[C@H]1CC[N@H+](CC(C)C)C1	ZINC000067885424	357634656	/nfs/dbraw/zinc/63/46/56/357634656.db2.gz	TWHLLESMHUBJPO-LLVKDONJSA-N	1	0	296.440	1.808	50	0		CDAARO
CCc1cnc(C)nc1N1CCO[C@@H](CC[NH+](C)C)C1	ZINC000071765237	357780168	/nfs/dbraw/zinc/78/01/68/357780168.db2.gz	GHNZXRUZFWKXHU-AWEZNQCLSA-N	1	0	278.400	1.504	50	0		CDAARO
Cc1nn(CCO)cc1CN1CCCC[C@H]1CC[NH+](C)C	ZINC000072430389	357834830	/nfs/dbraw/zinc/83/48/30/357834830.db2.gz	CXZSYBOGZVZBSP-INIZCTEOSA-N	1	0	294.443	1.490	50	0		CDAARO
Cc1nn(C)c2ncnc(N3CCC[N@@H+]4CCC[C@H]4C3)c12	ZINC000072427816	357835223	/nfs/dbraw/zinc/83/52/23/357835223.db2.gz	VNNMGLIQVWTWQD-LBPRGKRZSA-N	1	0	286.383	1.346	50	0		CDAARO
C[NH+](C)CCOCC[NH2+]Cc1ccc(OC(F)F)cc1	ZINC000097049984	357930070	/nfs/dbraw/zinc/93/00/70/357930070.db2.gz	YJANOEDETUGXHH-UHFFFAOYSA-N	1	0	288.338	1.956	50	0		CDAARO
[NH3+]C[C@@H](NS(=O)(=O)c1cc(F)ccc1Cl)C1CC1	ZINC000097229378	358043318	/nfs/dbraw/zinc/04/33/18/358043318.db2.gz	BHATWXGUNAQCEE-SNVBAGLBSA-N	1	0	292.763	1.495	50	0		CDAARO
CCCCCC[N@@H+]1CCn2nc(CNC(C)=O)cc2C1	ZINC000082126859	358147860	/nfs/dbraw/zinc/14/78/60/358147860.db2.gz	QCJIBPJDRKWEDY-UHFFFAOYSA-N	1	0	278.400	1.915	50	0		CDAARO
COc1ccc2[nH]c(C(=O)NC[C@@H]3C[C@H](F)C[NH2+]3)cc2c1	ZINC000082116115	358147920	/nfs/dbraw/zinc/14/79/20/358147920.db2.gz	CPIOKJBTTIUPSN-QWRGUYRKSA-N	1	0	291.326	1.606	50	0		CDAARO
COc1ccccc1C[NH2+]CC(C)(C)N1CCOCC1	ZINC000020097125	358325249	/nfs/dbraw/zinc/32/52/49/358325249.db2.gz	MISGQNITEUSHEE-UHFFFAOYSA-N	1	0	278.396	1.896	50	0		CDAARO
O=C(CCc1ccc(F)cc1)NC[C@@H]1CC[NH2+]C1	ZINC000195559562	358564711	/nfs/dbraw/zinc/56/47/11/358564711.db2.gz	HFVJAQJJRGQQEV-GFCCVEGCSA-N	1	0	250.317	1.484	50	0		CDAARO
CN(C[C@@H]1Cc2ccccc2C[N@@H+]1C)c1ccncn1	ZINC000091876925	358531720	/nfs/dbraw/zinc/53/17/20/358531720.db2.gz	YBYZTHMPAVXXHO-HNNXBMFYSA-N	1	0	268.364	1.970	50	0		CDAARO
COc1ccc(-n2c(C[NH3+])nnc2SC[C@H](C)O)cc1	ZINC000426411476	358631811	/nfs/dbraw/zinc/63/18/11/358631811.db2.gz	OQWRSANIWSLFRW-VIFPVBQESA-N	1	0	294.380	1.208	50	0		CDAARO
Cc1nnc(CCNC(=O)CC[C@@H]2CCCC[N@H+]2C)s1	ZINC000095371019	358687516	/nfs/dbraw/zinc/68/75/16/358687516.db2.gz	ZQSDZVGSBMOTSY-LBPRGKRZSA-N	1	0	296.440	1.770	50	0		CDAARO
CCc1[nH+]c(N)nc(N[C@H](C(N)=O)c2ccccc2)c1C	ZINC000095371023	358687730	/nfs/dbraw/zinc/68/77/30/358687730.db2.gz	BLPASEOFYUTAMG-LBPRGKRZSA-N	1	0	285.351	1.568	50	0		CDAARO
CCCCSc1nc(N)cc(N2CC[C@@H](C[NH3+])C2)n1	ZINC000095379933	358689511	/nfs/dbraw/zinc/68/95/11/358689511.db2.gz	ZTNLADYXNAAHPR-JTQLQIEISA-N	1	0	281.429	1.736	50	0		CDAARO
O=C(NCCc1c[nH]cn1)c1cccc([C@@H]2CCC[NH2+]C2)c1	ZINC000095391562	358692132	/nfs/dbraw/zinc/69/21/32/358692132.db2.gz	NCJXBJXWCFRDNR-OAHLLOKOSA-N	1	0	298.390	1.849	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)[C@@H]1CCOc2ccccc2C1	ZINC000096161481	358711434	/nfs/dbraw/zinc/71/14/34/358711434.db2.gz	UCAOXTAOIFVIFD-OAHLLOKOSA-N	1	0	288.391	1.840	50	0		CDAARO
CC1(C)Cc2cc(CN3CC[NH2+]C[C@H](O)C3)ccc2O1	ZINC000097394220	358772876	/nfs/dbraw/zinc/77/28/76/358772876.db2.gz	LTPXIQPFXNFCGD-AWEZNQCLSA-N	1	0	276.380	1.166	50	0		CDAARO
Cn1cc(CCC(=O)N[C@H]2Cc3ccccc3[C@@H]2[NH3+])cn1	ZINC000097394373	358773206	/nfs/dbraw/zinc/77/32/06/358773206.db2.gz	CVJZOURRNYZVIA-HOCLYGCPSA-N	1	0	284.363	1.094	50	0		CDAARO
C[NH2+]Cc1nc([C@@H]2CCOC2)nn1-c1cccc2c1CCC2	ZINC000097505918	358781506	/nfs/dbraw/zinc/78/15/06/358781506.db2.gz	HZVCALGSUBLRLI-CYBMUJFWSA-N	1	0	298.390	1.979	50	0		CDAARO
CCn1ncc(C(=O)N2CCN[C@H](c3ccccc3)C2)c1C	ZINC000097568795	358785133	/nfs/dbraw/zinc/78/51/33/358785133.db2.gz	JJQUGZVMYDUCLX-INIZCTEOSA-N	1	0	298.390	1.998	50	0		CDAARO
Cc1nccn1CC1(CNC(=O)C[C@H]2CCC[N@H+]2C)CC1	ZINC000097602245	358787602	/nfs/dbraw/zinc/78/76/02/358787602.db2.gz	XFWONAZNZHZHTJ-CQSZACIVSA-N	1	0	290.411	1.572	50	0		CDAARO
CC(C)O[C@H](C)C(=O)N1CCN(c2cc[nH+]cc2)CC1	ZINC000097730179	358795387	/nfs/dbraw/zinc/79/53/87/358795387.db2.gz	HXGITLSJWNDRSA-CYBMUJFWSA-N	1	0	277.368	1.544	50	0		CDAARO
Cc1nc(C2CC[NH+](C[C@H]3CCOC3)CC2)no1	ZINC000097797421	358799912	/nfs/dbraw/zinc/79/99/12/358799912.db2.gz	BEKBOYCKIMGMEJ-LLVKDONJSA-N	1	0	251.330	1.594	50	0		CDAARO
COc1cccc2ccc(CN3CCOC[C@H]3CO)nc21	ZINC000215482455	358891248	/nfs/dbraw/zinc/89/12/48/358891248.db2.gz	LTIZOWIBBHPLMJ-CQSZACIVSA-N	1	0	288.347	1.437	50	0		CDAARO
CC(C)(Cc1ccc(O)cc1)NC(=O)C[C@H]1CC[NH2+]C1	ZINC000215748931	358901007	/nfs/dbraw/zinc/90/10/07/358901007.db2.gz	KDHAHIKRPLRLPB-CYBMUJFWSA-N	1	0	276.380	1.829	50	0		CDAARO
c1cc2nonc2c(CN2CCN(c3cnccn3)CC2)c1	ZINC000216321131	358937640	/nfs/dbraw/zinc/93/76/40/358937640.db2.gz	SXSQKNBKXOLRCU-UHFFFAOYSA-N	1	0	296.334	1.335	50	0		CDAARO
Cc1cc(C[NH+]2CCC3(COC(=O)O3)CC2)on1	ZINC000216358588	358939916	/nfs/dbraw/zinc/93/99/16/358939916.db2.gz	DLZBVVPGUPIDDN-UHFFFAOYSA-N	1	0	252.270	1.484	50	0		CDAARO
CN1Cc2cccn2C[C@H]1CNC(=O)c1ccccc1F	ZINC000257176308	359070198	/nfs/dbraw/zinc/07/01/98/359070198.db2.gz	CGJTYWMXFACXRF-CYBMUJFWSA-N	1	0	287.338	1.871	50	0		CDAARO
C[C@H]1CCC[C@H](C)N1C(=O)C[N@H+](C)CC(C)(C)O	ZINC000087408553	359126869	/nfs/dbraw/zinc/12/68/69/359126869.db2.gz	FSPUGWSBXBHRPT-RYUDHWBXSA-N	1	0	256.390	1.479	50	0		CDAARO
Cn1ccc(C(=O)NCc2ccccc2C[NH+](C)C)cc1=O	ZINC000030563886	359616020	/nfs/dbraw/zinc/61/60/20/359616020.db2.gz	FGJHZANZQUSXAE-UHFFFAOYSA-N	1	0	299.374	1.377	50	0		CDAARO
C[NH+](C)CCCOC1CCN(C(=O)[C@H](O)C2CCC2)CC1	ZINC000408519583	359913104	/nfs/dbraw/zinc/91/31/04/359913104.db2.gz	VQGMABAACXJQJR-OAHLLOKOSA-N	1	0	298.427	1.107	50	0		CDAARO
Nc1ccc(C(=O)N2CC[C@@H]([NH+]3CCCCC3)C2)cn1	ZINC000062984977	360048592	/nfs/dbraw/zinc/04/85/92/360048592.db2.gz	XMFJYWYBAIZOBB-CYBMUJFWSA-N	1	0	274.368	1.364	50	0		CDAARO
C[NH+](C)C1(CC2CC2)CCN(S(C)(=O)=O)CC1	ZINC000409420210	360223053	/nfs/dbraw/zinc/22/30/53/360223053.db2.gz	XVBWLNMIBPBIRG-UHFFFAOYSA-N	1	0	260.403	1.142	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)[C@H]1CCOC1	ZINC000248161209	360419457	/nfs/dbraw/zinc/41/94/57/360419457.db2.gz	XQGCZQWMZBCQCW-YNEHKIRRSA-N	1	0	252.358	1.108	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)c2cc3ccccc3[nH]c2=O)C1	ZINC000178337077	189107845	/nfs/dbraw/zinc/10/78/45/189107845.db2.gz	QMQBGQAJQXUZKV-GFCCVEGCSA-N	1	0	299.374	1.600	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)c2ccc3nccn3c2)C1	ZINC000178336569	189107849	/nfs/dbraw/zinc/10/78/49/189107849.db2.gz	DITUIKLYLUKOJW-GFCCVEGCSA-N	1	0	272.352	1.406	50	0		CDAARO
O=C(NCCc1ccccc1F)NC[C@H]1CCC[NH2+]1	ZINC000426506861	360678018	/nfs/dbraw/zinc/67/80/18/360678018.db2.gz	TXARIHCVSGMNKX-GFCCVEGCSA-N	1	0	265.332	1.419	50	0		CDAARO
CC(=O)CCc1ccc(ON2CCC[NH2+]CC2)cc1	ZINC000426493977	360676732	/nfs/dbraw/zinc/67/67/32/360676732.db2.gz	HYQIXEZGKKMQEV-UHFFFAOYSA-N	1	0	262.353	1.797	50	0		CDAARO
Cc1c(C)n(C[C@@H](O)C[NH2+]CCO)c2c1cccc2Cl	ZINC000012421910	360698625	/nfs/dbraw/zinc/69/86/25/360698625.db2.gz	BTVOKTFWWOILBL-LBPRGKRZSA-N	1	0	296.798	1.854	50	0		CDAARO
O=C(NCc1cccs1)N1CCC2(CC1)C[NH2+]CCO2	ZINC000426715827	360699054	/nfs/dbraw/zinc/69/90/54/360699054.db2.gz	FPUHEVHXRLWEIF-UHFFFAOYSA-N	1	0	295.408	1.412	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)c2cncn2-c2ccc(F)cc2)C1	ZINC000178526683	189124247	/nfs/dbraw/zinc/12/42/47/189124247.db2.gz	XKHFHVBUYDUHLN-NSHDSACASA-N	1	0	288.326	1.432	50	0		CDAARO
Cc1c2ccccc2oc1[C@H](C)NC(=O)[C@@H]1C[C@@H](O)C[NH2+]1	ZINC000299741683	200853675	/nfs/dbraw/zinc/85/36/75/200853675.db2.gz	ADFQOFHVPPJFCW-LOWVWBTDSA-N	1	0	288.347	1.641	50	0		CDAARO
O=C(C[C@@H]1CC[NH2+]C1)NCCOc1cccc2cccnc21	ZINC000299775653	200867709	/nfs/dbraw/zinc/86/77/09/200867709.db2.gz	GIJYYCSSHSRPRR-ZDUSSCGKSA-N	1	0	299.374	1.729	50	0		CDAARO
CS(=O)(=O)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccoc1	ZINC000182555393	189328033	/nfs/dbraw/zinc/32/80/33/189328033.db2.gz	ZCHVZBWYEMJQRL-NWDGAFQWSA-N	1	0	257.355	1.725	50	0		CDAARO
c1nn(Cc2ccccc2)c[n+]1NCc1ccccc1	ZINC000000242786	361444328	/nfs/dbraw/zinc/44/43/28/361444328.db2.gz	FPCLJFAEMFICTP-UHFFFAOYSA-N	1	0	265.340	1.963	50	0	in-vitro	CDAARO
CC[N@@H+]1CC[C@H](N(C)Cc2c[nH]c(C(=O)OC)c2)[C@H](C)C1	ZINC000093639461	364419017	/nfs/dbraw/zinc/41/90/17/364419017.db2.gz	KQLCPLWCBAMGBO-DOMZBBRYSA-N	1	0	293.411	1.963	50	0		CDAARO
CCc1cccc(S(=O)(=O)N[C@H]2CCC[NH2+][C@H]2C)c1	ZINC000193454400	189643718	/nfs/dbraw/zinc/64/37/18/189643718.db2.gz	LWXQGQWHZHHIOO-FZMZJTMJSA-N	1	0	282.409	1.668	50	0		CDAARO
CC(=O)NC1CCC([NH2+]CCc2ccc(O)cc2)CC1	ZINC000275393052	193019558	/nfs/dbraw/zinc/01/95/58/193019558.db2.gz	YWTGYMNAGDTGDQ-UHFFFAOYSA-N	1	0	276.380	1.972	50	0		CDAARO
COC[C@](C)(CCO)[NH2+]Cc1cccc2c1OCCCO2	ZINC000089895573	366958146	/nfs/dbraw/zinc/95/81/46/366958146.db2.gz	MDFPWRLYGFEJTK-INIZCTEOSA-N	1	0	295.379	1.725	50	0		CDAARO
CCC(=O)N1CC[C@H]([NH2+]Cc2ccc(CO)o2)[C@@H](CC)C1	ZINC000089948954	366977017	/nfs/dbraw/zinc/97/70/17/366977017.db2.gz	CSVUMQVHCZBYBH-WFASDCNBSA-N	1	0	294.395	1.899	50	0		CDAARO
C[C@H](CC(=O)N(C)C)[NH2+]C[C@H](O)c1c(F)cccc1F	ZINC000090078229	367011673	/nfs/dbraw/zinc/01/16/73/367011673.db2.gz	ZIANQVNWJLCQEV-SKDRFNHKSA-N	1	0	286.322	1.455	50	0		CDAARO
C[N@H+](C[C@@H](O)c1ccc2c(c1)OCO2)C[C@H]1CCCO1	ZINC000241368009	367273828	/nfs/dbraw/zinc/27/38/28/367273828.db2.gz	MJHRUNBKNYWDAQ-CHWSQXEVSA-N	1	0	279.336	1.560	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@H]1NS(=O)(=O)c1ccccc1F	ZINC000094345704	367489044	/nfs/dbraw/zinc/48/90/44/367489044.db2.gz	KFFVUHRHKHUWJF-GXSJLCMTSA-N	1	0	272.345	1.102	50	0		CDAARO
COCC1(CNC(=O)NC[C@H]2CCC[N@H+](C)C2)CCC1	ZINC000252485417	367569871	/nfs/dbraw/zinc/56/98/71/367569871.db2.gz	GUTSEDCWOBLSMH-CYBMUJFWSA-N	1	0	283.416	1.444	50	0		CDAARO
C[C@H]1OCC[C@H]1[N@H+](CCO)CCSC(C)(C)C	ZINC000252493991	367641152	/nfs/dbraw/zinc/64/11/52/367641152.db2.gz	NIAQGSIKTZYRIL-VXGBXAGGSA-N	1	0	261.431	1.990	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCC[C@H]2C[NH3+])cc1F	ZINC000089091770	368833487	/nfs/dbraw/zinc/83/34/87/368833487.db2.gz	BJEIJVRQPLEWIP-GWCFXTLKSA-N	1	0	286.372	1.540	50	0		CDAARO
CC(=O)c1c(F)cccc1N1CCC([NH2+]CCO)CC1	ZINC000290882048	370082822	/nfs/dbraw/zinc/08/28/22/370082822.db2.gz	BYOFMGMYEMKXGG-UHFFFAOYSA-N	1	0	280.343	1.579	50	0		CDAARO
COC(=O)[C@@H]1[C@@H](O)CCC[N@@H+]1C[C@@H]1CC=CCC1	ZINC000252549060	284201055	/nfs/dbraw/zinc/20/10/55/284201055.db2.gz	QRDSPMVLVNJYBD-AGIUHOORSA-N	1	0	253.342	1.341	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1cccc(OC)c1OC	ZINC000026380389	370463071	/nfs/dbraw/zinc/46/30/71/370463071.db2.gz	RCZDXFJAMRSBKF-GFCCVEGCSA-N	1	0	292.379	1.918	50	0		CDAARO
CS(=O)(=O)N1CCC[C@H]([NH2+]C[C@@H]2CC=CCC2)C1	ZINC000334475969	371772004	/nfs/dbraw/zinc/77/20/04/371772004.db2.gz	OHUFSIHPLHFGNN-OLZOCXBDSA-N	1	0	272.414	1.356	50	0		CDAARO
Cc1nnc(CN2CC[NH+](C3CCSCC3)CC2)s1	ZINC000299767218	372748742	/nfs/dbraw/zinc/74/87/42/372748742.db2.gz	PLVKFTGJVNZWCB-UHFFFAOYSA-N	1	0	298.481	1.860	50	0		CDAARO
Cc1ccc(NC(=O)NCC[NH+](C)C)c(N(C)C)n1	ZINC000097052279	541882200	/nfs/dbraw/zinc/88/22/00/541882200.db2.gz	GNKGSAKJWSTZNM-UHFFFAOYSA-N	1	0	265.361	1.139	50	0		CDAARO
CCn1c(COc2ccc(C)nc2)nnc1[C@H]1C[C@@H]([NH3+])C1	ZINC000244601770	189907808	/nfs/dbraw/zinc/90/78/08/189907808.db2.gz	DRLYFPFVZBCSHC-TXEJJXNPSA-N	1	0	287.367	1.785	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CC[C@@H]([NH3+])C[C@H]2C)c(F)c1	ZINC000405028762	373291348	/nfs/dbraw/zinc/29/13/48/373291348.db2.gz	NJJDNKIRFJZASE-GHMZBOCLSA-N	1	0	286.372	1.634	50	0		CDAARO
CC[C@@H](CO)[NH2+]C[C@H](O)COCc1ccc(Cl)cc1	ZINC000003893462	373300887	/nfs/dbraw/zinc/30/08/87/373300887.db2.gz	RKQDUSVCVGWAKJ-KBPBESRZSA-N	1	0	287.787	1.578	50	0		CDAARO
CCN(Cc1ccc(Cl)s1)C(=O)[C@H]1C[C@H](O)C[NH2+]1	ZINC000037800013	373341046	/nfs/dbraw/zinc/34/10/46/373341046.db2.gz	FDYUEXSHPWNZFT-WCBMZHEXSA-N	1	0	288.800	1.473	50	0		CDAARO
Cc1ccc(C(=O)N2CC[N@@H+]3CCCC[C@@H]3C2)cc1N	ZINC000037812717	373414832	/nfs/dbraw/zinc/41/48/32/373414832.db2.gz	BLKRNFMMTKWURM-CQSZACIVSA-N	1	0	273.380	1.888	50	0		CDAARO
CCOc1ccccc1C[N@@H+]1C[C@@H](CO)[C@H](NC(C)=O)C1	ZINC000253408911	373716588	/nfs/dbraw/zinc/71/65/88/373716588.db2.gz	LEZGNQOLRKGVCG-LSDHHAIUSA-N	1	0	292.379	1.014	50	0		CDAARO
Cc1nc2ccc(N[C@@H]3CCC[C@H]([NH+](C)C)C3)nn2n1	ZINC000253415433	373726004	/nfs/dbraw/zinc/72/60/04/373726004.db2.gz	CPSQSWZENXNGCP-NEPJUHHUSA-N	1	0	274.372	1.717	50	0		CDAARO
CCCCC(=O)N1CCN(c2cn[nH+]c(N(C)C)c2)CC1	ZINC000206723534	374181485	/nfs/dbraw/zinc/18/14/85/374181485.db2.gz	RLYBUORXDUCYDV-UHFFFAOYSA-N	1	0	291.399	1.381	50	0		CDAARO
COc1ccc(C[NH2+]CC2(O)CCOCC2)cc1OC	ZINC000112717019	374226996	/nfs/dbraw/zinc/22/69/96/374226996.db2.gz	IFIJLOOZKZULML-UHFFFAOYSA-N	1	0	281.352	1.335	50	0		CDAARO
OC1(C[NH2+]Cc2c[nH]nc2-c2ccccc2)CCOCC1	ZINC000112717182	374228052	/nfs/dbraw/zinc/22/80/52/374228052.db2.gz	NHLUVUYFKXBLGH-UHFFFAOYSA-N	1	0	287.363	1.708	50	0		CDAARO
C[C@@H](COc1cccc(F)c1)NC(=O)[C@@H]1CCCC[NH2+]1	ZINC000095426458	374926912	/nfs/dbraw/zinc/92/69/12/374926912.db2.gz	ZLSLKIDFLODKIK-FZMZJTMJSA-N	1	0	280.343	1.851	50	0		CDAARO
Cc1nnc(CN(C)CC2(O)CCC(C)CC2)n1C	ZINC000095430669	374932303	/nfs/dbraw/zinc/93/23/03/374932303.db2.gz	CYSRFPBWLJQXFM-UHFFFAOYSA-N	1	0	266.389	1.497	50	0		CDAARO
C[N@H+](CC1CCC1)C1CCC2(CC1)NC(=O)NC2=O	ZINC000095443129	374943854	/nfs/dbraw/zinc/94/38/54/374943854.db2.gz	XBNQDEHWKACWMJ-UHFFFAOYSA-N	1	0	265.357	1.239	50	0		CDAARO
CN(CCc1cnccn1)C(=O)NCCC[NH+]1CCCC1	ZINC000095457409	374956229	/nfs/dbraw/zinc/95/62/29/374956229.db2.gz	UBMDPKAVEHRBNE-UHFFFAOYSA-N	1	0	291.399	1.146	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+][C@H]1CCCC[C@H]1S(C)(=O)=O	ZINC000095940760	375037721	/nfs/dbraw/zinc/03/77/21/375037721.db2.gz	CMUFVEOSXRYYBA-WDEREUQCSA-N	1	0	291.413	1.131	50	0		CDAARO
C[C@@H](CC(=O)N1CCCCCC1)[NH2+]CC(=O)NC(C)(C)C	ZINC000096476541	375104702	/nfs/dbraw/zinc/10/47/02/375104702.db2.gz	BTHDEXSTINSEMS-ZDUSSCGKSA-N	1	0	297.443	1.672	50	0		CDAARO
COC(=O)[C@]12CCC[C@@H]1C[N@H+](Cc1cccn1C)C2	ZINC000097084949	375146093	/nfs/dbraw/zinc/14/60/93/375146093.db2.gz	LRHCXIUSZNDQPC-DOMZBBRYSA-N	1	0	262.353	1.800	50	0		CDAARO
C[C@@H](O)C[NH2+]CC(=O)Nc1ccc(Cl)cc1F	ZINC000003338913	375653445	/nfs/dbraw/zinc/65/34/45/375653445.db2.gz	LTAKHORQJRDBMC-SSDOTTSWSA-N	1	0	260.696	1.388	50	0		CDAARO
Cc1nn(C)c(N(C)C)c1CN[C@@H]1CC[N@@H+]2CCCC[C@@H]12	ZINC000229306782	375869860	/nfs/dbraw/zinc/86/98/60/375869860.db2.gz	JXDYRIPWIBUNIM-CABCVRRESA-N	1	0	291.443	1.511	50	0		CDAARO
C[NH2+][C@@H](C)CNC(=O)c1cc(C2CC2)nc2onc(C)c21	ZINC000261645070	190042108	/nfs/dbraw/zinc/04/21/08/190042108.db2.gz	DPIGJVUWIDLOPP-QMMMGPOBSA-N	1	0	288.351	1.746	50	0		CDAARO
CO[C@@H](C[NH3+])CC(=O)N(C)[C@H]1CCc2ccccc2C1	ZINC000262745783	190061962	/nfs/dbraw/zinc/06/19/62/190061962.db2.gz	AFHIAOASWQBIIR-LSDHHAIUSA-N	1	0	276.380	1.366	50	0		CDAARO
Cc1ocnc1C(=O)N1CC([N@H+](C)Cc2ccccc2)C1	ZINC000288177659	197021111	/nfs/dbraw/zinc/02/11/11/197021111.db2.gz	BHSBKJXPGFZXEV-UHFFFAOYSA-N	1	0	285.347	1.939	50	0		CDAARO
COc1ccc(C)cc1/C=C\C(=O)N1CCC[NH2+]CC1	ZINC000493094583	253369016	/nfs/dbraw/zinc/36/90/16/253369016.db2.gz	RLCOYGHJRPBFAS-ALCCZGGFSA-N	1	0	274.364	1.839	50	0		CDAARO
CN(CC(N)=O)Cc1ccccc1N1CCCCC1	ZINC000015103714	390215280	/nfs/dbraw/zinc/21/52/80/390215280.db2.gz	WJDQSPUVSBJFBU-UHFFFAOYSA-N	1	0	261.369	1.594	50	0		CDAARO
[NH3+]CC1(NS(=O)(=O)Cc2ccccc2F)CCCC1	ZINC000095432066	184982047	/nfs/dbraw/zinc/98/20/47/184982047.db2.gz	GGTPNPQGORVXOC-UHFFFAOYSA-N	1	0	286.372	1.517	50	0		CDAARO
[NH3+][C@H]1CCCC[C@H]1NC(=O)c1cccnc1Cl	ZINC000079440092	390422584	/nfs/dbraw/zinc/42/25/84/390422584.db2.gz	FQRIPXUPVIYTSF-VHSXEESVSA-N	1	0	253.733	1.735	50	0		CDAARO
CC(C)SCC(=O)N1CCC2(CC1)C[N@H+](C)CCN2C	ZINC000067770423	390575212	/nfs/dbraw/zinc/57/52/12/390575212.db2.gz	ONGSSSKMIASEBJ-UHFFFAOYSA-N	1	0	299.484	1.366	50	0		CDAARO
CC[C@H]1CN(c2ncc(OC)cn2)CC[N@@H+]1C(C)C	ZINC000077356213	390810044	/nfs/dbraw/zinc/81/00/44/390810044.db2.gz	VEYCYXDCXPEAJK-LBPRGKRZSA-N	1	0	264.373	1.794	50	0		CDAARO
C[C@@H]1CN(c2ncnc3c2CN(C)CC3)CC(C)(C)O1	ZINC000097204121	390841568	/nfs/dbraw/zinc/84/15/68/390841568.db2.gz	XPNIEAAETXNEBN-LLVKDONJSA-N	1	0	276.384	1.468	50	0		CDAARO
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)N2CCCC[C@H]2C[NH3+])C1	ZINC000252205530	390941390	/nfs/dbraw/zinc/94/13/90/390941390.db2.gz	XBZQNYARGDTSTM-UPJWGTAASA-N	1	0	289.445	1.022	50	0		CDAARO
Cc1cc(C)n(-c2ccc(C(=O)N(C)[C@H]3CC[NH2+]C3)cc2)n1	ZINC000179120652	390943152	/nfs/dbraw/zinc/94/31/52/390943152.db2.gz	LLSBRGCXRYMALW-INIZCTEOSA-N	1	0	298.390	1.923	50	0		CDAARO
COc1cc(C(=O)N[C@@H]2CC[C@@H]([NH3+])C2)ccc1F	ZINC000244874209	391043812	/nfs/dbraw/zinc/04/38/12/391043812.db2.gz	WWNRKCHVYYGPEJ-NXEZZACHSA-N	1	0	252.289	1.444	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](Nc2cc(C)nc(C)n2)C1	ZINC000096456184	533343061	/nfs/dbraw/zinc/34/30/61/533343061.db2.gz	YSRRIUOVNUDCFA-CYBMUJFWSA-N	1	0	264.373	1.616	50	0		CDAARO
COc1c2c(cc3c1[C@H](C[C@H](C)O)[N@H+](C)CC3)OCO2	ZINC000004029121	391935738	/nfs/dbraw/zinc/93/57/38/391935738.db2.gz	QLEBYGRJDONRLS-ONGXEEELSA-N	1	0	279.336	1.724	50	0	biogenic	CDAARO
O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCCO1	ZINC000093066122	135078880	/nfs/dbraw/zinc/07/88/80/135078880.db2.gz	UUJBHGOGIPLHGK-HNNXBMFYSA-N	1	0	289.379	1.593	50	0		CDAARO
CC1(C)[C@H]2CCC[C@H]2[C@@H]1[NH2+]C[C@H](O)Cn1ccnn1	ZINC000658035954	413145903	/nfs/dbraw/zinc/14/59/03/413145903.db2.gz	SOZVOPLAWFBJEP-RNJOBUHISA-N	1	0	264.373	1.053	50	0		CDAARO
c1ccc([C@@H]2C[NH2+]C[C@H]2COc2ccncc2)nc1	ZINC000253395493	397603951	/nfs/dbraw/zinc/60/39/51/397603951.db2.gz	ALNDCZGWDLOXQF-GXTWGEPZSA-N	1	0	255.321	1.859	50	0		CDAARO
C[C@H]1C[C@H](C)C[NH+](CCn2nc3ccccn3c2=O)C1	ZINC000036392946	398007437	/nfs/dbraw/zinc/00/74/37/398007437.db2.gz	MHNQUYCOAOGCKT-STQMWFEESA-N	1	0	274.368	1.474	50	0		CDAARO
C[C@H]1C[NH2+]CCN1Cc1cc(-n2ccnc2)cs1	ZINC000097162635	397981330	/nfs/dbraw/zinc/98/13/30/397981330.db2.gz	XMRSIAUBHYTSKP-NSHDSACASA-N	1	0	262.382	1.728	50	0		CDAARO
O[C@H](CC[NH+]1CCC2(CC1)OCCO2)C(F)(F)F	ZINC000005612883	296576648	/nfs/dbraw/zinc/57/66/48/296576648.db2.gz	XYIKXAYOMCBCMV-SECBINFHSA-N	1	0	269.263	1.139	50	0		CDAARO
CCOC(=O)[C@@H]1[C@@H]([NH+]2CCCC2)C(C)(C)[C@H]1C(=O)OCC	ZINC000005796653	285890356	/nfs/dbraw/zinc/89/03/56/285890356.db2.gz	RJAIFMNTFDYYIO-YNEHKIRRSA-N	1	0	297.395	1.849	50	0		CDAARO
Cc1cccc(CCNC(=O)N(C)CC[NH+](C)C)c1	ZINC000176291243	148035579	/nfs/dbraw/zinc/03/55/79/148035579.db2.gz	XEAOTGHUZWFSBM-UHFFFAOYSA-N	1	0	263.385	1.741	50	0		CDAARO
C[C@]1([NH3+])CCCC[C@@H]1C(=O)NCc1ccc(F)cn1	ZINC000263222615	149123813	/nfs/dbraw/zinc/12/38/13/149123813.db2.gz	MERXFJOGQNIJHV-OCCSQVGLSA-N	1	0	265.332	1.745	50	0		CDAARO
Cc1ccc([C@H](CNC(=O)c2cn(C)cn2)[NH+](C)C)cc1	ZINC000178223166	292254715	/nfs/dbraw/zinc/25/47/15/292254715.db2.gz	NZQMCVMLHJHFMM-HNNXBMFYSA-N	1	0	286.379	1.761	50	0		CDAARO
CCOC(=O)C[C@@H]([NH3+])c1ccc2c(c1)OCCO2	ZINC000003678392	169907202	/nfs/dbraw/zinc/90/72/02/169907202.db2.gz	UPDOMKNNTODYIN-SNVBAGLBSA-N	1	0	251.282	1.411	50	0		CDAARO
CC(=O)c1cccc(S(=O)(=O)NCCC[NH+](C)C)c1	ZINC000007374540	170279848	/nfs/dbraw/zinc/27/98/48/170279848.db2.gz	IFDRRXYGCZADEG-UHFFFAOYSA-N	1	0	284.381	1.119	50	0		CDAARO
COC(=O)C1CC[NH+]([C@@H]2COc3ccccc3C2)CC1	ZINC000012074574	170468682	/nfs/dbraw/zinc/46/86/82/170468682.db2.gz	QILXOKNFUYTIBO-AWEZNQCLSA-N	1	0	275.348	1.875	50	0		CDAARO
COc1ccc(C[NH2+]CCCN2CCCC2=O)cc1	ZINC000013727763	170582710	/nfs/dbraw/zinc/58/27/10/170582710.db2.gz	PUJCPXXAMISQDZ-UHFFFAOYSA-N	1	0	262.353	1.797	50	0		CDAARO
[NH3+]C[C@@H]1CC(=O)N(CCc2cccc(Cl)c2)C1	ZINC000019669452	170834864	/nfs/dbraw/zinc/83/48/64/170834864.db2.gz	QYVXNYUYXOTERU-NSHDSACASA-N	1	0	252.745	1.690	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CCC[NH2+]C2)cc1C	ZINC000020432270	171196529	/nfs/dbraw/zinc/19/65/29/171196529.db2.gz	JZHOCYCESJMFOQ-GFCCVEGCSA-N	1	0	268.382	1.334	50	0		CDAARO
COc1cc(CN2CCO[C@@H](CC[NH+](C)C)C2)ccc1F	ZINC000020449503	171207614	/nfs/dbraw/zinc/20/76/14/171207614.db2.gz	WTUQHZBZUUWPKF-AWEZNQCLSA-N	1	0	296.386	1.987	50	0		CDAARO
[NH3+]C1CCN(S(=O)(=O)c2ccccc2Cl)CC1	ZINC000020473806	171218190	/nfs/dbraw/zinc/21/81/90/171218190.db2.gz	XOTWSVLZNRFUCW-UHFFFAOYSA-N	1	0	274.773	1.452	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2ccc(C)cc2C)CC1	ZINC000020608835	171267652	/nfs/dbraw/zinc/26/76/52/171267652.db2.gz	MSHGPKJJGWIGFI-UHFFFAOYSA-N	1	0	275.396	1.879	50	0		CDAARO
COc1ccc2c(ccn2CC(=O)NCCC[NH+](C)C)c1	ZINC000020746030	171271750	/nfs/dbraw/zinc/27/17/50/171271750.db2.gz	XTKNGOHZCLPGBT-UHFFFAOYSA-N	1	0	289.379	1.718	50	0		CDAARO
CC(C)(C)c1csc(NC(=O)N[C@@H]2CC[NH2+]C2)n1	ZINC000035287434	172105295	/nfs/dbraw/zinc/10/52/95/172105295.db2.gz	HESXGCQHEAHAOQ-MRVPVSSYSA-N	1	0	268.386	1.924	50	0		CDAARO
O=S(=O)(NC[C@@H]1CCC[NH2+]C1)c1ccc(F)cc1F	ZINC000036905540	172794279	/nfs/dbraw/zinc/79/42/79/172794279.db2.gz	KCUYQQWRLDANFQ-SECBINFHSA-N	1	0	290.335	1.243	50	0		CDAARO
COc1cccc([C@H]2C[C@@H]2C(=O)N2CC[NH2+]CC2)c1	ZINC000038478366	174141978	/nfs/dbraw/zinc/14/19/78/174141978.db2.gz	RYLRSJOYKZNHBE-KGLIPLIRSA-N	1	0	260.337	1.231	50	0		CDAARO
COc1ccc(C2=NN=C(N3CC[NH2+]CC3)SC2)cc1	ZINC000038478397	174142176	/nfs/dbraw/zinc/14/21/76/174142176.db2.gz	ANJNVOXLTPEWJB-UHFFFAOYSA-N	1	0	290.392	1.407	50	0		CDAARO
C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1cc(=O)n(C)c(=O)n1C	ZINC000040497573	174295581	/nfs/dbraw/zinc/29/55/81/174295581.db2.gz	SQEYXRNWVGQQNC-DGCLKSJQSA-N	1	0	279.384	1.095	50	0		CDAARO
CCCCc1ncc(S(C)(=O)=O)c([C@H]2CCC[NH2+]C2)n1	ZINC000071439344	176169281	/nfs/dbraw/zinc/16/92/81/176169281.db2.gz	GBYCCXJIEUFNOW-NSHDSACASA-N	1	0	297.424	1.690	50	0		CDAARO
[NH3+][C@@H](CC1CCCCC1)C(=O)N1CCCn2cncc2C1	ZINC000072143752	176324144	/nfs/dbraw/zinc/32/41/44/176324144.db2.gz	XSIIMCMVCLBVAD-HNNXBMFYSA-N	1	0	290.411	1.913	50	0		CDAARO
COc1ccc(F)c(CN2CCC[C@@]3(CC[NH2+]C3)C2=O)c1	ZINC000072147456	176325791	/nfs/dbraw/zinc/32/57/91/176325791.db2.gz	IDIIVWOQGDMOIK-INIZCTEOSA-N	1	0	292.354	1.936	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]1NC(=O)c1cccc(-n2cccn2)c1	ZINC000072154063	176327850	/nfs/dbraw/zinc/32/78/50/176327850.db2.gz	XXIWNIXMNZSEFJ-OLZOCXBDSA-N	1	0	256.309	1.092	50	0		CDAARO
O=C(C[C@H]1COCC[NH2+]1)NCc1csc2c1CCCC2	ZINC000072166914	176331728	/nfs/dbraw/zinc/33/17/28/176331728.db2.gz	QEJUMANLVCKNPF-LBPRGKRZSA-N	1	0	294.420	1.622	50	0		CDAARO
CN(C)C(=O)C1(CCCc2ccncc2)CC[NH2+]CC1	ZINC000077010600	177146302	/nfs/dbraw/zinc/14/63/02/177146302.db2.gz	GQIPERGGDLKWNE-UHFFFAOYSA-N	1	0	275.396	1.862	50	0		CDAARO
CC(C)c1noc([C@@H]2CCCN2C(=O)Cn2ccnc2)n1	ZINC000077343115	177254752	/nfs/dbraw/zinc/25/47/52/177254752.db2.gz	OWYUDLKCMKHCEW-NSHDSACASA-N	1	0	289.339	1.753	50	0		CDAARO
COCCNC(=O)CN1CC=C(c2ccccc2)CC1	ZINC000014124723	260078612	/nfs/dbraw/zinc/07/86/12/260078612.db2.gz	CSMOUVBUYBIQRK-UHFFFAOYSA-N	1	0	274.364	1.538	50	0		CDAARO
OCCOCC[NH2+]Cc1cc(Br)cs1	ZINC000020306162	260118189	/nfs/dbraw/zinc/11/81/89/260118189.db2.gz	SEYVSAKHVCGMRI-UHFFFAOYSA-N	1	0	280.187	1.609	50	0		CDAARO
COc1ccc2cc(C[N@@H+]3CC[C@H](O)C3)c(=O)[nH]c2c1	ZINC000067983575	260254485	/nfs/dbraw/zinc/25/44/85/260254485.db2.gz	CUWKVYPAYXQBFU-LBPRGKRZSA-N	1	0	274.320	1.103	50	0		CDAARO
CC[NH+](CC)CC(=O)Nc1ccsc1C(=O)OC	ZINC000004625614	273635384	/nfs/dbraw/zinc/63/53/84/273635384.db2.gz	UITPLTBNSRIXCZ-UHFFFAOYSA-N	1	0	270.354	1.815	50	0		CDAARO
CCN1C(=O)/C(=C/C=C2/CCC[N@@H+]2C)OC1=S	ZINC000013124365	276145303	/nfs/dbraw/zinc/14/53/03/276145303.db2.gz	YADMFLGOGVPZGG-LFPVQMOXSA-N	1	0	252.339	1.643	50	0		CDAARO
COC(=O)[C@H]1CC12CC[NH+](C[C@](C)(O)C(F)(F)F)CC2	ZINC000241171038	277124066	/nfs/dbraw/zinc/12/40/66/277124066.db2.gz	KDULBBBZOYIWAJ-KOLCDFICSA-N	1	0	295.301	1.575	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C[NH3+])C1	ZINC000091692697	277180661	/nfs/dbraw/zinc/18/06/61/277180661.db2.gz	BGZSTQMQTTUBPO-QMMMGPOBSA-N	1	0	250.289	1.837	50	0		CDAARO
CC1(C)CCC[C@@H]1[NH2+]CC1CCS(=O)(=O)CC1	ZINC000090883121	278236179	/nfs/dbraw/zinc/23/61/79/278236179.db2.gz	SICMGVWAPRQZHK-LBPRGKRZSA-N	1	0	259.415	1.980	50	0		CDAARO
CC1(C)CCC[C@H]([NH2+][C@H]2COC[C@H]2n2ccnn2)C1	ZINC000299745025	278243424	/nfs/dbraw/zinc/24/34/24/278243424.db2.gz	QUIGKMOUTDCXST-RWMBFGLXSA-N	1	0	264.373	1.776	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](N2CC[C@H](N(C)C(C)=O)C2)C1	ZINC000042926130	279292929	/nfs/dbraw/zinc/29/29/29/279292929.db2.gz	DJBJOHJIEJVGFU-UONOGXRCSA-N	1	0	253.390	1.023	50	0		CDAARO
Cn1ccnc1-c1ccc(N2C[C@H]([NH3+])[C@@H](C3CC3)C2)nn1	ZINC000095374269	279372688	/nfs/dbraw/zinc/37/26/88/279372688.db2.gz	NCQWSRFLQPUOGO-NEPJUHHUSA-N	1	0	284.367	1.051	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)/C=C\c2c(C)nn(C)c2Cl)C1	ZINC000254988908	289348789	/nfs/dbraw/zinc/34/87/89/289348789.db2.gz	BELXTNSSNJNKID-JMEBYUIHSA-N	1	0	296.802	1.606	50	0		CDAARO
CCn1nncc1C[NH2+][C@@H](C)c1ccc2c(c1)OCO2	ZINC000571143087	294375383	/nfs/dbraw/zinc/37/53/83/294375383.db2.gz	YPIGOFYGMLNHCP-JTQLQIEISA-N	1	0	274.324	1.878	50	0		CDAARO
COc1ccc([C@H]2CCC[N@@H+]2CCNC(C)=O)cc1	ZINC000090608690	295249556	/nfs/dbraw/zinc/24/95/56/295249556.db2.gz	WTLDOEIFCDYYGS-OAHLLOKOSA-N	1	0	262.353	1.968	50	0		CDAARO
[NH3+][C@@H]1CCc2ccc(S(=O)(=O)NC3CCCC3)cc21	ZINC000019746044	295323554	/nfs/dbraw/zinc/32/35/54/295323554.db2.gz	ZPIPJWXLRUZXSO-CQSZACIVSA-N	1	0	280.393	1.854	50	0		CDAARO
CCCCc1nc(C)cc(NCC[NH2+]C2CCOCC2)n1	ZINC000534632511	328332154	/nfs/dbraw/zinc/33/21/54/328332154.db2.gz	UOOKYBRLDHTXAR-UHFFFAOYSA-N	1	0	292.427	1.730	50	0		CDAARO
Cc1cccc2c1NC(=O)[C@@H]1C[C@@H]([NH+](C)C)CN1C2=O	ZINC000534637143	328334365	/nfs/dbraw/zinc/33/43/65/328334365.db2.gz	SRAILZBPSJWQAC-PWSUYJOCSA-N	1	0	273.336	1.092	50	0		CDAARO
COc1cc(NC[C@@H](C(C)C)[NH+](C)C)nc(OC)n1	ZINC000534640041	328335853	/nfs/dbraw/zinc/33/58/53/328335853.db2.gz	DSFJCOJJUKMXIE-JTQLQIEISA-N	1	0	268.361	1.492	50	0		CDAARO
COc1ccc(C(=O)N2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)cc1C	ZINC000534649861	328336258	/nfs/dbraw/zinc/33/62/58/328336258.db2.gz	CWAPYAZVVPHVDS-NMWPEEMBSA-N	1	0	286.375	1.826	50	0		CDAARO
CCn1ncc(CNC(=O)N2CC[C@H]([NH+](C)C)C2)c1C	ZINC000534658889	328341687	/nfs/dbraw/zinc/34/16/87/328341687.db2.gz	JHYBRVUGRWOGLP-ZDUSSCGKSA-N	1	0	279.388	1.057	50	0		CDAARO
Cc1ccc(C2(C(=O)NC[C@@H](O)C[NH+](C)C)CC2)cc1	ZINC000534647353	328342802	/nfs/dbraw/zinc/34/28/02/328342802.db2.gz	KXYOTNKBHJBAFW-CQSZACIVSA-N	1	0	276.380	1.065	50	0		CDAARO
CC[N@@H+]1C[C@H](NC(=O)COCc2ccccc2)[C@@H](OC)C1	ZINC000534647895	328343080	/nfs/dbraw/zinc/34/30/80/328343080.db2.gz	IATGIQDROHPUGG-GJZGRUSLSA-N	1	0	292.379	1.039	50	0		CDAARO
Fc1cnc(NC[C@H]2CC[N@@H+](C3CCCC3)C2)nc1	ZINC000534648183	328343237	/nfs/dbraw/zinc/34/32/37/328343237.db2.gz	HKAYIDQVMCDHEO-LLVKDONJSA-N	1	0	264.348	1.714	50	0		CDAARO
COCC1(C(=O)N2C[C@@H]3CC[C@H]2C[NH2+]C3)CCC1	ZINC000534647991	328343328	/nfs/dbraw/zinc/34/33/28/328343328.db2.gz	XFDSGMPHOVOFQF-NEPJUHHUSA-N	1	0	252.358	1.014	50	0		CDAARO
O=C(NC[C@@]1(O)CCC[NH2+]C1)c1sccc1Cl	ZINC000534657472	328341060	/nfs/dbraw/zinc/34/10/60/328341060.db2.gz	MXTIWCIKGKDWOA-LLVKDONJSA-N	1	0	274.773	1.246	50	0		CDAARO
CN(C)S(=O)(=O)CCC[NH2+][C@@H]1CCCCC1(C)C	ZINC000119917824	323208649	/nfs/dbraw/zinc/20/86/49/323208649.db2.gz	TVMIFNSQOPADBY-GFCCVEGCSA-N	1	0	276.446	1.826	50	0		CDAARO
CCOc1cc(NC[C@@H]2C[N@H+](CC(C)C)CCO2)ncn1	ZINC000185116695	323382459	/nfs/dbraw/zinc/38/24/59/323382459.db2.gz	YFPRTZMDJBHDJK-CYBMUJFWSA-N	1	0	294.399	1.644	50	0		CDAARO
C[C@@H]([NH2+]CCO)C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000004311028	326810935	/nfs/dbraw/zinc/81/09/35/326810935.db2.gz	ZAGOLSFRPKKKEZ-QFGHMXTESA-N	1	0	251.370	1.742	50	0		CDAARO
CCOC(=O)CC1([NH2+]C2(CC(=O)OCC)CC2)CC1	ZINC000498050808	329118971	/nfs/dbraw/zinc/11/89/71/329118971.db2.gz	FFRMGHFUVGAIBZ-UHFFFAOYSA-N	1	0	269.341	1.548	50	0		CDAARO
CCc1[nH+]c(N)nc(NC[C@@H](CO)Cc2ccco2)c1C	ZINC001772709357	1159443171	/nfs/dbraw/zinc/44/31/71/1159443171.db2.gz	GFSVFKFOVGKROL-NSHDSACASA-N	1	0	290.367	1.786	50	0		CDAARO
C[NH+](C)Cc1ccccc1NC(=O)c1nccnc1N	ZINC000024811580	482316839	/nfs/dbraw/zinc/31/68/39/482316839.db2.gz	YIDLAQNDTSNFNM-UHFFFAOYSA-N	1	0	271.324	1.373	50	0		CDAARO
Cn1ncnc1-c1ccc(C[NH+]2CCN(C)CC2)cc1	ZINC000091586879	482572128	/nfs/dbraw/zinc/57/21/28/482572128.db2.gz	LIHVMWHXVSNSHT-UHFFFAOYSA-N	1	0	271.368	1.230	50	0		CDAARO
CC(C)CC(=O)N1CC[NH+](C[C@H]2CCCOC2)CC1	ZINC000670439138	482983427	/nfs/dbraw/zinc/98/34/27/482983427.db2.gz	JTAYOUQJWVUZCC-CQSZACIVSA-N	1	0	268.401	1.603	50	0		CDAARO
COCC[C@H]1C[N@@H+](C2CSCCSC2)CCO1	ZINC000670441757	482986941	/nfs/dbraw/zinc/98/69/41/482986941.db2.gz	XRWNMAHRYJPQLJ-LBPRGKRZSA-N	1	0	277.455	1.572	50	0		CDAARO
Cc1cccc(CC[N@H+]2C[C@H]3CCC[C@@H](C2)NC3=O)n1	ZINC000670446653	482998093	/nfs/dbraw/zinc/99/80/93/482998093.db2.gz	HAORZVTYWRTLGH-HIFRSBDPSA-N	1	0	273.380	1.533	50	0		CDAARO
CC(C)[N@@H+]1CCO[C@@H](CC(=O)NCCc2nccs2)C1	ZINC000670456068	483032361	/nfs/dbraw/zinc/03/23/61/483032361.db2.gz	NYKJQMAXCXSIIA-LBPRGKRZSA-N	1	0	297.424	1.301	50	0		CDAARO
c1nnc([C@H]2CCC[N@H+](C3CSCCSC3)C2)[nH]1	ZINC000670465122	483055253	/nfs/dbraw/zinc/05/52/53/483055253.db2.gz	WIWAATDIHQJUCH-JTQLQIEISA-N	1	0	284.454	1.833	50	0		CDAARO
COc1ccc(NC(=O)NC2C[C@H]3CC[C@@H](C2)[NH2+]3)c(C)n1	ZINC000667207728	483145777	/nfs/dbraw/zinc/14/57/77/483145777.db2.gz	PHORXCBMVGIQTR-FOSCPWQOSA-N	1	0	290.367	1.803	50	0		CDAARO
Cc1cc([C@@H]2CCC[N@H+](CCN3CCCC3=O)C2)[nH]n1	ZINC000084111199	483246742	/nfs/dbraw/zinc/24/67/42/483246742.db2.gz	KEAVEDCTDGDGRK-CYBMUJFWSA-N	1	0	276.384	1.520	50	0		CDAARO
O=C(NC[C@@H]1C[N@@H+]2CCC[C@@H]2CO1)Nc1cccnc1	ZINC000084425143	483277342	/nfs/dbraw/zinc/27/73/42/483277342.db2.gz	AWIRCKFDCISURP-CHWSQXEVSA-N	1	0	276.340	1.066	50	0		CDAARO
O=C(NC[C@@H](O)c1ccccc1Cl)[C@H]1CCC[NH2+]1	ZINC000299741570	526489210	/nfs/dbraw/zinc/48/92/10/526489210.db2.gz	GLUXHDHYSWHQBV-VXGBXAGGSA-N	1	0	268.744	1.242	50	0		CDAARO
[NH3+]CCCS(=O)(=O)c1cccc(Br)c1	ZINC000055306572	527182038	/nfs/dbraw/zinc/18/20/38/527182038.db2.gz	MLHKPBKZXYUWCJ-UHFFFAOYSA-N	1	0	278.171	1.572	50	0		CDAARO
Cn1cc(C[NH2+]Cc2ccc(-n3cccn3)nc2)cn1	ZINC000097159092	538438054	/nfs/dbraw/zinc/43/80/54/538438054.db2.gz	KOBIOAKYVLDJDZ-UHFFFAOYSA-N	1	0	268.324	1.291	50	0		CDAARO
CO[C@@H]1CN(C(=O)OCc2ccccc2)CC[C@H]1[NH3+]	ZINC000118582109	1175043643	/nfs/dbraw/zinc/04/36/43/1175043643.db2.gz	OMPQDSCQQOWFJN-CHWSQXEVSA-N	1	0	264.325	1.371	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1C(=O)NCc1cccc2nsnc21	ZINC000952993594	616183732	/nfs/dbraw/zinc/18/37/32/616183732.db2.gz	ZRNYTMMVPOLNGN-LBPRGKRZSA-N	1	0	290.392	1.792	50	0		CDAARO
CC[C@@H]1CN(CC[NH2+][C@@H]2CCCn3ccnc32)CCO1	ZINC000888094087	617752991	/nfs/dbraw/zinc/75/29/91/617752991.db2.gz	GRBKHCWQYOAUPX-ZIAGYGMSSA-N	1	0	278.400	1.418	50	0		CDAARO
C[C@@H](Cc1ccccc1F)[NH2+][C@H]1CS(=O)(=O)C1(C)C	ZINC000877871972	678155935	/nfs/dbraw/zinc/15/59/35/678155935.db2.gz	ZKXFGNHEYHOZPS-GWCFXTLKSA-N	1	0	285.384	1.922	50	0		CDAARO
CC(C)(C)C[C@@H]([NH3+])C1(O)C[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000958528583	679679090	/nfs/dbraw/zinc/67/90/90/679679090.db2.gz	VOFYEEUVVAWTAM-YIVACMHISA-N	1	0	275.414	1.221	50	0		CDAARO
Cc1ncc(C[NH2+][C@@H]2CCCc3nc(N(C)C)ncc32)cn1	ZINC000012298083	678144318	/nfs/dbraw/zinc/14/43/18/678144318.db2.gz	VZHNZUYPMHLNKF-CQSZACIVSA-N	1	0	298.394	1.808	50	0		CDAARO
O=C(Nc1cnn(-c2ccccc2)c1)[C@H]1C[C@H](F)C[NH2+]1	ZINC000188447950	678152818	/nfs/dbraw/zinc/15/28/18/678152818.db2.gz	BMBHIFUICFBLIV-GXFFZTMASA-N	1	0	274.299	1.511	50	0		CDAARO
CC[NH+]1CCN(c2cc([C@H]3CCOC3)ncn2)CC1	ZINC000426529376	678209906	/nfs/dbraw/zinc/20/99/06/678209906.db2.gz	ORFSIKYDHILTQA-LBPRGKRZSA-N	1	0	262.357	1.122	50	0		CDAARO
COc1cccc(CC(=O)N2C[C@H]([NH3+])[C@@H](C(C)C)C2)c1	ZINC000091365032	678736918	/nfs/dbraw/zinc/73/69/18/678736918.db2.gz	MEYSEULXIAQHAH-CABCVRRESA-N	1	0	276.380	1.679	50	0		CDAARO
CC1(C)[NH2+]CC[C@@H]1NC(=O)N1CCc2ccccc21	ZINC000864094057	679006375	/nfs/dbraw/zinc/00/63/75/679006375.db2.gz	BVVYCIBBKLXOIA-ZDUSSCGKSA-N	1	0	259.353	1.899	50	0		CDAARO
O=C(NC[C@@H]1C[C@H](F)C[NH2+]1)c1c[nH]nc1C1CCCCC1	ZINC000082148553	679035459	/nfs/dbraw/zinc/03/54/59/679035459.db2.gz	GYZWHIDQAKTNAZ-RYUDHWBXSA-N	1	0	294.374	1.887	50	0		CDAARO
Cc1cccc2[nH]c(CCC(=O)NC[C@@H]3CCC[NH2+]3)nc21	ZINC000178752725	679045323	/nfs/dbraw/zinc/04/53/23/679045323.db2.gz	BTJJJBGTZJKBCB-LBPRGKRZSA-N	1	0	286.379	1.672	50	0		CDAARO
CCO[C@H]1C[C@@](CO)([NH2+]Cc2nn(C)cc2C)C1(C)C	ZINC000877871579	679114397	/nfs/dbraw/zinc/11/43/97/679114397.db2.gz	SEDAGQCHAUSKJI-ZFWWWQNUSA-N	1	0	281.400	1.384	50	0		CDAARO
[NH3+][Si](c1ccccc1)(c1ccccc1)c1ccccc1	ZINC000169808302	679461576	/nfs/dbraw/zinc/46/15/76/679461576.db2.gz	GLQOALGKMKUSBF-UHFFFAOYSA-N	1	0	275.427	1.612	50	0		CDAARO
CC(C)CC[N@@H+]1CCN(C2CCOCC2)C[C@@H]1CCO	ZINC000023360288	898220544	/nfs/dbraw/zinc/22/05/44/898220544.db2.gz	CZDTVCJXOSLUGI-INIZCTEOSA-N	1	0	284.444	1.580	50	0		CDAARO
C[NH2+]C[C@@H](O)[C@@H](C)C(=O)NC1CC(C)(C)CC(C)(C)C1	ZINC000952882212	910447455	/nfs/dbraw/zinc/44/74/55/910447455.db2.gz	JGOXBLQGYMWEQQ-DGCLKSJQSA-N	1	0	284.444	1.924	50	0		CDAARO
CNC(=O)N[C@@H]1CCCN(Cc2ccc(F)cn2)C1	ZINC000952884293	910456918	/nfs/dbraw/zinc/45/69/18/910456918.db2.gz	XEBRIFNIVPHEQE-GFCCVEGCSA-N	1	0	266.320	1.114	50	0		CDAARO
COCCC(=O)N1CCCC2(CC[NH2+]CC2)CC1	ZINC000824372159	925819382	/nfs/dbraw/zinc/81/93/82/925819382.db2.gz	XJTYLZFAAKTUAD-UHFFFAOYSA-N	1	0	254.374	1.405	50	0		CDAARO
Nc1ncccc1CNC(=O)CSCC[NH+]1CCCC1	ZINC000828029714	926026471	/nfs/dbraw/zinc/02/64/71/926026471.db2.gz	YAOHVWCWCZMPRL-UHFFFAOYSA-N	1	0	294.424	1.109	50	0		CDAARO
O=C1C[C@@H](Nc2cc[nH+]cc2)CN1Cc1ccccc1	ZINC000828248052	926084373	/nfs/dbraw/zinc/08/43/73/926084373.db2.gz	KIQQJGLRZXJFGS-OAHLLOKOSA-N	1	0	267.332	1.717	50	0		CDAARO
COc1cccc(CN2CC[C@H](CO)[C@H]([NH+](C)C)C2)c1	ZINC000581799397	927199448	/nfs/dbraw/zinc/19/94/48/927199448.db2.gz	XNJCKTYQRDMOLK-GDBMZVCRSA-N	1	0	278.396	1.440	50	0		CDAARO
C[N@H+](CCCO)Cc1ccc(Br)nc1N	ZINC000585116545	930967117	/nfs/dbraw/zinc/96/71/17/930967117.db2.gz	AHVRMBPLCMGLPJ-UHFFFAOYSA-N	1	0	274.162	1.241	50	0		CDAARO
C[C@H](C[NH+](C)C)[C@@H]1CCCCN1Cc1cnn(C)c1	ZINC000585117012	930969697	/nfs/dbraw/zinc/96/96/97/930969697.db2.gz	OXKWCWHYPNZXAG-HIFRSBDPSA-N	1	0	264.417	1.972	50	0		CDAARO
Cc1c(NC(=O)[C@@H]2CCC[N@@H+]3CCCC[C@H]23)cnn1C	ZINC001529104246	968980200	/nfs/dbraw/zinc/98/02/00/968980200.db2.gz	MTFQVYYTJQKCHV-TZMCWYRMSA-N	1	0	276.384	1.932	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CN(C)Cc2cccnc2C)C1	ZINC001529100434	968982030	/nfs/dbraw/zinc/98/20/30/968982030.db2.gz	SIRJRKSNJPBDNE-HNNXBMFYSA-N	1	0	277.412	1.790	50	0		CDAARO
CC[C@H]1CCCC[N@@H+]1CC(=O)Nc1nccn1C	ZINC001529099132	968982147	/nfs/dbraw/zinc/98/21/47/968982147.db2.gz	RDJILTWPAOUUBQ-NSHDSACASA-N	1	0	250.346	1.623	50	0		CDAARO
CN(C(=O)c1cnccn1)[C@@H]1C[C@@H]2C[C@H]([NH+](C)C)C[C@@H]2C1	ZINC001529113769	968984234	/nfs/dbraw/zinc/98/42/34/968984234.db2.gz	IJUUJOWXQVJOFB-KPWCQOOUSA-N	1	0	288.395	1.667	50	0		CDAARO
CCSCC[N@@H+]1CCC[C@](CO)(CN(C)C)C1	ZINC001506400256	975149221	/nfs/dbraw/zinc/14/92/21/975149221.db2.gz	BGCDYONHSBOFML-ZDUSSCGKSA-N	1	0	260.447	1.376	50	0		CDAARO
O=C(C1CCC1)N1CCC([NH2+]CCc2ncc[nH]2)CC1	ZINC001506416106	975155907	/nfs/dbraw/zinc/15/59/07/975155907.db2.gz	ULOGYPMNQLCHCI-UHFFFAOYSA-N	1	0	276.384	1.333	50	0		CDAARO
CN(C)C(=O)c1cccc(N2CC[C@H](C[NH+](C)C)C2)n1	ZINC001506417487	975155925	/nfs/dbraw/zinc/15/59/25/975155925.db2.gz	KMPRLXXRMOOVMS-GFCCVEGCSA-N	1	0	276.384	1.171	50	0		CDAARO
Cc1cccnc1N1C[C@H](O)[C@@H]([NH+]2CCCCC2)C1	ZINC001506415439	975156213	/nfs/dbraw/zinc/15/62/13/975156213.db2.gz	BWNIOSXJQTWFDQ-KBPBESRZSA-N	1	0	261.369	1.425	50	0		CDAARO
Cn1cncc1C(=O)Nc1ccnn1C1CC[NH+](C)CC1	ZINC001506424410	975159133	/nfs/dbraw/zinc/15/91/33/975159133.db2.gz	JTKHVXHSKKCISU-UHFFFAOYSA-N	1	0	288.355	1.136	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(C(=O)c2ccc3c(c2)COCO3)C1	ZINC000096444526	230374096	/nfs/dbraw/zinc/37/40/96/230374096.db2.gz	OYFARGRLXZNQSJ-AWEZNQCLSA-N	1	0	290.363	1.719	50	0		CDAARO
CN(C)C(=O)c1ccc(F)c(NC(=O)NCC[NH+](C)C)c1	ZINC000096499965	230384530	/nfs/dbraw/zinc/38/45/30/230384530.db2.gz	RSVPEMIRNNZLMJ-UHFFFAOYSA-N	1	0	296.346	1.211	50	0		CDAARO
OCC1(O)CC[NH+](C[C@H]2CCOc3ccccc3C2)CC1	ZINC000095515141	185001309	/nfs/dbraw/zinc/00/13/09/185001309.db2.gz	JDRGLDALXPJYRG-AWEZNQCLSA-N	1	0	291.391	1.447	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)Cc2cc3ccccc3[nH]c2=O)C1	ZINC000195119293	230396415	/nfs/dbraw/zinc/39/64/15/230396415.db2.gz	QYTMGGPCISNSAZ-ZDUSSCGKSA-N	1	0	285.347	1.020	50	0		CDAARO
CCOc1cc([C@@H]([NH3+])CS(C)(=O)=O)ccc1OC	ZINC000095766943	185027400	/nfs/dbraw/zinc/02/74/00/185027400.db2.gz	BXUJVINGXQGNFD-JTQLQIEISA-N	1	0	273.354	1.138	50	0		CDAARO
COC(=O)c1ccc(C[N@@H+]2CCC[C@@H]2Cn2ccnc2)[nH]1	ZINC000095940817	185035824	/nfs/dbraw/zinc/03/58/24/185035824.db2.gz	RJJXGQARFGJMQW-CYBMUJFWSA-N	1	0	288.351	1.662	50	0		CDAARO
CC(=O)N[C@H]1CCC[N@H+](CCC(=O)NC2CCCCC2)C1	ZINC000095952523	185040902	/nfs/dbraw/zinc/04/09/02/185040902.db2.gz	IJBMVGLVPGDPKB-HNNXBMFYSA-N	1	0	295.427	1.426	50	0		CDAARO
COC[C@@H](O)c1ccc(OC[C@H](O)C[NH2+]C(C)C)cc1	ZINC000002570883	169811202	/nfs/dbraw/zinc/81/12/02/169811202.db2.gz	OFRYBPCSEMMZHR-UKRRQHHQSA-N	1	0	283.368	1.104	50	0	world	CDAARO
Cn1cc(C(=O)NCC[NH2+]C2CCCCCC2)cn1	ZINC000095970946	185048724	/nfs/dbraw/zinc/04/87/24/185048724.db2.gz	ZRRRGDNSYQWSRB-UHFFFAOYSA-N	1	0	264.373	1.462	50	0		CDAARO
CCn1ccnc1[C@@H]1CCCCN1C(=O)[C@@H]1CCOC1	ZINC000239782373	361747121	/nfs/dbraw/zinc/74/71/21/361747121.db2.gz	COBOKRIYANASJX-OLZOCXBDSA-N	1	0	277.368	1.993	50	0		CDAARO
CCOC(=O)[C@@]1(C(C)C)CCN(Cc2nnc(C)n2C)C1	ZINC000194881723	342609283	/nfs/dbraw/zinc/60/92/83/342609283.db2.gz	ZDCNCTSWSRZIRT-HNNXBMFYSA-N	1	0	294.399	1.535	50	0		CDAARO
COc1ccc(CN2CCOCC2)c(OC)c1C	ZINC000016663126	342088860	/nfs/dbraw/zinc/08/88/60/342088860.db2.gz	BCWZIMOHLBMHLN-UHFFFAOYSA-N	1	0	251.326	1.844	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)c1cnn(C2CCCC2)c1C	ZINC000195554003	342625770	/nfs/dbraw/zinc/62/57/70/342625770.db2.gz	DXVUOYBONLJMLE-KGLIPLIRSA-N	1	0	292.383	1.023	50	0		CDAARO
CCn1nccc1C[N@@H+]1C[C@H]2CCC[C@@]2(C(=O)OC)C1	ZINC000195559167	342628479	/nfs/dbraw/zinc/62/84/79/342628479.db2.gz	FQDGPIADCAUKGN-IUODEOHRSA-N	1	0	277.368	1.678	50	0		CDAARO
Cc1cc(C[NH2+][C@@H]2CCCCC[C@H]2C(N)=O)no1	ZINC000195571244	342628775	/nfs/dbraw/zinc/62/87/75/342628775.db2.gz	MZGASURYIROXQG-VXGBXAGGSA-N	1	0	251.330	1.507	50	0		CDAARO
c1nnnn1CCCN1CC[NH+](C2CCCCC2)CC1	ZINC000243932707	361830482	/nfs/dbraw/zinc/83/04/82/361830482.db2.gz	BYGZRCGRYDZCLE-UHFFFAOYSA-N	1	0	278.404	1.014	50	0		CDAARO
CCc1nccn1CCNC(=O)c1ccc(OC)nc1	ZINC000244723685	361858314	/nfs/dbraw/zinc/85/83/14/361858314.db2.gz	MFNRNVFKXLPKNQ-UHFFFAOYSA-N	1	0	274.324	1.279	50	0		CDAARO
[NH3+][C@H]1C[C@H](c2cc(NCCNc3cccnc3)ncn2)C1	ZINC000244795733	361865115	/nfs/dbraw/zinc/86/51/15/361865115.db2.gz	RMQKIHSVNUJSCM-HAQNSBGRSA-N	1	0	284.367	1.600	50	0		CDAARO
Cc1c[nH]cc1C(=O)N1CCC2(C1)CC[NH+](C)CC2	ZINC000573711970	361920362	/nfs/dbraw/zinc/92/03/62/361920362.db2.gz	YLHWELJVUIYQJF-UHFFFAOYSA-N	1	0	261.369	1.881	50	0		CDAARO
O=C(NCCC[NH+]1Cc2ccccc2C1)c1cccc[n+]1[O-]	ZINC000096998571	185150270	/nfs/dbraw/zinc/15/02/70/185150270.db2.gz	HHUZIBZNTFHJGF-UHFFFAOYSA-N	1	0	297.358	1.456	50	0		CDAARO
CN(CCC[NH3+])C(=O)Cc1ccccc1Br	ZINC000097019676	185152795	/nfs/dbraw/zinc/15/27/95/185152795.db2.gz	SDVTYHVVOJMKKI-UHFFFAOYSA-N	1	0	285.185	1.799	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@@H]1NC(=O)C[C@@H](O)c1ccccc1	ZINC000585136738	342215988	/nfs/dbraw/zinc/21/59/88/342215988.db2.gz	QYLBBEAQZSIIMX-ZNEHSRBWSA-N	1	0	276.380	1.613	50	0		CDAARO
C[C@H]([NH2+]C[C@H](c1ccco1)N1CCCC1)c1cnnn1C	ZINC000585134842	342215559	/nfs/dbraw/zinc/21/55/59/342215559.db2.gz	LVTGDIZJMGHJQX-GXTWGEPZSA-N	1	0	289.383	1.896	50	0		CDAARO
CO[C@@H]1C[N@H+](CC2Cc3ccccc3C2)C[C@@H]1OC	ZINC000585085035	539103253	/nfs/dbraw/zinc/10/32/53/539103253.db2.gz	NODUEVVUPXTPKD-IYBDPMFKSA-N	1	0	261.365	1.747	50	0		CDAARO
CNC(=O)C1CC[NH+](CC(=O)N2[C@@H](C)CCC[C@@H]2C)CC1	ZINC000025755258	539133690	/nfs/dbraw/zinc/13/36/90/539133690.db2.gz	UWZLBWPIDFMDJH-STQMWFEESA-N	1	0	295.427	1.234	50	0		CDAARO
COC(=O)[C@@H](O)C(C)(C)[NH2+]Cc1ccc(Cl)c(F)c1	ZINC000252488100	342382194	/nfs/dbraw/zinc/38/21/94/342382194.db2.gz	IJMMTEUQROHKDL-LLVKDONJSA-N	1	0	289.734	1.881	50	0		CDAARO
CN(C(=O)c1c(F)cc(F)cc1F)[C@H]1CC[NH2+]C1	ZINC000086996246	362295534	/nfs/dbraw/zinc/29/55/34/362295534.db2.gz	ISBPNCPRVZLQPV-QMMMGPOBSA-N	1	0	258.243	1.538	50	0		CDAARO
CC(C)[C@H](C(=O)N(C)CC(=O)OC(C)(C)C)[NH+](C)C	ZINC000084622386	362268629	/nfs/dbraw/zinc/26/86/29/362268629.db2.gz	YRIJIMKSRZIHKC-GFCCVEGCSA-N	1	0	272.389	1.373	50	0		CDAARO
O=C(Cc1ccccc1Br)N[C@H]1CCC[NH2+]C1	ZINC000084719075	362270683	/nfs/dbraw/zinc/27/06/83/362270683.db2.gz	XVCCDFTUNSXLAV-NSHDSACASA-N	1	0	297.196	1.860	50	0		CDAARO
NC(=O)C[C@@H]([NH2+]Cc1ccsc1)C1CCOCC1	ZINC000097037633	185510443	/nfs/dbraw/zinc/51/04/43/185510443.db2.gz	RQMJYDDFGMMVPK-GFCCVEGCSA-N	1	0	268.382	1.508	50	0		CDAARO
O=C(CCc1cccc(F)c1)NC[C@@H]1CCC[NH2+]C1	ZINC000129730325	345997865	/nfs/dbraw/zinc/99/78/65/345997865.db2.gz	XUMPQSLVJPYUTN-CYBMUJFWSA-N	1	0	264.344	1.874	50	0		CDAARO
CC[C@@H](CSc1ccccc1)NC(=O)C[NH2+]C	ZINC000193137322	362835911	/nfs/dbraw/zinc/83/59/11/362835911.db2.gz	WGWVEXBLJKBMIQ-NSHDSACASA-N	1	0	252.383	1.893	50	0		CDAARO
CCNc1cc(NCCNC(=O)C(C)(C)C)nc(C)[nH+]1	ZINC000036708069	362836458	/nfs/dbraw/zinc/83/64/58/362836458.db2.gz	PNKGWJPPCMOQLD-UHFFFAOYSA-N	1	0	279.388	1.791	50	0		CDAARO
Cc1cc(C)c(C[NH2+][C@@H](C)CNS(=O)(=O)C2CC2)cn1	ZINC000584885396	349343096	/nfs/dbraw/zinc/34/30/96/349343096.db2.gz	CPFGJZUMYJBWBN-LBPRGKRZSA-N	1	0	297.424	1.258	50	0		CDAARO
COCC1CCN(C(=O)C[C@@H]2C[N@@H+](C(C)C)CCO2)CC1	ZINC000584885557	349343110	/nfs/dbraw/zinc/34/31/10/349343110.db2.gz	CVCHVFPPZQYLQZ-OAHLLOKOSA-N	1	0	298.427	1.371	50	0		CDAARO
O=C(C[C@@H]1CCOC1)N1CC[NH+](CC2CCCC2)CC1	ZINC000584891569	349350114	/nfs/dbraw/zinc/35/01/14/349350114.db2.gz	ZPGKUAOVZPZFRM-HNNXBMFYSA-N	1	0	280.412	1.747	50	0		CDAARO
CC1(C(=O)N2CCC[C@H](C[NH+]3CCCC3)C2)COC1	ZINC000584897770	349359206	/nfs/dbraw/zinc/35/92/06/349359206.db2.gz	HYDDKUGSYVDQJT-CYBMUJFWSA-N	1	0	266.385	1.357	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@@H]1CCC[NH2+]C1	ZINC000104449343	186006340	/nfs/dbraw/zinc/00/63/40/186006340.db2.gz	XOCRVKPDIJCZIB-SNVBAGLBSA-N	1	0	253.371	1.410	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CCC[NH2+][C@H]2C)cc1C	ZINC000091496974	180172564	/nfs/dbraw/zinc/17/25/64/180172564.db2.gz	WDDOTLZLDGROTP-GXTWGEPZSA-N	1	0	282.409	1.722	50	0		CDAARO
CCOc1ccc(N2C(=O)C[C@H]([NH2+]C(C)C)C2=O)cc1	ZINC000105187831	186046534	/nfs/dbraw/zinc/04/65/34/186046534.db2.gz	KYPPQCGLABCQRP-ZDUSSCGKSA-N	1	0	276.336	1.715	50	0		CDAARO
C[NH+](C)C[C@@H]1CN(C(=O)CCC2CCCC2)C[C@@H]1CO	ZINC000091831165	180266227	/nfs/dbraw/zinc/26/62/27/180266227.db2.gz	FIONWPIFHXGECE-HUUCEWRRSA-N	1	0	282.428	1.585	50	0		CDAARO
O=C1CCCN1CC[N@H+]1CCC[C@@](CO)(CC2CC2)C1	ZINC000092002158	180304621	/nfs/dbraw/zinc/30/46/21/180304621.db2.gz	LNFODXMPNPZJEG-MRXNPFEDSA-N	1	0	280.412	1.483	50	0		CDAARO
CNc1nc(C(=O)N2C[C@H]([NH+](C)C)[C@@H](C(C)C)C2)cs1	ZINC000092077917	180318554	/nfs/dbraw/zinc/31/85/54/180318554.db2.gz	IZCQXPCWHVLMHD-PWSUYJOCSA-N	1	0	296.440	1.843	50	0		CDAARO
COc1ccccc1C[NH2+]C[C@H]1CN(C2CC2)CCO1	ZINC000106379647	186112539	/nfs/dbraw/zinc/11/25/39/186112539.db2.gz	QEICMBRVDLRXHG-HNNXBMFYSA-N	1	0	276.380	1.648	50	0		CDAARO
c1ccn2c(c1)nnc2C[NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCC2	ZINC000108176380	186207694	/nfs/dbraw/zinc/20/76/94/186207694.db2.gz	HAJSXVJANHZYEY-KCPJHIHWSA-N	1	0	284.363	1.777	50	0		CDAARO
O=C(NCC[C@H]1CC[NH2+]C1)C1(c2ccccc2)CC1	ZINC000110796282	186325608	/nfs/dbraw/zinc/32/56/08/186325608.db2.gz	DMEQNQUPXVJGDF-CYBMUJFWSA-N	1	0	258.365	1.834	50	0		CDAARO
O=C1NCC[C@@H]1[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000248800079	366149517	/nfs/dbraw/zinc/14/95/17/366149517.db2.gz	ZZTWAMPBWNLWEN-AEGPPILISA-N	1	0	274.364	1.632	50	0		CDAARO
CC[NH+](CC)CCNC(=O)COc1ccccc1	ZINC000001771490	355951652	/nfs/dbraw/zinc/95/16/52/355951652.db2.gz	SWWSQEFOHKXSMO-UHFFFAOYSA-N	1	0	250.342	1.523	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)/C=C\c2c(F)cccc2F)C1	ZINC000255230686	356024198	/nfs/dbraw/zinc/02/41/98/356024198.db2.gz	VNGMZBHCFYBFKI-UMCURTJPSA-N	1	0	266.291	1.785	50	0		CDAARO
CC(C)C[C@@H]1COCCN1C(=O)[C@@H]1CC[C@H]([NH3+])C1	ZINC000299739617	356270315	/nfs/dbraw/zinc/27/03/15/356270315.db2.gz	QPQGNNZSVHXJRS-FRRDWIJNSA-N	1	0	254.374	1.387	50	0		CDAARO
CCc1cc(S(=O)(=O)N2CCN(C)CC2)ccc1OC	ZINC000012420547	356299245	/nfs/dbraw/zinc/29/92/45/356299245.db2.gz	IGCSQPDBIHXKPR-UHFFFAOYSA-N	1	0	298.408	1.194	50	0		CDAARO
CN1CCC([N@@H+]2CCC[C@@H](C(=O)NC3CC3)C2)CC1	ZINC000012574527	356309920	/nfs/dbraw/zinc/30/99/20/356309920.db2.gz	DYTPRJZEWBJYCO-GFCCVEGCSA-N	1	0	265.401	1.071	50	0		CDAARO
CCC[NH+]1CCN(C(=O)COc2ccccc2)CC1	ZINC000013324201	356343633	/nfs/dbraw/zinc/34/36/33/356343633.db2.gz	RBJYCWHJHROJGE-UHFFFAOYSA-N	1	0	262.353	1.620	50	0		CDAARO
OCCOc1ccc(C[NH2+]C[C@@H]2CCCO2)cc1	ZINC000013730999	356354907	/nfs/dbraw/zinc/35/49/07/356354907.db2.gz	XUNRLURNFSLDIN-AWEZNQCLSA-N	1	0	251.326	1.326	50	0		CDAARO
O=C(NCc1ccco1)[C@@H]1Cc2ccccc2C[NH2+]1	ZINC000034754834	356390486	/nfs/dbraw/zinc/39/04/86/356390486.db2.gz	XIJYOFKTTSJBSQ-AWEZNQCLSA-N	1	0	256.305	1.610	50	0		CDAARO
C[NH2+]CC[C@@H]1CCC(=O)N1Cc1cc(OC)ccc1OC	ZINC000014883133	356399600	/nfs/dbraw/zinc/39/96/00/356399600.db2.gz	HFOMXCVFKOCNKR-ZDUSSCGKSA-N	1	0	292.379	1.804	50	0		CDAARO
O[C@@H](CN1CCOCC1)C[N@@H+]1CCC[C@@H]1c1ccccc1	ZINC000032889930	356412467	/nfs/dbraw/zinc/41/24/67/356412467.db2.gz	JYIQSMZPACXSFW-DLBZAZTESA-N	1	0	290.407	1.517	50	0		CDAARO
Cc1ccc(OCCOCC[N@H+](C)CCO)cc1C	ZINC000015659045	356421819	/nfs/dbraw/zinc/42/18/19/356421819.db2.gz	KZWQWZOKRIQCBN-UHFFFAOYSA-N	1	0	267.369	1.623	50	0		CDAARO
CC(C)[NH+]1CCN(C(=O)COc2ccccc2)CC1	ZINC000019447987	356485616	/nfs/dbraw/zinc/48/56/16/356485616.db2.gz	QGRLVICGEKMZRD-UHFFFAOYSA-N	1	0	262.353	1.618	50	0		CDAARO
CCOc1ccc([C@H](C[NH3+])N2CCOCC2)cc1	ZINC000019201079	356476559	/nfs/dbraw/zinc/47/65/59/356476559.db2.gz	DYMOSECQTNSXEE-AWEZNQCLSA-N	1	0	250.342	1.417	50	0		CDAARO
Cc1cc(Cl)ccc1OC[C@H](O)CN1CC[NH+](C)CC1	ZINC000019781591	356503059	/nfs/dbraw/zinc/50/30/59/356503059.db2.gz	GJMGVZHQCMTAAE-CQSZACIVSA-N	1	0	298.814	1.636	50	0		CDAARO
COc1ccc(/C=C/C(=O)N2CC[C@]3(CC[NH2+]C3)C2)cc1	ZINC000033426354	356802897	/nfs/dbraw/zinc/80/28/97/356802897.db2.gz	LRTCUQOTDFGGLP-PFWMLDTASA-N	1	0	286.375	1.920	50	0		CDAARO
Clc1ccc2nc(CN3CC[NH2+]CC3)cn2c1	ZINC000036946271	356891074	/nfs/dbraw/zinc/89/10/74/356891074.db2.gz	DRBMDERIBMPMQG-UHFFFAOYSA-N	1	0	250.733	1.393	50	0		CDAARO
Cc1noc(-c2cccnc2N2CCC([NH3+])CC2)n1	ZINC000045948471	357131626	/nfs/dbraw/zinc/13/16/26/357131626.db2.gz	UIKHUYWCSVGEOA-UHFFFAOYSA-N	1	0	259.313	1.368	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)Cc1cccc(Cl)c1	ZINC000054369455	357318939	/nfs/dbraw/zinc/31/89/39/357318939.db2.gz	SKRBQEQCQQJECC-JTQLQIEISA-N	1	0	252.745	1.703	50	0		CDAARO
Cc1ccccc1CCNC(=O)[C@@H](C)[N@@H+]1CC[C@H](CO)C1	ZINC000095430701	357445595	/nfs/dbraw/zinc/44/55/95/357445595.db2.gz	YNWBSXYNXQEFLQ-CABCVRRESA-N	1	0	290.407	1.356	50	0		CDAARO
COC[C@H](C)[NH+]1CCN(c2cccc(F)n2)CC1	ZINC000096429403	357471395	/nfs/dbraw/zinc/47/13/95/357471395.db2.gz	SMBWSRWXJSPYLV-NSHDSACASA-N	1	0	253.321	1.378	50	0		CDAARO
CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)NC[C@H]1CCCCO1	ZINC000096436228	357472222	/nfs/dbraw/zinc/47/22/22/357472222.db2.gz	CEJJGMRBYNDVFF-CABCVRRESA-N	1	0	298.427	1.465	50	0		CDAARO
C[C@H]1CC(C)(C)C[C@@](CO)([NH2+]CCN2C(=O)CCC2=O)C1	ZINC000095432078	357514440	/nfs/dbraw/zinc/51/44/40/357514440.db2.gz	JVZHJPZAYTUROP-LRDDRELGSA-N	1	0	296.411	1.302	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCC(C)(C)[NH3+])c2cccnc12	ZINC000095432135	357516102	/nfs/dbraw/zinc/51/61/02/357516102.db2.gz	AACICWOTXFTUQS-UHFFFAOYSA-N	1	0	293.392	1.559	50	0		CDAARO
CCOC(=O)C1=C(N)CN(Cc2ccccc2)CC1	ZINC000066348999	357563321	/nfs/dbraw/zinc/56/33/21/357563321.db2.gz	LXFAPROJUMIFNK-UHFFFAOYSA-N	1	0	260.337	1.668	50	0		CDAARO
C[NH+]1CCC(CNC(=O)C(=O)Nc2cccc(F)c2)CC1	ZINC000022999038	357581749	/nfs/dbraw/zinc/58/17/49/357581749.db2.gz	LKOJRCJTSAJNED-UHFFFAOYSA-N	1	0	293.342	1.222	50	0		CDAARO
CCn1cnnc1CC[NH2+]C1CSCCSC1	ZINC000067541378	357611703	/nfs/dbraw/zinc/61/17/03/357611703.db2.gz	AGWDVPZJZNPVTM-UHFFFAOYSA-N	1	0	272.443	1.279	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@@H]2SCCc3sccc32)CC[NH2+]1	ZINC000188382973	357645612	/nfs/dbraw/zinc/64/56/12/357645612.db2.gz	CZVQNSCAZAMBRW-BXKDBHETSA-N	1	0	282.434	1.899	50	0		CDAARO
CN(C)C(=O)c1ccc(N2CC[C@@H]3CC[C@H](C2)[N@@H+]3C)nc1	ZINC000067852038	357632048	/nfs/dbraw/zinc/63/20/48/357632048.db2.gz	ZWRFGHNLLBYUQL-UONOGXRCSA-N	1	0	288.395	1.456	50	0		CDAARO
Cc1nn(C)cc1CN1CC[N@@H+](C)C[C@@H]1C(C)C	ZINC000097139289	357991658	/nfs/dbraw/zinc/99/16/58/357991658.db2.gz	FCYYNVAHLGKSPP-CQSZACIVSA-N	1	0	250.390	1.501	50	0		CDAARO
CC(C)C[C@H](C[NH+](C)C)NS(=O)(=O)CCOC(C)C	ZINC000097166158	358005846	/nfs/dbraw/zinc/00/58/46/358005846.db2.gz	QSDQEYKDYUMLMW-CYBMUJFWSA-N	1	0	294.461	1.307	50	0		CDAARO
CC(C)C[C@@H](C[NH+](C)C)NS(=O)(=O)CCCF	ZINC000097166155	358005883	/nfs/dbraw/zinc/00/58/83/358005883.db2.gz	QAFNBIKXEOQRLQ-NSHDSACASA-N	1	0	268.398	1.242	50	0		CDAARO
OC[C@H](Cc1ccc(O)cc1)[NH2+][C@H]1CCSC1	ZINC000190503610	358077420	/nfs/dbraw/zinc/07/74/20/358077420.db2.gz	OQNDNUHTSOGSRP-RYUDHWBXSA-N	1	0	253.367	1.391	50	0		CDAARO
COC1(CNC(=O)N[C@H]2CC[C@H]([NH+](C)C)C2)CCC1	ZINC000097055293	358134838	/nfs/dbraw/zinc/13/48/38/358134838.db2.gz	HZIBXRDLVHMJDC-RYUDHWBXSA-N	1	0	269.389	1.337	50	0		CDAARO
CCS(=O)(=O)N1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1	ZINC000004746102	358170851	/nfs/dbraw/zinc/17/08/51/358170851.db2.gz	OBHKVFLZCBWBCG-QWHCGFSZSA-N	1	0	274.430	1.532	50	0		CDAARO
CC(C)(C)c1ccc(S(=O)(=O)NCCC[NH3+])s1	ZINC000195544493	358559864	/nfs/dbraw/zinc/55/98/64/358559864.db2.gz	YUJVTQDHRASOIM-UHFFFAOYSA-N	1	0	276.427	1.673	50	0		CDAARO
C[C@@H](Cc1ccccc1)C[N@@H+]1CCO[C@@H](C(N)=O)C1	ZINC000195569284	358566373	/nfs/dbraw/zinc/56/63/73/358566373.db2.gz	AWVJPKFHLGAVTO-GXTWGEPZSA-N	1	0	262.353	1.051	50	0		CDAARO
Cc1ccsc1C[NH2+]CCCN1CCOCC1	ZINC000095098708	358678463	/nfs/dbraw/zinc/67/84/63/358678463.db2.gz	HWBHEQHKHWRRKN-UHFFFAOYSA-N	1	0	254.399	1.868	50	0		CDAARO
C[C@@H](NC(=O)CCC[NH+]1CCCCC1)c1nnc(N)s1	ZINC000095363553	358685782	/nfs/dbraw/zinc/68/57/82/358685782.db2.gz	FINDFICWXVRBFN-SNVBAGLBSA-N	1	0	297.428	1.564	50	0		CDAARO
CCCn1cc(CNC(=O)[C@H]2CCCCC[N@@H+]2C)cn1	ZINC000095379411	358689601	/nfs/dbraw/zinc/68/96/01/358689601.db2.gz	AJCNKGLWTKSBRB-CQSZACIVSA-N	1	0	278.400	1.784	50	0		CDAARO
Cc1nn(C)c(C)c1NC(=O)NCC[NH+]1CCCC1	ZINC000095500858	358696052	/nfs/dbraw/zinc/69/60/52/358696052.db2.gz	DEUZSNYYJJNIPS-UHFFFAOYSA-N	1	0	265.361	1.254	50	0		CDAARO
COCCc1noc([C@H]2CCC[N@@H+](C3CCOCC3)C2)n1	ZINC000096153327	358710088	/nfs/dbraw/zinc/71/00/88/358710088.db2.gz	MTYINVDYTKWKKU-LBPRGKRZSA-N	1	0	295.383	1.617	50	0		CDAARO
Cc1c(Cl)cccc1CNC(=O)C1(O)CC[NH+](C)CC1	ZINC000097713621	358794793	/nfs/dbraw/zinc/79/47/93/358794793.db2.gz	NQODXUFXAJLVOE-UHFFFAOYSA-N	1	0	296.798	1.721	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1C(=O)NCCc1ccco1	ZINC000097766679	358797368	/nfs/dbraw/zinc/79/73/68/358797368.db2.gz	WUJYVXNXPCXHNO-ZDUSSCGKSA-N	1	0	250.342	1.813	50	0		CDAARO
CCOc1ccc(CN2C[C@H](O)[C@@H]([NH+]3CCCC3)C2)cn1	ZINC000215170272	358877177	/nfs/dbraw/zinc/87/71/77/358877177.db2.gz	MTMCUZULEBTALI-GJZGRUSLSA-N	1	0	291.395	1.121	50	0		CDAARO
COc1ccc(C[N@H+](C)C[C@@H]2COCCO2)cc1F	ZINC000215420981	358888318	/nfs/dbraw/zinc/88/83/18/358888318.db2.gz	OSYLWSRRVVDBOL-GFCCVEGCSA-N	1	0	269.316	1.682	50	0		CDAARO
C[N@H+](CCO)C[C@H](O)COc1c(Cl)cccc1Cl	ZINC000014238204	358964367	/nfs/dbraw/zinc/96/43/67/358964367.db2.gz	VCTDOUSPQVPEJQ-VIFPVBQESA-N	1	0	294.178	1.657	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(CC[NH2+]CC2)[C@H](CO)C1	ZINC000216643738	358955180	/nfs/dbraw/zinc/95/51/80/358955180.db2.gz	TVWJNPSVCJUULZ-LBPRGKRZSA-N	1	0	284.400	1.606	50	0		CDAARO
NC(=O)COC[C@@H]1C[N@@H+](C2CCC2)C[C@H]1c1ccccn1	ZINC000257176712	359077059	/nfs/dbraw/zinc/07/70/59/359077059.db2.gz	UNBPEWSBZLQNCB-GXTWGEPZSA-N	1	0	289.379	1.151	50	0		CDAARO
Cc1c[nH]c(C(=O)NCC[C@@H]2CCC[N@@H+](C)C2)n1	ZINC000223722253	359449998	/nfs/dbraw/zinc/44/99/98/359449998.db2.gz	DOFCXHRYDSPAEJ-NSHDSACASA-N	1	0	250.346	1.180	50	0		CDAARO
CC(C)C[NH+]1CCC(C(=O)NC[C@H]2CCCO2)CC1	ZINC000000317520	359497976	/nfs/dbraw/zinc/49/79/76/359497976.db2.gz	BMKRXSMMNJGRCG-CQSZACIVSA-N	1	0	268.401	1.650	50	0		CDAARO
Cc1ccc(NC(=O)CSc2nc(N)cc(N)[nH+]2)cc1	ZINC000000351579	359569758	/nfs/dbraw/zinc/56/97/58/359569758.db2.gz	SAPHUPBUVMLFAA-UHFFFAOYSA-N	1	0	289.364	1.680	50	0		CDAARO
CCOC[C@@H]1CCN(C(=O)C[N@@H+]2CC[C@@H](C)C2)C1	ZINC000408517902	359902686	/nfs/dbraw/zinc/90/26/86/359902686.db2.gz	OOVDAYPLLGRWBJ-CHWSQXEVSA-N	1	0	254.374	1.213	50	0		CDAARO
COc1ccccc1C[NH2+]C1(CCO)CCOCC1	ZINC000089473745	359929097	/nfs/dbraw/zinc/92/90/97/359929097.db2.gz	WIWZBTBBWFZAQA-UHFFFAOYSA-N	1	0	265.353	1.716	50	0		CDAARO
O=C(C1CC1)N1CCC2(C[N@H+](C3CCC3)C[C@H]2CO)CC1	ZINC000409419525	360227542	/nfs/dbraw/zinc/22/75/42/360227542.db2.gz	QMLGXQSCKSZLDF-AWEZNQCLSA-N	1	0	292.423	1.482	50	0		CDAARO
COCCOc1ccc(C(=O)N2CCC[C@@H]([NH3+])C2)cc1	ZINC000178325414	189107457	/nfs/dbraw/zinc/10/74/57/189107457.db2.gz	BJRPFPAHVVLNGX-CYBMUJFWSA-N	1	0	278.352	1.275	50	0		CDAARO
CCn1nc(C)nc1-c1ccc(N2CC[NH2+]CC2)cc1	ZINC000426535377	360682502	/nfs/dbraw/zinc/68/25/02/360682502.db2.gz	AVWWJOOEXXVXMA-UHFFFAOYSA-N	1	0	271.368	1.683	50	0		CDAARO
Cc1nonc1CSc1nnc(C[NH3+])n1CC(C)C	ZINC000426440295	360670652	/nfs/dbraw/zinc/67/06/52/360670652.db2.gz	PANSFTQIVLAFBM-UHFFFAOYSA-N	1	0	282.373	1.377	50	0		CDAARO
Cc1cc(C(=O)N2CC[C@@H](C[NH3+])C2)nn1-c1ccccc1	ZINC000178549847	189126149	/nfs/dbraw/zinc/12/61/49/189126149.db2.gz	ZTYBITPGYUGUQC-ZDUSSCGKSA-N	1	0	284.363	1.602	50	0		CDAARO
CCc1c(C(=O)N(C)[C@@H]2CC[NH2+]C2)cnn1-c1ccccn1	ZINC000179111134	189170663	/nfs/dbraw/zinc/17/06/63/189170663.db2.gz	RDJDPJLLZFNGKA-GFCCVEGCSA-N	1	0	299.378	1.264	50	0		CDAARO
C[C@H](C[NH+]1CCCCC1)NS(=O)(=O)c1cccnc1	ZINC000189130617	361201664	/nfs/dbraw/zinc/20/16/64/361201664.db2.gz	IDHJFFNPNVMQNB-GFCCVEGCSA-N	1	0	283.397	1.234	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N1CCC(C[NH3+])CC1	ZINC000036296649	361461457	/nfs/dbraw/zinc/46/14/57/361461457.db2.gz	MSOIXAFLTRUXTL-UHFFFAOYSA-N	1	0	286.372	1.494	50	0		CDAARO
COc1ccc(S(=O)(=O)N2CCC[C@@H]([NH3+])C2)cc1C	ZINC000036297013	361462361	/nfs/dbraw/zinc/46/23/61/361462361.db2.gz	JDMIWOSJVTZZRN-LLVKDONJSA-N	1	0	284.381	1.115	50	0		CDAARO
CC(C)(O)C(=O)NC1CC[NH+](CC2CCCC2)CC1	ZINC000185898141	189425391	/nfs/dbraw/zinc/42/53/91/189425391.db2.gz	LDSOVHMCGWMSTI-UHFFFAOYSA-N	1	0	268.401	1.528	50	0		CDAARO
O=C(c1ccc(Cl)nc1)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000195543003	189677965	/nfs/dbraw/zinc/67/79/65/189677965.db2.gz	YKLNJLGWRPQOOT-MNOVXSKESA-N	1	0	265.744	1.702	50	0		CDAARO
C=C1C(C(=O)N(CC)CC)[N+](=O)c2ccccc2N1O	ZINC000526055738	365472456	/nfs/dbraw/zinc/47/24/56/365472456.db2.gz	AOCXLKKFWPTMFC-UHFFFAOYSA-N	1	0	276.316	1.584	50	0		CDAARO
Cc1ccc(-n2nnnc2N2CC[C@@H]([NH+]3CCCC3)C2)cc1	ZINC000089643100	366895923	/nfs/dbraw/zinc/89/59/23/366895923.db2.gz	OLOSJWZNKIOACF-OAHLLOKOSA-N	1	0	298.394	1.645	50	0		CDAARO
Cc1cccc(CNC(=O)C[N@@H+](CCO)C(C)C)c1	ZINC000089669506	366907199	/nfs/dbraw/zinc/90/71/99/366907199.db2.gz	DXEYCGKOJMEFJP-UHFFFAOYSA-N	1	0	264.369	1.314	50	0		CDAARO
Cc1cnn(CC[NH2+]Cc2cccc3nccn32)c1	ZINC000089702508	366915530	/nfs/dbraw/zinc/91/55/30/366915530.db2.gz	QYPNPOVDRDIFTH-UHFFFAOYSA-N	1	0	255.325	1.629	50	0		CDAARO
C[C@@H]1C[NH+](CCCCNC(=O)C2CC=CC2)C[C@@H](C)O1	ZINC000089930312	366970576	/nfs/dbraw/zinc/97/05/76/366970576.db2.gz	VWWRJRGKUMGLKW-ZIAGYGMSSA-N	1	0	280.412	1.958	50	0		CDAARO
C[C@H](CC(=O)N(C)C)[NH2+]C[C@@H](O)c1c(F)cccc1F	ZINC000090078231	367011824	/nfs/dbraw/zinc/01/18/24/367011824.db2.gz	ZIANQVNWJLCQEV-BXKDBHETSA-N	1	0	286.322	1.455	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]Cc2cccnc2)CC1	ZINC000000757555	367056788	/nfs/dbraw/zinc/05/67/88/367056788.db2.gz	ZEGIJMMFIREOAN-UHFFFAOYSA-N	1	0	263.341	1.792	50	0		CDAARO
Cc1ccc(F)cc1C(=O)N[C@H]1CC[NH2+]C[C@@H]1C	ZINC000094345416	367468338	/nfs/dbraw/zinc/46/83/38/367468338.db2.gz	ZBCSOGYAIKSGKV-GWCFXTLKSA-N	1	0	250.317	1.862	50	0		CDAARO
COC(=O)[C@@H]1CC[N@H+](C[C@@H](O)C(F)(F)F)C[C@@H]1C	ZINC000249088688	284059073	/nfs/dbraw/zinc/05/90/73/284059073.db2.gz	NOFMBKAGFXNTPR-DJLDLDEBSA-N	1	0	269.263	1.041	50	0		CDAARO
Clc1ccc(-c2nncnc2N2CC[NH2+]CC2)cc1	ZINC000006221889	371097240	/nfs/dbraw/zinc/09/72/40/371097240.db2.gz	CNQWMUXMKGLQJH-UHFFFAOYSA-N	1	0	275.743	1.602	50	0		CDAARO
O=C(Nc1ccc(Cl)c(F)c1)N[C@@H]1CC[NH2+]C[C@H]1O	ZINC000299773401	372751989	/nfs/dbraw/zinc/75/19/89/372751989.db2.gz	ACHYCGJPTCTBAM-GHMZBOCLSA-N	1	0	287.722	1.323	50	0		CDAARO
CO[C@]12CC[N@H+](Cc3[nH]cnc3C)[C@H]1C[C@H](O)CC2	ZINC000299782615	372760143	/nfs/dbraw/zinc/76/01/43/372760143.db2.gz	FUUQGTKQOPOSOQ-KWCYVHTRSA-N	1	0	265.357	1.222	50	0		CDAARO
C[NH+](C)CC[C@@H]1CCCN(C(=O)CCc2cn[nH]c2)C1	ZINC000299784221	372760491	/nfs/dbraw/zinc/76/04/91/372760491.db2.gz	LLNJXQBBFMGMNR-ZDUSSCGKSA-N	1	0	278.400	1.533	50	0		CDAARO
Cc1nccn1CCC(=O)NCCc1nc(C(C)C)no1	ZINC000299801396	372771471	/nfs/dbraw/zinc/77/14/71/372771471.db2.gz	XYAYOFJFCJZOKS-UHFFFAOYSA-N	1	0	291.355	1.447	50	0		CDAARO
C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)C[C@H]([NH3+])c1ccccc1	ZINC000037821553	373524449	/nfs/dbraw/zinc/52/44/49/373524449.db2.gz	NNHAUDROYHJQIB-XBFCOCLRSA-N	1	0	289.379	1.189	50	0		CDAARO
CC(C)N1CC[C@H]([NH2+][C@@H]2[C@H]3CCO[C@H]3C2(C)C)C1	ZINC000253371004	373679895	/nfs/dbraw/zinc/67/98/95/373679895.db2.gz	ZIRKEUWASJAMDP-REWJHTLYSA-N	1	0	252.402	1.872	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)c2ccnc(OCC3CC3)c2)CC1	ZINC000253399630	373685985	/nfs/dbraw/zinc/68/59/85/373685985.db2.gz	JSPKRBLCHSVWMV-UHFFFAOYSA-N	1	0	289.379	1.648	50	0		CDAARO
C[N@@H+]1CCC[C@H]1CNC(=O)[C@H](c1ccccc1)n1cccn1	ZINC000106178383	373752435	/nfs/dbraw/zinc/75/24/35/373752435.db2.gz	LMVNSBYFCOIXAQ-HOTGVXAUSA-N	1	0	298.390	1.683	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CCCNc1ccc2nnnn2n1	ZINC000013002073	374087576	/nfs/dbraw/zinc/08/75/76/374087576.db2.gz	SEEQCYRCWVZUAE-NSHDSACASA-N	1	0	275.360	1.196	50	0		CDAARO
Cc1ccccc1CC(=O)N1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1	ZINC000248666923	374248757	/nfs/dbraw/zinc/24/87/57/374248757.db2.gz	WVMZCRDWAHFHFL-SOUVJXGZSA-N	1	0	258.365	1.733	50	0		CDAARO
CNC(=O)C[C@H]1CC[N@@H+](C2CSCCSC2)C1	ZINC000670457267	483036904	/nfs/dbraw/zinc/03/69/04/483036904.db2.gz	VHGQVMISAKCSHZ-SNVBAGLBSA-N	1	0	274.455	1.293	50	0		CDAARO
c1cnn(CCC[NH+]2CCC(Oc3ncccn3)CC2)c1	ZINC000252500853	189978340	/nfs/dbraw/zinc/97/83/40/189978340.db2.gz	TWOBLLYOFIDODW-UHFFFAOYSA-N	1	0	287.367	1.607	50	0		CDAARO
CC(C)[N@H+](CCNC(=O)N1CCN(C2CC2)CC1)C1CC1	ZINC000095351226	374887806	/nfs/dbraw/zinc/88/78/06/374887806.db2.gz	ZFCLUROCQMFWKL-UHFFFAOYSA-N	1	0	294.443	1.349	50	0		CDAARO
CCCc1nnc(N2CCC([N@@H+]3CCC[C@H](O)C3)CC2)o1	ZINC000095384207	374897942	/nfs/dbraw/zinc/89/79/42/374897942.db2.gz	OYVOHQCXEAZSKX-ZDUSSCGKSA-N	1	0	294.399	1.448	50	0		CDAARO
C[C@@H]1CCC[C@@H](C)C1[NH2+]CCN1C(=O)NC(C)(C)C1=O	ZINC000095462562	374959328	/nfs/dbraw/zinc/95/93/28/374959328.db2.gz	HNDQKGZCBDRNMJ-GHMZBOCLSA-N	1	0	281.400	1.731	50	0		CDAARO
CCCCO[C@@H]1C[C@H]([NH2+][C@@H]2CCN(C)C2=O)C1(C)C	ZINC000095407256	374909753	/nfs/dbraw/zinc/90/97/53/374909753.db2.gz	PYFLVOMQWNGHTF-FRRDWIJNSA-N	1	0	268.401	1.791	50	0		CDAARO
NC(=O)[C@H](c1ccccc1)[NH+]1CCC(c2cn[nH]c2)CC1	ZINC000097202712	375156734	/nfs/dbraw/zinc/15/67/34/375156734.db2.gz	LQFISMSZDKUQPR-HNNXBMFYSA-N	1	0	284.363	1.816	50	0		CDAARO
C[NH2+]C1CCN(C(=O)c2ccc(F)c(COC)c2)CC1	ZINC000299740412	375202433	/nfs/dbraw/zinc/20/24/33/375202433.db2.gz	ZKEGIVXWRFSACH-UHFFFAOYSA-N	1	0	280.343	1.796	50	0		CDAARO
CC[C@@H](CO)[NH2+]CC(=O)Nc1ccc(C)cc1F	ZINC000003338949	375653956	/nfs/dbraw/zinc/65/39/56/375653956.db2.gz	VAJFRNOAXMGLQV-JTQLQIEISA-N	1	0	254.305	1.433	50	0		CDAARO
C[NH+](C)CC1(CO)CCN(C(=O)[C@@H]2CC23CCC3)CC1	ZINC000670468334	483059285	/nfs/dbraw/zinc/05/92/85/483059285.db2.gz	SBOSQKQLHXUHKK-ZDUSSCGKSA-N	1	0	280.412	1.339	50	0		CDAARO
COCC1(C(=O)NCC2([NH+](C)C)CCCC2)CCC1	ZINC000339847295	375821961	/nfs/dbraw/zinc/82/19/61/375821961.db2.gz	OLURRLBLIMBALT-UHFFFAOYSA-N	1	0	268.401	1.794	50	0		CDAARO
CCOc1c(Cl)cc(C(=O)N2CC[NH2+]CC2)cc1OC	ZINC000032073509	375876487	/nfs/dbraw/zinc/87/64/87/375876487.db2.gz	JKWYWFNJRDTAAR-UHFFFAOYSA-N	1	0	298.770	1.793	50	0		CDAARO
COc1cccc(CN2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)c1	ZINC000241701804	376018448	/nfs/dbraw/zinc/01/84/48/376018448.db2.gz	QLGQAIIUCDWDJE-KBPBESRZSA-N	1	0	278.396	1.582	50	0		CDAARO
CCOc1ccc(C[N@@H+]2CC[C@H](C)[C@H]2CO)nc1	ZINC000241466153	376019557	/nfs/dbraw/zinc/01/95/57/376019557.db2.gz	NVDVKJWJAUQYII-SMDDNHRTSA-N	1	0	250.342	1.683	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCO[C@@H](c2ccccc2C)C1	ZINC000129903228	377475812	/nfs/dbraw/zinc/47/58/12/377475812.db2.gz	PVKPNXUXSPULAV-ZIAGYGMSSA-N	1	0	262.353	1.632	50	0		CDAARO
CN(C)C(=O)[C@@H]1CCCN1CC(=O)Nc1cccc(F)c1	ZINC000012744335	377999143	/nfs/dbraw/zinc/99/91/43/377999143.db2.gz	UCCSGQKKUVXAOS-ZDUSSCGKSA-N	1	0	293.342	1.317	50	0		CDAARO
Nc1nnc(CC[NH2+]C2CSCCSC2)s1	ZINC000067432998	295375547	/nfs/dbraw/zinc/37/55/47/295375547.db2.gz	ZEVMVSJZJRQWNM-UHFFFAOYSA-N	1	0	276.456	1.101	50	0		CDAARO
CC(=O)N1CCC([NH2+][C@H](C(C)C)[C@H](CO)C(C)C)CC1	ZINC000449513614	250885078	/nfs/dbraw/zinc/88/50/78/250885078.db2.gz	TXVPNJBCEVWDGW-HZPDHXFCSA-N	1	0	284.444	1.876	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)/C=C\c2cccnc2)C1	ZINC000493753854	253547132	/nfs/dbraw/zinc/54/71/32/253547132.db2.gz	LCUOTMBKUKPJBR-LMVHVUTASA-N	1	0	259.353	1.553	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CCc2c(Cl)cccc2C1	ZINC000096417901	256762942	/nfs/dbraw/zinc/76/29/42/256762942.db2.gz	HVKHHZHSASSUSD-LLVKDONJSA-N	1	0	255.745	1.705	50	0		CDAARO
COc1ccc(CC[NH2+]Cc2cnc(N)nc2)cc1OC	ZINC000046085502	390440281	/nfs/dbraw/zinc/44/02/81/390440281.db2.gz	HICNAYHVKUOHPF-UHFFFAOYSA-N	1	0	288.351	1.408	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cc(C)n(-c3ccccc3)n2)C1	ZINC000178989540	390927326	/nfs/dbraw/zinc/92/73/26/390927326.db2.gz	NYDDPJCQQWHFAG-CQSZACIVSA-N	1	0	298.390	1.862	50	0		CDAARO
CSCC[N@H+](C)Cc1cccc(OCC(N)=O)c1	ZINC000215576879	390995308	/nfs/dbraw/zinc/99/53/08/390995308.db2.gz	DNQYEGQOYZNOAY-UHFFFAOYSA-N	1	0	268.382	1.346	50	0		CDAARO
[NH3+]CCCNC(=O)NCc1ccccc1C(F)(F)F	ZINC000258006685	391043883	/nfs/dbraw/zinc/04/38/83/391043883.db2.gz	FCFQNBCNKZPDEL-UHFFFAOYSA-N	1	0	275.274	1.853	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2Cc3ccccc3C[NH2+]2)C[C@H](C)O1	ZINC000019474681	391321142	/nfs/dbraw/zinc/32/11/42/391321142.db2.gz	OJBMKRPUCMZCIY-TYNCELHUSA-N	1	0	274.364	1.337	50	0		CDAARO
CC[C@@H](C(=O)[O-])[N@@H+]1CC[C@@H](CNc2cc(C)cc[nH+]2)C1	ZINC000364253808	391326258	/nfs/dbraw/zinc/32/62/58/391326258.db2.gz	GMWJYEIZJQRLCX-STQMWFEESA-N	1	0	277.368	1.987	50	0		CDAARO
CC(C)[C@H](O)C[N@@H+]1CC[C@@H]2[C@H](CCC(=O)N2C2CC2)C1	ZINC000366596189	391405148	/nfs/dbraw/zinc/40/51/48/391405148.db2.gz	JQFASDZYGMLPOI-BPLDGKMQSA-N	1	0	280.412	1.479	50	0		CDAARO
CCC(=O)N1c2ccccc2C[C@@H]1C(=O)NCC[NH+](C)C	ZINC000015773503	391656194	/nfs/dbraw/zinc/65/61/94/391656194.db2.gz	JLSTVOCSWHPFLU-CQSZACIVSA-N	1	0	289.379	1.032	50	0		CDAARO
C[C@H]1OCC[C@H]1[N@H+](CCO)Cc1cnn(C(C)(C)C)c1	ZINC000449675542	392854651	/nfs/dbraw/zinc/85/46/51/392854651.db2.gz	AKTLJBAADQPGJA-TZMCWYRMSA-N	1	0	281.400	1.610	50	0		CDAARO
COCCNC(=O)[C@@H]1CC[C@@H](C)[N@H+](Cc2cccnc2)C1	ZINC000096403443	393178444	/nfs/dbraw/zinc/17/84/44/393178444.db2.gz	HRAOFMBZFWIFNZ-UKRRQHHQSA-N	1	0	291.395	1.445	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@H]1C(=O)NCCOc1cccnc1	ZINC000096421716	393185423	/nfs/dbraw/zinc/18/54/23/393185423.db2.gz	TZKIVAHBPWBTCD-HNNXBMFYSA-N	1	0	291.395	1.840	50	0		CDAARO
C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NC(=O)NC1CC1	ZINC000195617209	393315728	/nfs/dbraw/zinc/31/57/28/393315728.db2.gz	VRFZWMGHVPDFPF-UTUOFQBUSA-N	1	0	253.390	1.814	50	0		CDAARO
Cc1[nH+]c(N)nc(N2CCC(c3ccnc(N)n3)CC2)c1C	ZINC000091476931	135070938	/nfs/dbraw/zinc/07/09/38/135070938.db2.gz	YTCXLVGIJIRUKY-UHFFFAOYSA-N	1	0	299.382	1.432	50	0		CDAARO
[NH3+][C@@H]1CCC[C@@H](CNS(=O)(=O)CCC2CCC2)C1	ZINC000261590482	140357502	/nfs/dbraw/zinc/35/75/02/140357502.db2.gz	XBYLMXXFOKGFKS-CHWSQXEVSA-N	1	0	274.430	1.614	50	0		CDAARO
Cc1ccc(C(=O)N2CCOC23CC[NH+](C)CC3)cc1	ZINC000028292581	292057573	/nfs/dbraw/zinc/05/75/73/292057573.db2.gz	AENCXTHHQUBMHF-UHFFFAOYSA-N	1	0	274.364	1.889	50	0		CDAARO
CN(C)c1nccc(NCc2ccc3c(c2)C[NH2+]C3)n1	ZINC000097829784	147126044	/nfs/dbraw/zinc/12/60/44/147126044.db2.gz	VNVRVSSARGMZOE-UHFFFAOYSA-N	1	0	269.352	1.758	50	0		CDAARO
C([NH2+]C1CCOCC1)C1(N2CCOCC2)CCCCC1	ZINC000363264236	159316493	/nfs/dbraw/zinc/31/64/93/159316493.db2.gz	KFHUPHCKUULIKJ-UHFFFAOYSA-N	1	0	282.428	1.790	50	0		CDAARO
Fc1cccc(C[NH2+]CCCN2CCOCC2)c1	ZINC000002510434	169797427	/nfs/dbraw/zinc/79/74/27/169797427.db2.gz	ZSYQXTSWVRPLFN-UHFFFAOYSA-N	1	0	252.333	1.638	50	0		CDAARO
COc1cccc(OC[C@H](O)C[NH+]2CCCC2)c1	ZINC000005092323	170066031	/nfs/dbraw/zinc/06/60/31/170066031.db2.gz	PWXXQKICNMWMQW-GFCCVEGCSA-N	1	0	251.326	1.531	50	0		CDAARO
Cn1c2ccc(C[NH2+]C[C@@H]3CCCO3)cc2n(C)c1=O	ZINC000006678552	170225836	/nfs/dbraw/zinc/22/58/36/170225836.db2.gz	JKZACAYIDAUPLN-LBPRGKRZSA-N	1	0	275.352	1.146	50	0		CDAARO
C[C@@H]1CCC[N@H+](CC(=O)NCc2ccc3c(c2)OCO3)C1	ZINC000010030152	170396138	/nfs/dbraw/zinc/39/61/38/170396138.db2.gz	OQXRYIFUPQIUCZ-GFCCVEGCSA-N	1	0	290.363	1.763	50	0		CDAARO
OCC[C@@H]1C[NH2+]CCN1Cc1ccc(F)c(F)c1	ZINC000019367997	170777721	/nfs/dbraw/zinc/77/77/21/170777721.db2.gz	GUXIIDOQCZJWFE-LLVKDONJSA-N	1	0	256.296	1.121	50	0		CDAARO
COc1ccc(S(=O)(=O)N2CCC[C@H]2C[NH3+])c(C)c1	ZINC000020182664	171045940	/nfs/dbraw/zinc/04/59/40/171045940.db2.gz	KZNMUZOYFZLOLP-NSHDSACASA-N	1	0	284.381	1.115	50	0		CDAARO
c1csc(-c2noc(CN3CC[NH2+]CC3)n2)c1	ZINC000020268699	171125144	/nfs/dbraw/zinc/12/51/44/171125144.db2.gz	GCWWJONDLAANOF-UHFFFAOYSA-N	1	0	250.327	1.203	50	0		CDAARO
CN(C)CC[NH2+]CCOCCOc1ccccc1	ZINC000020418771	171183577	/nfs/dbraw/zinc/18/35/77/171183577.db2.gz	NBCXSWPSZHPJMP-UHFFFAOYSA-N	1	0	252.358	1.233	50	0		CDAARO
[NH3+]CCCNS(=O)(=O)c1ccccc1Br	ZINC000020475509	171219110	/nfs/dbraw/zinc/21/91/10/171219110.db2.gz	GGORYQROLPWBFY-UHFFFAOYSA-N	1	0	293.186	1.076	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COc2ccccc2C)CC1	ZINC000020513020	171231533	/nfs/dbraw/zinc/23/15/33/171231533.db2.gz	MXCCUVAEFMDTRW-HNNXBMFYSA-N	1	0	278.396	1.372	50	0		CDAARO
C[NH2+]CCCC(=O)Nc1ccc(C(N)=O)c(Cl)c1	ZINC000037611521	173559349	/nfs/dbraw/zinc/55/93/49/173559349.db2.gz	NVINDMXYUPAMKG-UHFFFAOYSA-N	1	0	269.732	1.377	50	0		CDAARO
C[NH+](C)CC(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000067801265	175792900	/nfs/dbraw/zinc/79/29/00/175792900.db2.gz	SOYNWULUYQZNKB-LLVKDONJSA-N	1	0	285.388	1.064	50	0		CDAARO
C[C@@H](C[NH+]1CCC2(CC1)NCCNC2=O)c1ccccc1	ZINC000067868035	175797774	/nfs/dbraw/zinc/79/77/74/175797774.db2.gz	YUZVYRGEGCCOEY-AWEZNQCLSA-N	1	0	287.407	1.344	50	0		CDAARO
CN(CC[NH+]1CCCCCC1)C(=O)C(=O)c1cccnc1	ZINC000071639204	176238410	/nfs/dbraw/zinc/23/84/10/176238410.db2.gz	OPCSAEJTOFUBEL-UHFFFAOYSA-N	1	0	289.379	1.599	50	0		CDAARO
O=C1N(Cc2ccc(F)cc2)CCC[C@@]12CC[NH2+]C2	ZINC000072143571	176323857	/nfs/dbraw/zinc/32/38/57/176323857.db2.gz	BEAFJVANWSQDDL-HNNXBMFYSA-N	1	0	262.328	1.928	50	0		CDAARO
COc1cc(C(=O)N2CCC[C@@H]([NH+](C)C)CC2)ccc1O	ZINC000072168990	176332330	/nfs/dbraw/zinc/33/23/30/176332330.db2.gz	AXDHJEJKVJBZQX-CYBMUJFWSA-N	1	0	292.379	1.957	50	0		CDAARO
Cc1snnc1C(=O)N1CCC[N@H+](CC2CC2)CC1	ZINC000072254296	176350844	/nfs/dbraw/zinc/35/08/44/176350844.db2.gz	FVUXFINENXFVGU-UHFFFAOYSA-N	1	0	280.397	1.404	50	0		CDAARO
CS(=O)(=O)N1CC2(CC[NH2+]CC2)c2ccccc21	ZINC000006850018	274172566	/nfs/dbraw/zinc/17/25/66/274172566.db2.gz	NSECJXCOETXUHS-UHFFFAOYSA-N	1	0	266.366	1.087	50	0		CDAARO
OCC(CO)[NH2+][C@@H]1CCc2c1cc(Cl)cc2Cl	ZINC000089703976	275045460	/nfs/dbraw/zinc/04/54/60/275045460.db2.gz	CDOFAXQJYWQBSX-GFCCVEGCSA-N	1	0	276.163	1.924	50	0		CDAARO
CCOC(=O)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)[C@@H]([NH3+])C1	ZINC000095743353	276294133	/nfs/dbraw/zinc/29/41/33/276294133.db2.gz	LJJYOYONMCBZHC-DCAQKATOSA-N	1	0	286.372	1.570	50	0		CDAARO
CCN(CC)C(=O)[C@@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000003683517	276319261	/nfs/dbraw/zinc/31/92/61/276319261.db2.gz	PPCBIZLRRZTOBD-CQSZACIVSA-N	1	0	281.444	1.661	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)[C@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC000269172506	277029013	/nfs/dbraw/zinc/02/90/13/277029013.db2.gz	JUTKEDZZCQGLRF-CQDKDKBSSA-N	1	0	276.355	1.997	50	0		CDAARO
COC(=O)[C@H]1CC12CCN(CC[NH2+]C(C)C)CC2	ZINC000253420888	277123790	/nfs/dbraw/zinc/12/37/90/277123790.db2.gz	NHCARJNKRPMLTI-GFCCVEGCSA-N	1	0	254.374	1.260	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN(c2cc[nH+]cc2N)CC1	ZINC000035368294	277188807	/nfs/dbraw/zinc/18/88/07/277188807.db2.gz	SSZANZXFYGCOGL-UHFFFAOYSA-N	1	0	278.356	1.721	50	0		CDAARO
Cc1c(C(=O)N2CCN(C3CC3)CC2)cnn1C(C)(C)C	ZINC000195129353	280071105	/nfs/dbraw/zinc/07/11/05/280071105.db2.gz	ZAWJUIFXMMOGMD-UHFFFAOYSA-N	1	0	290.411	1.867	50	0		CDAARO
O=c1c2cccc(Cl)c2ncn1C[C@H]1CCC[NH2+]1	ZINC000043040697	280391274	/nfs/dbraw/zinc/39/12/74/280391274.db2.gz	MANBPKXONSXGHJ-SECBINFHSA-N	1	0	263.728	1.802	50	0		CDAARO
O=C(C[C@H]1CCCOC1)NCC1(C[NH+]2CCCC2)CC1	ZINC000534584952	328314977	/nfs/dbraw/zinc/31/49/77/328314977.db2.gz	WXOISIRIOHDZOG-CQSZACIVSA-N	1	0	280.412	1.795	50	0		CDAARO
C[C@H](C(=O)NCCn1cncn1)[N@H+](C)C1CCCCC1	ZINC000534586233	328315583	/nfs/dbraw/zinc/31/55/83/328315583.db2.gz	QNJMALZFNCPFMX-GFCCVEGCSA-N	1	0	279.388	1.047	50	0		CDAARO
CC(=O)N1CCC[C@@H]([NH2+]C2CSCCSC2)C1	ZINC000534590023	328317621	/nfs/dbraw/zinc/31/76/21/328317621.db2.gz	IHAJOSYZZHPYBL-LLVKDONJSA-N	1	0	274.455	1.436	50	0		CDAARO
CC(C)[C@@H](CNC(=O)CCc1ccno1)[NH+](C)C	ZINC000534591345	328318050	/nfs/dbraw/zinc/31/80/50/328318050.db2.gz	HOSOWOGAUXDNPW-GFCCVEGCSA-N	1	0	253.346	1.310	50	0		CDAARO
O=C(NC[C@H]1CC[N@@H+](C2CCCCC2)C1)c1cncnc1	ZINC000534645471	328330517	/nfs/dbraw/zinc/33/05/17/328330517.db2.gz	ZTOGTOAONGJPLI-CYBMUJFWSA-N	1	0	288.395	1.861	50	0		CDAARO
Cc1n[nH]c(CCC(=O)NC2(C)CC[NH2+]CC2)c1C	ZINC000534639159	328334869	/nfs/dbraw/zinc/33/48/69/328334869.db2.gz	WYBOETSAOIAREY-UHFFFAOYSA-N	1	0	264.373	1.217	50	0		CDAARO
O=C(NC[C@]1(O)CCC[NH2+]C1)C12CC3CC(CC(C3)C1)C2	ZINC000534640021	328335800	/nfs/dbraw/zinc/33/58/00/328335800.db2.gz	BLQOGPNHYGSKSW-CMOKZPMJSA-N	1	0	292.423	1.434	50	0		CDAARO
C[C@@H](CN1CCCCCC1)[NH2+]CCn1ccnn1	ZINC000534652372	328337919	/nfs/dbraw/zinc/33/79/19/328337919.db2.gz	VHYSUQBWCZETPI-ZDUSSCGKSA-N	1	0	251.378	1.132	50	0		CDAARO
O=C(c1ccc(C[NH2+][C@@H]2CCOC2)cc1)N1CCCC1	ZINC000534665970	328345153	/nfs/dbraw/zinc/34/51/53/328345153.db2.gz	HROSKBLTYUDRKU-OAHLLOKOSA-N	1	0	274.364	1.801	50	0		CDAARO
O=C(NCCc1ccc(O)cc1)[C@H]1CCC[NH2+]CC1	ZINC000534670065	328347051	/nfs/dbraw/zinc/34/70/51/328347051.db2.gz	YPSANDAUVVNXLS-ZDUSSCGKSA-N	1	0	262.353	1.441	50	0		CDAARO
CCOC(=O)N1CC[C@H]([NH2+]CCc2nc(C)cs2)C1	ZINC000534675230	328347850	/nfs/dbraw/zinc/34/78/50/328347850.db2.gz	LNAREHCMJARUTG-NSHDSACASA-N	1	0	283.397	1.814	50	0		CDAARO
C[C@H]1CC(C)(C)CC[C@H]1[NH2+]CCCN1C(=O)CNC1=O	ZINC000097099880	323207377	/nfs/dbraw/zinc/20/73/77/323207377.db2.gz	RXEPNIIWWBYGJN-NWDGAFQWSA-N	1	0	281.400	1.733	50	0		CDAARO
CC[C@@H](C(=O)N1CCC(OC[C@@H]2CCOC2)CC1)[NH+](C)C	ZINC000097372836	323207891	/nfs/dbraw/zinc/20/78/91/323207891.db2.gz	GRGOTYQUZWQTNR-HIFRSBDPSA-N	1	0	298.427	1.371	50	0		CDAARO
CC(C)[N@@H+]1CC[C@H](c2nc(-c3cccnn3)no2)C1	ZINC000091519412	482569717	/nfs/dbraw/zinc/56/97/17/482569717.db2.gz	WHRBRZPTPPXDSR-JTQLQIEISA-N	1	0	259.313	1.724	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OCC1CCOCC1	ZINC000088273554	482927078	/nfs/dbraw/zinc/92/70/78/482927078.db2.gz	BYGCPSBHFHXSGC-ZDUSSCGKSA-N	1	0	257.374	1.967	50	0		CDAARO
O=C(c1ccoc1)N1CCC[N@H+](CC[C@@H]2CCOC2)CC1	ZINC000670444589	482991843	/nfs/dbraw/zinc/99/18/43/482991843.db2.gz	YFYSCBCUPGBYHA-CQSZACIVSA-N	1	0	292.379	1.854	50	0		CDAARO
Cc1nncn1CC[NH+]1CCN(c2cccc(C)c2)CC1	ZINC000670459034	483041003	/nfs/dbraw/zinc/04/10/03/483041003.db2.gz	RUYCVSKUHKTDMF-UHFFFAOYSA-N	1	0	285.395	1.717	50	0		CDAARO
Cc1cc([C@H]2CCCN(C(=O)[C@@H]3CCCC[N@H+]3C)C2)[nH]n1	ZINC000084110272	483247184	/nfs/dbraw/zinc/24/71/84/483247184.db2.gz	GWOYZULSCDQUQW-ZFWWWQNUSA-N	1	0	290.411	1.908	50	0		CDAARO
COC(=O)c1ccc(C(=O)N2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)cc1	ZINC000186931915	533998395	/nfs/dbraw/zinc/99/83/95/533998395.db2.gz	VJEAXYPEDANVGG-MJBXVCDLSA-N	1	0	288.347	1.283	50	0		CDAARO
Cc1ccc(CSc2nnc(CC[NH3+])n2C)cc1	ZINC000426488320	534108324	/nfs/dbraw/zinc/10/83/24/534108324.db2.gz	SVTGYXQPQJHMAL-UHFFFAOYSA-N	1	0	262.382	1.917	50	0		CDAARO
CC(C)(C)[NH2+]CCNC(=O)[C@H]1COc2ccccc21	ZINC000096437209	526330818	/nfs/dbraw/zinc/33/08/18/526330818.db2.gz	OPKPHIGHSZKTQA-LBPRGKRZSA-N	1	0	262.353	1.667	50	0		CDAARO
CCN(CC)C(=O)[C@H](C)OC(=O)C[C@@H](C[NH3+])CC(C)C	ZINC000408525603	528059563	/nfs/dbraw/zinc/05/95/63/528059563.db2.gz	HTWBXPQPQQWLGV-STQMWFEESA-N	1	0	286.416	1.798	50	0		CDAARO
CC[C@@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)C(=O)N1CCOCC1	ZINC000096479174	529202497	/nfs/dbraw/zinc/20/24/97/529202497.db2.gz	YSXKTDZKHZXBBH-CHWSQXEVSA-N	1	0	298.427	1.560	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNS(=O)(=O)CC1CCCC1	ZINC000178337726	535490707	/nfs/dbraw/zinc/49/07/07/535490707.db2.gz	BHICFHPYEBEYEQ-CQSZACIVSA-N	1	0	288.457	1.970	50	0		CDAARO
Cc1cc(N2CCC(O)(CO)CC2)c2ccccc2[nH+]1	ZINC000067654369	538298891	/nfs/dbraw/zinc/29/88/91/538298891.db2.gz	FJTGIEDBSRWKNE-UHFFFAOYSA-N	1	0	272.348	1.867	50	0		CDAARO
CC(C)[C@@H]([NH3+])[C@]1(O)CCN(C(=O)OC(C)(C)C)C1	ZINC000958528425	614119499	/nfs/dbraw/zinc/11/94/99/614119499.db2.gz	OPCBBJZQVXDNLK-MFKMUULPSA-N	1	0	258.362	1.342	50	0		CDAARO
CCCN1C[C@@H]([NH2+]Cc2cccc3nonc32)CC1=O	ZINC000952978600	614785740	/nfs/dbraw/zinc/78/57/40/614785740.db2.gz	RCFRLRGYRSBTNQ-NSHDSACASA-N	1	0	274.324	1.323	50	0		CDAARO
CC1(C)[NH2+]CC[C@@H]1NC(=O)c1c(F)cncc1F	ZINC000952992978	614806704	/nfs/dbraw/zinc/80/67/04/614806704.db2.gz	LREUULLNIHXKLD-VIFPVBQESA-N	1	0	255.268	1.230	50	0		CDAARO
CC[C@@H](C(=O)NC1(COC)CCCC1)[N@H+](C)CC	ZINC000952985132	615379748	/nfs/dbraw/zinc/37/97/48/615379748.db2.gz	CGDSLDGATOGCQD-LBPRGKRZSA-N	1	0	256.390	1.792	50	0		CDAARO
C[C@@H]1[C@H](C)[NH2+]CCN1C(=O)C[C@@H](O)c1cccc(F)c1	ZINC000888096331	617758227	/nfs/dbraw/zinc/75/82/27/617758227.db2.gz	AUXYOANJCDNZNL-MISXGVKJSA-N	1	0	280.343	1.458	50	0		CDAARO
[NH3+][C@@H]1CCCCCC[C@@H]1C(=O)N1CCC(O)CC1	ZINC000888096023	617757598	/nfs/dbraw/zinc/75/75/98/617757598.db2.gz	HPJWYAXGCHUHCP-QWHCGFSZSA-N	1	0	254.374	1.267	50	0		CDAARO
Cc1nc([C@@H]2CCCN2C[C@@H](O)Cn2cccn2)[nH]c1C	ZINC000952994894	679870608	/nfs/dbraw/zinc/87/06/08/679870608.db2.gz	VZYDQTXMAVRPQY-KGLIPLIRSA-N	1	0	289.383	1.421	50	0		CDAARO
Cn1c(C[NH3+])nnc1SCc1nccn1C1CC1	ZINC000426489500	682136961	/nfs/dbraw/zinc/13/69/61/682136961.db2.gz	GHVVUPNBARXTDT-UHFFFAOYSA-N	1	0	264.358	1.098	50	0		CDAARO
C[C@@H](CCC(=O)NCCc1ncc[nH]1)[NH+]1CCCC1	ZINC000426538721	682223223	/nfs/dbraw/zinc/22/32/23/682223223.db2.gz	YZFCIAUJJCVSPW-LBPRGKRZSA-N	1	0	264.373	1.333	50	0		CDAARO
CN(C(=O)Cn1ccnc1-c1ccccc1)[C@H]1CC[N@H+](C)C1	ZINC000095392445	682367065	/nfs/dbraw/zinc/36/70/65/682367065.db2.gz	UYRABQKNODGETM-HNNXBMFYSA-N	1	0	298.390	1.713	50	0		CDAARO
Cc1cnc(NCCC[N@@H+]2CCC[C@H](O)C2)nc1N(C)C	ZINC000952964599	682793218	/nfs/dbraw/zinc/79/32/18/682793218.db2.gz	MQEWJRIIXYHQEM-ZDUSSCGKSA-N	1	0	293.415	1.110	50	0		CDAARO
Cc1nc(C(=O)N2CCN(c3cc[nH+]cc3)CC2)cs1	ZINC000049307625	682817945	/nfs/dbraw/zinc/81/79/45/682817945.db2.gz	YZTGOALDVSOPOY-UHFFFAOYSA-N	1	0	288.376	1.809	50	0		CDAARO
Cc1ncc(Cl)c(NC[C@@H](O)C[NH+]2CCCC2)n1	ZINC001772705080	1159440657	/nfs/dbraw/zinc/44/06/57/1159440657.db2.gz	VOMXNZCVVBTJQS-SNVBAGLBSA-N	1	0	270.764	1.307	50	0		CDAARO
CC[C@H](C(=O)NCCCn1ccnc1)[N@H+](C)CC	ZINC000822555094	1161928729	/nfs/dbraw/zinc/92/87/29/1161928729.db2.gz	QBHMKZMZURSTOH-GFCCVEGCSA-N	1	0	252.362	1.120	50	0		CDAARO
O=C([C@H]1CCOC1)N1CCC[N@H+](Cc2cccs2)CC1	ZINC000066916685	1171410291	/nfs/dbraw/zinc/41/02/91/1171410291.db2.gz	KJBXEBOQCPYLSJ-ZDUSSCGKSA-N	1	0	294.420	1.819	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](CCCn3cccc3)C[C@@H]2O)on1	ZINC001704302806	1177680303	/nfs/dbraw/zinc/68/03/03/1177680303.db2.gz	CVVKKIHMRCZZPD-ZBFHGGJFSA-N	1	0	289.379	1.710	50	0		CDAARO
Cc1n[nH]c(C)c1CC[N@@H+](C)[C@H](C)C(=O)NC1CCCC1	ZINC001704351496	1177699389	/nfs/dbraw/zinc/69/93/89/1177699389.db2.gz	YEGWRRZZNUHTOE-CYBMUJFWSA-N	1	0	292.427	1.948	50	0		CDAARO
OC[C@H]1CCC[N@H+](CCNc2ncccc2F)C1	ZINC000952870176	910421682	/nfs/dbraw/zinc/42/16/82/910421682.db2.gz	UGEBOSZQWGOFCQ-NSHDSACASA-N	1	0	253.321	1.337	50	0		CDAARO
CCO[C@H](C)CNC(=O)CCC[NH+]1CCCCC1	ZINC000952872381	910430130	/nfs/dbraw/zinc/43/01/30/910430130.db2.gz	NHTOCYRFLRNRCV-CYBMUJFWSA-N	1	0	256.390	1.794	50	0		CDAARO
CC(C)[C@H](CNC(=O)c1cncnc1)[NH+]1CCCC1	ZINC000820696458	925543484	/nfs/dbraw/zinc/54/34/84/925543484.db2.gz	XIXGMETVKHSPLD-ZDUSSCGKSA-N	1	0	262.357	1.327	50	0		CDAARO
CC(=O)NC(C)(C)C[C@H](C)[NH2+]CCC1(O)CCCC1	ZINC000820978105	925556179	/nfs/dbraw/zinc/55/61/79/925556179.db2.gz	NZLMTLHJTXSTOV-LBPRGKRZSA-N	1	0	270.417	1.965	50	0		CDAARO
CNC(=O)C[C@@H]1CC[N@H+](Cc2nc(C)cs2)C1	ZINC000823820918	925731256	/nfs/dbraw/zinc/73/12/56/925731256.db2.gz	FVJIMFZNKKIDPQ-JTQLQIEISA-N	1	0	253.371	1.410	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CCNc1cc(NCCO)ncn1	ZINC000828767796	926179557	/nfs/dbraw/zinc/17/95/57/926179557.db2.gz	QRNCIFMRGRYCGT-LBPRGKRZSA-N	1	0	279.388	1.167	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](CNc2nc(N)nc3n[nH]cc32)C1	ZINC000200527836	929260595	/nfs/dbraw/zinc/26/05/95/929260595.db2.gz	RDPUNJZLNYKNIS-VIFPVBQESA-N	1	0	275.360	1.079	50	0		CDAARO
NC(=O)[C@@H]1CC[N@H+](Cc2ccc(C3OCCO3)cc2)C1	ZINC000585117763	930984848	/nfs/dbraw/zinc/98/48/48/930984848.db2.gz	WAPQOACLQORLHY-CYBMUJFWSA-N	1	0	276.336	1.039	50	0		CDAARO
C[C@H]1CCC[C@@H](CC[NH+](C)C)N1C(=O)c1ccn(C)n1	ZINC000585128243	931012743	/nfs/dbraw/zinc/01/27/43/931012743.db2.gz	WVCHUCQJWSTTIS-STQMWFEESA-N	1	0	278.400	1.755	50	0		CDAARO
CCc1cc(N2C[C@@H](O)[C@H](F)C2)nc(N2CCCCC2)[nH+]1	ZINC001529100170	968981277	/nfs/dbraw/zinc/98/12/77/968981277.db2.gz	PBRIHGFHEHKSDI-CHWSQXEVSA-N	1	0	294.374	1.548	50	0		CDAARO
NC(=O)CC[N@H+](CCO)CC12CC3CC(CC(C3)C1)C2	ZINC001529120901	968986666	/nfs/dbraw/zinc/98/66/66/968986666.db2.gz	TXLNIBHMABUXSB-UHFFFAOYSA-N	1	0	280.412	1.373	50	0		CDAARO
Cc1cnc(NCCC2CC[NH+](C)CC2)nc1N(C)C	ZINC001529151253	968995131	/nfs/dbraw/zinc/99/51/31/968995131.db2.gz	JCJDFSUEQBXSKC-UHFFFAOYSA-N	1	0	277.416	1.995	50	0		CDAARO
O[C@H]1CN(c2ccncc2F)C[C@@H]1[NH+]1CCCCC1	ZINC001506397672	975147893	/nfs/dbraw/zinc/14/78/93/975147893.db2.gz	BQRJZQVMDTXIMM-KBPBESRZSA-N	1	0	265.332	1.256	50	0		CDAARO
CN1CC[NH+](C[C@H]2CCCN(c3ncccc3F)C2)CC1	ZINC000084485939	342450784	/nfs/dbraw/zinc/45/07/84/342450784.db2.gz	LJYARSWZQDFWFN-CQSZACIVSA-N	1	0	292.402	1.685	50	0		CDAARO
Cc1n[nH]c(NC(=O)c2oc3ccccc3c2C[NH+](C)C)n1	ZINC000096437359	230372225	/nfs/dbraw/zinc/37/22/25/230372225.db2.gz	JMXLRBFNLKZHQB-UHFFFAOYSA-N	1	0	299.334	1.595	50	0		CDAARO
Cc1ncsc1CN1CCC[C@@H]1C[N@@H+]1CCC[C@@H]1CO	ZINC000096490084	230382258	/nfs/dbraw/zinc/38/22/58/230382258.db2.gz	JKENYPXAEQBNHO-ZIAGYGMSSA-N	1	0	295.452	1.873	50	0		CDAARO
CC(C)[NH+]1CCC(CC(=O)N[C@@H](C)c2ncnn2C)CC1	ZINC000095516411	185001909	/nfs/dbraw/zinc/00/19/09/185001909.db2.gz	BAXRFTCWANHGGP-LBPRGKRZSA-N	1	0	293.415	1.503	50	0		CDAARO
C[NH+]1CCC(COc2cnc(Br)nc2)CC1	ZINC000095742764	185024550	/nfs/dbraw/zinc/02/45/50/185024550.db2.gz	ODGGBWNOLRXLKZ-UHFFFAOYSA-N	1	0	286.173	1.960	50	0		CDAARO
O=S(=O)(CC[NH2+][C@@H]1CCCSC1)CC1CCC1	ZINC000097371174	342002211	/nfs/dbraw/zinc/00/22/11/342002211.db2.gz	YXUROMPGCVCFQD-GFCCVEGCSA-N	1	0	277.455	1.687	50	0		CDAARO
Cc1cc(S(=O)(=O)NCC(C)(C)C[NH+](C)C)c(C)o1	ZINC000095939895	185035517	/nfs/dbraw/zinc/03/55/17/185035517.db2.gz	HDXWVVTVZFSMOW-UHFFFAOYSA-N	1	0	288.413	1.763	50	0		CDAARO
COC[C@@H](O)C[NH2+]Cc1ccc(C)cc1Br	ZINC000095973526	185049247	/nfs/dbraw/zinc/04/92/47/185049247.db2.gz	NCTRAQHFKXWXHQ-NSHDSACASA-N	1	0	288.185	1.854	50	0		CDAARO
NC(=O)CC[NH2+]Cc1c(F)cccc1N1CCCC1	ZINC000095991085	185058207	/nfs/dbraw/zinc/05/82/07/185058207.db2.gz	SQXOMFPRUFLWMV-UHFFFAOYSA-N	1	0	265.332	1.391	50	0		CDAARO
CC(CO)(CO)[NH2+]Cc1cc2cc(F)ccc2o1	ZINC000096007543	185063804	/nfs/dbraw/zinc/06/38/04/185063804.db2.gz	XXLOTDPXMYIESZ-UHFFFAOYSA-N	1	0	253.273	1.405	50	0		CDAARO
CC(C)(C)OC(=O)NCC[N@@H+]1CCC12CCOCC2	ZINC000241657615	361753642	/nfs/dbraw/zinc/75/36/42/361753642.db2.gz	PXTCJSOLDFKOOD-UHFFFAOYSA-N	1	0	270.373	1.766	50	0		CDAARO
[NH3+][C@H](C(=O)N1CC[C@H]2OCCC[C@@H]2C1)c1ccccc1	ZINC000195554481	342625963	/nfs/dbraw/zinc/62/59/63/342625963.db2.gz	NGQVWZPTWQUYRU-KFWWJZLASA-N	1	0	274.364	1.714	50	0		CDAARO
[NH3+][C@H](C(=O)N1CCOC[C@H]1C1CC1)c1ccccc1	ZINC000195554889	342626148	/nfs/dbraw/zinc/62/61/48/342626148.db2.gz	DZLINGUKWWFQNQ-KBPBESRZSA-N	1	0	260.337	1.324	50	0		CDAARO
C[C@H]1CCCN(C(=O)c2cccc(Cl)n2)[C@H]1C[NH3+]	ZINC000195542974	342626680	/nfs/dbraw/zinc/62/66/80/342626680.db2.gz	AHUBNEOOOWNICW-ONGXEEELSA-N	1	0	267.760	1.934	50	0		CDAARO
C[C@H](C1CCN(c2nc(CO)cs2)CC1)[NH+](C)C	ZINC000096148411	185106872	/nfs/dbraw/zinc/10/68/72/185106872.db2.gz	IKDQIGNCLWWNIP-SNVBAGLBSA-N	1	0	269.414	1.802	50	0		CDAARO
Cn1cc([C@](C)(O)C[NH2+][C@@H]2CCCSC2)cn1	ZINC000195558530	342628421	/nfs/dbraw/zinc/62/84/21/342628421.db2.gz	DQKWDRUYAFXQLI-VXGBXAGGSA-N	1	0	255.387	1.113	50	0		CDAARO
NC(=O)[C@H](C[NH2+][C@@H]1CCCSC1)Cc1ccc(F)cc1	ZINC000195561835	342628463	/nfs/dbraw/zinc/62/84/63/342628463.db2.gz	AVOVMYYDHOHUFD-GXTWGEPZSA-N	1	0	296.411	1.955	50	0		CDAARO
Cc1c(NC(=O)N2CC[C@@H]([NH+](C)C)C2)cccc1C(N)=O	ZINC000096141687	185107052	/nfs/dbraw/zinc/10/70/52/185107052.db2.gz	YCQPBXFNSFYFSL-LLVKDONJSA-N	1	0	290.367	1.262	50	0		CDAARO
O=S1(=O)CC[C@@H](C[NH2+][C@H]2CCc3ccc(F)cc32)C1	ZINC000095419620	539087978	/nfs/dbraw/zinc/08/79/78/539087978.db2.gz	HDHVKYHTZIWKFY-HZMBPMFUSA-N	1	0	283.368	1.837	50	0		CDAARO
CCCC(=O)N1CCC([NH2+][C@H](CC)[C@H]2C[C@H](O)C2)CC1	ZINC000244873443	361867997	/nfs/dbraw/zinc/86/79/97/361867997.db2.gz	WQNSZHXBHQPTLZ-BPLDGKMQSA-N	1	0	282.428	1.917	50	0		CDAARO
COCC[N@H+](C)CCNC(=O)N1CCC[C@H](C)[C@H]1C	ZINC000097010469	185151263	/nfs/dbraw/zinc/15/12/63/185151263.db2.gz	FZZCPJYZNVCULW-QWHCGFSZSA-N	1	0	271.405	1.395	50	0		CDAARO
CN(C(=O)CSC1=[NH+]CCN1)C1CCCCCC1	ZINC000685944337	539046108	/nfs/dbraw/zinc/04/61/08/539046108.db2.gz	HUCVLMXXIAJZLK-UHFFFAOYSA-N	1	0	269.414	1.860	50	0		CDAARO
NC(=O)[C@@H]1CC[N@H+](C[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000585141359	342219091	/nfs/dbraw/zinc/21/90/91/342219091.db2.gz	ULHGKWXZOONNPH-UONOGXRCSA-N	1	0	273.380	1.320	50	0		CDAARO
O=C(c1ccccc1)N1CC[C@@H]([NH2+]C2CCOCC2)C1	ZINC000098020259	539095628	/nfs/dbraw/zinc/09/56/28/539095628.db2.gz	LSUSYJAQRGJHIR-OAHLLOKOSA-N	1	0	274.364	1.670	50	0		CDAARO
C[C@@H]1C[N@H+](C)C[C@H]1NS(=O)(=O)CCC(C)(C)C	ZINC000107142612	349664657	/nfs/dbraw/zinc/66/46/57/349664657.db2.gz	VEDSYNSMJWCTKW-GHMZBOCLSA-N	1	0	262.419	1.292	50	0		CDAARO
Cc1cnn(-c2ccc(C(=O)N3CC[NH2+]C[C@@H]3C)cc2)c1	ZINC000125784036	187199277	/nfs/dbraw/zinc/19/92/77/187199277.db2.gz	BFJSWKPGENKZFC-ZDUSSCGKSA-N	1	0	284.363	1.615	50	0		CDAARO
CCO[C@@H]1C[C@H](N(C)C(=O)[C@H]2CC[NH2+]C2)C1(C)C	ZINC000262636969	362014451	/nfs/dbraw/zinc/01/44/51/362014451.db2.gz	XKZFGBJIOBZSNT-SDDRHHMPSA-N	1	0	254.374	1.258	50	0		CDAARO
CC[C@@H]1[C@@H](C(=O)N2CC[C@H](O)CC(C)(C)C2)CC[N@@H+]1C	ZINC000585131467	362057851	/nfs/dbraw/zinc/05/78/51/362057851.db2.gz	WXWAJKNRJJKRAQ-MELADBBJSA-N	1	0	282.428	1.726	50	0		CDAARO
O=C(OC1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H](CO)c1ccccc1	ZINC000000900485	362280000	/nfs/dbraw/zinc/28/00/00/362280000.db2.gz	ATKYNAZQGVYHIB-IZGVIRRGSA-N	1	0	275.348	1.589	50	0	biogenic,in-vitro	CDAARO
C[C@H]1CN(C(=O)c2nccc3ccccc32)CC[NH2+]1	ZINC000088059246	362302920	/nfs/dbraw/zinc/30/29/20/362302920.db2.gz	FIRPHFQMRVRWKI-NSHDSACASA-N	1	0	255.321	1.669	50	0		CDAARO
CC[N@H+](C)CCNS(=O)(=O)c1ccccc1SC	ZINC000187081966	362336680	/nfs/dbraw/zinc/33/66/80/362336680.db2.gz	PDLSUHLGGJVULI-UHFFFAOYSA-N	1	0	288.438	1.639	50	0		CDAARO
CCc1nnc(CN(C)C[C@@H]2CC[N@@H+](CC)C2)o1	ZINC000252481351	362385553	/nfs/dbraw/zinc/38/55/53/362385553.db2.gz	CJOBCQXLDYKQIW-NSHDSACASA-N	1	0	252.362	1.406	50	0		CDAARO
Cc1nnc2n1CCC[C@@H]2NC1CC[NH+](CC2CC2)CC1	ZINC000095969045	282352447	/nfs/dbraw/zinc/35/24/47/282352447.db2.gz	MNROROXRKKNCSH-HNNXBMFYSA-N	1	0	289.427	1.885	50	0		CDAARO
C[C@H](CCc1ccc(O)cc1)NC(=O)C[NH+](C)C	ZINC000097101808	185531733	/nfs/dbraw/zinc/53/17/33/185531733.db2.gz	RQWYPTUFBFWKGO-LLVKDONJSA-N	1	0	250.342	1.391	50	0		CDAARO
C[NH+](C)CCN(Cc1ccco1)C(=O)c1ncccc1O	ZINC000097165509	185553510	/nfs/dbraw/zinc/55/35/10/185553510.db2.gz	AEQDYFHXZDKSIE-UHFFFAOYSA-N	1	0	289.335	1.584	50	0		CDAARO
CCn1cc([C@@H]2OCC[C@H]2C[NH2+]C2CCOCC2)cn1	ZINC000089305950	346755706	/nfs/dbraw/zinc/75/57/06/346755706.db2.gz	CKMDKBBQNOVWAU-SWLSCSKDSA-N	1	0	279.384	1.749	50	0		CDAARO
Cc1cc(C)c(C[NH2+][C@H](C)CNS(=O)(=O)C2CC2)cn1	ZINC000584885395	349342961	/nfs/dbraw/zinc/34/29/61/349342961.db2.gz	CPFGJZUMYJBWBN-GFCCVEGCSA-N	1	0	297.424	1.258	50	0		CDAARO
C[C@@H](CNC(=O)N1CCc2n[nH]cc2C1)[NH+]1CCCCC1	ZINC000584885135	349343153	/nfs/dbraw/zinc/34/31/53/349343153.db2.gz	PWQVZFNURALTSZ-LBPRGKRZSA-N	1	0	291.399	1.352	50	0		CDAARO
CO[C@H](C)C(=O)N1CCC[N@@H+](C2CCCCC2)CC1	ZINC000584887570	349345666	/nfs/dbraw/zinc/34/56/66/349345666.db2.gz	SERNEQXSTYCCHN-CYBMUJFWSA-N	1	0	268.401	1.888	50	0		CDAARO
CC(C)C[NH+]1CCC(CN(C)C(=O)C2(C)COC2)CC1	ZINC000584898884	349360602	/nfs/dbraw/zinc/36/06/02/349360602.db2.gz	NVFPETFJPDOQED-UHFFFAOYSA-N	1	0	282.428	1.849	50	0		CDAARO
CN(CC[NH+]1CCCC1)C(=O)C[C@H]1CCCOC1	ZINC000584899810	349361677	/nfs/dbraw/zinc/36/16/77/349361677.db2.gz	XWODGFPCNQKXDV-CYBMUJFWSA-N	1	0	254.374	1.357	50	0		CDAARO
C[N@@H+]1CCN(Cc2cccc(F)c2F)C[C@H]1CCO	ZINC000104486509	186007818	/nfs/dbraw/zinc/00/78/18/186007818.db2.gz	LYONPMWCRZCWSQ-GFCCVEGCSA-N	1	0	270.323	1.463	50	0		CDAARO
O=C(CC[NH+]1CCC2(CC1)OCCC[C@H]2O)N1CCCC1	ZINC000091487046	180167885	/nfs/dbraw/zinc/16/78/85/180167885.db2.gz	AOQREXMEEASPAW-CQSZACIVSA-N	1	0	296.411	1.005	50	0		CDAARO
[NH3+][C@H]1CCCN(Cc2cc(=O)c3cccc(F)c3[nH]2)CC1	ZINC000091575083	180197143	/nfs/dbraw/zinc/19/71/43/180197143.db2.gz	HIUAFMDNFMLGEN-NSHDSACASA-N	1	0	289.354	1.980	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNc2ncnc(C)c2C)C1	ZINC000091526567	180178632	/nfs/dbraw/zinc/17/86/32/180178632.db2.gz	FNQGJCIOAKTPOQ-ZDUSSCGKSA-N	1	0	264.373	1.474	50	0		CDAARO
COc1cccc(C(=O)[C@@H]2CCC[N@H+](CCC(N)=O)C2)c1	ZINC000091663707	180220728	/nfs/dbraw/zinc/22/07/28/180220728.db2.gz	OLMOYPZYRWHIAB-CYBMUJFWSA-N	1	0	290.363	1.465	50	0		CDAARO
CC(C)Cc1cc(C(=O)N(C)CC[NH+](C)C)on1	ZINC000091678181	180225482	/nfs/dbraw/zinc/22/54/82/180225482.db2.gz	VTHDIWJVZLFVFZ-UHFFFAOYSA-N	1	0	253.346	1.507	50	0		CDAARO
CC[NH+](CC)CCN1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000110711602	350289540	/nfs/dbraw/zinc/28/95/40/350289540.db2.gz	WFJBSCWGXITUQX-RRFJBIMHSA-N	1	0	270.417	1.597	50	0		CDAARO
COC(=O)C[C@@H]1CCCC[N@@H+]1Cc1cc(C(N)=O)cs1	ZINC000092378759	180372203	/nfs/dbraw/zinc/37/22/03/180372203.db2.gz	NZQPULGHDJVNOA-NSHDSACASA-N	1	0	296.392	1.765	50	0		CDAARO
CC[C@@H]1CN(C(=O)C[NH2+][C@@H](C)[C@H](C)n2cccn2)CCO1	ZINC000106909892	186149690	/nfs/dbraw/zinc/14/96/90/186149690.db2.gz	YQGITJFJGZTUBZ-MELADBBJSA-N	1	0	294.399	1.060	50	0		CDAARO
CCOC[C@H](O)C[NH2+][C@]1(CO)C[C@@H](C)CC(C)(C)C1	ZINC000108125967	186205492	/nfs/dbraw/zinc/20/54/92/186205492.db2.gz	ANXDBOQKBDETAP-GZBFAFLISA-N	1	0	273.417	1.551	50	0		CDAARO
C[N@@H+]1C[C@H](NCc2nncn2-c2ccccc2)CC1(C)C	ZINC000583651143	366009207	/nfs/dbraw/zinc/00/92/07/366009207.db2.gz	ICJZBDPLJGJVDX-CYBMUJFWSA-N	1	0	285.395	1.840	50	0		CDAARO
C[C@H](Cn1cccn1)[NH2+][C@H]1CCN(CC(F)(F)F)C1=O	ZINC000111229653	186372202	/nfs/dbraw/zinc/37/22/02/186372202.db2.gz	CLAOWZILUPQXHT-ZJUUUORDSA-N	1	0	290.289	1.024	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1C(=O)N[C@H]1CCc2nccn2C1	ZINC000257365242	350963319	/nfs/dbraw/zinc/96/33/19/350963319.db2.gz	AVJZYWUJKFRRSX-STQMWFEESA-N	1	0	276.384	1.189	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1csc(C2CC2)n1	ZINC000124323219	187132031	/nfs/dbraw/zinc/13/20/31/187132031.db2.gz	WOYOQIWVAMKFJE-MRVPVSSYSA-N	1	0	251.355	1.454	50	0		CDAARO
CO[C@@H](C)CS(=O)(=O)N[C@@H](C)C[NH+]1CCCCCC1	ZINC000195459989	363435499	/nfs/dbraw/zinc/43/54/99/363435499.db2.gz	WPUIUKMKEUJBBT-STQMWFEESA-N	1	0	292.445	1.205	50	0		CDAARO
COC(=O)c1c(N)sc2c1CC[N@@H+](C(C)C)C2	ZINC000000390362	355908381	/nfs/dbraw/zinc/90/83/81/355908381.db2.gz	XTPDQXGAWXHVLX-UHFFFAOYSA-N	1	0	254.355	1.883	50	0		CDAARO
O=c1sc2ccccc2n1C[C@@H](O)C[n+]1ccccc1	ZINC000000405483	355909367	/nfs/dbraw/zinc/90/93/67/355909367.db2.gz	TXQNSZFBHHFFDY-LBPRGKRZSA-N	1	0	287.364	1.412	50	0		CDAARO
CC(C)N1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC000000115760	355887860	/nfs/dbraw/zinc/88/78/60/355887860.db2.gz	SBPOJPDKNKHHMR-UHFFFAOYSA-N	1	0	250.317	1.992	50	0		CDAARO
Cc1ccc(NC(=O)CC[NH+]2CCC(C(N)=O)CC2)cc1	ZINC000000176408	355893609	/nfs/dbraw/zinc/89/36/09/355893609.db2.gz	WRSGCWPSUJEPIF-UHFFFAOYSA-N	1	0	289.379	1.521	50	0		CDAARO
CS(=O)(=O)N1CC[NH+](C2C3CC4CC(C3)CC2C4)CC1	ZINC000000285107	355900783	/nfs/dbraw/zinc/90/07/83/355900783.db2.gz	ZDHBFBNOTDGAHU-UHFFFAOYSA-N	1	0	298.452	1.388	50	0		CDAARO
Cc1cccc(OC[C@@H](O)C[NH2+]C(C)(C)CO)c1C	ZINC000002851459	355984541	/nfs/dbraw/zinc/98/45/41/355984541.db2.gz	AOEIEHYJEGXZOI-ZDUSSCGKSA-N	1	0	267.369	1.404	50	0		CDAARO
C[n+]1cccc(C(=O)NCCOC(=O)Cc2ccccc2)c1	ZINC000002880537	355986166	/nfs/dbraw/zinc/98/61/66/355986166.db2.gz	HIFCTBZRRYQNHY-UHFFFAOYSA-O	1	0	299.350	1.027	50	0		CDAARO
Cc1nn(-c2cccc(C)c2)c(C)c1C[NH2+]CCO	ZINC000002025617	355958485	/nfs/dbraw/zinc/95/84/85/355958485.db2.gz	RTVJNASUWGINQJ-UHFFFAOYSA-N	1	0	259.353	1.879	50	0		CDAARO
COC(=O)c1ccc(NC(=S)NCCC[NH+](C)C)cc1	ZINC000002211962	355963176	/nfs/dbraw/zinc/96/31/76/355963176.db2.gz	DYALFZWPHUNHCM-UHFFFAOYSA-N	1	0	295.408	1.711	50	0		CDAARO
COc1ccc(C[NH2+]CCCN2CCOCC2)cc1OC	ZINC000002380311	355968548	/nfs/dbraw/zinc/96/85/48/355968548.db2.gz	UQCUWZDCPKMUHA-UHFFFAOYSA-N	1	0	294.395	1.516	50	0		CDAARO
CCOC(=O)NC(=O)CN1CCN(c2ccccc2)CC1	ZINC000035362430	356020064	/nfs/dbraw/zinc/02/00/64/356020064.db2.gz	YBCARYFPCZZKGC-UHFFFAOYSA-N	1	0	291.351	1.081	50	0		CDAARO
O=C(CCc1c[nH]c2ccccc12)N1CC[NH2+]CC1	ZINC000011866573	356281512	/nfs/dbraw/zinc/28/15/12/356281512.db2.gz	GRXZLAUCZFNHDF-UHFFFAOYSA-N	1	0	257.337	1.532	50	0		CDAARO
[NH3+]Cc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000012505255	356301974	/nfs/dbraw/zinc/30/19/74/356301974.db2.gz	DKCONARVRUECOQ-UHFFFAOYSA-N	1	0	254.355	1.320	50	0		CDAARO
CCc1ccc2oc(=O)cc(C[N@H+](C)CCO)c2c1	ZINC000004353953	356313115	/nfs/dbraw/zinc/31/31/15/356313115.db2.gz	UHJMNEJGKHVQOQ-UHFFFAOYSA-N	1	0	261.321	1.780	50	0		CDAARO
CNC(=S)N1CCCC[C@@H]1CC[NH+]1CCCC1	ZINC000013690953	356353819	/nfs/dbraw/zinc/35/38/19/356353819.db2.gz	GFNCVGPEPMUBNF-GFCCVEGCSA-N	1	0	255.431	1.831	50	0		CDAARO
C[C@H]1C[NH+](CCCNC(=O)c2cccs2)C[C@H](C)O1	ZINC000032826837	356383033	/nfs/dbraw/zinc/38/30/33/356383033.db2.gz	SBRVKAJGGMVBPE-RYUDHWBXSA-N	1	0	282.409	1.977	50	0		CDAARO
CCS(=O)(=O)c1ccc(N2CC[NH2+]CC2)c(F)c1	ZINC000015443243	356416337	/nfs/dbraw/zinc/41/63/37/356416337.db2.gz	ZGXFBHQTAPXKIK-UHFFFAOYSA-N	1	0	272.345	1.029	50	0		CDAARO
COc1ccc(CN2CC[NH2+]C[C@@H]2CCO)cc1C	ZINC000019368016	356482483	/nfs/dbraw/zinc/48/24/83/356482483.db2.gz	ZQHYBIGZQONQPV-AWEZNQCLSA-N	1	0	264.369	1.160	50	0		CDAARO
Cc1cccc(OCC(=O)N2CC[NH+](C(C)C)CC2)c1	ZINC000019841659	356510022	/nfs/dbraw/zinc/51/00/22/356510022.db2.gz	ZQHOMWDVGMHWLV-UHFFFAOYSA-N	1	0	276.380	1.926	50	0		CDAARO
COCCNC(=O)C1CC[NH+](Cc2ccccc2F)CC1	ZINC000020100504	356525766	/nfs/dbraw/zinc/52/57/66/356525766.db2.gz	QAJYCTMMISTOAV-UHFFFAOYSA-N	1	0	294.370	1.800	50	0		CDAARO
C[N@H+](CC(=O)N1CCC(C(N)=O)CC1)C1CCCCCC1	ZINC000029599030	356739646	/nfs/dbraw/zinc/73/96/46/356739646.db2.gz	QTUWHBSRTPBFBO-UHFFFAOYSA-N	1	0	295.427	1.365	50	0		CDAARO
CCc1noc(CC)c1CC(=O)N1CC[NH2+][C@H](C)C1	ZINC000188443471	356770158	/nfs/dbraw/zinc/77/01/58/356770158.db2.gz	GNGGFYMSVLSCTD-SNVBAGLBSA-N	1	0	265.357	1.162	50	0		CDAARO
Cc1ccc(-c2nccc(N3CC[NH2+]CC3)n2)cc1	ZINC000032918505	356790675	/nfs/dbraw/zinc/79/06/75/356790675.db2.gz	IJMDXTMBVQOIAM-UHFFFAOYSA-N	1	0	254.337	1.862	50	0		CDAARO
O=S(=O)(NC[C@H]1CCCC[NH2+]1)c1ccccc1F	ZINC000019400228	356795395	/nfs/dbraw/zinc/79/53/95/356795395.db2.gz	SRRJARZLXSMNLE-SNVBAGLBSA-N	1	0	272.345	1.246	50	0		CDAARO
CC(C)C[NH+]1CCC(NCC(=O)NC(C)C)CC1	ZINC000067713790	356810116	/nfs/dbraw/zinc/81/01/16/356810116.db2.gz	HNWMKXUMIDKTIO-UHFFFAOYSA-N	1	0	255.406	1.221	50	0		CDAARO
CC(=O)N1CCC([NH2+]CCc2cccc(F)c2)CC1	ZINC000000216199	356813459	/nfs/dbraw/zinc/81/34/59/356813459.db2.gz	BHACFEROOGUDJM-UHFFFAOYSA-N	1	0	264.344	1.969	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCN(C)CC2)c(C)c1	ZINC000035993546	356854266	/nfs/dbraw/zinc/85/42/66/356854266.db2.gz	FINBYCRZTUVPHN-UHFFFAOYSA-N	1	0	268.382	1.240	50	0		CDAARO
CNC(=O)c1ccc(C[NH2+]C[C@H]2CCCn3ccnc32)cc1	ZINC000083882293	357109484	/nfs/dbraw/zinc/10/94/84/357109484.db2.gz	AWQPKFIDAUCHCW-OAHLLOKOSA-N	1	0	298.390	1.910	50	0		CDAARO
COC(=O)[C@@H]1CN(CCc2ccccc2)CCC1=O	ZINC000049786393	357222342	/nfs/dbraw/zinc/22/23/42/357222342.db2.gz	URYCIMSKJIWGEO-CYBMUJFWSA-N	1	0	261.321	1.293	50	0		CDAARO
CCN1CCN(C(=O)CC[NH+]2CCCCCCC2)CC1	ZINC000055088596	357328449	/nfs/dbraw/zinc/32/84/49/357328449.db2.gz	HDSGHXWSORIEFH-UHFFFAOYSA-N	1	0	281.444	1.807	50	0		CDAARO
CCOc1ccccc1C[N@H+](C[C@H](O)CO)C1CC1	ZINC000055369321	357332228	/nfs/dbraw/zinc/33/22/28/357332228.db2.gz	PJQKORZHNDMRNC-AWEZNQCLSA-N	1	0	265.353	1.403	50	0		CDAARO
O=C(CCC(F)(F)F)N1CCC[C@@]2(CC[NH2+]C2)C1	ZINC000067673865	357618196	/nfs/dbraw/zinc/61/81/96/357618196.db2.gz	YAKZIUQWVVAQCF-NSHDSACASA-N	1	0	264.291	1.931	50	0		CDAARO
COc1cc(C)sc1C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188429575	357677860	/nfs/dbraw/zinc/67/78/60/357677860.db2.gz	LIZBZUJRPFEDNY-MRVPVSSYSA-N	1	0	254.355	1.499	50	0		CDAARO
C[C@@H]1CN(C(=O)c2cccc(C[NH+]3CCCC3)c2)CC[NH2+]1	ZINC000188468022	357692628	/nfs/dbraw/zinc/69/26/28/357692628.db2.gz	FJFSXPLOPWMZEX-CQSZACIVSA-N	1	0	287.407	1.716	50	0		CDAARO
C[C@H]1CN(C(=O)COc2cccc(F)c2)CC[NH2+]1	ZINC000299738578	357700884	/nfs/dbraw/zinc/70/08/84/357700884.db2.gz	CJJBHZGHUBCKJY-JTQLQIEISA-N	1	0	252.289	1.025	50	0		CDAARO
OCCn1ncc(-c2ccncc2)c1[C@H]1CCC[NH2+]1	ZINC000072344084	357829804	/nfs/dbraw/zinc/82/98/04/357829804.db2.gz	AMIRELMVGNSVOG-CYBMUJFWSA-N	1	0	258.325	1.362	50	0		CDAARO
C[C@H](NCc1nncn1C)[C@@H]1CCC[N@@H+](C2CCC2)C1	ZINC000097110949	357986547	/nfs/dbraw/zinc/98/65/47/357986547.db2.gz	VUZZMUCDIAPGBP-QWHCGFSZSA-N	1	0	277.416	1.558	50	0		CDAARO
CCCc1cc(N2C[C@@H]3CCC[NH2+][C@@H]3C2)n2nccc2n1	ZINC000072433287	357986711	/nfs/dbraw/zinc/98/67/11/357986711.db2.gz	UHPLYAKLQVMPIC-GXTWGEPZSA-N	1	0	285.395	1.870	50	0		CDAARO
O=C(CCCc1ccc(Cl)cc1)N[C@@H]1CC[NH2+]C[C@H]1O	ZINC000077439710	358018864	/nfs/dbraw/zinc/01/88/64/358018864.db2.gz	DZUUCTBIZDITJC-ZIAGYGMSSA-N	1	0	296.798	1.502	50	0		CDAARO
C[C@H]([NH2+]CCNC(=O)c1ccn[nH]1)c1ccccc1F	ZINC000097236319	358048992	/nfs/dbraw/zinc/04/89/92/358048992.db2.gz	PRNIZDDZRXADKW-JTQLQIEISA-N	1	0	276.315	1.629	50	0		CDAARO
CN1C[C@H]([NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)CCC1=O	ZINC000245339036	358140694	/nfs/dbraw/zinc/14/06/94/358140694.db2.gz	QCSIWJPUYBPFBG-AYRXBEOTSA-N	1	0	278.396	1.545	50	0		CDAARO
O=C(C[NH2+][C@@H]1CCCSC1)NCc1ccco1	ZINC000097084460	358184140	/nfs/dbraw/zinc/18/41/40/358184140.db2.gz	VROPAAVRVLLFGK-SNVBAGLBSA-N	1	0	254.355	1.381	50	0		CDAARO
C[C@@H](CCc1ccc(O)cc1)[NH2+]CCN1CCOCC1	ZINC000019954547	358224198	/nfs/dbraw/zinc/22/41/98/358224198.db2.gz	AVRVBCOFSZRXIV-AWEZNQCLSA-N	1	0	278.396	1.635	50	0		CDAARO
c1cc(C[N@@H+]2CCS[C@H]3COCC[C@@H]32)ccn1	ZINC000089884958	358442944	/nfs/dbraw/zinc/44/29/44/358442944.db2.gz	HDVUHCFWUIJPGR-STQMWFEESA-N	1	0	250.367	1.788	50	0		CDAARO
O=C(NC[C@H]1CCC[NH2+]C1)c1cnn(Cc2ccccc2)c1	ZINC000195542802	358559781	/nfs/dbraw/zinc/55/97/81/358559781.db2.gz	KGEXIYZHQPDHJG-HNNXBMFYSA-N	1	0	298.390	1.661	50	0		CDAARO
CCCC(=O)N1CCN(c2nc(NCC)cc(C)[nH+]2)CC1	ZINC000009620247	358562909	/nfs/dbraw/zinc/56/29/09/358562909.db2.gz	GFPSDJZRCYPASA-UHFFFAOYSA-N	1	0	291.399	1.666	50	0		CDAARO
CN(C)c1cnn(CC[C@H]2CCCC[N@@H+]2C)c(=O)c1	ZINC000095354843	358683905	/nfs/dbraw/zinc/68/39/05/358683905.db2.gz	RIXSLZHQTRGOQQ-GFCCVEGCSA-N	1	0	264.373	1.184	50	0		CDAARO
CCCc1nnc(N2CCC[C@](O)(C[NH+](C)C)CC2)o1	ZINC000095367224	358686938	/nfs/dbraw/zinc/68/69/38/358686938.db2.gz	WVOPILKFDGCXKD-CQSZACIVSA-N	1	0	282.388	1.305	50	0		CDAARO
CCCn1cc(CNC(=O)[C@@H]2CCCCC[N@@H+]2C)cn1	ZINC000095379410	358689633	/nfs/dbraw/zinc/68/96/33/358689633.db2.gz	AJCNKGLWTKSBRB-AWEZNQCLSA-N	1	0	278.400	1.784	50	0		CDAARO
[NH3+][C@H]1CN(c2noc(-c3ccccc3)n2)C[C@@H]1C1CC1	ZINC000095391463	358692149	/nfs/dbraw/zinc/69/21/49/358692149.db2.gz	LYZYAPKWDOBVIZ-OLZOCXBDSA-N	1	0	270.336	1.910	50	0		CDAARO
C/C=C/CN1CC[N@H+](Cc2ccccc2)C[C@H](O)C1	ZINC000095496984	358694813	/nfs/dbraw/zinc/69/48/13/358694813.db2.gz	WDSROIIQWISPAJ-WOMSROEHSA-N	1	0	260.381	1.741	50	0		CDAARO
COCCc1noc(CC[C@@H]2CCC[N@H+](C)C2)n1	ZINC000096137126	358709575	/nfs/dbraw/zinc/70/95/75/358709575.db2.gz	HSMKLIUUVBUEHY-NSHDSACASA-N	1	0	253.346	1.533	50	0		CDAARO
CCOCCOc1cccc(NC(=O)NCC[NH3+])c1	ZINC000096163890	358712267	/nfs/dbraw/zinc/71/22/67/358712267.db2.gz	RHAXUBKMOZUOIC-UHFFFAOYSA-N	1	0	267.329	1.182	50	0		CDAARO
Nc1nc(Cl)cc(N2CC[N@@H+]3CCCC[C@H]3C2)n1	ZINC000247695459	358741832	/nfs/dbraw/zinc/74/18/32/358741832.db2.gz	ZTFJKNKZUYSTSJ-VIFPVBQESA-N	1	0	267.764	1.387	50	0		CDAARO
Cc1nc(CN2CCCO[C@H](C[NH+]3CCCCC3)C2)c[nH]1	ZINC000215375483	358886524	/nfs/dbraw/zinc/88/65/24/358886524.db2.gz	OMCIKQHISSAVRH-MRXNPFEDSA-N	1	0	292.427	1.795	50	0		CDAARO
CCc1nccc(C[NH+]2CCC3(CC2)OCCC[C@@H]3O)n1	ZINC000215725261	358900276	/nfs/dbraw/zinc/90/02/76/358900276.db2.gz	OMBDERKIZDNFHE-AWEZNQCLSA-N	1	0	291.395	1.545	50	0		CDAARO
COc1cc(OC)c(CN2CCC[C@@H]2C(N)=O)cc1Cl	ZINC000216323139	358936988	/nfs/dbraw/zinc/93/69/88/358936988.db2.gz	WEVRTEKQSSYGPC-LLVKDONJSA-N	1	0	298.770	1.807	50	0		CDAARO
C[C@H]1Cc2ccccc2N(C(=O)[C@@H]2C[NH2+]CCO2)C1	ZINC000105569028	291167189	/nfs/dbraw/zinc/16/71/89/291167189.db2.gz	NLCPQTGQHASCJJ-FZMZJTMJSA-N	1	0	260.337	1.200	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2cccn2C)CC1	ZINC000219296409	359086494	/nfs/dbraw/zinc/08/64/94/359086494.db2.gz	QIVNNCHGCAZVDB-UHFFFAOYSA-N	1	0	279.384	1.113	50	0		CDAARO
CCC[N@@H+]1CC[C@H](NC(=O)c2ccnc(CC)c2)C1	ZINC000221222689	359218669	/nfs/dbraw/zinc/21/86/69/359218669.db2.gz	GHPAMXLCCMUZIC-AWEZNQCLSA-N	1	0	261.369	1.858	50	0		CDAARO
[NH3+]Cc1ccc(C(=O)NCCCc2ccncc2)cc1	ZINC000223106565	359400972	/nfs/dbraw/zinc/40/09/72/359400972.db2.gz	FDTSPFVVHJCKMY-UHFFFAOYSA-N	1	0	269.348	1.903	50	0		CDAARO
CC[N@@H+]1CCCN(C(=O)C(C)C)CC12CCOCC2	ZINC000257185947	359517753	/nfs/dbraw/zinc/51/77/53/359517753.db2.gz	YBGWXRNWIFFTAF-UHFFFAOYSA-N	1	0	268.401	1.746	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)c2ccc3[nH]ccc3c2)C[C@H]1CO	ZINC000257189422	359533269	/nfs/dbraw/zinc/53/32/69/359533269.db2.gz	IQKXXFCZYNCEJM-DZGCQCFKSA-N	1	0	287.363	1.162	50	0		CDAARO
COc1ccc(C)cc1[C@@H](C)[NH2+][C@H](C)C(=O)NC(N)=O	ZINC000012781965	359660758	/nfs/dbraw/zinc/66/07/58/359660758.db2.gz	FKKBGXLWSHSIKZ-NXEZZACHSA-N	1	0	279.340	1.238	50	0		CDAARO
CCn1cnc2c1ncnc2N1CC[C@H]([NH+](C)C)[C@H]1C	ZINC000408518610	359908956	/nfs/dbraw/zinc/90/89/56/359908956.db2.gz	PWMDKAWYBNWBHF-MNOVXSKESA-N	1	0	274.372	1.375	50	0		CDAARO
CC(=O)NC1(C(=O)N2C[C@H]([NH+](C)C)[C@@H](C)C2)CCCCC1	ZINC000089937149	360197456	/nfs/dbraw/zinc/19/74/56/360197456.db2.gz	WCOWEQKCLIFFPR-JSGCOSHPSA-N	1	0	295.427	1.234	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@@H]1CCN(C(=O)c2nccn2C)C1	ZINC000409421172	360230221	/nfs/dbraw/zinc/23/02/21/360230221.db2.gz	URAYYZWNLIHCKB-GFCCVEGCSA-N	1	0	273.340	1.321	50	0		CDAARO
[NH3+]CCc1nnc(SCCCO)n1-c1ccccc1F	ZINC000426433656	360527608	/nfs/dbraw/zinc/52/76/08/360527608.db2.gz	MMJPRWMTCHGOCO-UHFFFAOYSA-N	1	0	296.371	1.382	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)CCc1nc2ccccc2[nH]1	ZINC000178498751	189121481	/nfs/dbraw/zinc/12/14/81/189121481.db2.gz	HEWJLAVITHPMKE-LLVKDONJSA-N	1	0	272.352	1.316	50	0		CDAARO
Cc1ccc(C)c(CNC(=O)N2CCC[C@H]([NH3+])C2)c1	ZINC000426495880	360676890	/nfs/dbraw/zinc/67/68/90/360676890.db2.gz	WIDUCTHUKWJSFX-AWEZNQCLSA-N	1	0	261.369	1.936	50	0		CDAARO
CN(C)[C@@H](C(=O)N1CC[C@H](C[NH3+])C1)c1ccccc1	ZINC000178551730	189126066	/nfs/dbraw/zinc/12/60/66/189126066.db2.gz	LDNNGYPSMAVLIK-TZMCWYRMSA-N	1	0	261.369	1.097	50	0		CDAARO
CC[C@H](NC(=O)C(C)(C)[NH+]1CCCC1)c1ccnn1C	ZINC000426723892	360699746	/nfs/dbraw/zinc/69/97/46/360699746.db2.gz	OISQUUGOMUXQMR-LBPRGKRZSA-N	1	0	278.400	1.862	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)/C=C/c2c(C)nn(C)c2Cl)C1	ZINC000179015390	189162404	/nfs/dbraw/zinc/16/24/04/189162404.db2.gz	OIDHXNNPLYTURJ-SGUJLRQBSA-N	1	0	296.802	1.463	50	0		CDAARO
COc1ccc(Cl)cc1CC(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179045615	189164642	/nfs/dbraw/zinc/16/46/42/189164642.db2.gz	FAPLTHNSCXFGEI-LBPRGKRZSA-N	1	0	282.771	1.711	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCN(C(=O)c2ccnc(-n3ccnc3)c2)C1	ZINC000179220578	189178674	/nfs/dbraw/zinc/17/86/74/189178674.db2.gz	RMRZSEOCIVCHFB-JSGCOSHPSA-N	1	0	299.378	1.467	50	0		CDAARO
CCc1oc2ccccc2c1CN1C[C@@H]([NH3+])[C@H](O)C1	ZINC000426518888	360929488	/nfs/dbraw/zinc/92/94/88/360929488.db2.gz	BCZWLKWBBPTEBO-CHWSQXEVSA-N	1	0	260.337	1.499	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)c2ccnc(C3CC3)n2)C1	ZINC000299739379	200852542	/nfs/dbraw/zinc/85/25/42/200852542.db2.gz	NTUPSDCATRFZFZ-ZYHUDNBSSA-N	1	0	274.368	1.553	50	0		CDAARO
Cc1nn(C(C)C)c(C)c1CNC(=O)[C@@H]1C=CC[NH2+]1	ZINC000299779047	200869285	/nfs/dbraw/zinc/86/92/85/200869285.db2.gz	PQABWOAJNYWDMG-ZDUSSCGKSA-N	1	0	262.357	1.225	50	0		CDAARO
Nc1cc(N)[nH+]c(SCC(=O)N2CCCCCC2)n1	ZINC000000417741	283658028	/nfs/dbraw/zinc/65/80/28/283658028.db2.gz	XQJFQQMXOMPZBK-UHFFFAOYSA-N	1	0	281.385	1.136	50	0		CDAARO
O=C1C[C@H]([NH2+]C2CCCC2)C(=O)N1c1ccccc1	ZINC000019372934	361450812	/nfs/dbraw/zinc/45/08/12/361450812.db2.gz	BOECZKNDQUNYMW-ZDUSSCGKSA-N	1	0	258.321	1.851	50	0		CDAARO
O=C([C@@H]1CC12CC[NH2+]CC2)N1CCN(c2ccccc2)CC1	ZINC000237932762	361599489	/nfs/dbraw/zinc/59/94/89/361599489.db2.gz	FHJABIYTSFOHBN-INIZCTEOSA-N	1	0	299.418	1.725	50	0		CDAARO
Cc1nnc(-c2ccccc2NC(=O)C2([NH3+])CC2)o1	ZINC000088129832	364245896	/nfs/dbraw/zinc/24/58/96/364245896.db2.gz	YHWGNHQVTIQVMQ-UHFFFAOYSA-N	1	0	258.281	1.475	50	0		CDAARO
CCC1(CC)[C@H]([N@H+](C)CCn2cncn2)C[C@@H]1OC	ZINC000089948128	366975430	/nfs/dbraw/zinc/97/54/30/366975430.db2.gz	DBHLLYUGMWDOSZ-OLZOCXBDSA-N	1	0	266.389	1.804	50	0		CDAARO
COc1ccc(C(=O)N[C@@H]2CC[NH2+]C[C@H]2C)c(OC)c1	ZINC000094344997	367399612	/nfs/dbraw/zinc/39/96/12/367399612.db2.gz	VUOLDKORNKBSSV-ZWNOBZJWSA-N	1	0	278.352	1.432	50	0		CDAARO
Cc1nc2ccc(NCCc3cn4ccccc4n3)nn2n1	ZINC000252484022	367568762	/nfs/dbraw/zinc/56/87/62/367568762.db2.gz	FMEGJBNXIRKCBZ-UHFFFAOYSA-N	1	0	293.334	1.735	50	0		CDAARO
CC(C)COC(=O)N1CCC([NH2+][C@@H]2CCC[C@@H]2CO)CC1	ZINC000089157189	370140215	/nfs/dbraw/zinc/14/02/15/370140215.db2.gz	ZTKUNKSAVDGOEC-UKRRQHHQSA-N	1	0	298.427	1.994	50	0		CDAARO
Cc1cc(N2CCC[C@H](CS(C)(=O)=O)C2)cc[nH+]1	ZINC000292627100	370368768	/nfs/dbraw/zinc/36/87/68/370368768.db2.gz	DVCQGWIZIDCIQV-LBPRGKRZSA-N	1	0	268.382	1.651	50	0		CDAARO
CCCOc1cncc(NC(=O)[C@H]([NH3+])C(C)C)c1	ZINC000638583741	371302674	/nfs/dbraw/zinc/30/26/74/371302674.db2.gz	MUDJMXKXIHILRX-GFCCVEGCSA-N	1	0	251.330	1.792	50	0		CDAARO
Cc1nc(C(=O)NC[C@H]2CCC3(CC[NH2+]CC3)O2)cs1	ZINC000299799353	372771218	/nfs/dbraw/zinc/77/12/18/372771218.db2.gz	RAKHPSWREJZJKR-LLVKDONJSA-N	1	0	295.408	1.483	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)[C@H](C)n1cccn1	ZINC000253375903	373679345	/nfs/dbraw/zinc/67/93/45/373679345.db2.gz	RIJSKECRKBTQOE-RRFJBIMHSA-N	1	0	290.411	1.919	50	0		CDAARO
C[C@H](c1ccc(S(C)(=O)=O)cc1)N1CC[C@@H](O)[C@H](C)C1	ZINC000253396606	373685288	/nfs/dbraw/zinc/68/52/88/373685288.db2.gz	ANRBVUSBLGFONX-LALPHHSUSA-N	1	0	297.420	1.854	50	0		CDAARO
O=C(CNC1CC[NH+](C2CCCCC2)CC1)NC1CC1	ZINC000253431579	373746340	/nfs/dbraw/zinc/74/63/40/373746340.db2.gz	SIIBSBGQXVMXLB-UHFFFAOYSA-N	1	0	279.428	1.652	50	0		CDAARO
[NH3+]C1(Cc2ccc(Cl)cc2)CCS(=O)(=O)CC1	ZINC000255190193	374267158	/nfs/dbraw/zinc/26/71/58/374267158.db2.gz	VNWODLPGERZOTP-UHFFFAOYSA-N	1	0	273.785	1.789	50	0		CDAARO
C[C@H](NC(=O)N1CC[C@@H](C[NH+](C)C)C1)c1cnn(C)c1	ZINC000130124615	374356121	/nfs/dbraw/zinc/35/61/21/374356121.db2.gz	USLCLKVVQRYRES-RYUDHWBXSA-N	1	0	279.388	1.074	50	0		CDAARO
COC(=O)CCC[N@@H+]1CCCC[C@H]1c1cn[nH]c1	ZINC000117341882	374536253	/nfs/dbraw/zinc/53/62/53/374536253.db2.gz	LWQLCVAXIXPOGZ-LBPRGKRZSA-N	1	0	251.330	1.890	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)Cc2cccc(F)c2F)C1	ZINC000094713528	374643690	/nfs/dbraw/zinc/64/36/90/374643690.db2.gz	YDLLOOSBCYDEFD-VIFPVBQESA-N	1	0	254.280	1.315	50	0		CDAARO
CCO[C@H](CC)C(=O)N1C[C@@H]2CCCC[N@@H+]2C[C@@H]1C	ZINC000095398128	374901886	/nfs/dbraw/zinc/90/18/86/374901886.db2.gz	OBYQYPIBXJNZMM-MELADBBJSA-N	1	0	268.401	1.887	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+][C@@H]1CCCC[C@@H]1S(C)(=O)=O	ZINC000095940757	375037285	/nfs/dbraw/zinc/03/72/85/375037285.db2.gz	CMUFVEOSXRYYBA-MNOVXSKESA-N	1	0	291.413	1.131	50	0		CDAARO
C[C@H](Cc1cnccn1)[N@H+](C)Cc1cccnc1N	ZINC000215653395	375269836	/nfs/dbraw/zinc/26/98/36/375269836.db2.gz	SVWOJTSJZVXJKH-LLVKDONJSA-N	1	0	257.341	1.517	50	0		CDAARO
CCOc1ccc(OCC(=O)NCC[NH+](CC)CC)cc1	ZINC000003643030	375771017	/nfs/dbraw/zinc/77/10/17/375771017.db2.gz	LTFLVIDGYGRZLL-UHFFFAOYSA-N	1	0	294.395	1.922	50	0		CDAARO
CC(C)(C)OC(=O)C(=O)Nc1ccc(CC[NH3+])cc1	ZINC000261506730	190039912	/nfs/dbraw/zinc/03/99/12/190039912.db2.gz	ALXOMXHFDMCHPR-UHFFFAOYSA-N	1	0	264.325	1.468	50	0		CDAARO
CCc1ccc(CN2CCN3CC[N@H+](C)C[C@H]3C2)o1	ZINC000244882870	376022826	/nfs/dbraw/zinc/02/28/26/376022826.db2.gz	YATWVNYXCRJWIU-ZDUSSCGKSA-N	1	0	263.385	1.274	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]1)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000261753411	190043795	/nfs/dbraw/zinc/04/37/95/190043795.db2.gz	QJIYAIKCOWJNRW-HRCADAONSA-N	1	0	288.391	1.853	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1[nH]nnc1-c1ccccc1	ZINC000188932254	377122265	/nfs/dbraw/zinc/12/22/65/377122265.db2.gz	CMKIJDRYQRSIGE-CYBMUJFWSA-N	1	0	299.378	1.686	50	0		CDAARO
COCCC[NH2+]C[C@@H](O)COc1ccccc1F	ZINC000002651840	169818190	/nfs/dbraw/zinc/81/81/90/169818190.db2.gz	IRBVFBDRQAMZGW-LLVKDONJSA-N	1	0	257.305	1.192	50	0		CDAARO
COCc1ccc(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@@H+]3C)o1	ZINC000067921503	377302507	/nfs/dbraw/zinc/30/25/07/377302507.db2.gz	AFXYILKFSWINPI-NWDGAFQWSA-N	1	0	278.352	1.735	50	0		CDAARO
CC[NH+]1CCC(CNC(=O)c2c(Cl)cnn2C)CC1	ZINC000667111962	483093279	/nfs/dbraw/zinc/09/32/79/483093279.db2.gz	QKLYRDCHSOXWIL-UHFFFAOYSA-N	1	0	284.791	1.535	50	0		CDAARO
CC[NH+](CC)C[C@H](C)NC(=O)c1c(Cl)c(C)nn1C	ZINC000002781825	378055397	/nfs/dbraw/zinc/05/53/97/378055397.db2.gz	DBDZSIXVYADLTM-VIFPVBQESA-N	1	0	286.807	1.842	50	0		CDAARO
CC(C)C[NH+]1CCC(C(=O)NC[C@@H]2CCCO2)CC1	ZINC000000317523	169607072	/nfs/dbraw/zinc/60/70/72/169607072.db2.gz	BMKRXSMMNJGRCG-AWEZNQCLSA-N	1	0	268.401	1.650	50	0		CDAARO
O=S(=O)(N[C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1ccccc1	ZINC000216281643	285041997	/nfs/dbraw/zinc/04/19/97/285041997.db2.gz	CCJULNHRHTZKFT-KGLIPLIRSA-N	1	0	280.393	1.592	50	0		CDAARO
O=S1(=O)CCC([NH2+][C@H]2CCc3ccccc3C2)CC1	ZINC000037269949	285053335	/nfs/dbraw/zinc/05/33/35/285053335.db2.gz	TZWVVKWLRCMFGW-HNNXBMFYSA-N	1	0	279.405	1.711	50	0		CDAARO
COCC[C@@H]1CCCC[N@@H+]1CCn1cc[nH]c1=O	ZINC000244602013	285145018	/nfs/dbraw/zinc/14/50/18/285145018.db2.gz	DWBOUSYXIURSMX-LBPRGKRZSA-N	1	0	253.346	1.067	50	0		CDAARO
[NH3+]C[C@H]1CCCN1C(=O)Cc1cccc(F)c1F	ZINC000094714867	184845322	/nfs/dbraw/zinc/84/53/22/184845322.db2.gz	QIUVPTZWONSZTG-SNVBAGLBSA-N	1	0	254.280	1.457	50	0		CDAARO
Cc1cc(S(=O)(=O)NC[C@@H]([NH3+])C(C)C)ccc1F	ZINC000095432096	184982093	/nfs/dbraw/zinc/98/20/93/184982093.db2.gz	AHGURLQTCSTTGW-GFCCVEGCSA-N	1	0	274.361	1.396	50	0		CDAARO
CCOCCN1CC[N@H+](C[C@H]2CCCCO2)C[C@H]1CC	ZINC000247206971	390267557	/nfs/dbraw/zinc/26/75/57/390267557.db2.gz	PKUOPQFCZNLPOI-HZPDHXFCSA-N	1	0	284.444	1.988	50	0		CDAARO
[NH3+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O	ZINC000070495344	390607807	/nfs/dbraw/zinc/60/78/07/390607807.db2.gz	NQNUYIFAYFLLID-SNVBAGLBSA-N	1	0	256.252	1.742	50	0		CDAARO
CCOC(=O)c1nn(-c2ccccc2)c2c1C[NH2+]CC2	ZINC000082810696	391320993	/nfs/dbraw/zinc/32/09/93/391320993.db2.gz	AHKZWNMWUQLZME-UHFFFAOYSA-N	1	0	271.320	1.695	50	0		CDAARO
COCC[NH2+]CC(=O)N[C@@H]1CCCC[C@H]1C(C)(C)C	ZINC000092495312	391483112	/nfs/dbraw/zinc/48/31/12/391483112.db2.gz	GTUAQPFNRUCIQJ-CHWSQXEVSA-N	1	0	270.417	1.944	50	0		CDAARO
CCC[C@H]1CCC[N@@H+]([C@H](C)C(=O)NC(N)=O)CC1	ZINC000106516911	392727405	/nfs/dbraw/zinc/72/74/05/392727405.db2.gz	ABTJWSUDQXKBNP-MNOVXSKESA-N	1	0	255.362	1.472	50	0		CDAARO
CNc1cc(C)[nH+]c(N2CC[C@@](O)(CCOC)[C@H](C)C2)n1	ZINC000091987901	135074551	/nfs/dbraw/zinc/07/45/51/135074551.db2.gz	QWBUMCCSLIGMLI-IAQYHMDHSA-N	1	0	294.399	1.441	50	0		CDAARO
Clc1ccc(CN2CCN([C@@H]3CC[NH2+]C3)CC2)s1	ZINC000261572939	140352487	/nfs/dbraw/zinc/35/24/87/140352487.db2.gz	MCJDCWRUDHDDNS-LLVKDONJSA-N	1	0	285.844	1.881	50	0		CDAARO
C[NH+](C)CC(C)(C)CNC(=O)c1n[nH]c2c1CCCC2	ZINC000126682050	413083325	/nfs/dbraw/zinc/08/33/25/413083325.db2.gz	BDCKZZRHIURJJW-UHFFFAOYSA-N	1	0	278.400	1.606	50	0		CDAARO
O=C(Nc1ccccc1-n1cccn1)[C@H]1CCC[NH2+]1	ZINC000037026651	398056031	/nfs/dbraw/zinc/05/60/31/398056031.db2.gz	NNESVKFDNJYKNI-GFCCVEGCSA-N	1	0	256.309	1.563	50	0		CDAARO
CCOCCC[N@@H+]1CC[C@H](NC(=O)[C@H]2CCCO2)[C@H](C)C1	ZINC000252477286	286061854	/nfs/dbraw/zinc/06/18/54/286061854.db2.gz	LGJWVIAKXMVFNP-QLFBSQMISA-N	1	0	298.427	1.419	50	0		CDAARO
COc1ccc(COC[C@H](O)C[NH2+]C(C)C)cc1	ZINC000003122987	169858333	/nfs/dbraw/zinc/85/83/33/169858333.db2.gz	GOAPGSMNVDOHLI-CYBMUJFWSA-N	1	0	253.342	1.571	50	0		CDAARO
Cc1ccccc1NC(=O)CC[NH+]1CCC(C(N)=O)CC1	ZINC000004725290	170006801	/nfs/dbraw/zinc/00/68/01/170006801.db2.gz	BFTSLIIJDAPZMJ-UHFFFAOYSA-N	1	0	289.379	1.521	50	0		CDAARO
Cc1ccc(N2C(=O)C[C@@H]([NH2+]C[C@@H]3CCCO3)C2=O)cc1	ZINC000004996532	170051800	/nfs/dbraw/zinc/05/18/00/170051800.db2.gz	ATIPQIZIPFWXSA-UONOGXRCSA-N	1	0	288.347	1.396	50	0		CDAARO
C[NH+](C)CCCNC(=S)N1CCc2ccccc2C1	ZINC000006588917	170216878	/nfs/dbraw/zinc/21/68/78/170216878.db2.gz	QWCKFMOTOHVSFF-UHFFFAOYSA-N	1	0	277.437	1.871	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)CSc2ccccc2)CC1	ZINC000006728686	170234297	/nfs/dbraw/zinc/23/42/97/170234297.db2.gz	APFRRPXOMMIPSS-UHFFFAOYSA-N	1	0	264.394	1.943	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[NH2+][C@@H](c1ccccc1)C(C)C	ZINC000008002959	170313205	/nfs/dbraw/zinc/31/32/05/170313205.db2.gz	MAZKPHBZWATHRH-WCQYABFASA-N	1	0	277.368	1.817	50	0		CDAARO
C[C@@H](C(=O)NC(=O)NC1CCCC1)[N@@H+]1CCC[C@H](C)C1	ZINC000008142773	170321035	/nfs/dbraw/zinc/32/10/35/170321035.db2.gz	DLPYQIMDWHNFQY-RYUDHWBXSA-N	1	0	281.400	1.875	50	0		CDAARO
COc1cc(C[NH2+]CCN2CCCC2)cc(OC)c1	ZINC000020127018	171012437	/nfs/dbraw/zinc/01/24/37/171012437.db2.gz	BDMCJYFZCAFHGU-UHFFFAOYSA-N	1	0	264.369	1.889	50	0		CDAARO
C[C@H](c1nc(-c2ccccc2)no1)N1CC[NH2+]CC1	ZINC000020283453	171132805	/nfs/dbraw/zinc/13/28/05/171132805.db2.gz	QTEWSPNIERTTFZ-LLVKDONJSA-N	1	0	258.325	1.703	50	0		CDAARO
NS(=O)(=O)c1ccc(-c2ccc(C[NH3+])o2)cc1	ZINC000020282676	171133068	/nfs/dbraw/zinc/13/30/68/171133068.db2.gz	LXPXMOXLVAJPGX-UHFFFAOYSA-N	1	0	252.295	1.053	50	0		CDAARO
COc1cc(C)ccc1OCC[NH2+]CCN(C)C	ZINC000020418801	171184006	/nfs/dbraw/zinc/18/40/06/171184006.db2.gz	DFGAFTUNQFDETB-UHFFFAOYSA-N	1	0	252.358	1.534	50	0		CDAARO
C[NH+](C)Cc1ccc(CNC(=O)c2nccnc2N)cc1	ZINC000021401485	171303662	/nfs/dbraw/zinc/30/36/62/171303662.db2.gz	CRUPFVPWOJKHDW-UHFFFAOYSA-N	1	0	285.351	1.050	50	0		CDAARO
C[NH+](C)Cc1ccccc1CNC(=O)c1cnccn1	ZINC000021938356	171337893	/nfs/dbraw/zinc/33/78/93/171337893.db2.gz	YDKPBDYXLWIOPB-UHFFFAOYSA-N	1	0	270.336	1.468	50	0		CDAARO
OCC[NH+]1CCN(Cc2ccc(O)c3ncccc23)CC1	ZINC000022450566	171387608	/nfs/dbraw/zinc/38/76/08/171387608.db2.gz	XIXFNVDWEWCEOI-UHFFFAOYSA-N	1	0	287.363	1.050	50	0		CDAARO
CCCc1nc(CNC(=O)C2CC[NH2+]CC2)cs1	ZINC000045795879	175383912	/nfs/dbraw/zinc/38/39/12/175383912.db2.gz	XWTPVPPTTDPYNK-UHFFFAOYSA-N	1	0	267.398	1.711	50	0		CDAARO
Brc1ccc(CN2CC[NH2+]CC2)nc1	ZINC000061862834	175656812	/nfs/dbraw/zinc/65/68/12/175656812.db2.gz	RUPAVCIRAJDWNB-UHFFFAOYSA-N	1	0	256.147	1.249	50	0		CDAARO
O=C(Cc1ccccc1Cl)N[C@@H]1CCC[NH2+]C1	ZINC000071397132	176150771	/nfs/dbraw/zinc/15/07/71/176150771.db2.gz	FCGVZYHUKUKQOK-LLVKDONJSA-N	1	0	252.745	1.751	50	0		CDAARO
CCn1ncc(Cl)c1C(=O)N1CCC[N@@H+]2CCC[C@H]2C1	ZINC000071730432	176256144	/nfs/dbraw/zinc/25/61/44/176256144.db2.gz	LACXTTVNYZGPCS-NSHDSACASA-N	1	0	296.802	1.867	50	0		CDAARO
CC(C)([NH3+])C(=O)N1CCO[C@H](CCCc2ccccc2)C1	ZINC000071745821	176258539	/nfs/dbraw/zinc/25/85/39/176258539.db2.gz	FSKIUJYWJMSYKW-OAHLLOKOSA-N	1	0	290.407	1.974	50	0		CDAARO
COCc1cc(C[N@@H+]2CC[C@H](CO)[C@@H](O)C2)ccc1OC	ZINC000072165116	176331224	/nfs/dbraw/zinc/33/12/24/176331224.db2.gz	WBDSZCLGGLTSEK-HIFRSBDPSA-N	1	0	295.379	1.017	50	0		CDAARO
CC(C)c1nnsc1C[N@H+]1C[C@@H]2C[C@H](O)[C@@H](O)C[C@@H]2C1	ZINC000072167274	176331899	/nfs/dbraw/zinc/33/18/99/176331899.db2.gz	GRRQYHGJFQATKE-USZNOCQGSA-N	1	0	297.424	1.225	50	0		CDAARO
C[C@@H]1CCC[N@@H+]([C@@H](C(=O)NC(N)=O)c2ccccc2)C1	ZINC000012592694	287359419	/nfs/dbraw/zinc/35/94/19/287359419.db2.gz	YQZDTCLVHTYKIG-DGCLKSJQSA-N	1	0	275.352	1.655	50	0		CDAARO
COc1cc(CO[C@H]2CCC[NH2+]C2)cc(OC)c1	ZINC000035781819	260153387	/nfs/dbraw/zinc/15/33/87/260153387.db2.gz	WJSFQIKHCILIIB-LBPRGKRZSA-N	1	0	251.326	1.972	50	0		CDAARO
CC[NH+](CC)[C@H](C)CNC(=O)N[C@H]1CCCSC1	ZINC000096452323	262515922	/nfs/dbraw/zinc/51/59/22/262515922.db2.gz	JLMYIMPARLBPPZ-NEPJUHHUSA-N	1	0	273.446	1.912	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)[C@@H]2CSc3ccccc32)C1	ZINC000092239245	274952987	/nfs/dbraw/zinc/95/29/87/274952987.db2.gz	WCVFTYSWBRFJRF-ZYHUDNBSSA-N	1	0	262.378	1.683	50	0		CDAARO
CC(C)n1cccc1C(=O)N1C[C@H]([NH3+])[C@@H](C2CC2)C1	ZINC000091793844	273575263	/nfs/dbraw/zinc/57/52/63/273575263.db2.gz	GCYBKWLBXHDXDV-OLZOCXBDSA-N	1	0	261.369	1.878	50	0		CDAARO
COc1ccccc1C[N@@H+]1CC[C@@H](N2CCOCC2)C1	ZINC000121062323	274157376	/nfs/dbraw/zinc/15/73/76/274157376.db2.gz	VYURPSICDREIIN-OAHLLOKOSA-N	1	0	276.380	1.602	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@H](c2ccccc2)[C@@H](C)[C@]12NC(=O)NC2=O	ZINC000239159626	274341091	/nfs/dbraw/zinc/34/10/91/274341091.db2.gz	MMSXRWNFSXWXPU-RLSLPTNOSA-N	1	0	287.363	1.524	50	0		CDAARO
C[C@H]1CN(C(=O)[C@@H]2CCOc3ccccc32)CC[NH2+]1	ZINC000088059129	274575289	/nfs/dbraw/zinc/57/52/89/274575289.db2.gz	FKNNEELFNGPQKF-WCQYABFASA-N	1	0	260.337	1.373	50	0		CDAARO
CC[NH+](CC)C[C@H](O)COc1ccc2c(c1)OCO2	ZINC000004477665	276108930	/nfs/dbraw/zinc/10/89/30/276108930.db2.gz	LQHAKJFBKRVIHB-NSHDSACASA-N	1	0	267.325	1.497	50	0		CDAARO
CCCC[C@H]([NH2+][C@H]1CCN(C(C)=O)C[C@@H]1CC)C(N)=O	ZINC000089950136	276243815	/nfs/dbraw/zinc/24/38/15/276243815.db2.gz	BMPWBKARDJXSBE-IHRRRGAJSA-N	1	0	283.416	1.267	50	0		CDAARO
C[NH2+]CC(=O)N1CCC[C@@H](c2nc3c(cccc3C)[nH]2)C1	ZINC000071755167	277263489	/nfs/dbraw/zinc/26/34/89/277263489.db2.gz	DKOVWVXTZPIIKX-GFCCVEGCSA-N	1	0	286.379	1.797	50	0		CDAARO
CS(=O)(=O)N1CCC([NH2+]Cc2ccc(F)cc2)CC1	ZINC000030656169	277495352	/nfs/dbraw/zinc/49/53/52/277495352.db2.gz	OZPMLZAONBBQRK-UHFFFAOYSA-N	1	0	286.372	1.339	50	0		CDAARO
COc1cccc2c1ncn([C@H]1CCC[NH2+]C1)c2=O	ZINC000032576734	278043148	/nfs/dbraw/zinc/04/31/48/278043148.db2.gz	WJCJIEGNOXQCLB-JTQLQIEISA-N	1	0	259.309	1.330	50	0		CDAARO
CC(=O)O[C@H](CN1CCCC1=O)C[NH+]1CCCCCC1	ZINC000001409538	278221858	/nfs/dbraw/zinc/22/18/58/278221858.db2.gz	DIKFZDBCKAHZCZ-AWEZNQCLSA-N	1	0	282.384	1.417	50	0		CDAARO
Cc1cc(C(=O)NCC[N@H+]2CCC[C@H](C)C2)[nH]n1	ZINC000048963389	280348752	/nfs/dbraw/zinc/34/87/52/280348752.db2.gz	LQWLFZCZJPNENN-JTQLQIEISA-N	1	0	250.346	1.180	50	0		CDAARO
Cc1cnc(C)c(NC[C@H](O)C[NH+]2CCC(C)CC2)n1	ZINC000195563814	281583820	/nfs/dbraw/zinc/58/38/20/281583820.db2.gz	KSLINOKYXAMUAW-AWEZNQCLSA-N	1	0	278.400	1.598	50	0		CDAARO
Cn1nccc1[C@H]1CCCCN1C[C@H]1CCC[NH2+]C1	ZINC000261629220	303088900	/nfs/dbraw/zinc/08/89/00/303088900.db2.gz	CLLJPKHCJXBMMA-DZGCQCFKSA-N	1	0	262.401	1.947	50	0		CDAARO
[NH3+]C1(C(=O)N2CC[C@@](O)(C(F)(F)F)C2)CCCCC1	ZINC000261616214	303354527	/nfs/dbraw/zinc/35/45/27/303354527.db2.gz	TZOIBMWPNIDVTI-NSHDSACASA-N	1	0	280.290	1.174	50	0		CDAARO
O=C(N1CC[NH2+]C[C@@H](O)C1)C1(c2ccccc2)CCCC1	ZINC000097117617	303682487	/nfs/dbraw/zinc/68/24/87/303682487.db2.gz	KVOVKLYYKZLXCO-OAHLLOKOSA-N	1	0	288.391	1.291	50	0		CDAARO
COCC1(C(=O)N2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)CCC1	ZINC000534590036	328317629	/nfs/dbraw/zinc/31/76/29/328317629.db2.gz	DIEXTHFTBPVFPQ-MPZDIEGVSA-N	1	0	264.369	1.012	50	0		CDAARO
Cc1nccn1-c1ccc(CNC(=O)[C@@H]2C=CC[NH2+]2)cc1	ZINC000534640766	328335992	/nfs/dbraw/zinc/33/59/92/328335992.db2.gz	OXZPWVBLDJLNTR-HNNXBMFYSA-N	1	0	282.347	1.325	50	0		CDAARO
c1ccc(-c2nc(CN3C[C@@H]4CC[NH2+][C@@H]4C3)no2)cc1	ZINC000534649549	328343827	/nfs/dbraw/zinc/34/38/27/328343827.db2.gz	NLGHEOMKRQFTSW-QWHCGFSZSA-N	1	0	270.336	1.530	50	0		CDAARO
CCC[C@@H](CNC(=O)Cn1nc2ccccc2n1)[NH+](C)C	ZINC000534647885	328342912	/nfs/dbraw/zinc/34/29/12/328342912.db2.gz	YFUQFOGOXLGHOR-LBPRGKRZSA-N	1	0	289.383	1.278	50	0		CDAARO
COc1cccc(-n2cc(CNC(=O)[C@@H]3C=CC[NH2+]3)cn2)c1	ZINC000534657557	328341142	/nfs/dbraw/zinc/34/11/42/328341142.db2.gz	DOBPCMOCYBNYFG-HNNXBMFYSA-N	1	0	298.346	1.025	50	0		CDAARO
CC(C)c1nc(N2CCC3(CC2)C[NH2+]CCO3)no1	ZINC000534674497	328349128	/nfs/dbraw/zinc/34/91/28/328349128.db2.gz	JBGUKOVRQWFFCV-UHFFFAOYSA-N	1	0	266.345	1.152	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@@H]1CCC(C)(C)C[C@H]1C	ZINC000097099856	323207481	/nfs/dbraw/zinc/20/74/81/323207481.db2.gz	YRBLQUQCMWXHCS-VXGBXAGGSA-N	1	0	276.446	1.730	50	0		CDAARO
CN(C)[C@@H](C[NH2+][C@H]1CC(C)(C)OC1(C)C)c1cnn(C)c1	ZINC000096477911	329526758	/nfs/dbraw/zinc/52/67/58/329526758.db2.gz	VCBNADBPQYUKLA-KBPBESRZSA-N	1	0	294.443	1.959	50	0		CDAARO
CC1([C@H]2CCC[N@H+](CCn3ccnc3)C2)OCCO1	ZINC000097086635	482455816	/nfs/dbraw/zinc/45/58/16/482455816.db2.gz	LNWJLJDCPXHLCS-ZDUSSCGKSA-N	1	0	265.357	1.358	50	0		CDAARO
CC[NH+]1CCN(C(=O)/C=C/c2cccs2)CC1	ZINC000055009886	482723897	/nfs/dbraw/zinc/72/38/97/482723897.db2.gz	MQWHDGBMJITHES-AATRIKPKSA-N	1	0	250.367	1.925	50	0		CDAARO
C[N@@H+]1CC[C@H](NS(=O)(=O)Cc2ccc(Cl)cc2)C1	ZINC000074864979	482774408	/nfs/dbraw/zinc/77/44/08/482774408.db2.gz	GXGBGFMMUFDQBI-LBPRGKRZSA-N	1	0	288.800	1.464	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H]1CN(C(=O)CCCn1cncn1)C2	ZINC000670457256	483037523	/nfs/dbraw/zinc/03/75/23/483037523.db2.gz	WPCMSJMTVYYSRA-KBPBESRZSA-N	1	0	291.399	1.001	50	0		CDAARO
CCn1nc(CO)c2c1CC[N@H+](CCCn1cccc1)C2	ZINC000670471860	483076726	/nfs/dbraw/zinc/07/67/26/483076726.db2.gz	MFBXXFIEJYMIEL-UHFFFAOYSA-N	1	0	288.395	1.645	50	0		CDAARO
c1n[nH]cc1CC[NH2+][C@@H]1CCN(c2ccccc2)C1	ZINC000685627568	483191882	/nfs/dbraw/zinc/19/18/82/483191882.db2.gz	QJFBXYBQKLUCQA-CQSZACIVSA-N	1	0	256.353	1.821	50	0		CDAARO
CCc1nc(CN2CCc3c(ncn3C3CC3)C2)no1	ZINC000083830453	483203277	/nfs/dbraw/zinc/20/32/77/483203277.db2.gz	AGCJPFQEVNQSKU-UHFFFAOYSA-N	1	0	273.340	1.722	50	0		CDAARO
CO[C@H](C)CC(=O)NC[C@@H]1CCC[N@@H+](C(C)C)C1	ZINC000084597485	483296857	/nfs/dbraw/zinc/29/68/57/483296857.db2.gz	QBYSCYXNMFQLFV-OLZOCXBDSA-N	1	0	256.390	1.648	50	0		CDAARO
Cc1cc(N2CC[C@H](OCC[NH+]3CCCCC3)C2)ncn1	ZINC000096484309	533908184	/nfs/dbraw/zinc/90/81/84/533908184.db2.gz	MMDWLKXDLLYOKX-HNNXBMFYSA-N	1	0	290.411	1.866	50	0		CDAARO
Cc1cc(C(=O)N(C)[C@@H]2CC[NH2+]C2)nn1C(C)(C)C	ZINC000179081879	526226841	/nfs/dbraw/zinc/22/68/41/526226841.db2.gz	GEGVXEBXNLXLKD-LLVKDONJSA-N	1	0	264.373	1.380	50	0		CDAARO
CC(C)N(CC[NH+](C)C)C(=O)Nc1cccnn1	ZINC000096500848	528900476	/nfs/dbraw/zinc/90/04/76/528900476.db2.gz	GJNXKXPKELXTHH-UHFFFAOYSA-N	1	0	251.334	1.281	50	0		CDAARO
CC[C@@H]([NH2+]C[C@@H]1CCOC1)c1cccc(S(N)(=O)=O)c1	ZINC000096501605	529176869	/nfs/dbraw/zinc/17/68/69/529176869.db2.gz	LWKUHQOBWQGQBP-SMDDNHRTSA-N	1	0	298.408	1.411	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1N1CCC[C@H](COC)C1	ZINC000091461892	536070480	/nfs/dbraw/zinc/07/04/80/536070480.db2.gz	FERBOFAWMNMPMT-NSHDSACASA-N	1	0	264.373	1.792	50	0		CDAARO
C[C@]1(CNS(C)(=O)=O)CCC[N@@H+]1Cc1ccccc1	ZINC000097165460	567905434	/nfs/dbraw/zinc/90/54/34/567905434.db2.gz	VISWRJGICLJNME-CQSZACIVSA-N	1	0	282.409	1.590	50	0		CDAARO
NC[C@@H]1CC[C@H]([C@H]2CC[C@H](C(F)(F)F)NC2)C[NH2+]1	ZINC000757211930	574906523	/nfs/dbraw/zinc/90/65/23/574906523.db2.gz	JJIVXKCAOKVNDZ-XWLWVQCSSA-N	1	0	265.323	1.244	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)NCc1nnc2ccccn21	ZINC000952966062	685602936	/nfs/dbraw/zinc/60/29/36/685602936.db2.gz	DYNKYJVFJSOUIU-UHFFFAOYSA-N	1	0	287.367	1.222	50	0		CDAARO
CSc1ncc(C[NH2+]Cc2c(C)nn(C)c2C)n1C	ZINC000952985792	684696711	/nfs/dbraw/zinc/69/67/11/684696711.db2.gz	DKYWJTRDZUUHNZ-UHFFFAOYSA-N	1	0	279.413	1.782	50	0		CDAARO
c1ccc(C[NH+]2CCC(NN3CCOCC3)CC2)cc1	ZINC000019169867	684779529	/nfs/dbraw/zinc/77/95/29/684779529.db2.gz	POYWDVUWOJRSSD-UHFFFAOYSA-N	1	0	275.396	1.488	50	0		CDAARO
[NH3+][C@H](CC(=O)N1CC(OCC(F)F)C1)c1ccccc1	ZINC000707215650	684820304	/nfs/dbraw/zinc/82/03/04/684820304.db2.gz	MRZZBGWGRAUXDQ-GFCCVEGCSA-N	1	0	284.306	1.569	50	0		CDAARO
OC[C@@H]1CCCN(CC[NH2+]Cc2ccc(F)c(F)c2)C1	ZINC000952972049	685220486	/nfs/dbraw/zinc/22/04/86/685220486.db2.gz	YZHRQAOLHDVIDN-CYBMUJFWSA-N	1	0	284.350	1.759	50	0		CDAARO
CCOc1cnc(C(=O)N[C@@H]2CCC[N@H+](CC)C2)cn1	ZINC000189202263	685833615	/nfs/dbraw/zinc/83/36/15/685833615.db2.gz	ZFQPCATYXNSUQA-LLVKDONJSA-N	1	0	278.356	1.089	50	0		CDAARO
COCCn1cncc1CNC(=O)C(C)(C)[NH+]1CCCC1	ZINC000426495582	686012580	/nfs/dbraw/zinc/01/25/80/686012580.db2.gz	ILQSQUNTXIQXDH-UHFFFAOYSA-N	1	0	294.399	1.020	50	0		CDAARO
O=C(C=C1CC[NH2+]CC1)NCC[C@H]1CCCCO1	ZINC000852884375	686638274	/nfs/dbraw/zinc/63/82/74/686638274.db2.gz	KBFPDLQMHMTGBE-CYBMUJFWSA-N	1	0	252.358	1.372	50	0		CDAARO
O=C(COc1ccc2c(c1)CCC2)N1C[C@H]2C[NH2+]C[C@H]2C1	ZINC000195274448	686988043	/nfs/dbraw/zinc/98/80/43/686988043.db2.gz	BJEDBBBCJUUJIA-GASCZTMLSA-N	1	0	286.375	1.232	50	0		CDAARO
Cc1cnc(N2CCC([NH+]3CCSCC3)CC2)nc1N	ZINC000032541459	687098002	/nfs/dbraw/zinc/09/80/02/687098002.db2.gz	KKAMWGRJUFLGDN-UHFFFAOYSA-N	1	0	293.440	1.385	50	0		CDAARO
O=C1CC[C@H]([NH2+]CCc2c[nH]cn2)CCN1CC1CC1	ZINC000952981398	688176650	/nfs/dbraw/zinc/17/66/50/688176650.db2.gz	SXAPDRFNLGTIIQ-ZDUSSCGKSA-N	1	0	276.384	1.333	50	0		CDAARO
CC(C)=CCC[N@@H+]1CCCN(C(=O)[C@@H]2CCC(=O)N2)CC1	ZINC001772709918	1159444629	/nfs/dbraw/zinc/44/46/29/1159444629.db2.gz	KRFJRHPYFRYSJL-AWEZNQCLSA-N	1	0	293.411	1.156	50	0		CDAARO
Cc1ncc(C[N@H+](CCO)CCc2ccccc2)[nH]1	ZINC001704307353	1177681400	/nfs/dbraw/zinc/68/14/00/1177681400.db2.gz	XTCBLKVGUSPDKD-UHFFFAOYSA-N	1	0	259.353	1.755	50	0		CDAARO
CN(C)c1nccnc1NC[C@H]1CC2(CO1)CC[NH2+]CC2	ZINC001704331282	1177691078	/nfs/dbraw/zinc/69/10/78/1177691078.db2.gz	LPFPTUCQFWXCSL-GFCCVEGCSA-N	1	0	291.399	1.113	50	0		CDAARO
c1cc(-c2nc(CO[C@H]3CCC[NH2+]C3)no2)ccn1	ZINC000675016764	899873418	/nfs/dbraw/zinc/87/34/18/899873418.db2.gz	KNRAZHRGVMFDSD-NSHDSACASA-N	1	0	260.297	1.400	50	0		CDAARO
C[NH2+]Cc1nc(-c2ccco2)nn1CC(C)(C)O	ZINC000952872231	910424553	/nfs/dbraw/zinc/42/45/53/910424553.db2.gz	KYNKCUWSIXWTJY-UHFFFAOYSA-N	1	0	250.302	1.028	50	0		CDAARO
CCc1ncc(CN(C)C[C@H]2CC[N@@H+](CC)C2)cn1	ZINC000823104884	925672893	/nfs/dbraw/zinc/67/28/93/925672893.db2.gz	DVDPTXIZBLDANS-CYBMUJFWSA-N	1	0	262.401	1.813	50	0		CDAARO
CN1CCC([NH2+]C[C@H]2Cc3ccccc3CN2C)CC1	ZINC000823764773	925727936	/nfs/dbraw/zinc/72/79/36/925727936.db2.gz	FIBDOQCWAGZSDB-QGZVFWFLSA-N	1	0	273.424	1.727	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1CCNC(=O)c1cscn1	ZINC000581813294	927202122	/nfs/dbraw/zinc/20/21/22/927202122.db2.gz	SMHLXFBQRODPMY-UHFFFAOYSA-N	1	0	276.365	1.955	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@@H]1C(=O)NCCc1ccccn1	ZINC000585120678	930992063	/nfs/dbraw/zinc/99/20/63/930992063.db2.gz	AQXSGZPAMITGQS-CYBMUJFWSA-N	1	0	261.369	1.613	50	0		CDAARO
Cc1ccc(=O)n(CC2CC[NH+](CC(C)C)CC2)n1	ZINC000585503403	932837185	/nfs/dbraw/zinc/83/71/85/932837185.db2.gz	PRGNSMWOPKWIIZ-UHFFFAOYSA-N	1	0	263.385	1.920	50	0		CDAARO
C[N@H+](CCn1cnnc1)Cc1cccc2cnccc21	ZINC001529187449	969007584	/nfs/dbraw/zinc/00/75/84/969007584.db2.gz	SNTGGUDLJSLLEB-UHFFFAOYSA-N	1	0	267.336	1.958	50	0		CDAARO
COCC(=O)Nc1ccc(NC(=O)[C@@H]2CCC[NH2+]2)cc1C	ZINC001506396186	975147683	/nfs/dbraw/zinc/14/76/83/975147683.db2.gz	QCODQYCPPPKTIT-ZDUSSCGKSA-N	1	0	291.351	1.270	50	0		CDAARO
Cn1ccnc1-c1ccc(NC[C@]2(C)CC[N@H+](C)C2)nn1	ZINC001506401304	975150755	/nfs/dbraw/zinc/15/07/55/975150755.db2.gz	IRVHCECXNWMDID-HNNXBMFYSA-N	1	0	286.383	1.631	50	0		CDAARO
OC[C@@H](C[NH2+]C1CSCCSC1)Cc1ccco1	ZINC001506410489	975152916	/nfs/dbraw/zinc/15/29/16/975152916.db2.gz	UHSTXQCQJJVGMS-LLVKDONJSA-N	1	0	287.450	1.869	50	0		CDAARO
CCNC(=O)c1ccc(NC(=O)[C@H](C)[NH3+])cc1Cl	ZINC001506415164	975156032	/nfs/dbraw/zinc/15/60/32/975156032.db2.gz	WLEYQEXPIHQBCU-ZETCQYMHSA-N	1	0	269.732	1.375	50	0		CDAARO
C[N@@H+]1CC[C@H](NC(=O)/C=C/c2cc(CO)cs2)C1	ZINC001506419398	975157424	/nfs/dbraw/zinc/15/74/24/975157424.db2.gz	ZVNVHGNRORSVOQ-VUDBWIFFSA-N	1	0	266.366	1.074	50	0		CDAARO
Cn1ccnc1CC[N@H+](C)C[C@H]1Cc2ccccc2CN1C	ZINC001506430112	975161845	/nfs/dbraw/zinc/16/18/45/975161845.db2.gz	XCKGNASVRXFTMW-QGZVFWFLSA-N	1	0	298.434	1.951	50	0		CDAARO
C[C@H](C(=O)NC[C@H](O)C1CCOCC1)[NH+]1CCCCCC1	ZINC000096436967	230372154	/nfs/dbraw/zinc/37/21/54/230372154.db2.gz	ZQNLNZHNAYVBTF-HIFRSBDPSA-N	1	0	298.427	1.155	50	0		CDAARO
Cc1ncsc1CN1CCC[C@H]1C[N@@H+]1CCC[C@@H]1CO	ZINC000096490086	230382436	/nfs/dbraw/zinc/38/24/36/230382436.db2.gz	JKENYPXAEQBNHO-UONOGXRCSA-N	1	0	295.452	1.873	50	0		CDAARO
O=C(C1CCC1)N1CCC[N@@H+]([C@H]2CCCOC2)CC1	ZINC000584903152	341986532	/nfs/dbraw/zinc/98/65/32/341986532.db2.gz	YNWDSZMKHKGNOH-AWEZNQCLSA-N	1	0	266.385	1.500	50	0		CDAARO
Cc1cc(C(=O)N2CCN(C)[C@H](CCO)C2)sc1C	ZINC000584902746	341987018	/nfs/dbraw/zinc/98/70/18/341987018.db2.gz	QVLCYAYMSWQDAM-GFCCVEGCSA-N	1	0	282.409	1.504	50	0		CDAARO
CCn1nc(CO)c2c1CCN(Cc1ccoc1)C2	ZINC000584903574	341987241	/nfs/dbraw/zinc/98/72/41/341987241.db2.gz	VSVZAETVQJEYJM-UHFFFAOYSA-N	1	0	261.325	1.547	50	0		CDAARO
c1ccc(C[N@@H+]2CC[C@H](Nc3ncncn3)C2)cc1	ZINC000220558207	230397610	/nfs/dbraw/zinc/39/76/10/230397610.db2.gz	NRDNBSPYHRNLDR-ZDUSSCGKSA-N	1	0	255.325	1.558	50	0		CDAARO
CC[N@H+](Cc1ccc(C(=O)N2CC(O)C2)cc1)C1CC1	ZINC000095967823	185047006	/nfs/dbraw/zinc/04/70/06/185047006.db2.gz	UTCFAHYJYYEAKT-UHFFFAOYSA-N	1	0	274.364	1.488	50	0		CDAARO
CC[C@@H](O)C[NH2+][C@@H](CO)c1cc(F)c(F)c(F)c1	ZINC000096006504	185063281	/nfs/dbraw/zinc/06/32/81/185063281.db2.gz	FYZLTFMRGZHOMW-KCJUWKMLSA-N	1	0	263.259	1.498	50	0		CDAARO
COc1ccc(OCC[N@H+](C)[C@@H](C)C[S@@](C)=O)cc1	ZINC000096012898	185065892	/nfs/dbraw/zinc/06/58/92/185065892.db2.gz	NOGUJTHNANSQPL-BUXKBTBVSA-N	1	0	285.409	1.773	50	0		CDAARO
C[C@@H]1CC[N@H+](C[C@@H](O)COC(C)(C)C)CCS1	ZINC000248979596	361771032	/nfs/dbraw/zinc/77/10/32/361771032.db2.gz	FIQNDXGUDAJWIW-VXGBXAGGSA-N	1	0	261.431	1.990	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@H](CO)C2)ccc1O	ZINC000023115118	342089053	/nfs/dbraw/zinc/08/90/53/342089053.db2.gz	NZFPAOIVNXCIEP-LBPRGKRZSA-N	1	0	251.326	1.605	50	0		CDAARO
Cc1nc(C(=O)NCC[N@@H+]2CCCC[C@H]2CO)cs1	ZINC000096140509	185105375	/nfs/dbraw/zinc/10/53/75/185105375.db2.gz	GMODJLUSAVOYPQ-NSHDSACASA-N	1	0	283.397	1.028	50	0		CDAARO
CN1CCC([NH2+][C@@H]2CC(=O)N(c3ccccc3)C2)CC1	ZINC000095421057	539087949	/nfs/dbraw/zinc/08/79/49/539087949.db2.gz	HJRYYHHUJLMNMN-CQSZACIVSA-N	1	0	273.380	1.476	50	0		CDAARO
OC[C@@H]1CCC[N@@H+]1C[C@H]1CCCN1c1ncc(Cl)cn1	ZINC000252476873	361841029	/nfs/dbraw/zinc/84/10/29/361841029.db2.gz	CWOLRFWBQSVZCT-OLZOCXBDSA-N	1	0	296.802	1.556	50	0		CDAARO
Cc1noc(C)c1CN(C)C(=O)[C@H]1Cc2ccccc2C[NH2+]1	ZINC000095951321	539088174	/nfs/dbraw/zinc/08/81/74/539088174.db2.gz	SFYIOCFOBXDJTB-MRXNPFEDSA-N	1	0	299.374	1.964	50	0		CDAARO
CC(C)[N@H+](C)CCNc1cc([C@H]2C[C@@H](O)C2)ncn1	ZINC000244900082	361869753	/nfs/dbraw/zinc/86/97/53/361869753.db2.gz	ZVQBKVDICLNWDS-TXEJJXNPSA-N	1	0	264.373	1.467	50	0		CDAARO
CC(C)OC[C@@H](O)C[N@H+](C)CCOc1ccc(F)cc1	ZINC000096968027	185143098	/nfs/dbraw/zinc/14/30/98/185143098.db2.gz	DISIOCNQIDSOSX-AWEZNQCLSA-N	1	0	285.359	1.922	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OC[C@H]1CCCNC1=O	ZINC000585133973	342215810	/nfs/dbraw/zinc/21/58/10/342215810.db2.gz	PAKIWQGUEXDWRP-NWDGAFQWSA-N	1	0	270.373	1.067	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@@H]1NC(=O)C[C@H](O)c1ccccc1	ZINC000585136737	342215972	/nfs/dbraw/zinc/21/59/72/342215972.db2.gz	QYLBBEAQZSIIMX-UNIGVISCSA-N	1	0	276.380	1.613	50	0		CDAARO
O=C(NCCC[NH2+][C@@H]1CCCNC(=O)C1)c1cccs1	ZINC000585134820	342215551	/nfs/dbraw/zinc/21/55/51/342215551.db2.gz	KTWCFVLQDHHNHM-LLVKDONJSA-N	1	0	295.408	1.126	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@H]2COc3ccccc32)C[C@@H]1[NH+](C)C	ZINC000685939523	539045716	/nfs/dbraw/zinc/04/57/16/539045716.db2.gz	JYZXTYZNUKKJFX-SNPRPXQTSA-N	1	0	288.391	1.961	50	0		CDAARO
Cc1ccnc(C[NH2+][C@H]2CCC[C@@H](S(C)(=O)=O)C2)c1	ZINC000392826400	539061310	/nfs/dbraw/zinc/06/13/10/539061310.db2.gz	LSOWCJBLNDBORA-GXTWGEPZSA-N	1	0	282.409	1.835	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCC([C@@H](O)c2ccc(F)cc2)CC1	ZINC000129786826	529555956	/nfs/dbraw/zinc/55/59/56/529555956.db2.gz	SMXYQUFXRLNLPV-CABCVRRESA-N	1	0	294.370	1.835	50	0		CDAARO
C[C@@H]1C[C@H](C)C[N@@H+](CCNC(=O)c2cc(C3CC3)n[nH]2)C1	ZINC000036394388	362060163	/nfs/dbraw/zinc/06/01/63/362060163.db2.gz	ORHHEFURZAZZFW-TXEJJXNPSA-N	1	0	290.411	1.995	50	0		CDAARO
Cc1ccc(C)c(CC(=O)N2CCO[C@@H]([C@@H](C)[NH3+])C2)c1	ZINC000127868246	187338361	/nfs/dbraw/zinc/33/83/61/187338361.db2.gz	MCRWVYRTFWGVLE-UKRRQHHQSA-N	1	0	276.380	1.421	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@@H]2COc3ccc(Cl)cc3C2)C1	ZINC000178516690	362245849	/nfs/dbraw/zinc/24/58/49/362245849.db2.gz	PAIOCXSARRSALD-JQWIXIFHSA-N	1	0	294.782	1.698	50	0		CDAARO
C[NH+]1CCN(Cc2cccc(C(=O)NC3(C)CC3)c2)CC1	ZINC000096444754	529774176	/nfs/dbraw/zinc/77/41/76/529774176.db2.gz	HVKVARMMKSXSEN-UHFFFAOYSA-N	1	0	287.407	1.716	50	0		CDAARO
C[C@H](NC(=O)N[C@@H]1CCCC[C@@H]1O)C(C)(C)C[NH+](C)C	ZINC000084139561	362260019	/nfs/dbraw/zinc/26/00/19/362260019.db2.gz	BZASLPIMKDGYFN-XQQFMLRXSA-N	1	0	285.432	1.565	50	0		CDAARO
C[C@@H]([NH2+]Cc1nncn1-c1ccccc1)[C@H]1CCCO1	ZINC000273186153	192069051	/nfs/dbraw/zinc/06/90/51/192069051.db2.gz	PCOKWTZMPIWHCM-TZMCWYRMSA-N	1	0	272.352	1.924	50	0		CDAARO
C[C@H](CN1CCN(c2cccc(O)c2)CC1)[NH+]1CCCC1	ZINC000252479838	362384225	/nfs/dbraw/zinc/38/42/25/362384225.db2.gz	BNQDJADHHGCSSS-OAHLLOKOSA-N	1	0	289.423	1.999	50	0		CDAARO
COC[C@H](c1ccccn1)[N@H+](C)CCc1cn[nH]c1	ZINC000252499170	362388924	/nfs/dbraw/zinc/38/89/24/362388924.db2.gz	RWNGRKOVDDNREV-CQSZACIVSA-N	1	0	260.341	1.667	50	0		CDAARO
C[C@@H]1C[N@H+](CCC(=O)NCc2cccs2)CCCO1	ZINC000252509507	362390089	/nfs/dbraw/zinc/39/00/89/362390089.db2.gz	YOWSOAYSWPIOPV-GFCCVEGCSA-N	1	0	282.409	1.865	50	0		CDAARO
CC(=O)N1CCC(C[NH2+]C2CSCCSC2)CC1	ZINC000584884703	349342214	/nfs/dbraw/zinc/34/22/14/349342214.db2.gz	YUYZYKJHLQRNNJ-UHFFFAOYSA-N	1	0	288.482	1.683	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@H]1CNC(=O)c1cncn1C	ZINC000584886188	349343861	/nfs/dbraw/zinc/34/38/61/349343861.db2.gz	KJDVOXUDLWZHET-NSHDSACASA-N	1	0	250.346	1.023	50	0		CDAARO
NC(=O)[C@@H]1CC=CC[C@H]1NC(=O)C[NH+]1CCCCCCC1	ZINC000584888612	349347409	/nfs/dbraw/zinc/34/74/09/349347409.db2.gz	JDLOXPGDOWSBIG-ZIAGYGMSSA-N	1	0	293.411	1.189	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1NCCc1nc(C)c[nH]1	ZINC000091256054	180114773	/nfs/dbraw/zinc/11/47/73/180114773.db2.gz	MFYKCTRLDIYSIF-UHFFFAOYSA-N	1	0	260.345	1.616	50	0		CDAARO
CCN(Cc1ccccc1Cl)C(=O)C1C[NH2+]C1	ZINC000091415156	180149580	/nfs/dbraw/zinc/14/95/80/180149580.db2.gz	WZOAOBPVFCBSLJ-UHFFFAOYSA-N	1	0	252.745	1.908	50	0		CDAARO
C[C@@H]1C[N@H+](CCC(=O)NCc2ccc(F)cc2)C[C@]1(C)O	ZINC000091574855	180197334	/nfs/dbraw/zinc/19/73/34/180197334.db2.gz	JXBNWJAGSHBNHJ-WBMJQRKESA-N	1	0	294.370	1.535	50	0		CDAARO
CN(CCOc1ccccc1F)C(=O)[C@@H]1CC[C@H]([NH3+])C1	ZINC000091544108	180185063	/nfs/dbraw/zinc/18/50/63/180185063.db2.gz	MNRKJWFPKXXKOL-NEPJUHHUSA-N	1	0	280.343	1.790	50	0		CDAARO
COc1ccccc1S(=O)(=O)N1C[C@H]([NH3+])[C@@H](C(C)C)C1	ZINC000091655993	180217983	/nfs/dbraw/zinc/21/79/83/180217983.db2.gz	JYIOGSVFBGCGPJ-NEPJUHHUSA-N	1	0	298.408	1.299	50	0		CDAARO
COCC[C@@]1(CO)CCC[N@H+](Cc2c(C)n[nH]c2C)C1	ZINC000091713477	180231294	/nfs/dbraw/zinc/23/12/94/180231294.db2.gz	MGPXUYFXPWUBJA-HNNXBMFYSA-N	1	0	281.400	1.638	50	0		CDAARO
CN1CCO[C@@H](C[NH2+]Cc2ccc(F)c(F)c2)C1	ZINC000105472308	186059356	/nfs/dbraw/zinc/05/93/56/186059356.db2.gz	UJOOXNQJNIKGRA-NSHDSACASA-N	1	0	256.296	1.385	50	0		CDAARO
CCCCc1c(C)[nH+]c(N)nc1N1CC[C@@H](C(=O)NC)C1	ZINC000091857995	180274742	/nfs/dbraw/zinc/27/47/42/180274742.db2.gz	OUSMGYAZQBJGEK-LLVKDONJSA-N	1	0	291.399	1.282	50	0		CDAARO
Cc1cc(CNC(=O)CC[C@H]2CCC[N@H+](C)C2)n(C)n1	ZINC000091908381	180284548	/nfs/dbraw/zinc/28/45/48/180284548.db2.gz	SDITWYPNWNRDDK-CYBMUJFWSA-N	1	0	278.400	1.467	50	0		CDAARO
CC(=O)N1C[C@H]2CC[C@H](C[N@H+]2Cc2cccc(C)n2)C1	ZINC000092020226	180307466	/nfs/dbraw/zinc/30/74/66/180307466.db2.gz	XYZWFVANDPUIEV-GOEBONIOSA-N	1	0	273.380	1.833	50	0		CDAARO
Cn1cc(C[N@@H+]2CCC[C@@](CO)(CC3CC3)C2)cn1	ZINC000092062078	180315583	/nfs/dbraw/zinc/31/55/83/180315583.db2.gz	MZJCEBVRVJDOHZ-OAHLLOKOSA-N	1	0	263.385	1.795	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CCNC(=O)N1CCC[C@@H](CCO)C1	ZINC000106838816	186138469	/nfs/dbraw/zinc/13/84/69/186138469.db2.gz	QQZVQCZLVQURQO-GJZGRUSLSA-N	1	0	297.443	1.665	50	0		CDAARO
CC1(C)C(=O)NCCN1C(=O)CC[C@@H]([NH3+])c1ccccc1	ZINC000110665773	186311302	/nfs/dbraw/zinc/31/13/02/186311302.db2.gz	BNSQGJXAROFQDL-CYBMUJFWSA-N	1	0	289.379	1.204	50	0		CDAARO
Cc1ccc(CC(=O)N[C@H](C)[C@@H]2CCCC[NH2+]2)cn1	ZINC000583651845	366017915	/nfs/dbraw/zinc/01/79/15/366017915.db2.gz	UGDHREFFTITJIN-OCCSQVGLSA-N	1	0	261.369	1.579	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1ccc2c(c1)C[C@H](C)O2	ZINC000124919413	351385809	/nfs/dbraw/zinc/38/58/09/351385809.db2.gz	OTGLZHXRWPQFTE-CMPLNLGQSA-N	1	0	298.408	1.416	50	0		CDAARO
COc1ccc2c3c1O[C@@H]1[C@@H](O)C=C[C@@H]4[C@@H](C2)[N@@H+](C)CC[C@]314	ZINC000000490121	355913881	/nfs/dbraw/zinc/91/38/81/355913881.db2.gz	OROGSEYTTFOCAN-HXHAXSGFSA-N	1	0	299.370	1.501	50	0	in-vitro	CDAARO
COc1ccccc1/C(C)=C\C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000255276317	356032675	/nfs/dbraw/zinc/03/26/75/356032675.db2.gz	MCPLYNCXVBIVTG-KXXVWKPMSA-N	1	0	274.364	1.919	50	0		CDAARO
C[C@H]([NH2+]CC(=O)NCc1ccc(F)cc1)[C@@H]1CCCO1	ZINC000097374120	356094729	/nfs/dbraw/zinc/09/47/29/356094729.db2.gz	NNPSNGLPANITQW-FZMZJTMJSA-N	1	0	280.343	1.599	50	0		CDAARO
Cc1nc(N2CC[NH+](C)CC2)[nH]c(=O)c1Cc1ccccc1	ZINC000009348325	356226718	/nfs/dbraw/zinc/22/67/18/356226718.db2.gz	QOJNMYLYKDVUFY-UHFFFAOYSA-N	1	0	298.390	1.421	50	0		CDAARO
Cc1ccc(Nc2cc(N3CC[NH2+]CC3)cnn2)cc1	ZINC000032624412	356322091	/nfs/dbraw/zinc/32/20/91/356322091.db2.gz	TVWZVHRWCRCFFA-UHFFFAOYSA-N	1	0	269.352	1.938	50	0		CDAARO
COc1cccc2c1OC[C@H]([NH2+]CCn1cccn1)C2	ZINC000012301371	356292955	/nfs/dbraw/zinc/29/29/55/356292955.db2.gz	WJWBCLNDCKDYQJ-CYBMUJFWSA-N	1	0	273.336	1.485	50	0		CDAARO
CC(=O)c1ccccc1OCC[NH+]1CCC(O)CC1	ZINC000032667618	356332954	/nfs/dbraw/zinc/33/29/54/356332954.db2.gz	PIWYCXLFOICCRJ-UHFFFAOYSA-N	1	0	263.337	1.725	50	0		CDAARO
Cc1cc(C(=O)NCc2cccnc2N(C)C)on1	ZINC000032688137	356334398	/nfs/dbraw/zinc/33/43/98/356334398.db2.gz	STUPZPQOMWSXTP-UHFFFAOYSA-N	1	0	260.297	1.374	50	0		CDAARO
C[NH+](C)CCNC(=O)c1cc(Br)cs1	ZINC000013746785	356355341	/nfs/dbraw/zinc/35/53/41/356355341.db2.gz	QUWIDXSEAUGAHV-UHFFFAOYSA-N	1	0	277.187	1.802	50	0		CDAARO
C[C@@H]1CN(C[C@@H](O)COc2ccccc2)C[C@H](C)O1	ZINC000014359601	356386160	/nfs/dbraw/zinc/38/61/60/356386160.db2.gz	SMXAAYNAUFATPY-HZSPNIEDSA-N	1	0	265.353	1.536	50	0		CDAARO
CC[n+]1c(C)n(C)c2cc(S(=O)(=O)N(C)C)ccc21	ZINC000015961619	356428264	/nfs/dbraw/zinc/42/82/64/356428264.db2.gz	ZFAFHUYPGAAPCW-UHFFFAOYSA-N	1	0	282.389	1.044	50	0		CDAARO
COc1ccc(CN2CC[NH+](C)CC2)c(OC)c1	ZINC000019537098	356491182	/nfs/dbraw/zinc/49/11/82/356491182.db2.gz	FDWUACWVIJVFOF-UHFFFAOYSA-N	1	0	250.342	1.451	50	0		CDAARO
CCc1ccc(OCCOCCNCC[NH3+])cc1	ZINC000019772475	356501081	/nfs/dbraw/zinc/50/10/81/356501081.db2.gz	RYRJCGNNYCCCOX-UHFFFAOYSA-N	1	0	252.358	1.193	50	0		CDAARO
C[N@@H+]1CCC[C@@H](N2CCN(c3ccccc3)CC2)C1	ZINC000019774146	356502105	/nfs/dbraw/zinc/50/21/05/356502105.db2.gz	KRDOHUGSALCVFQ-MRXNPFEDSA-N	1	0	259.397	1.903	50	0		CDAARO
C[C@@H]1CN(C(=O)C(C)(C)n2cc(Cl)cn2)C[C@H]1[NH+](C)C	ZINC000078896452	538476891	/nfs/dbraw/zinc/47/68/91/538476891.db2.gz	VNYOOFCPBOGLOF-ZYHUDNBSSA-N	1	0	298.818	1.680	50	0		CDAARO
CNC(=O)NC(=O)[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1OC	ZINC000024865234	356663481	/nfs/dbraw/zinc/66/34/81/356663481.db2.gz	IKPIKVIWHDZQKS-WDEREUQCSA-N	1	0	293.367	1.498	50	0		CDAARO
C[C@@H]([NH2+]CC1(c2ccccc2)CCCC1)C(=O)NC(N)=O	ZINC000025898361	356685848	/nfs/dbraw/zinc/68/58/48/356685848.db2.gz	GBUJKBHFRNTWDZ-GFCCVEGCSA-N	1	0	289.379	1.671	50	0		CDAARO
c1n[nH]cc1CCC[N@@H+]1CCCC[C@H]1CN1CCOCC1	ZINC000032498400	356780517	/nfs/dbraw/zinc/78/05/17/356780517.db2.gz	RXJPXKFSYLTAKJ-INIZCTEOSA-N	1	0	292.427	1.529	50	0		CDAARO
OCCN1CC[NH+]([C@H]2CCc3ccccc3C2)CC1	ZINC000023282392	356816752	/nfs/dbraw/zinc/81/67/52/356816752.db2.gz	GYGVGXZFOWNKHR-INIZCTEOSA-N	1	0	260.381	1.154	50	0		CDAARO
C[C@@H]([NH2+]C[C@@H]1CCN(S(C)(=O)=O)C1)c1ccsc1	ZINC000090797587	356831552	/nfs/dbraw/zinc/83/15/52/356831552.db2.gz	DXKNFBOZLPELMJ-MNOVXSKESA-N	1	0	288.438	1.680	50	0		CDAARO
C[N@@H+]1Cc2ccccc2C[C@@H]1CNc1ncnc2nc[nH]c21	ZINC000032519382	356781645	/nfs/dbraw/zinc/78/16/45/356781645.db2.gz	GBEXVQBTQQUTKD-CYBMUJFWSA-N	1	0	294.362	1.822	50	0		CDAARO
CC(C)c1nc(-c2ccnc(N3CC[NH2+]CC3)n2)no1	ZINC000036532792	356873995	/nfs/dbraw/zinc/87/39/95/356873995.db2.gz	HVWCATYMGKQKLU-UHFFFAOYSA-N	1	0	274.328	1.060	50	0		CDAARO
C[NH2+]CC(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000037822446	356936927	/nfs/dbraw/zinc/93/69/27/356936927.db2.gz	FWWMESRISCGHGG-GFCCVEGCSA-N	1	0	268.744	1.459	50	0		CDAARO
C[C@@H]1C[NH+](CCCCNc2ncc(F)cn2)C[C@@H](C)O1	ZINC000269529607	357077649	/nfs/dbraw/zinc/07/76/49/357077649.db2.gz	YDTPLFGLKSZJHI-VXGBXAGGSA-N	1	0	282.363	1.917	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CCC(=O)N1CC(n2cccn2)C1	ZINC000065399231	357537806	/nfs/dbraw/zinc/53/78/06/357537806.db2.gz	DGHADBNZFZZICO-ZDUSSCGKSA-N	1	0	276.384	1.531	50	0		CDAARO
CCCCN(C)c1cc(C)[nH+]c(N2CCOCC2)n1	ZINC000065410074	357539273	/nfs/dbraw/zinc/53/92/73/357539273.db2.gz	VDOGZUUMPQXRLK-UHFFFAOYSA-N	1	0	264.373	1.858	50	0		CDAARO
CCN(C(=O)CC[N@@H+]1CCC[C@@H](O)C1)c1ccccc1	ZINC000065530064	357548113	/nfs/dbraw/zinc/54/81/13/357548113.db2.gz	GCHCUINVZUBOGU-OAHLLOKOSA-N	1	0	276.380	1.886	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CCC[NH2+][C@@H]2C)c(C)c1	ZINC000091496856	357602787	/nfs/dbraw/zinc/60/27/87/357602787.db2.gz	KYZNYRGCPAPKPY-CHWSQXEVSA-N	1	0	282.409	1.722	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@H](CCNC(=O)C2([NH3+])CCCC2)C1	ZINC000067955023	357640037	/nfs/dbraw/zinc/64/00/37/357640037.db2.gz	SYLDIRPOFVFXGT-CQSZACIVSA-N	1	0	297.443	1.121	50	0		CDAARO
C[NH+]1CCC(Cc2noc([C@](C)(O)C(F)(F)F)n2)CC1	ZINC000067840373	357631679	/nfs/dbraw/zinc/63/16/79/357631679.db2.gz	PUFYWBURHUBIKO-NSHDSACASA-N	1	0	293.289	1.724	50	0		CDAARO
Cc1cc2c(c(-c3cccc(N)n3)c1)O[C@@H](C[NH3+])C2	ZINC000067910311	357637580	/nfs/dbraw/zinc/63/75/80/357637580.db2.gz	QVERDXCFXVJOFX-LLVKDONJSA-N	1	0	255.321	1.901	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)CC[NH2+]1	ZINC000188456813	357689018	/nfs/dbraw/zinc/68/90/18/357689018.db2.gz	ZHQLSTPEPTZABL-SUZMYJTESA-N	1	0	280.318	1.889	50	0		CDAARO
COC(=O)C1(C[NH2+]Cc2nc(C)cs2)CCOCC1	ZINC000097108635	357984378	/nfs/dbraw/zinc/98/43/78/357984378.db2.gz	YCTVHJHXZKTSNI-UHFFFAOYSA-N	1	0	284.381	1.511	50	0		CDAARO
C[C@@H]1Cc2cc(S(=O)(=O)N[C@H](C[NH3+])C3CC3)ccc2O1	ZINC000097229370	358043190	/nfs/dbraw/zinc/04/31/90/358043190.db2.gz	RIVZJDXJLOHCKN-NOZJJQNGSA-N	1	0	296.392	1.026	50	0		CDAARO
CCC[C@H](C)C[N@@H+]1CC[C@H](S(=O)(=O)NCC)C1	ZINC000097235514	358050520	/nfs/dbraw/zinc/05/05/20/358050520.db2.gz	ZJXKONBRHZRZMI-RYUDHWBXSA-N	1	0	262.419	1.436	50	0		CDAARO
CCNc1ncc(-c2nccn2CCc2nncn2C)cn1	ZINC000082147329	358149551	/nfs/dbraw/zinc/14/95/51/358149551.db2.gz	QOQQMWUUQNQSPR-UHFFFAOYSA-N	1	0	298.354	1.143	50	0		CDAARO
CCc1ncc(NC(=O)N(CC[NH+](C)C)C(C)C)cn1	ZINC000097081511	358159078	/nfs/dbraw/zinc/15/90/78/358159078.db2.gz	ABURIUDZTDTSCT-UHFFFAOYSA-N	1	0	279.388	1.843	50	0		CDAARO
O=S(=O)(Cc1ccccc1)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000247510299	358551283	/nfs/dbraw/zinc/55/12/83/358551283.db2.gz	PJCXBWFHDXPOAN-AWEZNQCLSA-N	1	0	280.393	1.296	50	0		CDAARO
CC(C)(C(=O)N[C@@H]1CCC[NH2+]C1)c1ccc(F)cc1	ZINC000195542726	358559788	/nfs/dbraw/zinc/55/97/88/358559788.db2.gz	CIRDJAOCGMJUFY-CYBMUJFWSA-N	1	0	264.344	1.972	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@H]2CO)cc2c1OCO2	ZINC000023280125	358655795	/nfs/dbraw/zinc/65/57/95/358655795.db2.gz	BSHNYWYYKXRJGT-NSHDSACASA-N	1	0	265.309	1.381	50	0		CDAARO
OC1(Cn2ccnc2)CC[NH+](Cc2ccccc2)CC1	ZINC000095221180	358680670	/nfs/dbraw/zinc/68/06/70/358680670.db2.gz	GUVQIDJBSBWXEJ-UHFFFAOYSA-N	1	0	271.364	1.910	50	0		CDAARO
Cc1n[nH]c(C)c1CNC(=O)CCC[NH+]1CCCCC1	ZINC000095355680	358684018	/nfs/dbraw/zinc/68/40/18/358684018.db2.gz	CEIYROLRQGWKEZ-UHFFFAOYSA-N	1	0	278.400	1.909	50	0		CDAARO
COCC[N@@H+]1C[C@H]2CC[C@@H]1CN(Cc1cc(C)no1)C2	ZINC000095363398	358685301	/nfs/dbraw/zinc/68/53/01/358685301.db2.gz	HMCZFVOIXQDBKX-UONOGXRCSA-N	1	0	279.384	1.526	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)N1CC(c2ccccn2)C1	ZINC000095377933	358689382	/nfs/dbraw/zinc/68/93/82/358689382.db2.gz	XDQHOERNYJWOGT-OAHLLOKOSA-N	1	0	273.380	1.882	50	0		CDAARO
O=C(CCC[NH+]1CCCCC1)N[C@H]1CCc2n[nH]cc2C1	ZINC000095381144	358690324	/nfs/dbraw/zinc/69/03/24/358690324.db2.gz	BPPZWNDFTKXGPR-AWEZNQCLSA-N	1	0	290.411	1.649	50	0		CDAARO
CCc1nnc(CNC(=O)CC[C@H]2CCCC[N@@H+]2C)s1	ZINC000095388517	358692002	/nfs/dbraw/zinc/69/20/02/358692002.db2.gz	ZALBTLGGCYVOCV-LLVKDONJSA-N	1	0	296.440	1.981	50	0		CDAARO
CC[C@@H]1Cc2ccccc2C[N@@H+]1CCCC(=O)NC(N)=O	ZINC000185802148	358786143	/nfs/dbraw/zinc/78/61/43/358786143.db2.gz	FIBJXYJXDUQMDZ-CQSZACIVSA-N	1	0	289.379	1.798	50	0		CDAARO
CC[N@H+](Cc1ccc(F)c(F)c1)[C@H]1COC[C@@H]1O	ZINC000097610061	358787440	/nfs/dbraw/zinc/78/74/40/358787440.db2.gz	JXQXQSHWUOHTGN-STQMWFEESA-N	1	0	257.280	1.546	50	0		CDAARO
CC[N@H+](Cc1cccc2[nH]ccc21)[C@H]1COC[C@@H]1O	ZINC000215088382	358874714	/nfs/dbraw/zinc/87/47/14/358874714.db2.gz	XTEDTHNOFLBKAO-GJZGRUSLSA-N	1	0	260.337	1.750	50	0		CDAARO
CC(C)(C[NH+]1CCC(c2nnc[nH]2)CC1)N1CCOCC1	ZINC000215309777	358883168	/nfs/dbraw/zinc/88/31/68/358883168.db2.gz	VNCODPDTEZRBHG-UHFFFAOYSA-N	1	0	293.415	1.095	50	0		CDAARO
C[C@H](Oc1cccc(Cl)c1)C(=O)N1CCC[NH2+]CC1	ZINC000041439877	358888030	/nfs/dbraw/zinc/88/80/30/358888030.db2.gz	OILKOVQXFMXDBK-NSHDSACASA-N	1	0	282.771	1.929	50	0		CDAARO
Cc1nnc(CN(C)C(=O)[C@@H](C)[NH+]2CCCCCC2)o1	ZINC000218884517	359069472	/nfs/dbraw/zinc/06/94/72/359069472.db2.gz	RGDUFIZFCGPJCG-LLVKDONJSA-N	1	0	280.372	1.601	50	0		CDAARO
CCC[C@H](NC(=O)CC[NH+]1CCCC1)c1nccn1C	ZINC000218987807	359073895	/nfs/dbraw/zinc/07/38/95/359073895.db2.gz	GCGMWJYCOYOTON-ZDUSSCGKSA-N	1	0	278.400	1.863	50	0		CDAARO
CN(Cc1nccs1)c1cc(C2CC([NH3+])C2)ncn1	ZINC000219319781	359088458	/nfs/dbraw/zinc/08/84/58/359088458.db2.gz	QSVBQYFZZGDYHP-UHFFFAOYSA-N	1	0	275.381	1.774	50	0		CDAARO
Cn1ncc2c1ncnc2S[C@@H]1CCCCNC1=O	ZINC000011685931	359193317	/nfs/dbraw/zinc/19/33/17/359193317.db2.gz	MIOUCWRXULULIN-SECBINFHSA-N	1	0	277.353	1.124	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N(C)CCOc1cccc(C)c1	ZINC000037816498	359452692	/nfs/dbraw/zinc/45/26/92/359452692.db2.gz	ULVSMPBCZRYUJR-ZDUSSCGKSA-N	1	0	250.342	1.570	50	0		CDAARO
C[N@H+](CCC(N)=O)Cc1ccc(Br)o1	ZINC000030536925	359615943	/nfs/dbraw/zinc/61/59/43/359615943.db2.gz	WWQSBSJONMXUEJ-UHFFFAOYSA-N	1	0	261.119	1.349	50	0		CDAARO
C[C@@H]([NH2+]C[C@@H](O)CN1CCCC1=O)c1ccc(F)cc1F	ZINC000089515115	360095072	/nfs/dbraw/zinc/09/50/72/360095072.db2.gz	SGBIGUQYMHCUNR-ZYHUDNBSSA-N	1	0	298.333	1.599	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)N[C@H]1CCCC[C@H]1CO	ZINC000231315715	360054676	/nfs/dbraw/zinc/05/46/76/360054676.db2.gz	QDVBLSFGMSFNRX-STQMWFEESA-N	1	0	254.374	1.043	50	0		CDAARO
O=C(NCc1ccco1)N1CC[NH+](C2CCOCC2)CC1	ZINC000176935989	189015074	/nfs/dbraw/zinc/01/50/74/189015074.db2.gz	DLWGQWXNPKRVFW-UHFFFAOYSA-N	1	0	293.367	1.286	50	0		CDAARO
COc1ccc2c(c1)nc(C)cc2C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000426493025	360574021	/nfs/dbraw/zinc/57/40/21/360574021.db2.gz	AGNQPYMWRJITAY-LBPRGKRZSA-N	1	0	299.374	1.973	50	0		CDAARO
C[C@H](CCC(=O)NCc1ccncc1)[NH+]1CCCC1	ZINC000426358685	360658782	/nfs/dbraw/zinc/65/87/82/360658782.db2.gz	XSVQCDZDPXALCM-CYBMUJFWSA-N	1	0	261.369	1.962	50	0		CDAARO
Cc1nccn1[C@@H](C)C(=O)N(C)CCc1cnn(C)c1	ZINC000426369971	360660050	/nfs/dbraw/zinc/66/00/50/360660050.db2.gz	QEWMKERSWWEOIG-NSHDSACASA-N	1	0	275.356	1.187	50	0		CDAARO
Cn1c(CC[NH3+])nnc1SCc1nccn1C1CC1	ZINC000426443065	360670673	/nfs/dbraw/zinc/67/06/73/360670673.db2.gz	CBYIHTVHEGONAI-UHFFFAOYSA-N	1	0	278.385	1.140	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)COc2ccccc2Cl)C1	ZINC000178555845	189126399	/nfs/dbraw/zinc/12/63/99/189126399.db2.gz	SXDXRCSLGUSJHY-JTQLQIEISA-N	1	0	268.744	1.526	50	0		CDAARO
O=C(Nc1n[nH]c2c1cccc2Cl)[C@@H]1CCC[NH2+]1	ZINC000182821204	189336404	/nfs/dbraw/zinc/33/64/04/189336404.db2.gz	ANVSNPTVLJOULF-VIFPVBQESA-N	1	0	264.716	1.907	50	0		CDAARO
Cn1cc(C[NH2+][C@H]2CC(=O)N(C)C2)c(C2CCCCC2)n1	ZINC000273124509	239046565	/nfs/dbraw/zinc/04/65/65/239046565.db2.gz	RXTPMMWIYQPWIT-AWEZNQCLSA-N	1	0	290.411	1.788	50	0		CDAARO
O=C(NCC1CC[NH+]([C@@H]2CCOC2)CC1)c1ccsc1	ZINC000575415681	364803712	/nfs/dbraw/zinc/80/37/12/364803712.db2.gz	OAMGQYNWEWQCLY-CQSZACIVSA-N	1	0	294.420	1.979	50	0		CDAARO
Cc1c(CNC(=O)[C@@H](C)[N@H+]2[C@H](C)CC[C@@H]2C)cnn1C	ZINC000089882973	366951753	/nfs/dbraw/zinc/95/17/53/366951753.db2.gz	IPKCOFQOZAPJSF-NTZNESFSSA-N	1	0	278.400	1.606	50	0		CDAARO
OC[C@@H]1C[C@H](O)C[N@@H+]1CCSC1CCCCC1	ZINC000252488461	367578229	/nfs/dbraw/zinc/57/82/29/367578229.db2.gz	ISHPOYHPSRVTLM-RYUDHWBXSA-N	1	0	259.415	1.480	50	0		CDAARO
C[NH+]1CCN(c2ccccc2NC(=O)[C@H]2CCCO2)CC1	ZINC000007779276	369262049	/nfs/dbraw/zinc/26/20/49/369262049.db2.gz	SESMRFKJLTTZTN-OAHLLOKOSA-N	1	0	289.379	1.556	50	0		CDAARO
CC[C@@H]1CCCCCN1C(=O)[C@@H]1CN(C)CCO1	ZINC000089948273	370197545	/nfs/dbraw/zinc/19/75/45/370197545.db2.gz	UUJYQBIYORHNFR-OLZOCXBDSA-N	1	0	254.374	1.498	50	0		CDAARO
Cc1oncc1C(=O)NCC1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000575609061	370629095	/nfs/dbraw/zinc/62/90/95/370629095.db2.gz	XZYGAIQFBJOUFK-CYBMUJFWSA-N	1	0	293.367	1.214	50	0		CDAARO
CCOCC[NH2+][C@@H]1COc2ccc(OC)cc2C1	ZINC000295977032	371546653	/nfs/dbraw/zinc/54/66/53/371546653.db2.gz	MZUBXOPZZRRODV-LBPRGKRZSA-N	1	0	251.326	1.625	50	0		CDAARO
Nc1nc(C(=O)NC2(C[NH+]3CCCCC3)CC2)cs1	ZINC000299775661	372752398	/nfs/dbraw/zinc/75/23/98/372752398.db2.gz	GOPXCIRESGAHOF-UHFFFAOYSA-N	1	0	280.397	1.474	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@H]([NH3+])CN1Cc1ccc(Cl)cc1	ZINC000299784681	372758554	/nfs/dbraw/zinc/75/85/54/372758554.db2.gz	ZXQMGFPUTUZWDI-STQMWFEESA-N	1	0	281.787	1.378	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1NC(=O)c1ncc(F)cc1F	ZINC000299803009	372773251	/nfs/dbraw/zinc/77/32/51/372773251.db2.gz	UDZISCNZBZSTKZ-RYUDHWBXSA-N	1	0	299.321	1.197	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+](Cc2cncn2C)C1	ZINC000177271115	372838212	/nfs/dbraw/zinc/83/82/12/372838212.db2.gz	WSPGUDKBQVTECW-KBPBESRZSA-N	1	0	292.427	1.937	50	0		CDAARO
O=C(Nc1cccc2c1CCCC2)[C@H]1C[NH2+]CCO1	ZINC000043707508	284354893	/nfs/dbraw/zinc/35/48/93/284354893.db2.gz	CVADLKMZDHYUTG-CQSZACIVSA-N	1	0	260.337	1.492	50	0		CDAARO
Nc1ccccc1C(=O)N1CC[N@@H+]2CCCC[C@@H]2C1	ZINC000037839726	373596458	/nfs/dbraw/zinc/59/64/58/373596458.db2.gz	RBUHCSLJIHVBCR-GFCCVEGCSA-N	1	0	259.353	1.579	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@@H]1CCCN1C(=O)[C@H](C)COC	ZINC000253371217	373678486	/nfs/dbraw/zinc/67/84/86/373678486.db2.gz	AMZBBAMALDXUDK-MCIONIFRSA-N	1	0	268.401	1.744	50	0		CDAARO
CC1CC[NH+](CCNS(=O)(=O)CCC2CCC2)CC1	ZINC000253426933	373734491	/nfs/dbraw/zinc/73/44/91/373734491.db2.gz	BYPUXUKJASTGCV-UHFFFAOYSA-N	1	0	288.457	1.828	50	0		CDAARO
CC(C)C[C@@H](CNc1ccc2nnnn2n1)[NH+]1CCCC1	ZINC000012985239	373914737	/nfs/dbraw/zinc/91/47/37/373914737.db2.gz	FOKBKUVVXKVWAG-LBPRGKRZSA-N	1	0	289.387	1.442	50	0		CDAARO
O[C@@H](COc1ccc2c(c1)OCO2)C[NH+]1CCCC1	ZINC000002686870	374161156	/nfs/dbraw/zinc/16/11/56/374161156.db2.gz	BZPFFNAHPRWJCJ-LLVKDONJSA-N	1	0	265.309	1.251	50	0		CDAARO
CCOCC(=O)N1CC[C@@H](Oc2ccncc2)C1	ZINC000121466645	374166692	/nfs/dbraw/zinc/16/66/92/374166692.db2.gz	SIRSROKJFFDPNY-GFCCVEGCSA-N	1	0	250.298	1.098	50	0		CDAARO
CN(CC1(CO)CCCC1)c1cc([C@H]2C[C@@H]([NH3+])C2)ncn1	ZINC000252571984	189981538	/nfs/dbraw/zinc/98/15/38/189981538.db2.gz	YQNYAYCIJMYYIO-BETUJISGSA-N	1	0	290.411	1.670	50	0		CDAARO
CC[C@H](C(=O)Nc1ccc(OC)c(CO)c1)[NH+](C)C	ZINC000095447848	374948632	/nfs/dbraw/zinc/94/86/32/374948632.db2.gz	VAGMJCRJAHOZQB-GFCCVEGCSA-N	1	0	266.341	1.466	50	0		CDAARO
CCSCC[N@H+](C)Cc1ccnc(N(C)C)n1	ZINC000095462490	374959997	/nfs/dbraw/zinc/95/99/97/374959997.db2.gz	BQHFWWUNUTTWND-UHFFFAOYSA-N	1	0	254.403	1.728	50	0		CDAARO
Cc1cccc([C@H](C)[N@@H+]2CCCN(S(N)(=O)=O)CC2)c1	ZINC000095405138	374909654	/nfs/dbraw/zinc/90/96/54/374909654.db2.gz	IIBAFHUYOXWBRU-ZDUSSCGKSA-N	1	0	297.424	1.267	50	0		CDAARO
Cc1ccccc1OCCN(C)C(=O)[C@@]1(F)CC[NH2+]C1	ZINC000299740202	375201877	/nfs/dbraw/zinc/20/18/77/375201877.db2.gz	WWUJLJYYJHPAPV-OAHLLOKOSA-N	1	0	280.343	1.534	50	0		CDAARO
COC[C@H]1CCC[N@H+](CC(=O)NCc2ccc(F)cc2)C1	ZINC000056908350	375386160	/nfs/dbraw/zinc/38/61/60/375386160.db2.gz	AKTIMTBBKWTPKI-AWEZNQCLSA-N	1	0	294.370	1.800	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C\C(=O)N1CCCC[C@@H]1C[NH3+]	ZINC000493342447	375443913	/nfs/dbraw/zinc/44/39/13/375443913.db2.gz	ZLHDBLDEDVKLOI-JMEBYUIHSA-N	1	0	296.802	1.735	50	0		CDAARO
CCOC(=O)c1ccc(NC(=O)CN(C)C2CC2)cc1	ZINC000031655309	375810636	/nfs/dbraw/zinc/81/06/36/375810636.db2.gz	PEFXVYWBODOHNI-UHFFFAOYSA-N	1	0	276.336	1.896	50	0		CDAARO
CCOc1ccnc(N2CCC[C@@H](CC[NH3+])C2)n1	ZINC000164807531	375826230	/nfs/dbraw/zinc/82/62/30/375826230.db2.gz	CSHRGPXTQVJDAM-NSHDSACASA-N	1	0	250.346	1.441	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNC(=O)NC[C@H]1CCCO1	ZINC000239761001	376017393	/nfs/dbraw/zinc/01/73/93/376017393.db2.gz	CJDVBKBIKBYHGV-QWHCGFSZSA-N	1	0	269.389	1.339	50	0		CDAARO
CCOCCN1CC[N@H+](C[C@H](O)c2ccccc2)C[C@H]1C	ZINC000242389444	376021383	/nfs/dbraw/zinc/02/13/83/376021383.db2.gz	ZXGPTXPFXNQJJI-WBVHZDCISA-N	1	0	292.423	1.763	50	0		CDAARO
CC(C)[N@@H+]1C[C@@H](C)[C@H](NS(=O)(=O)c2ccccc2)C1	ZINC000246946930	377020570	/nfs/dbraw/zinc/02/05/70/377020570.db2.gz	KHBKFZCSRPVMAS-TZMCWYRMSA-N	1	0	282.409	1.694	50	0		CDAARO
CC[NH+](CC)C[C@@]1(O)CCCN(CC(C)(C)C)C1=O	ZINC000012751809	378665197	/nfs/dbraw/zinc/66/51/97/378665197.db2.gz	LFDDIBNWWGKNDC-HNNXBMFYSA-N	1	0	270.417	1.728	50	0		CDAARO
O=C1[C@@H]2CC(Cl)=CC[C@@H]2C(=O)N1CC[n+]1ccccc1	ZINC000100648700	284982897	/nfs/dbraw/zinc/98/28/97/284982897.db2.gz	MKYMTEZDKHZESB-QWHCGFSZSA-N	1	0	291.758	1.492	50	0		CDAARO
CCc1ccc(C(=O)N2CCC(OCCC[NH3+])CC2)o1	ZINC000094070829	184753689	/nfs/dbraw/zinc/75/36/89/184753689.db2.gz	ICPRPEHZXXXDGP-UHFFFAOYSA-N	1	0	280.368	1.812	50	0		CDAARO
C[C@@H]1CC[NH2+]C[C@@H]1NC(=O)c1ccc(F)c(F)c1F	ZINC000094184050	184760395	/nfs/dbraw/zinc/76/03/95/184760395.db2.gz	XSDVHYUVXJZHAT-XCBNKYQSSA-N	1	0	272.270	1.832	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)N[C@@H](C)CCn2cccn2)CC1	ZINC000095379079	184959338	/nfs/dbraw/zinc/95/93/38/184959338.db2.gz	KZUSRYCRGCBMTE-AWEZNQCLSA-N	1	0	292.427	1.898	50	0		CDAARO
CO[C@H](CC(C)C)CN1CCN(C)[C@@H](c2nc(C)no2)C1	ZINC000419274317	390418635	/nfs/dbraw/zinc/41/86/35/390418635.db2.gz	XURINCBOYAIBJJ-ZIAGYGMSSA-N	1	0	296.415	1.728	50	0		CDAARO
C[N@H+](CC(N)=O)CC1(c2ccc(Br)cc2)CC1	ZINC000096421184	390513974	/nfs/dbraw/zinc/51/39/74/390513974.db2.gz	DSBLBJQUPLOFKF-UHFFFAOYSA-N	1	0	297.196	1.898	50	0		CDAARO
CC[C@@H]1CN(Cc2ccccc2)CCN1C(=O)c1cn[nH]n1	ZINC000096431761	390519951	/nfs/dbraw/zinc/51/99/51/390519951.db2.gz	JVADQGAXOQXCCE-CQSZACIVSA-N	1	0	299.378	1.541	50	0		CDAARO
C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)[C@H]2C[NH2+]CCO2)C1	ZINC000187819002	390852906	/nfs/dbraw/zinc/85/29/06/390852906.db2.gz	OBMWJTAAOCXTGY-KCPJHIHWSA-N	1	0	292.354	1.724	50	0		CDAARO
C[C@@H]([NH2+]Cc1cnn(C)c1)[C@H](O)c1ccc(F)c(F)c1	ZINC000096452787	533467257	/nfs/dbraw/zinc/46/72/57/533467257.db2.gz	UGYCVKWRRINOCN-OTYXRUKQSA-N	1	0	281.306	1.910	50	0		CDAARO
[NH3+][C@@H](CO)c1nc2cc(Br)ccc2[nH]1	ZINC000037441216	392809670	/nfs/dbraw/zinc/80/96/70/392809670.db2.gz	MFSOZANVKBGVPQ-LURJTMIESA-N	1	0	256.103	1.318	50	0		CDAARO
O=C(NC[C@H](O)c1ccccc1F)[C@@H]1CCCC[NH2+]1	ZINC000269099514	132111639	/nfs/dbraw/zinc/11/16/39/132111639.db2.gz	QLQQXJQCQMSLLA-STQMWFEESA-N	1	0	266.316	1.117	50	0		CDAARO
[NH3+]CC1CCN(c2cnn(Cc3ccccc3)c(=O)c2)CC1	ZINC000261542291	140344192	/nfs/dbraw/zinc/34/41/92/140344192.db2.gz	GNRSUMXSWHKHPL-UHFFFAOYSA-N	1	0	298.390	1.467	50	0		CDAARO
O[C@@H](CC[NH+]1CCC2(CC1)OCCO2)C(F)(F)F	ZINC000005612882	296559588	/nfs/dbraw/zinc/55/95/88/296559588.db2.gz	XYIKXAYOMCBCMV-VIFPVBQESA-N	1	0	269.263	1.139	50	0		CDAARO
C[C@@H](CN1CCOCC1)OC(=O)c1ccn2c[nH+]cc2c1	ZINC000097107138	397605332	/nfs/dbraw/zinc/60/53/32/397605332.db2.gz	IASRCMGFDBMWAX-LBPRGKRZSA-N	1	0	289.335	1.212	50	0		CDAARO
COc1cccc(CN2CC[NH2+][C@H](C)[C@H]2C)c1OC	ZINC000097162671	397981429	/nfs/dbraw/zinc/98/14/29/397981429.db2.gz	CMDFEYASUYJHCK-VXGBXAGGSA-N	1	0	264.369	1.886	50	0		CDAARO
O=C(C[C@H]1CCOC1)NC1CC[NH+](C2CCCC2)CC1	ZINC000370083612	159865990	/nfs/dbraw/zinc/86/59/90/159865990.db2.gz	RIGAMAAYOASUMM-CYBMUJFWSA-N	1	0	280.412	1.936	50	0		CDAARO
OCC[NH2+]CCOc1c(Cl)cccc1Cl	ZINC000005024045	170057390	/nfs/dbraw/zinc/05/73/90/170057390.db2.gz	JGJNJZROPUMMFY-UHFFFAOYSA-N	1	0	250.125	1.954	50	0		CDAARO
CCc1ccc(C[N@H+](C)[C@H](C)C(=O)N2CCNC2=O)cc1	ZINC000007683358	170297147	/nfs/dbraw/zinc/29/71/47/170297147.db2.gz	ABCYQZNXRKDINX-GFCCVEGCSA-N	1	0	289.379	1.621	50	0		CDAARO
Cc1cc(=O)n2nc(C[N@H+]3CCCC[C@@H]3C)sc2n1	ZINC000008338765	170331954	/nfs/dbraw/zinc/33/19/54/170331954.db2.gz	KHTZGLGWRLBSMY-JTQLQIEISA-N	1	0	278.381	1.834	50	0		CDAARO
[NH3+]CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000009426196	170376391	/nfs/dbraw/zinc/37/63/91/170376391.db2.gz	RDNOSICORUKYCJ-UHFFFAOYSA-N	1	0	282.287	1.333	50	0		CDAARO
COc1ccc(S(=O)(=O)NCC[NH+](C)C)cc1Cl	ZINC000010111641	170397766	/nfs/dbraw/zinc/39/77/66/170397766.db2.gz	OCUIUGASBMQOFR-UHFFFAOYSA-N	1	0	292.788	1.189	50	0		CDAARO
Cc1ccc(/C=C2\SC(=O)N(CC[NH3+])C2=O)cc1	ZINC000012504613	170491380	/nfs/dbraw/zinc/49/13/80/170491380.db2.gz	ULMJBADUWJWWFN-FLIBITNWSA-N	1	0	262.334	1.990	50	0		CDAARO
OCCOc1ccc(C[NH2+]C[C@@H](O)c2ccccc2)cc1	ZINC000013731063	170583139	/nfs/dbraw/zinc/58/31/39/170583139.db2.gz	XDJVWIXORPXWLC-QGZVFWFLSA-N	1	0	287.359	1.881	50	0		CDAARO
Cc1ncc(C(C)C)c(NC[C@@]2(O)CCC[NH2+]C2)n1	ZINC000534586724	411828223	/nfs/dbraw/zinc/82/82/23/411828223.db2.gz	AUTVZOVSQBPRRF-CQSZACIVSA-N	1	0	264.373	1.435	50	0		CDAARO
COc1cc(NC[C@H](C(C)C)[NH+](C)C)nc(N)n1	ZINC000534659076	411828863	/nfs/dbraw/zinc/82/88/63/411828863.db2.gz	LBSSMDKORYSURC-SECBINFHSA-N	1	0	253.350	1.066	50	0		CDAARO
CCOC(=O)CN1CC[NH+](Cc2ccccc2C)CC1	ZINC000020167657	171040567	/nfs/dbraw/zinc/04/05/67/171040567.db2.gz	JQNNMWYIWGMALT-UHFFFAOYSA-N	1	0	276.380	1.676	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)Nc2cccc(OC)c2)CC1	ZINC000020595173	171264081	/nfs/dbraw/zinc/26/40/81/171264081.db2.gz	JCXGNUXNCYDQDB-UHFFFAOYSA-N	1	0	291.395	1.661	50	0		CDAARO
CC[NH+]1CCN(Cc2cc(OC)c(O)c(OC)c2)CC1	ZINC000022454602	171388387	/nfs/dbraw/zinc/38/83/87/171388387.db2.gz	JXRHNRLUTLWUOB-UHFFFAOYSA-N	1	0	280.368	1.547	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)c1ccc(=O)[nH]c1)Cc1ccccc1	ZINC000022682066	171395724	/nfs/dbraw/zinc/39/57/24/171395724.db2.gz	HHSCNYKWYLCFRK-OAHLLOKOSA-N	1	0	299.374	1.278	50	0		CDAARO
CCOC(=O)C1CC[NH+](C[C@@H](O)c2ccccc2)CC1	ZINC000037485777	173229596	/nfs/dbraw/zinc/22/95/96/173229596.db2.gz	XBVUKHLIAZYGGU-OAHLLOKOSA-N	1	0	277.364	1.995	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)NC(C)C)CC1	ZINC000038583087	174148631	/nfs/dbraw/zinc/14/86/31/174148631.db2.gz	WJOAFWRNVGYWKJ-UHFFFAOYSA-N	1	0	257.378	1.052	50	0		CDAARO
CCOC(=O)N1CCC([NH2+][C@H](C)Cc2cc(C)n[nH]2)CC1	ZINC000065498548	175744535	/nfs/dbraw/zinc/74/45/35/175744535.db2.gz	RYGJIDSNDVHUAU-LLVKDONJSA-N	1	0	294.399	1.860	50	0		CDAARO
Cc1nnsc1C(=O)N1CCC[C@H]([NH+](C)C)CC1	ZINC000072133599	176321778	/nfs/dbraw/zinc/32/17/78/176321778.db2.gz	REQMZBZRAHZJOP-JTQLQIEISA-N	1	0	268.386	1.403	50	0		CDAARO
COc1ccc(C(C)C)cc1C[N@@H+]1CC[C@H](CO)[C@H](O)C1	ZINC000072133587	176321836	/nfs/dbraw/zinc/32/18/36/176321836.db2.gz	ZGYMCZSTXBNUKX-GDBMZVCRSA-N	1	0	293.407	1.994	50	0		CDAARO
CC(=O)c1cccc(C[N@@H+]2CCC[C@@](O)(CO)CC2)c1	ZINC000072140350	176323624	/nfs/dbraw/zinc/32/36/24/176323624.db2.gz	FRLQZZSQTGSIRM-INIZCTEOSA-N	1	0	277.364	1.599	50	0		CDAARO
O=C(NCc1ccc(Cl)cc1)NC[C@H]1C[NH2+]CCOC1	ZINC000072158292	176329139	/nfs/dbraw/zinc/32/91/39/176329139.db2.gz	QDUUTFXUGXWAEM-GFCCVEGCSA-N	1	0	297.786	1.375	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCN(C(=O)C2(c3ccccc3)CC2)C1	ZINC000072163503	176330417	/nfs/dbraw/zinc/33/04/17/176330417.db2.gz	NTEXFHQQTWYWOQ-MRXNPFEDSA-N	1	0	288.391	1.243	50	0		CDAARO
O=C(NC[C@H]1CCCO1)c1ccc(C2CC[NH2+]CC2)nc1	ZINC000072343447	176372063	/nfs/dbraw/zinc/37/20/63/176372063.db2.gz	HARJQOAKVMCVTJ-CQSZACIVSA-N	1	0	289.379	1.457	50	0		CDAARO
O[C@H]1COCC[N@H+](C/C=C/c2ccc(F)cc2)C1	ZINC000077485619	177273825	/nfs/dbraw/zinc/27/38/25/177273825.db2.gz	CEYXLEVTVMJMHN-VSZDKKFSSA-N	1	0	251.301	1.532	50	0		CDAARO
C[C@@H]1CCCN(C(=O)C[C@@H]2CCCCO2)[C@@H]1C[NH3+]	ZINC000095032528	287329939	/nfs/dbraw/zinc/32/99/39/287329939.db2.gz	NEMIIYIMYJGNHJ-FRRDWIJNSA-N	1	0	254.374	1.531	50	0		CDAARO
O=C(C[C@@H]1COCC[NH2+]1)N1CCC[C@H]1c1ccccc1	ZINC000097815489	274976810	/nfs/dbraw/zinc/97/68/10/274976810.db2.gz	QJBVKOUKYUFYLF-CABCVRRESA-N	1	0	274.364	1.729	50	0		CDAARO
CC[N@@H+]1CCC[C@]2(CCC(=O)N(CCc3c[nH]cn3)C2)C1	ZINC000082125922	276188062	/nfs/dbraw/zinc/18/80/62/276188062.db2.gz	KHNYCSZCONZUEX-INIZCTEOSA-N	1	0	290.411	1.677	50	0		CDAARO
CCC[C@@H]([NH3+])C(=O)N1CCOC[C@H]1c1ccccc1	ZINC000376789929	276270793	/nfs/dbraw/zinc/27/07/93/276270793.db2.gz	PIGFLTSUJGSXSV-KGLIPLIRSA-N	1	0	262.353	1.714	50	0		CDAARO
CCS[C@@H]1CCCC[C@H]1[NH2+]CCN1C(=O)CCC1=O	ZINC000190021994	276397357	/nfs/dbraw/zinc/39/73/57/276397357.db2.gz	QJOHJAORROEHAC-VXGBXAGGSA-N	1	0	284.425	1.789	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H](C)CC(=O)N1CCCCCC1	ZINC000096492700	277222066	/nfs/dbraw/zinc/22/20/66/277222066.db2.gz	GOISWYGXEHTHLM-ZDUSSCGKSA-N	1	0	297.443	1.529	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@H]1NC(=O)c1cc(F)ccc1F	ZINC000091496488	280048662	/nfs/dbraw/zinc/04/86/62/280048662.db2.gz	MKIJMIQMGVEXRM-PRHODGIISA-N	1	0	254.280	1.835	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1C[C@H](C)OC[C@H]1c1ccccc1	ZINC000253432748	280874319	/nfs/dbraw/zinc/87/43/19/280874319.db2.gz	NKALIXWFNBCPJQ-UBHSHLNASA-N	1	0	262.353	1.712	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1	ZINC000255089906	289355770	/nfs/dbraw/zinc/35/57/70/289355770.db2.gz	XMONNQXKGBKPON-DEBLGDTFSA-N	1	0	287.363	1.009	50	0		CDAARO
C[C@H](Cc1nc2c([nH]1)C(=O)NCC(C)(C)C2)[NH+]1CCCC1	ZINC000065428491	289750350	/nfs/dbraw/zinc/75/03/50/289750350.db2.gz	TXTHDBKKUWTCPS-LLVKDONJSA-N	1	0	290.411	1.749	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@H]1CCC[NH2+][C@H]1C	ZINC000091496979	301318463	/nfs/dbraw/zinc/31/84/63/301318463.db2.gz	AAYHRVOVMJWPEO-JQWIXIFHSA-N	1	0	286.372	1.553	50	0		CDAARO
COc1ccnc(NC2CC[NH+](Cc3cccnc3)CC2)n1	ZINC000191691186	327874064	/nfs/dbraw/zinc/87/40/64/327874064.db2.gz	RWUXMBZRSMETMM-UHFFFAOYSA-N	1	0	299.378	1.957	50	0		CDAARO
Cc1nccn1CCN(C)C(=O)NCCc1cccn1C	ZINC000534583241	328312464	/nfs/dbraw/zinc/31/24/64/328312464.db2.gz	LCDOTMQKBCKKIP-UHFFFAOYSA-N	1	0	289.383	1.414	50	0		CDAARO
C[C@@H](Cn1ccnc1)[NH2+]CC1(N(C)C)CCCC1	ZINC000534587355	328316030	/nfs/dbraw/zinc/31/60/30/328316030.db2.gz	BFNPRFHZHYENNN-ZDUSSCGKSA-N	1	0	250.390	1.736	50	0		CDAARO
CCC[C@H](CNC(=O)c1cc(O)ccc1F)[NH+](C)C	ZINC000534653732	328338487	/nfs/dbraw/zinc/33/84/87/328338487.db2.gz	QGKRDRUWERNFIX-SNVBAGLBSA-N	1	0	268.332	1.991	50	0		CDAARO
Cc1[nH]c2ccccc2c1CCNC(=O)[C@@H]1C=CC[NH2+]1	ZINC000534648365	328343357	/nfs/dbraw/zinc/34/33/57/328343357.db2.gz	OBRQUZPOBCFTGG-HNNXBMFYSA-N	1	0	269.348	1.663	50	0		CDAARO
C[C@@H](CCC(=O)NCC1(CO)CC1)[NH+]1CCCC1	ZINC000534657462	328340689	/nfs/dbraw/zinc/34/06/89/328340689.db2.gz	JGSPZCSEIUSFMP-LBPRGKRZSA-N	1	0	254.374	1.140	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)c1cnn(C(C)C)c1	ZINC000097229350	323207613	/nfs/dbraw/zinc/20/76/13/323207613.db2.gz	ZPQPSCLOBGWQJQ-UHFFFAOYSA-N	1	0	288.417	1.260	50	0		CDAARO
C[C@H](NC(=O)N1CC[C@H](C[NH+](C)C)C1)[C@H]1CCOC1	ZINC000130149026	323210585	/nfs/dbraw/zinc/21/05/85/323210585.db2.gz	NUNLYNCOPGGQOX-XQQFMLRXSA-N	1	0	269.389	1.005	50	0		CDAARO
CO[C@H]1CCN(C(=O)CCc2cccs2)[C@@H](C[NH3+])C1	ZINC000195557548	323571623	/nfs/dbraw/zinc/57/16/23/323571623.db2.gz	XYEWXMJHTUYLIE-NEPJUHHUSA-N	1	0	282.409	1.645	50	0		CDAARO
OC[C@H](O)C1CC[NH+](CCOc2ccccc2)CC1	ZINC001772708046	1159442267	/nfs/dbraw/zinc/44/22/67/1159442267.db2.gz	CIIMJOXUZRGORY-HNNXBMFYSA-N	1	0	265.353	1.131	50	0		CDAARO
OC[C@@]1(O)CCC[N@H+](Cc2ccccc2C2CC2)C1	ZINC000585087140	482823016	/nfs/dbraw/zinc/82/30/16/482823016.db2.gz	JSZRMEWMSXZHDO-MRXNPFEDSA-N	1	0	261.365	1.883	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]Cc2cnc3cnccn23)n1	ZINC000670436369	482975340	/nfs/dbraw/zinc/97/53/40/482975340.db2.gz	WORXXNHLBMREKN-LBPRGKRZSA-N	1	0	284.367	1.721	50	0		CDAARO
O[C@H]1C[C@H]2C[N@H+](C3Cc4ccccc4C3)C[C@H]2C[C@@H]1O	ZINC000670437941	482980392	/nfs/dbraw/zinc/98/03/92/482980392.db2.gz	ODYCVPIUHILDEM-FSDCSDTHSA-N	1	0	273.376	1.217	50	0		CDAARO
CC[N@@H+]1CC[C@@H](CN(C)Cc2c(C)nn(CCO)c2C)C1	ZINC000670446519	482997628	/nfs/dbraw/zinc/99/76/28/482997628.db2.gz	ZOUORGPCVSBCPM-HNNXBMFYSA-N	1	0	294.443	1.266	50	0		CDAARO
c1cnn(CCC[N@@H+]2CCC[C@H](c3nnc[nH]3)C2)c1	ZINC000670449845	483010466	/nfs/dbraw/zinc/01/04/66/483010466.db2.gz	AJLYTSZEDBDCAV-LBPRGKRZSA-N	1	0	260.345	1.271	50	0		CDAARO
CCN1C[C@H](C[N@H+](C)Cc2cnc(N(C)C)s2)CC1=O	ZINC000670451542	483012385	/nfs/dbraw/zinc/01/23/85/483012385.db2.gz	GNWVUPGNOZMOIF-NSHDSACASA-N	1	0	296.440	1.509	50	0		CDAARO
CC[S@@](=O)[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(CO)o1	ZINC000083477155	483173799	/nfs/dbraw/zinc/17/37/99/483173799.db2.gz	OXGRAOFNVSCIEB-NJSLBKSFSA-N	1	0	285.409	1.941	50	0		CDAARO
O[C@H](COC[C@@H]1CCCO1)C[N@@H+]1CCO[C@@H]2CCCC[C@H]21	ZINC000084544025	483286352	/nfs/dbraw/zinc/28/63/52/483286352.db2.gz	JOZHAXHLVOTTSN-CAOSSQGBSA-N	1	0	299.411	1.186	50	0		CDAARO
O[C@H](COC[C@@H]1CCCO1)C[N@@H+]1CCO[C@H]2CCCC[C@@H]21	ZINC000084544028	483286726	/nfs/dbraw/zinc/28/67/26/483286726.db2.gz	JOZHAXHLVOTTSN-VGWMRTNUSA-N	1	0	299.411	1.186	50	0		CDAARO
O=C(CCNc1cc[nH+]c2ccccc12)N1CCOCC1	ZINC000110127044	483422368	/nfs/dbraw/zinc/42/23/68/483422368.db2.gz	FMKKLZCUQHHCAB-UHFFFAOYSA-N	1	0	285.347	1.896	50	0		CDAARO
CC/C(C)=C/CC[N@@H+]1CCO[C@H](C(=O)N(C)C)C1	ZINC000822289027	1161927720	/nfs/dbraw/zinc/92/77/20/1161927720.db2.gz	UUCLKKDKHPKVCY-WHGQRRHOSA-N	1	0	254.374	1.522	50	0		CDAARO
CC[C@@H](C(=O)N(C)Cc1cscn1)[N@H+](C)CC	ZINC000822541676	1161927866	/nfs/dbraw/zinc/92/78/66/1161927866.db2.gz	QBIQWZNZYRMEAV-NSHDSACASA-N	1	0	255.387	1.832	50	0		CDAARO
Cc1ccccc1C[NH2+]CCCSc1nnnn1C	ZINC000004993836	525168313	/nfs/dbraw/zinc/16/83/13/525168313.db2.gz	HRAFGGDVSVHTTJ-UHFFFAOYSA-N	1	0	277.397	1.791	50	0		CDAARO
COc1cc(C[NH2+]CCN2CCCC[C@@H]2CO)ccc1F	ZINC000952988763	617189101	/nfs/dbraw/zinc/18/91/01/617189101.db2.gz	PDGPHAZABRZTOU-CQSZACIVSA-N	1	0	296.386	1.771	50	0		CDAARO
CC(C)(O)CC[N@@H+]1CCC[C@H](CNC(=O)c2ccoc2)C1	ZINC000952974389	614184147	/nfs/dbraw/zinc/18/41/47/614184147.db2.gz	MGCCXFBRBDGXBK-CYBMUJFWSA-N	1	0	294.395	1.882	50	0		CDAARO
CCCN1C[C@@H]([NH2+]Cc2cc(C(C)=O)cn2C)CC1=O	ZINC000952971475	614786213	/nfs/dbraw/zinc/78/62/13/614786213.db2.gz	ONNRECWOQZGAGN-ZDUSSCGKSA-N	1	0	277.368	1.328	50	0		CDAARO
Cn1cc(C[N@H+](C)C2CSCCSC2)cn1	ZINC000952982762	616096725	/nfs/dbraw/zinc/09/67/25/616096725.db2.gz	RKJLEVZZXWAJMK-UHFFFAOYSA-N	1	0	257.428	1.701	50	0		CDAARO
C[N@@H+]1CCC[C@H]1C(=O)N1CCC2(CCCO2)CC1	ZINC000952984097	616209246	/nfs/dbraw/zinc/20/92/46/616209246.db2.gz	ZSVVPMKJKFXOIS-LBPRGKRZSA-N	1	0	252.358	1.252	50	0		CDAARO
CC[C@H]1CN(CC[NH2+][C@@H]2CCCn3ccnc32)CCO1	ZINC000888094086	617753202	/nfs/dbraw/zinc/75/32/02/617753202.db2.gz	GRBKHCWQYOAUPX-UONOGXRCSA-N	1	0	278.400	1.418	50	0		CDAARO
Cc1c[nH+]ccc1N1CCC(C(=O)O[C@H](C)C(N)=O)CC1	ZINC000888097502	617760351	/nfs/dbraw/zinc/76/03/51/617760351.db2.gz	MCUDQAKOWCIDNZ-LLVKDONJSA-N	1	0	291.351	1.023	50	0		CDAARO
Cc1nccn1CCN1CCC([NH+]2CCC(O)CC2)CC1	ZINC000244873078	688213660	/nfs/dbraw/zinc/21/36/60/688213660.db2.gz	WJRBZQJKCKEWJY-UHFFFAOYSA-N	1	0	292.427	1.113	50	0		CDAARO
Cc1nc([C@H]2CCC[NH2+]C2)cc(N2CCCOCC2)n1	ZINC000039430452	693020228	/nfs/dbraw/zinc/02/02/28/693020228.db2.gz	BNILQERTVPXMOG-ZDUSSCGKSA-N	1	0	276.384	1.479	50	0		CDAARO
Cn1nccc1C(=O)NC[C@@H]1CCCN(c2cc[nH+]cc2)C1	ZINC000952981101	694850071	/nfs/dbraw/zinc/85/00/71/694850071.db2.gz	CAFRRWDGEXLQQQ-ZDUSSCGKSA-N	1	0	299.378	1.462	50	0		CDAARO
Cc1cccc(CC[N@@H+](C)[C@H]2C[C@H]3CNC(=O)C[C@H]3C2)n1	ZINC001704342857	1177695450	/nfs/dbraw/zinc/69/54/50/1177695450.db2.gz	RMOSKYMSVPAJQG-IJEWVQPXSA-N	1	0	287.407	1.779	50	0		CDAARO
C[C@H](CN(C)CCO)[NH2+]CCc1nc2ccccc2[nH]1	ZINC000952984678	723244700	/nfs/dbraw/zinc/24/47/00/723244700.db2.gz	LVXDGLFDFXQONX-GFCCVEGCSA-N	1	0	276.384	1.008	50	0		CDAARO
Nc1nc2nc[nH]c2c(-c2cccc(CC[NH3+])c2)n1	ZINC000032520409	723638888	/nfs/dbraw/zinc/63/88/88/723638888.db2.gz	VMFLZSBKZYZTLO-UHFFFAOYSA-N	1	0	254.297	1.103	50	0		CDAARO
OCc1cc(N2CC[C@@](O)(c3ccccc3)C2)cc[nH+]1	ZINC000032511782	912703796	/nfs/dbraw/zinc/70/37/96/912703796.db2.gz	GEYCIEPYVHSVGF-INIZCTEOSA-N	1	0	270.332	1.672	50	0		CDAARO
Cc1ccc(C[N@@H+]2CCCC[C@H]2CCCO)c(=O)[nH]1	ZINC000020539890	899252553	/nfs/dbraw/zinc/25/25/53/899252553.db2.gz	AZOSMYCGXOLUDB-AWEZNQCLSA-N	1	0	264.369	1.810	50	0		CDAARO
CC1(C)CC(CC(=O)N2CC(O)C2)CC(C)(C)[NH2+]1	ZINC000952869179	910420230	/nfs/dbraw/zinc/42/02/30/910420230.db2.gz	FTLNKDKCDHUQDR-UHFFFAOYSA-N	1	0	254.374	1.136	50	0		CDAARO
C[C@H](CN(C)CCO)[NH2+]CCc1cccc(F)c1	ZINC000952968252	910534396	/nfs/dbraw/zinc/53/43/96/910534396.db2.gz	PDPACOGNQQEMLF-GFCCVEGCSA-N	1	0	254.349	1.270	50	0		CDAARO
COc1ncccc1C[NH2+]CCN1CCCC[C@H]1CO	ZINC000952992222	910538225	/nfs/dbraw/zinc/53/82/25/910538225.db2.gz	YVUNLQGELZYSSW-AWEZNQCLSA-N	1	0	279.384	1.027	50	0		CDAARO
Cc1nonc1CN[C@H](C)C[NH+]1CCCCCC1	ZINC000821260045	925574080	/nfs/dbraw/zinc/57/40/80/925574080.db2.gz	JGUJVUMCIHRNFQ-LLVKDONJSA-N	1	0	252.362	1.732	50	0		CDAARO
CCCc1ccc(OCCNC(=O)[C@@H]2C=CC[NH2+]2)cc1	ZINC000823010349	925660702	/nfs/dbraw/zinc/66/07/02/925660702.db2.gz	CNZRZTWRJVNKMS-HNNXBMFYSA-N	1	0	274.364	1.662	50	0		CDAARO
CC(C)C[N@@H+]1CCN(CCCn2cccn2)C[C@H]1CCO	ZINC000828747222	926174559	/nfs/dbraw/zinc/17/45/59/926174559.db2.gz	JULKFGCENXZHFE-MRXNPFEDSA-N	1	0	294.443	1.298	50	0		CDAARO
COCC(=O)N[C@@H]1C[N@@H+](C2CCCCCC2)CC[C@@H]1CO	ZINC000581799381	927199499	/nfs/dbraw/zinc/19/94/99/927199499.db2.gz	VFTKCVRSFBHMRP-UKRRQHHQSA-N	1	0	298.427	1.155	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+](CC2COCOC2)C1	ZINC000585116870	930969338	/nfs/dbraw/zinc/96/93/38/930969338.db2.gz	KWXCZIXDOYALKN-ZFWWWQNUSA-N	1	0	298.427	1.624	50	0		CDAARO
CCCCCOCC(=O)N1C[C@@H]2CC[N@H+](C)C[C@@H]2C1	ZINC000585127288	931008921	/nfs/dbraw/zinc/00/89/21/931008921.db2.gz	WDJZQSMCKRIPDT-UONOGXRCSA-N	1	0	268.401	1.603	50	0		CDAARO
CCCCCOCC(=O)N(CCO)C1CC[NH+](C)CC1	ZINC000585127225	931009346	/nfs/dbraw/zinc/00/93/46/931009346.db2.gz	UAVACBKDUBTOAZ-UHFFFAOYSA-N	1	0	286.416	1.108	50	0		CDAARO
C[C@H](C[NH+](C)C)[C@@H]1CCCCN1C(=O)c1ccn(C)n1	ZINC000585128030	931013280	/nfs/dbraw/zinc/01/32/80/931013280.db2.gz	PZQKUTBBNDUKPR-OCCSQVGLSA-N	1	0	278.400	1.613	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1ncc(F)c(N(C)C)n1	ZINC001529090285	968979791	/nfs/dbraw/zinc/97/97/91/968979791.db2.gz	FTLPZIOCJPAKFM-NSHDSACASA-N	1	0	281.379	1.968	50	0		CDAARO
COCC(=O)Nc1ccc(NC(=O)[C@H]2CCC[NH2+]2)cc1C	ZINC001506396184	975147734	/nfs/dbraw/zinc/14/77/34/975147734.db2.gz	QCODQYCPPPKTIT-CYBMUJFWSA-N	1	0	291.351	1.270	50	0		CDAARO
NC(=O)C1([NH2+][C@@H]2CCC(=O)N(CC3CC3)CC2)CCCC1	ZINC001506404209	975150403	/nfs/dbraw/zinc/15/04/03/975150403.db2.gz	SGQAGEHKCGHLIC-CYBMUJFWSA-N	1	0	293.411	1.165	50	0		CDAARO
COC1CC[NH+]([C@@H]2CCC(=O)N(CC3CC3)CC2)CC1	ZINC001506420866	975158065	/nfs/dbraw/zinc/15/80/65/975158065.db2.gz	BHLBYHAUSRZNTQ-CQSZACIVSA-N	1	0	280.412	1.888	50	0		CDAARO
CCc1c(C)nn(C)c1NC(=O)[C@@H]1CC12CC[NH2+]CC2	ZINC001506422994	975159746	/nfs/dbraw/zinc/15/97/46/975159746.db2.gz	BRSDNMVZVBKSOW-LBPRGKRZSA-N	1	0	276.384	1.619	50	0		CDAARO
COC(=O)[C@H](C)C[C@@H](C)[NH2+]Cc1ccnc(OC)c1	ZINC000095940674	185036582	/nfs/dbraw/zinc/03/65/82/185036582.db2.gz	WPIOERJJJLZOLQ-GHMZBOCLSA-N	1	0	266.341	1.768	50	0		CDAARO
c1ncn(Cc2ccc(C[NH2+]C[C@H]3CCOC3)cc2)n1	ZINC000095966290	185045928	/nfs/dbraw/zinc/04/59/28/185045928.db2.gz	AIABOKBTYRHIBA-OAHLLOKOSA-N	1	0	272.352	1.453	50	0		CDAARO
C[C@H]1[C@H](NC(=O)c2cc(-c3ccco3)n[nH]2)CCC[N@@H+]1C	ZINC000096010243	185064547	/nfs/dbraw/zinc/06/45/47/185064547.db2.gz	CMQDWAOFWFXWCP-WDEREUQCSA-N	1	0	288.351	1.882	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1	ZINC000125199101	187174251	/nfs/dbraw/zinc/17/42/51/187174251.db2.gz	IAYLPRPKBUVVHJ-JLLWLGSASA-N	1	0	280.318	1.889	50	0		CDAARO
CC[C@@H](C(=O)N[C@@H]1C[NH2+]C[C@@H]1OC)c1ccc(OC)cc1	ZINC000195554045	342625809	/nfs/dbraw/zinc/62/58/09/342625809.db2.gz	SCBATRITYQFNPX-KFWWJZLASA-N	1	0	292.379	1.292	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)[C@@H](C)c1c(F)cccc1F	ZINC000195554084	342625813	/nfs/dbraw/zinc/62/58/13/342625813.db2.gz	CXGNCIGNRVUNIA-UWJYBYFXSA-N	1	0	284.306	1.171	50	0		CDAARO
[NH3+][C@@H](C(=O)N1CCO[C@H](c2ccco2)C1)c1ccccc1	ZINC000195554329	342625948	/nfs/dbraw/zinc/62/59/48/342625948.db2.gz	VXYWCOPAKANRIG-LSDHHAIUSA-N	1	0	286.331	1.880	50	0		CDAARO
COc1ccc2nc(C)cc(C(=O)N3CC[NH2+]C[C@H]3C)c2c1	ZINC000125274966	187177088	/nfs/dbraw/zinc/17/70/88/187177088.db2.gz	SYVWNCYZTYKHEJ-GFCCVEGCSA-N	1	0	299.374	1.986	50	0		CDAARO
CCNC(=O)CC[N@H+](C)Cc1ccc2nsnc2c1	ZINC000244882762	361868004	/nfs/dbraw/zinc/86/80/04/361868004.db2.gz	XYNBDTSSHYHZPT-UHFFFAOYSA-N	1	0	278.381	1.649	50	0		CDAARO
C[C@@H](CC(=O)N1CCCCCC1)[NH2+][C@@]1(C)CCOC1	ZINC000097231653	342205243	/nfs/dbraw/zinc/20/52/43/342205243.db2.gz	YLXOPQJUXHMDTF-ZFWWWQNUSA-N	1	0	268.401	1.936	50	0		CDAARO
CCCC[C@@H]([NH3+])C(=O)N(C)Cc1ncc(Cl)n1C	ZINC000097234157	342205402	/nfs/dbraw/zinc/20/54/02/342205402.db2.gz	UGPBNMPSDRKWJC-SECBINFHSA-N	1	0	272.780	1.549	50	0		CDAARO
C[NH2+]CCCNS(=O)(=O)N1CCC(C(C)(C)C)CC1	ZINC000097234953	342205619	/nfs/dbraw/zinc/20/56/19/342205619.db2.gz	LQNKWOZJXKYVFW-UHFFFAOYSA-N	1	0	291.461	1.188	50	0		CDAARO
COCc1noc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2CO)n1	ZINC000253370474	361925389	/nfs/dbraw/zinc/92/53/89/361925389.db2.gz	RGSSMHKFNNLJBB-GARJFASQSA-N	1	0	269.345	1.418	50	0		CDAARO
c1snnc1CN1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccccc1	ZINC000585136836	342216237	/nfs/dbraw/zinc/21/62/37/342216237.db2.gz	VESZBWFTKLSHBT-GJZGRUSLSA-N	1	0	286.404	1.997	50	0		CDAARO
CCC(=O)N1CCC([NH2+][C@H]2CCN3CCCC[C@@H]23)CC1	ZINC000685939660	539045774	/nfs/dbraw/zinc/04/57/74/539045774.db2.gz	XJBXDRNIQXEHLD-GJZGRUSLSA-N	1	0	279.428	1.604	50	0		CDAARO
CC(C)(C)OC(=O)NC1CC(C[NH3+])(c2cccnc2)C1	ZINC000072233582	342273344	/nfs/dbraw/zinc/27/33/44/342273344.db2.gz	VSWIGAJTDSFBOR-UHFFFAOYSA-N	1	0	277.368	1.965	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1ccc(Cn2ccnc2)cc1	ZINC000125729893	187197616	/nfs/dbraw/zinc/19/76/16/187197616.db2.gz	DQEMJJVUSSPVBP-ZDUSSCGKSA-N	1	0	284.363	1.365	50	0		CDAARO
CC[C@@H](C)C[N@H+](C)[C@@H]1CCN(CCC(=O)OC)C1=O	ZINC000585094196	362021316	/nfs/dbraw/zinc/02/13/16/362021316.db2.gz	OEPYSUCRPIPTGG-VXGBXAGGSA-N	1	0	270.373	1.128	50	0		CDAARO
Cc1nc(C[NH2+][C@H]2CCc3nnc(C)n3C2)cs1	ZINC000065563091	342410124	/nfs/dbraw/zinc/41/01/24/342410124.db2.gz	PEPRXCFBGDTEEU-JTQLQIEISA-N	1	0	263.370	1.456	50	0		CDAARO
Cc1ccc(C)c(CC(=O)N2CCO[C@H]([C@@H](C)[NH3+])C2)c1	ZINC000127868013	187337902	/nfs/dbraw/zinc/33/79/02/187337902.db2.gz	MCRWVYRTFWGVLE-HIFRSBDPSA-N	1	0	276.380	1.421	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000126973167	187274340	/nfs/dbraw/zinc/27/43/40/187274340.db2.gz	NPUVZNQJNDVSIU-DZGCQCFKSA-N	1	0	267.344	1.697	50	0		CDAARO
Cc1c(Cl)cccc1OCC(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179115105	362252092	/nfs/dbraw/zinc/25/20/92/362252092.db2.gz	UHUNNTTXJXUVLJ-LLVKDONJSA-N	1	0	282.771	1.848	50	0		CDAARO
C[C@@H](CC[NH+](C)C)NC(=O)N1CCSC(C)(C)C1	ZINC000083715340	362253680	/nfs/dbraw/zinc/25/36/80/362253680.db2.gz	RZGGEDUQPBQQCC-NSHDSACASA-N	1	0	273.446	1.864	50	0		CDAARO
CC(C)CNC(=O)NC(=O)[C@H](C)SCC[NH+](C)C	ZINC000084544319	362266425	/nfs/dbraw/zinc/26/64/25/362266425.db2.gz	GHUSLGAGGUYVTB-JTQLQIEISA-N	1	0	275.418	1.152	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)Cc2ccccc2Br)C1	ZINC000084719064	362270756	/nfs/dbraw/zinc/27/07/56/362270756.db2.gz	LTUDBSUKZGSCDU-LLVKDONJSA-N	1	0	297.196	1.941	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCCNC(=O)c2ccn[nH]2)C[C@H](C)O1	ZINC000084706186	362273635	/nfs/dbraw/zinc/27/36/35/362273635.db2.gz	IVQKBGMYEMEXRC-TXEJJXNPSA-N	1	0	280.372	1.029	50	0		CDAARO
C[C@@H]([NH2+]Cc1nncn1-c1ccccc1)[C@@H]1CCCO1	ZINC000273186151	192068836	/nfs/dbraw/zinc/06/88/36/192068836.db2.gz	PCOKWTZMPIWHCM-OCCSQVGLSA-N	1	0	272.352	1.924	50	0		CDAARO
O=C(N[C@@H]1CC[NH2+]C1)c1c[nH]nc1C1CCCCC1	ZINC000097288691	185579457	/nfs/dbraw/zinc/57/94/57/185579457.db2.gz	ULDGHAGDDCLORY-LLVKDONJSA-N	1	0	262.357	1.549	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCCNC(=O)[C@@H]2CCCOC2)C[C@H](C)O1	ZINC000085456233	179068135	/nfs/dbraw/zinc/06/81/35/179068135.db2.gz	JOEOGIXRYNCBEB-QLFBSQMISA-N	1	0	298.427	1.419	50	0		CDAARO
NC(=O)C1([NH2+]CCCc2ccc3c(c2)CCO3)CC1	ZINC000193312755	362909921	/nfs/dbraw/zinc/90/99/21/362909921.db2.gz	CWHXQHHFHBPCIX-UHFFFAOYSA-N	1	0	260.337	1.162	50	0		CDAARO
COc1cc(OC)c(NC(=O)[C@H]2CCC[NH2+]2)cc1F	ZINC000087393326	179419039	/nfs/dbraw/zinc/41/90/39/179419039.db2.gz	DZGHGJXPSUNUAV-SECBINFHSA-N	1	0	268.288	1.533	50	0		CDAARO
Cc1cccnc1C[N@@H+]1CCCN(c2ncccn2)CC1	ZINC000020859231	348533733	/nfs/dbraw/zinc/53/37/33/348533733.db2.gz	CBDNRSGCYHEOEQ-UHFFFAOYSA-N	1	0	283.379	1.892	50	0		CDAARO
C(c1nnc(C2CCC2)o1)N1CC[N@@H+]2CCC[C@@H]2C1	ZINC000089598032	179826800	/nfs/dbraw/zinc/82/68/00/179826800.db2.gz	PNQXGLIKTKDDHI-GFCCVEGCSA-N	1	0	262.357	1.617	50	0		CDAARO
COCC1(CNC(=O)[C@@]2(C)CCC[NH2+]C2)CCCC1	ZINC000584884611	349342442	/nfs/dbraw/zinc/34/24/42/349342442.db2.gz	ATHUGVURPQYWJH-AWEZNQCLSA-N	1	0	268.401	1.699	50	0		CDAARO
Cc1[nH]nc(C(=O)NC[C@@H]2CCCC[N@H+]2C)c1Cl	ZINC000584885473	349343409	/nfs/dbraw/zinc/34/34/09/349343409.db2.gz	UJPKIUDJRPOMBZ-VIFPVBQESA-N	1	0	270.764	1.586	50	0		CDAARO
O=C(N1CCCC1)N1CCC([NH2+][C@H]2CCSC2)CC1	ZINC000584889168	349348000	/nfs/dbraw/zinc/34/80/00/349348000.db2.gz	CRFLIKGZGBEDPY-ZDUSSCGKSA-N	1	0	283.441	1.762	50	0		CDAARO
Cc1c(C[NH2+]C2CSCCSC2)cnn1C	ZINC000584892008	349351162	/nfs/dbraw/zinc/35/11/62/349351162.db2.gz	MTNHKWMGHDMERU-UHFFFAOYSA-N	1	0	257.428	1.667	50	0		CDAARO
O=C(CCC(F)(F)F)N1C[C@H](O)[C@@H]([NH+]2CCCCC2)C1	ZINC000584897808	349358829	/nfs/dbraw/zinc/35/88/29/349358829.db2.gz	JJZHSBMZTSLEBG-QWRGUYRKSA-N	1	0	294.317	1.387	50	0		CDAARO
CCC[N@@H+]1CCCN(C(=O)c2cccc3ccnn32)CC1	ZINC000584895742	349356025	/nfs/dbraw/zinc/35/60/25/349356025.db2.gz	YYIMIJWCNUKQGQ-UHFFFAOYSA-N	1	0	286.379	1.892	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]CC2(CO)CCOCC2)n1	ZINC000584899016	349360692	/nfs/dbraw/zinc/36/06/92/349360692.db2.gz	PGJLFBBNHBUXMZ-ZDUSSCGKSA-N	1	0	281.400	1.267	50	0		CDAARO
Cc1ncnc(NCC[N@@H+]2CCC[C@H](CO)C2)c1C	ZINC000091657060	180218036	/nfs/dbraw/zinc/21/80/36/180218036.db2.gz	LKKXTIFACNRFFM-ZDUSSCGKSA-N	1	0	264.373	1.210	50	0		CDAARO
Cc1cc[nH+]c(NCCN2C[C@@]3(CCOC3)CCC2=O)c1	ZINC000091664846	180220914	/nfs/dbraw/zinc/22/09/14/180220914.db2.gz	GLFZTVGJCQDCDH-INIZCTEOSA-N	1	0	289.379	1.831	50	0		CDAARO
Cc1cc(CN2CC3(CC[NH2+]CC3)CCC2=O)ccn1	ZINC000091769756	180248854	/nfs/dbraw/zinc/24/88/54/180248854.db2.gz	QCXLJGZSXQUSHZ-UHFFFAOYSA-N	1	0	273.380	1.882	50	0		CDAARO
Cc1nc(NCCCNc2cccnc2)cc(N)[nH+]1	ZINC000091933251	180288540	/nfs/dbraw/zinc/28/85/40/180288540.db2.gz	JZBJIRCABIQRDU-UHFFFAOYSA-N	1	0	258.329	1.676	50	0		CDAARO
OCCn1ncnc1CC[NH+]1CCCCCCC1	ZINC000091973699	180296395	/nfs/dbraw/zinc/29/63/95/180296395.db2.gz	UWIQPQOUDSAOAL-UHFFFAOYSA-N	1	0	252.362	1.079	50	0		CDAARO
COc1ccc(NC(=O)[C@H](C(C)C)[NH+](C)C)cn1	ZINC000106425281	186116895	/nfs/dbraw/zinc/11/68/95/186116895.db2.gz	BKLUXBQJNSKJSA-LBPRGKRZSA-N	1	0	251.330	1.615	50	0		CDAARO
O[C@@H](Cn1cccn1)C[N@@H+]1CC[C@H](c2ccccc2)C1	ZINC000106632786	186130356	/nfs/dbraw/zinc/13/03/56/186130356.db2.gz	XAORPBTUNDXXHS-JKSUJKDBSA-N	1	0	271.364	1.734	50	0		CDAARO
[NH3+]CC1(NC(=O)CCOc2ccccc2)CCCC1	ZINC000107914841	186197043	/nfs/dbraw/zinc/19/70/43/186197043.db2.gz	NGWANFNQKFWGST-UHFFFAOYSA-N	1	0	262.353	1.843	50	0		CDAARO
O=C(N[C@H]1CCC[N@@H+](C2CCCCC2)C1)c1cn[nH]c1	ZINC000109303265	186246867	/nfs/dbraw/zinc/24/68/67/186246867.db2.gz	QWUONYSJQBEGFW-ZDUSSCGKSA-N	1	0	276.384	1.937	50	0		CDAARO
C[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)c1cnccn1	ZINC000257365753	350963699	/nfs/dbraw/zinc/96/36/99/350963699.db2.gz	KJJVADXBLICJNG-QWHCGFSZSA-N	1	0	260.341	1.175	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)c1sccc1OC	ZINC000122582529	187039445	/nfs/dbraw/zinc/03/94/45/187039445.db2.gz	MXKJTHCGZRSMCQ-VIFPVBQESA-N	1	0	254.355	1.581	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N2CCC[NH2+]CC2)c1	ZINC000036983621	363311280	/nfs/dbraw/zinc/31/12/80/363311280.db2.gz	FJQOGTCWZGJIGK-UHFFFAOYSA-N	1	0	272.345	1.118	50	0		CDAARO
C[N@@H+]1CC[C@H](NC(=O)C(F)F)[C@@H]1c1ccccc1	ZINC000194814108	283119825	/nfs/dbraw/zinc/11/98/25/283119825.db2.gz	YTLVKVDVNPNSIH-QWRGUYRKSA-N	1	0	254.280	1.813	50	0		CDAARO
COc1ccc2c3c1O[C@@H]1C[C@H](O)C=C[C@@]31CC[N@@H+](C)C2	ZINC000000018473	355879775	/nfs/dbraw/zinc/87/97/75/355879775.db2.gz	ASUTZQLVASHGKV-MRRJBJDNSA-N	1	0	287.359	1.850	50	0	biogenic	CDAARO
Cc1cccc(NC(=O)CC[NH+]2CCC(C(N)=O)CC2)c1	ZINC000000176292	355893306	/nfs/dbraw/zinc/89/33/06/355893306.db2.gz	MPNQXIVRZIYFQC-UHFFFAOYSA-N	1	0	289.379	1.521	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)c1ccc2c(c1)OCCO2	ZINC000002849634	355984256	/nfs/dbraw/zinc/98/42/56/355984256.db2.gz	UJLLFPZPUHUQIO-UHFFFAOYSA-N	1	0	276.336	1.283	50	0		CDAARO
C[NH+](C)CCCNC(=O)/C=C/c1ccc2c(c1)OCO2	ZINC000002328343	355967271	/nfs/dbraw/zinc/96/72/71/355967271.db2.gz	DYYXJLQAQYUAFV-FNORWQNLSA-N	1	0	276.336	1.496	50	0		CDAARO
Ic1cncc(OC[C@@H]2CC[NH2+]2)c1	ZINC000003829025	356010299	/nfs/dbraw/zinc/01/02/99/356010299.db2.gz	RKVRGRXOYDTUEY-QMMMGPOBSA-N	1	0	290.104	1.427	50	0	in-vitro	CDAARO
[NH3+]C[C@@H]1CCN(C(=O)/C=C\c2c(F)cccc2F)C1	ZINC000255230679	356023932	/nfs/dbraw/zinc/02/39/32/356023932.db2.gz	VNGMZBHCFYBFKI-LWTINBJPSA-N	1	0	266.291	1.785	50	0		CDAARO
CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+]CCCN1C(=O)CNC1=O	ZINC000097373773	356094613	/nfs/dbraw/zinc/09/46/13/356094613.db2.gz	TYDPEXTVPVODBM-MGPQQGTHSA-N	1	0	295.427	1.979	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cn1)[C@H]1CCCO1	ZINC000097374149	356094614	/nfs/dbraw/zinc/09/46/14/356094614.db2.gz	UCKIOGAVCQKVRI-MWLCHTKSSA-N	1	0	283.759	1.831	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)NCc1ccc(F)cc1)[C@@H]1CCCO1	ZINC000097374121	356094656	/nfs/dbraw/zinc/09/46/56/356094656.db2.gz	NNPSNGLPANITQW-RISCZKNCSA-N	1	0	280.343	1.599	50	0		CDAARO
CC(C)CC1(C(=O)N2CCN([C@H]3CC[NH2+]C3)CC2)CCC1	ZINC000377529983	356263156	/nfs/dbraw/zinc/26/31/56/356263156.db2.gz	KNKIOOKBSQMPRU-HNNXBMFYSA-N	1	0	293.455	1.709	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]1)N1CCN(Cc2ccccc2)CC1	ZINC000011754409	356277835	/nfs/dbraw/zinc/27/78/35/356277835.db2.gz	HVHGAJURRVBUQI-HNNXBMFYSA-N	1	0	273.380	1.083	50	0		CDAARO
COc1ccc(C(=O)[C@H]2CCC[N@H+](CCO)C2)cc1OC	ZINC000012704104	356319298	/nfs/dbraw/zinc/31/92/98/356319298.db2.gz	AIMDWBJNXDMWAF-ZDUSSCGKSA-N	1	0	293.363	1.591	50	0		CDAARO
CC[NH+]1CCC2(CC1)OCCN2C(=O)c1snnc1C	ZINC000013736255	356355668	/nfs/dbraw/zinc/35/56/68/356355668.db2.gz	PLXLLLURZBNGRY-UHFFFAOYSA-N	1	0	296.396	1.131	50	0		CDAARO
O=C(C1CCOCC1)N1CCC[C@H]1C[NH+]1CCCC1	ZINC000066945388	356450494	/nfs/dbraw/zinc/45/04/94/356450494.db2.gz	DKCINXMNVVUQLA-AWEZNQCLSA-N	1	0	266.385	1.500	50	0		CDAARO
CC[NH+]1CCC(NC(=O)c2cccc(OC)c2OC)CC1	ZINC000016603813	356442977	/nfs/dbraw/zinc/44/29/77/356442977.db2.gz	BVVVRTIZOHCKJM-UHFFFAOYSA-N	1	0	292.379	1.918	50	0		CDAARO
COc1ccc(C(=O)NC2CC[NH+](C)CC2)cc1OC	ZINC000016605859	356443064	/nfs/dbraw/zinc/44/30/64/356443064.db2.gz	OSJKAVDCFNRVIX-UHFFFAOYSA-N	1	0	278.352	1.528	50	0		CDAARO
C[C@H](Oc1ccccc1F)C(=O)N1CC[NH2+]CC1	ZINC000019476686	356486638	/nfs/dbraw/zinc/48/66/38/356486638.db2.gz	LGFYGRLDEYHARN-JTQLQIEISA-N	1	0	252.289	1.025	50	0		CDAARO
COc1ccc2c(c1)nc(CN1CC[NH+](C)CC1)n2C	ZINC000019933644	356517175	/nfs/dbraw/zinc/51/71/75/356517175.db2.gz	XIXRARMCTIDCFH-UHFFFAOYSA-N	1	0	274.368	1.329	50	0		CDAARO
CC[NH+]1CCN([C@@H](C)C(=O)Nc2ccccc2)CC1	ZINC000022912663	356623738	/nfs/dbraw/zinc/62/37/38/356623738.db2.gz	BKGFRRVHFOZVHI-ZDUSSCGKSA-N	1	0	261.369	1.651	50	0		CDAARO
FC(F)(F)Oc1ccc(CN2CC[NH2+]CC2)cc1	ZINC000022942238	356624985	/nfs/dbraw/zinc/62/49/85/356624985.db2.gz	YYHAJSIKVDIQNW-UHFFFAOYSA-N	1	0	260.259	1.990	50	0		CDAARO
C[C@@H]1C[N@H+](C)C[C@@H]1NS(=O)(=O)Cc1ccc(F)cc1	ZINC000078899054	538476985	/nfs/dbraw/zinc/47/69/85/538476985.db2.gz	KOLRNSALKIOEPA-MFKMUULPSA-N	1	0	286.372	1.195	50	0		CDAARO
C[N@@H+]1C[C@@H]2CCC[C@H](O)[C@H]2[C@@]2(CCCCC2=O)C1	ZINC000245255179	283206378	/nfs/dbraw/zinc/20/63/78/283206378.db2.gz	FYBWQOYLTXRONY-JURCDPSOSA-N	1	0	251.370	1.839	50	0		CDAARO
C[C@@H](c1ccc(-n2cncn2)cc1)[N@H+](C)CC(=O)N1CCC1	ZINC000025926582	356685348	/nfs/dbraw/zinc/68/53/48/356685348.db2.gz	BBYPTTCNPPQHOP-ZDUSSCGKSA-N	1	0	299.378	1.492	50	0		CDAARO
CCOc1cc(C[NH+]2CCC(C(N)=O)CC2)ccc1OC	ZINC000023281256	356815671	/nfs/dbraw/zinc/81/56/71/356815671.db2.gz	DBIFSTDQMYWGHC-UHFFFAOYSA-N	1	0	292.379	1.791	50	0		CDAARO
[NH3+]C1(CNS(=O)(=O)c2cccs2)CCCCC1	ZINC000036266736	356868160	/nfs/dbraw/zinc/86/81/60/356868160.db2.gz	UBEIVCWJMLIKQA-UHFFFAOYSA-N	1	0	274.411	1.688	50	0		CDAARO
C[NH+]1CCC2(CCN(S(=O)(=O)c3cccnc3)C2)CC1	ZINC000065394130	357535930	/nfs/dbraw/zinc/53/59/30/357535930.db2.gz	UIMKUDVBHCJANL-UHFFFAOYSA-N	1	0	295.408	1.188	50	0		CDAARO
CCc1nccn1CCC[NH2+][C@H]1CCCN(CC)C1	ZINC000065461409	357543527	/nfs/dbraw/zinc/54/35/27/357543527.db2.gz	TTXJGRNDBFSAAU-AWEZNQCLSA-N	1	0	264.417	1.910	50	0		CDAARO
C[C@@H](Cn1cncn1)[NH2+]CCN1CCc2ccccc21	ZINC000065488031	357544712	/nfs/dbraw/zinc/54/47/12/357544712.db2.gz	MCZXHLWWWNNXPS-ZDUSSCGKSA-N	1	0	271.368	1.319	50	0		CDAARO
C[NH+](C)CC(=O)N1CCCC[C@H]1CCc1ccccn1	ZINC000067712601	357619920	/nfs/dbraw/zinc/61/99/20/357619920.db2.gz	GMCVILQVBIZNDK-HNNXBMFYSA-N	1	0	275.396	1.957	50	0		CDAARO
Cc1cc(=O)[nH]c(CC[NH2+][C@@H](C)COc2ccccc2)n1	ZINC000067712996	357620232	/nfs/dbraw/zinc/62/02/32/357620232.db2.gz	MJAVKEINTLDLJI-ZDUSSCGKSA-N	1	0	287.363	1.678	50	0		CDAARO
C[C@@H]1CCCN(C(=O)CC[C@H]2CCCOC2)[C@H]1C[NH3+]	ZINC000299738733	357700973	/nfs/dbraw/zinc/70/09/73/357700973.db2.gz	FSJVGQNNRVVCND-MCIONIFRSA-N	1	0	268.401	1.779	50	0		CDAARO
CCc1ccc(CN2CC[C@@](O)(C[NH+](C)C)C2)nc1	ZINC000072424647	357833840	/nfs/dbraw/zinc/83/38/40/357833840.db2.gz	HBJXTUPMCQVPPL-OAHLLOKOSA-N	1	0	263.385	1.142	50	0		CDAARO
Cc1nn2c(nc(C)cc2N2C[C@@H]3CCC[NH2+][C@@H]3C2)c1C	ZINC000072424904	357834635	/nfs/dbraw/zinc/83/46/35/357834635.db2.gz	PTWZANUGXZTKDD-UONOGXRCSA-N	1	0	285.395	1.843	50	0		CDAARO
CNC(=O)[C@H]1C[N@H+](Cc2cccc3[nH]ccc32)CCO1	ZINC000097081629	357945045	/nfs/dbraw/zinc/94/50/45/357945045.db2.gz	ZUFHULYNTJNYMZ-CQSZACIVSA-N	1	0	273.336	1.115	50	0		CDAARO
COC(=O)[C@]12CCC[C@@H]1C[N@H+](Cc1cnn(C)c1C)C2	ZINC000097082970	357945970	/nfs/dbraw/zinc/94/59/70/357945970.db2.gz	HBNPJZPSOGOKLI-HIFRSBDPSA-N	1	0	277.368	1.504	50	0		CDAARO
C[C@H]([NH2+]CCNS(=O)(=O)c1ccccc1)[C@@H]1CCCO1	ZINC000097108748	357983553	/nfs/dbraw/zinc/98/35/53/357983553.db2.gz	LYQBXOXWASLSHF-JSGCOSHPSA-N	1	0	298.408	1.122	50	0		CDAARO
COc1cccc(OC)c1OCCN1CCCC[C@@H]([NH3+])C1	ZINC000082125643	358148085	/nfs/dbraw/zinc/14/80/85/358148085.db2.gz	DCJDZPKSHDPWJU-CYBMUJFWSA-N	1	0	294.395	1.896	50	0		CDAARO
COC(=O)[C@@]12CCC[C@@H]1C[N@H+](CC(=O)N1CCCCC1)C2	ZINC000097082975	358184068	/nfs/dbraw/zinc/18/40/68/358184068.db2.gz	HYCDTQQMPGYENK-CZUORRHYSA-N	1	0	294.395	1.274	50	0		CDAARO
COc1ccc(O[C@H](C)C(=O)N2CCN(C)CC2)cc1	ZINC000019877154	358207666	/nfs/dbraw/zinc/20/76/66/358207666.db2.gz	SOEXULQZCXKZQS-GFCCVEGCSA-N	1	0	278.352	1.237	50	0		CDAARO
CCC[C@H](CCc1ccccc1)NC(=O)[C@@H]1C[NH2+]CCO1	ZINC000195543620	358559853	/nfs/dbraw/zinc/55/98/53/358559853.db2.gz	QLBCFSIRLMEIKJ-CVEARBPZSA-N	1	0	290.407	1.893	50	0		CDAARO
CC(C)[C@@H](CCO)[NH2+]CC(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000195563989	358565662	/nfs/dbraw/zinc/56/56/62/358565662.db2.gz	IXQGBRHOVLBGMG-HZSPNIEDSA-N	1	0	270.417	1.488	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CNc2ncc(C)cn2)C1	ZINC000095356324	358684042	/nfs/dbraw/zinc/68/40/42/358684042.db2.gz	UNPULOMBZJLOEA-GFCCVEGCSA-N	1	0	250.346	1.165	50	0		CDAARO
CCN(Cc1nc(C)no1)C(=O)CC[C@@H]1CCC[N@H+](C)C1	ZINC000095362016	358685550	/nfs/dbraw/zinc/68/55/50/358685550.db2.gz	XYMAYOICALHOOZ-ZDUSSCGKSA-N	1	0	294.399	1.849	50	0		CDAARO
CN(C)[C@H](C(=O)NCCCCC[NH3+])c1ccccc1F	ZINC000095360879	358685853	/nfs/dbraw/zinc/68/58/53/358685853.db2.gz	SSDWRHDJEYCKED-AWEZNQCLSA-N	1	0	281.375	1.674	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)N(CCO)Cc1nccs1	ZINC000097711669	358793930	/nfs/dbraw/zinc/79/39/30/358793930.db2.gz	UPYRMYPWLJIVAD-LBPRGKRZSA-N	1	0	297.424	1.338	50	0		CDAARO
COc1c(F)ccc(CN2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)c1F	ZINC000214970374	358866766	/nfs/dbraw/zinc/86/67/66/358866766.db2.gz	ONACMYUEVLVWHV-TXEJJXNPSA-N	1	0	282.334	1.967	50	0		CDAARO
CCc1nccc(C[NH+]2CCC(c3ccnc(N)n3)CC2)n1	ZINC000215313656	358883392	/nfs/dbraw/zinc/88/33/92/358883392.db2.gz	CQROTNIYSDRQQB-UHFFFAOYSA-N	1	0	298.394	1.791	50	0		CDAARO
CNC(=O)C[C@@H](C)[N@H+](C)Cc1ccnc(C(C)C)n1	ZINC000215559348	358894384	/nfs/dbraw/zinc/89/43/84/358894384.db2.gz	NDXFNBRFTIUIFZ-LLVKDONJSA-N	1	0	264.373	1.556	50	0		CDAARO
CO[C@@H](CNc1cc(-n2cccn2)nc(N)[nH+]1)C(C)(C)C	ZINC000092918581	358895122	/nfs/dbraw/zinc/89/51/22/358895122.db2.gz	IJRVANQARVXVFZ-JTQLQIEISA-N	1	0	290.371	1.718	50	0		CDAARO
[NH3+]C[C@H](c1cccnc1)N1CCN(c2ccccc2)CC1	ZINC000019271930	358895306	/nfs/dbraw/zinc/89/53/06/358895306.db2.gz	XCMWUJNMFJHDAC-QGZVFWFLSA-N	1	0	282.391	1.904	50	0		CDAARO
Cc1ccc(C[N@H+]2C[C@@H]3C(=O)N(C)C(=O)[C@@H]3C2)cc1C	ZINC000257179649	359164839	/nfs/dbraw/zinc/16/48/39/359164839.db2.gz	JCTHVGYSHOEVCA-OKILXGFUSA-N	1	0	272.348	1.350	50	0		CDAARO
C[C@H]1CCCN(C(=O)COc2cccc(F)c2)[C@@H]1C[NH3+]	ZINC000408519274	359911928	/nfs/dbraw/zinc/91/19/28/359911928.db2.gz	YUGBOCYKIZGLCF-SMDDNHRTSA-N	1	0	280.343	1.790	50	0		CDAARO
CCN1C(=O)[C@@H]2CC3(CN2C1=O)CC[NH+](CC1CC1)CC3	ZINC000409419985	360229131	/nfs/dbraw/zinc/22/91/31/360229131.db2.gz	IKJXPYXDSIEAHQ-ZDUSSCGKSA-N	1	0	291.395	1.535	50	0		CDAARO
CC[C@@H]1CN(C(=O)CO)CC[N@@H+]1Cc1ccccc1	ZINC000274125308	363713100	/nfs/dbraw/zinc/71/31/00/363713100.db2.gz	BLOQCUITSAGGST-CQSZACIVSA-N	1	0	262.353	1.102	50	0		CDAARO
CCc1ccccc1CNC(=O)N(C)CC[NH+](C)C	ZINC000176393744	360275272	/nfs/dbraw/zinc/27/52/72/360275272.db2.gz	QCOHGQFWXGJHAK-UHFFFAOYSA-N	1	0	263.385	1.952	50	0		CDAARO
CN(CC(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1C)C1CC1	ZINC000248124876	360384994	/nfs/dbraw/zinc/38/49/94/360384994.db2.gz	LIRRQMWHNXVVMF-ZIAGYGMSSA-N	1	0	265.401	1.166	50	0		CDAARO
C[NH+](C)Cc1ccnc(NC(=O)CC[C@H]2CCOC2)c1	ZINC000177542583	189055662	/nfs/dbraw/zinc/05/56/62/189055662.db2.gz	CSOUXTWHPLUZMO-LBPRGKRZSA-N	1	0	277.368	1.898	50	0		CDAARO
[NH3+][C@H]1[C@@H]2CC[C@H]1CN(Cc1ccc3nsnc3c1)C2	ZINC000426658631	360693005	/nfs/dbraw/zinc/69/30/05/360693005.db2.gz	ZYQBSVXJNVROIX-YABSGUDNSA-N	1	0	274.393	1.860	50	0		CDAARO
CN(C)[C@H](C(=O)N1CC[C@@H](C[NH3+])C1)c1ccccc1	ZINC000178551742	189126263	/nfs/dbraw/zinc/12/62/63/189126263.db2.gz	LDNNGYPSMAVLIK-JSGCOSHPSA-N	1	0	261.369	1.097	50	0		CDAARO
Cc1ccc(OCCC(=O)N2CC[C@H](C[NH3+])C2)c(C)c1	ZINC000178558487	189126541	/nfs/dbraw/zinc/12/65/41/189126541.db2.gz	CYOPXXLLBQXUGE-CQSZACIVSA-N	1	0	276.380	1.880	50	0		CDAARO
CC1(C)C[N@H+](CCc2nn[nH]n2)C[C@H]1c1ccccc1	ZINC000426719846	360699064	/nfs/dbraw/zinc/69/90/64/360699064.db2.gz	KHGJEWYNEMHKLQ-ZDUSSCGKSA-N	1	0	271.368	1.868	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2c(Cl)nc3ccccn32)C1	ZINC000178990136	189160257	/nfs/dbraw/zinc/16/02/57/189160257.db2.gz	LZKGKDLBBOUHQE-SNVBAGLBSA-N	1	0	292.770	1.669	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCN(C(=O)c2cnc3ccccc3n2)C1	ZINC000179213774	189177990	/nfs/dbraw/zinc/17/79/90/189177990.db2.gz	BDNGGPIKORYWLT-NWDGAFQWSA-N	1	0	284.363	1.829	50	0		CDAARO
COc1ccnc(-c2cccc(C(=O)N3CC[C@@H]([NH3+])C3)c2)n1	ZINC000426504631	360935678	/nfs/dbraw/zinc/93/56/78/360935678.db2.gz	RBAIZODOLZXLKF-CYBMUJFWSA-N	1	0	298.346	1.325	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](CNC(=O)c2cncnc2)C1	ZINC000299775018	200867521	/nfs/dbraw/zinc/86/75/21/200867521.db2.gz	JBVMBFONKYHTOR-GFCCVEGCSA-N	1	0	262.357	1.328	50	0		CDAARO
O=C(C[C@@H]1CC[NH2+]C1)N1CC(Oc2cccc(Cl)c2)C1	ZINC000299773188	200867581	/nfs/dbraw/zinc/86/75/81/200867581.db2.gz	CZBZVDMPCZRUJF-NSHDSACASA-N	1	0	294.782	1.929	50	0		CDAARO
Cc1cc(Cl)ccc1S(=O)(=O)N1CCC[C@H]([NH3+])C1	ZINC000036297080	361462328	/nfs/dbraw/zinc/46/23/28/361462328.db2.gz	UGRVZQRKZUNBBW-NSHDSACASA-N	1	0	288.800	1.760	50	0		CDAARO
CC1=CC[N@H+](C[C@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000339659369	361686039	/nfs/dbraw/zinc/68/60/39/361686039.db2.gz	PKBTZZJUSSKQFA-ZDUSSCGKSA-N	1	0	291.347	1.807	50	0		CDAARO
C[C@H]1CCc2[nH]c(=O)c(C(=O)NCCC[NH+](C)C)cc2C1	ZINC000049551699	364071167	/nfs/dbraw/zinc/07/11/67/364071167.db2.gz	VGONBCZAZAMBDB-NSHDSACASA-N	1	0	291.395	1.181	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1ccc(Br)o1	ZINC000002771503	364639412	/nfs/dbraw/zinc/63/94/12/364639412.db2.gz	KFFOHUPHWXZKGQ-UHFFFAOYSA-N	1	0	275.146	1.724	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1C(=O)N1CCC[C@H]1Cn1cccn1	ZINC000249693950	365193312	/nfs/dbraw/zinc/19/33/12/365193312.db2.gz	OHQGVEMGBMLXNX-GJZGRUSLSA-N	1	0	290.411	1.749	50	0		CDAARO
CS[C@@H]1CN(C(=O)Nc2cc(C)no2)C[C@@H]1[NH+](C)C	ZINC000089608785	366884157	/nfs/dbraw/zinc/88/41/57/366884157.db2.gz	OLGOISRCAPGDOP-VHSXEESVSA-N	1	0	284.385	1.492	50	0		CDAARO
Cc1cc(CNC(=O)N2CC[N@@H+]3CCCC[C@@H]3C2)no1	ZINC000089604897	366884282	/nfs/dbraw/zinc/88/42/82/366884282.db2.gz	AAXYUEMTMORIQG-CYBMUJFWSA-N	1	0	278.356	1.363	50	0		CDAARO
CC[C@@H]1CN(C(=O)C2CC2)CC[C@H]1[NH2+]Cc1c[nH]nc1C	ZINC000089948807	366977781	/nfs/dbraw/zinc/97/77/81/366977781.db2.gz	MTGFFYDXOHGZJP-IUODEOHRSA-N	1	0	290.411	1.845	50	0		CDAARO
CCC(=O)N1CC[C@@H]([NH2+]Cc2nccn2C)[C@@H](CC)C1	ZINC000089949198	366979074	/nfs/dbraw/zinc/97/90/74/366979074.db2.gz	VIDJXJXJSZPSAM-QWHCGFSZSA-N	1	0	278.400	1.547	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@@H]1NS(=O)(=O)c1ccc(F)cc1F	ZINC000094345686	367465909	/nfs/dbraw/zinc/46/59/09/367465909.db2.gz	IYXWKDHMGWXYCZ-KWQFWETISA-N	1	0	290.335	1.241	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)NCCOc2ccc(Cl)cc2)C1	ZINC000416849648	242185019	/nfs/dbraw/zinc/18/50/19/242185019.db2.gz	NTZMVIPVZNCZLE-LBPRGKRZSA-N	1	0	297.786	1.852	50	0		CDAARO
COc1ccc(CNC(=O)N2CCCC[C@H]2C[NH3+])cc1F	ZINC000417087876	242309363	/nfs/dbraw/zinc/30/93/63/242309363.db2.gz	IJICRFSKMZLOCT-LBPRGKRZSA-N	1	0	295.358	1.857	50	0		CDAARO
Cc1ccc(C(=O)N2C[C@H](C)[NH2+][C@@H](C)C2)c(F)c1	ZINC000094919101	367682493	/nfs/dbraw/zinc/68/24/93/367682493.db2.gz	GHQABJQSMJBXGT-QWRGUYRKSA-N	1	0	250.317	1.957	50	0		CDAARO
CCn1ccc(C(=O)NCCn2c(C)c[nH+]c2C)n1	ZINC000575554444	369117616	/nfs/dbraw/zinc/11/76/16/369117616.db2.gz	DEWLYZCFVOYLLY-UHFFFAOYSA-N	1	0	261.329	1.146	50	0		CDAARO
COc1ccc(C(=O)NCCn2c(C)c[nH+]c2C)cc1	ZINC000575555686	369132615	/nfs/dbraw/zinc/13/26/15/369132615.db2.gz	QYTISTGOGYXESF-UHFFFAOYSA-N	1	0	273.336	1.939	50	0		CDAARO
CC(C)COC(=O)N1CCC([NH2+][C@H]2CCC[C@@H]2CO)CC1	ZINC000089157191	370139660	/nfs/dbraw/zinc/13/96/60/370139660.db2.gz	ZTKUNKSAVDGOEC-HIFRSBDPSA-N	1	0	298.427	1.994	50	0		CDAARO
CS(=O)(=O)N1CCC[C@@H]([NH2+]C[C@@H]2CC=CCC2)C1	ZINC000334475967	371772863	/nfs/dbraw/zinc/77/28/63/371772863.db2.gz	OHUFSIHPLHFGNN-CHWSQXEVSA-N	1	0	272.414	1.356	50	0		CDAARO
CC(C)(C)c1cc(CNC(=O)C[C@H]2CC[NH2+]C2)[nH]n1	ZINC000299777743	372754688	/nfs/dbraw/zinc/75/46/88/372754688.db2.gz	OREXABYAPYSNJD-SNVBAGLBSA-N	1	0	264.373	1.323	50	0		CDAARO
C[C@@H](O)[C@H]([NH3+])C(=O)NC1(c2ccccc2Cl)CC1	ZINC000299802361	372772786	/nfs/dbraw/zinc/77/27/86/372772786.db2.gz	LBHBQUXKBXSEPH-KCJUWKMLSA-N	1	0	268.744	1.153	50	0		CDAARO
C[C@H](c1cnccn1)N1C[C@@H]2C[N@@H+]3CCCC[C@@H]3[C@H]2C1	ZINC000253370472	373679140	/nfs/dbraw/zinc/67/91/40/373679140.db2.gz	RGQIXNORXCMUOF-ORIJERBGSA-N	1	0	272.396	1.954	50	0		CDAARO
Cc1n[nH]cc1CNCC1([NH+]2CCCCC2)CCOCC1	ZINC000111403396	374189490	/nfs/dbraw/zinc/18/94/90/374189490.db2.gz	IHKWJAKOYXTEMU-UHFFFAOYSA-N	1	0	292.427	1.843	50	0		CDAARO
COc1ccc(-c2cn(O)c3c([n+]2=O)CCC3)c(OC)c1	ZINC000334157225	206120922	/nfs/dbraw/zinc/12/09/22/206120922.db2.gz	XGTFOUSGNGQEJT-UHFFFAOYSA-N	1	0	289.311	1.813	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@@H]2COc3ccccc32)C[C@H]1[NH+](C)C	ZINC000089948375	541983070	/nfs/dbraw/zinc/98/30/70/541983070.db2.gz	JYZXTYZNUKKJFX-BPLDGKMQSA-N	1	0	288.391	1.961	50	0		CDAARO
O[C@H](COc1ccccc1-c1cc[nH]n1)C[NH+]1CCCC1	ZINC000019741573	374782708	/nfs/dbraw/zinc/78/27/08/374782708.db2.gz	CSNNGJMIZDYYEP-ZDUSSCGKSA-N	1	0	287.363	1.912	50	0		CDAARO
C[C@@H](C[NH2+][C@H]1CCc2ncnn2C1)c1ccccc1	ZINC000095398047	374902352	/nfs/dbraw/zinc/90/23/52/374902352.db2.gz	HORPZXGPBLYPGO-JSGCOSHPSA-N	1	0	256.353	1.986	50	0		CDAARO
COCCN1CCC[C@@H]1C[NH2+][C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000108490397	412830285	/nfs/dbraw/zinc/83/02/85/412830285.db2.gz	YIOJOBYLYDHOJH-QXSJWSMHSA-N	1	0	296.455	1.890	50	0		CDAARO
COC[C@H](O)C[N@H+](CC(=O)Nc1ccc(F)cc1)C(C)C	ZINC000095431911	374932339	/nfs/dbraw/zinc/93/23/39/374932339.db2.gz	XQNBZMZAQIOUMB-CQSZACIVSA-N	1	0	298.358	1.482	50	0		CDAARO
CCCCCNC(=O)N(C)CC1CC[NH+](C[C@H](C)O)CC1	ZINC000095461027	374958445	/nfs/dbraw/zinc/95/84/45/374958445.db2.gz	DECUWUDGAGNUAW-AWEZNQCLSA-N	1	0	299.459	1.911	50	0		CDAARO
CNc1snc(C)c1C(=O)N1C[C@@H](C)[C@@H]([NH+](C)C)C1	ZINC000095402452	374906187	/nfs/dbraw/zinc/90/61/87/374906187.db2.gz	BTXDYVUGBQUACI-SCZZXKLOSA-N	1	0	282.413	1.515	50	0		CDAARO
COc1ccnc(N2CCC[N@H+](Cc3ccncc3)CC2)n1	ZINC000095401510	374906536	/nfs/dbraw/zinc/90/65/36/374906536.db2.gz	JJNRZTAAYNTCOI-UHFFFAOYSA-N	1	0	299.378	1.593	50	0		CDAARO
CNc1snc(C)c1C(=O)N1C[C@H]([NH+](C)C)[C@@H](C)C1	ZINC000095402451	374906881	/nfs/dbraw/zinc/90/68/81/374906881.db2.gz	BTXDYVUGBQUACI-WPRPVWTQSA-N	1	0	282.413	1.515	50	0		CDAARO
C[C@H](Cc1cnccn1)[NH2+]C1CCN(c2ncccn2)CC1	ZINC000095509856	374976759	/nfs/dbraw/zinc/97/67/59/374976759.db2.gz	QUWYLLRRUDJJRB-CYBMUJFWSA-N	1	0	298.394	1.456	50	0		CDAARO
CCO[C@@H]1C[C@H](NC(=O)NCC[N@H+](C)C2CC2)C12CCC2	ZINC000096444032	375100221	/nfs/dbraw/zinc/10/02/21/375100221.db2.gz	KPYHKZOZTORFLX-UONOGXRCSA-N	1	0	295.427	1.728	50	0		CDAARO
CCOc1ccccc1N1CC[NH+]([C@H](C)[C@H](C)O)CC1	ZINC000095964818	375043508	/nfs/dbraw/zinc/04/35/08/375043508.db2.gz	VGSSTNKXKXDXKU-KGLIPLIRSA-N	1	0	278.396	1.977	50	0		CDAARO
CCOC(=O)c1ccc(C[NH2+][C@@H]2CCO[C@@H]2C)o1	ZINC000095988513	375048532	/nfs/dbraw/zinc/04/85/32/375048532.db2.gz	DHIMOWMCXLTHOJ-MWLCHTKSSA-N	1	0	253.298	1.723	50	0		CDAARO
Cn1cc([C@H](CO)[NH2+]C2CC(c3ccccc3)C2)cn1	ZINC000097084862	375146875	/nfs/dbraw/zinc/14/68/75/375146875.db2.gz	WXCKMFBBUVPPEG-BCLQGDPASA-N	1	0	271.364	1.989	50	0		CDAARO
C[C@H]1CCCN(C(=O)C2CCSCC2)[C@H]1C[NH3+]	ZINC000299739873	375199326	/nfs/dbraw/zinc/19/93/26/375199326.db2.gz	SOXPZDJAUARDJX-JQWIXIFHSA-N	1	0	256.415	1.715	50	0		CDAARO
CC[C@]1(O)CC[N@H+](Cc2cnc(N(C)C)s2)C1	ZINC000428437973	247300505	/nfs/dbraw/zinc/30/05/05/247300505.db2.gz	MRWGHCZELTZVRD-LBPRGKRZSA-N	1	0	255.387	1.556	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)/C=C\c2ccccc2F)C1	ZINC000606441517	375823406	/nfs/dbraw/zinc/82/34/06/375823406.db2.gz	YSRUGJMNCAEABS-DGMVEKRQSA-N	1	0	262.328	1.907	50	0		CDAARO
Cc1cc(F)ccc1CN1CC[N@@H+](C)[C@H](CO)C1	ZINC000215548276	375895934	/nfs/dbraw/zinc/89/59/34/375895934.db2.gz	PWYHBMSDISNSQD-AWEZNQCLSA-N	1	0	252.333	1.242	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CC[N@@H+]3CCC[C@H]3C2)cc1	ZINC000245227602	376024467	/nfs/dbraw/zinc/02/44/67/376024467.db2.gz	KTVIWFIEOVGCHN-ZDUSSCGKSA-N	1	0	280.393	1.464	50	0		CDAARO
COCCNC(=O)[C@H](C)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C(C)C	ZINC000246281992	376604551	/nfs/dbraw/zinc/60/45/51/376604551.db2.gz	HXHUPBOMGKMDSI-ZNMIVQPWSA-N	1	0	297.443	1.085	50	0		CDAARO
Cc1nc2cc(C)ccn2c1C(=O)N[C@@H]1CC[C@@H]([NH3+])C1	ZINC000067726049	377232224	/nfs/dbraw/zinc/23/22/24/377232224.db2.gz	PROOOUVZPUMOEU-VXGBXAGGSA-N	1	0	272.352	1.561	50	0		CDAARO
Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3c[nH]cn3)C2)cn1	ZINC000067934976	377316430	/nfs/dbraw/zinc/31/64/30/377316430.db2.gz	ITHSZWQTEZETJW-ZDUSSCGKSA-N	1	0	299.378	1.365	50	0		CDAARO
OC[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1	ZINC000245289579	378045904	/nfs/dbraw/zinc/04/59/04/378045904.db2.gz	CTUMWRFFXBTOBG-BBWFWOEESA-N	1	0	274.408	1.979	50	0		CDAARO
C[C@H](C(N)=O)N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000193877328	378308529	/nfs/dbraw/zinc/30/85/29/378308529.db2.gz	SNXXPOGSXNNCCK-SECBINFHSA-N	1	0	284.306	1.682	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCCN1C(=O)/C=C\c1cncc(F)c1	ZINC000493294772	253422819	/nfs/dbraw/zinc/42/28/19/253422819.db2.gz	WSRBQGVYEWUSNW-NCETYUCASA-N	1	0	277.343	1.962	50	0		CDAARO
C[C@@H](NC(=O)C[C@H]1CCOC1)C(C)(C)C[NH+](C)C	ZINC000096449605	533092020	/nfs/dbraw/zinc/09/20/20/533092020.db2.gz	GZIIVSSPQRDQCC-VXGBXAGGSA-N	1	0	256.390	1.506	50	0		CDAARO
CCN1C(=O)OC2(CC(C)(C)[NH2+]C(C)(C)C2)[C@@]1(C)O	ZINC000000036920	285173931	/nfs/dbraw/zinc/17/39/31/285173931.db2.gz	PWMMQYFWZDAZKR-CYBMUJFWSA-N	1	0	270.373	1.846	50	0		CDAARO
Cc1nn(C)c2nc(N3CC[C@H]([NH+](C)C)C3)sc12	ZINC000095497385	256880615	/nfs/dbraw/zinc/88/06/15/256880615.db2.gz	MYLYUYIMCUGKBO-VIFPVBQESA-N	1	0	265.386	1.479	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@H]1NC(=O)Cc1c(F)cccc1F	ZINC000095048567	184924446	/nfs/dbraw/zinc/92/44/46/184924446.db2.gz	GXCZDYPQUCEUOH-NOZJJQNGSA-N	1	0	268.307	1.764	50	0		CDAARO
C[C@H](Cc1cnccn1)NC(=O)CCC[NH+]1CCCCC1	ZINC000095377984	184958666	/nfs/dbraw/zinc/95/86/66/184958666.db2.gz	WDGVMPYQAVELKV-CQSZACIVSA-N	1	0	290.411	1.790	50	0		CDAARO
COC(=O)c1ccc(C(=O)N2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)cc1	ZINC000186931952	390157733	/nfs/dbraw/zinc/15/77/33/390157733.db2.gz	VJEAXYPEDANVGG-BFHYXJOUSA-N	1	0	288.347	1.283	50	0		CDAARO
CCc1ccc(S(=O)(=O)NC2(C[NH3+])CCCC2)s1	ZINC000095394517	184965023	/nfs/dbraw/zinc/96/50/23/184965023.db2.gz	WPHYZTULJBUGCB-UHFFFAOYSA-N	1	0	288.438	1.860	50	0		CDAARO
Cc1cc(C(=O)NC2CC[NH+](CCOC(C)C)CC2)on1	ZINC000096403288	390505056	/nfs/dbraw/zinc/50/50/56/390505056.db2.gz	XZKIGCCPQFKXTL-UHFFFAOYSA-N	1	0	295.383	1.602	50	0		CDAARO
COc1ccc(OC)c([C@H](O)C[NH2+]Cc2c[nH]nc2C)c1	ZINC000097159529	390800950	/nfs/dbraw/zinc/80/09/50/390800950.db2.gz	FRYWZXHOYMZINW-CQSZACIVSA-N	1	0	291.351	1.559	50	0		CDAARO
CN1CC[NH+](CC2CCN(C(=O)[C@H]3CC3(C)C)CC2)CC1	ZINC000119664386	390855393	/nfs/dbraw/zinc/85/53/93/390855393.db2.gz	RQFSGBKDGRAMRC-OAHLLOKOSA-N	1	0	293.455	1.519	50	0		CDAARO
CC(C)c1nn(C)c(N(C)C)c1C[NH2+]C[C@H]1CCCN1C	ZINC000065478074	390942098	/nfs/dbraw/zinc/94/20/98/390942098.db2.gz	KFKGIDAXZWPMBO-CYBMUJFWSA-N	1	0	293.459	1.793	50	0		CDAARO
CS(=O)(=O)[C@H]1CCC[C@H]([NH2+]Cc2ccns2)C1	ZINC000404273479	390958685	/nfs/dbraw/zinc/95/86/85/390958685.db2.gz	MDWLWJHWGAYBSA-ONGXEEELSA-N	1	0	274.411	1.589	50	0		CDAARO
Nc1ccc(NC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3[NH2+]2)cn1	ZINC000237998182	390897386	/nfs/dbraw/zinc/89/73/86/390897386.db2.gz	RDCZMMMSVGSZQK-USWWRNFRSA-N	1	0	260.341	1.523	50	0		CDAARO
COc1ccc2nc(C(=O)N3CC[NH2+][C@H](C)C3)ccc2c1	ZINC000188396863	533343906	/nfs/dbraw/zinc/34/39/06/533343906.db2.gz	ZPSNMXVFXSFUAN-LLVKDONJSA-N	1	0	285.347	1.677	50	0		CDAARO
CO[C@@]1(C)C[C@H](NC(=O)[C@@H]2CCCC[NH2+]2)C1(C)C	ZINC000121681840	391612792	/nfs/dbraw/zinc/61/27/92/391612792.db2.gz	ZXOAFLJOGGXRMQ-MJVIPROJSA-N	1	0	254.374	1.448	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+](C[C@@H]2COCCO2)C1	ZINC000431010251	391706335	/nfs/dbraw/zinc/70/63/35/391706335.db2.gz	NFVAZVCQMPNXPU-SOUVJXGZSA-N	1	0	298.427	1.419	50	0		CDAARO
CCC[C@]1(COC)CCC[N@@H+]1Cc1nc(COC)no1	ZINC000194922566	392006131	/nfs/dbraw/zinc/00/61/31/392006131.db2.gz	UWEZSAHEPNIPNT-CQSZACIVSA-N	1	0	283.372	1.997	50	0		CDAARO
CS[C@@H]1CC[C@@H]([N@H+](C)CCC(=O)N2CCOCC2)C1	ZINC000107064371	392732808	/nfs/dbraw/zinc/73/28/08/392732808.db2.gz	SPHUPVKMEXUCGK-CHWSQXEVSA-N	1	0	286.441	1.451	50	0		CDAARO
CCc1nc2c(C)nn(CC)c2c(N2CC[NH+](C)CC2)n1	ZINC000057355587	393212794	/nfs/dbraw/zinc/21/27/94/393212794.db2.gz	NVRSPYALDVONCQ-UHFFFAOYSA-N	1	0	288.399	1.469	50	0		CDAARO
[NH3+][C@H]1CCC[C@H]1C(=O)N1CCN(c2ccccc2F)CC1	ZINC000085365300	134505692	/nfs/dbraw/zinc/50/56/92/134505692.db2.gz	DCBSSNIMRUJCSZ-OCCSQVGLSA-N	1	0	291.370	1.602	50	0		CDAARO
[NH3+]CC[C@H]1CN(c2ccnc(C(F)(F)F)n2)CCO1	ZINC000091663404	135072683	/nfs/dbraw/zinc/07/26/83/135072683.db2.gz	ZJSBGGIXWYWBMF-QMMMGPOBSA-N	1	0	276.262	1.049	50	0		CDAARO
O=C(NCC[C@@H]1CCC[NH2+]C1)c1ccc2nccn2c1	ZINC000179128956	140013452	/nfs/dbraw/zinc/01/34/52/140013452.db2.gz	DDHMREJTWWNMCZ-LBPRGKRZSA-N	1	0	272.352	1.454	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1ccc2nnc(C)n2c1	ZINC000033261861	397925509	/nfs/dbraw/zinc/92/55/09/397925509.db2.gz	FIQVPYVASPCXTI-CYBMUJFWSA-N	1	0	287.367	1.252	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC([NH3+])CC2)c(C)c1	ZINC000020267699	292172762	/nfs/dbraw/zinc/17/27/62/292172762.db2.gz	DVMURSLYIMWGOC-UHFFFAOYSA-N	1	0	268.382	1.415	50	0		CDAARO
C[C@@H]1C[C@H]1N1C[C@@H](Nc2ncnc(N)c2Cl)CC1=O	ZINC000372967596	160161918	/nfs/dbraw/zinc/16/19/18/160161918.db2.gz	OASGNRZBMIGLEO-GJMOJQLCSA-N	1	0	281.747	1.133	50	0		CDAARO
O=Cc1cn(C[C@@H](O)C[NH+]2CCCC2)c2ccccc12	ZINC000005520929	170107430	/nfs/dbraw/zinc/10/74/30/170107430.db2.gz	ZAQTVTPMMVNLTJ-AWEZNQCLSA-N	1	0	272.348	1.911	50	0		CDAARO
COC[C@@H](O)c1ccc(OC[C@@H](O)C[NH2+]C(C)C)cc1	ZINC000005760466	170137724	/nfs/dbraw/zinc/13/77/24/170137724.db2.gz	OFRYBPCSEMMZHR-DZGCQCFKSA-N	1	0	283.368	1.104	50	0	world	CDAARO
NC(=O)C1CC[NH+](CCCOc2ccccc2)CC1	ZINC000008317202	170330508	/nfs/dbraw/zinc/33/05/08/170330508.db2.gz	LUQNIIMRBSWLKR-UHFFFAOYSA-N	1	0	262.353	1.653	50	0		CDAARO
COc1ccc(CCN2C[C@@H]([NH2+]C(C)C)CC2=O)cc1	ZINC000012594656	170499264	/nfs/dbraw/zinc/49/92/64/170499264.db2.gz	ZUPZRECWPURJIF-AWEZNQCLSA-N	1	0	276.380	1.837	50	0		CDAARO
CC(C)C(=O)NCC[NH2+]Cc1cnn(-c2ccccc2)c1	ZINC000020125180	171008521	/nfs/dbraw/zinc/00/85/21/171008521.db2.gz	HLPCUPGGTYDHFD-UHFFFAOYSA-N	1	0	286.379	1.734	50	0		CDAARO
COc1cccc(C=O)c1OCCN1C[C@@H](C)O[C@H](C)C1	ZINC000020652616	171269153	/nfs/dbraw/zinc/26/91/53/171269153.db2.gz	BLJGUMXPDNDKPL-CHWSQXEVSA-N	1	0	293.363	1.996	50	0		CDAARO
O=C(CN1CC[N@@H+]2CCC[C@@H]2C1)NCc1ccccc1	ZINC000022752667	171397368	/nfs/dbraw/zinc/39/73/68/171397368.db2.gz	JFMWDCIZWBWCDF-OAHLLOKOSA-N	1	0	273.380	1.083	50	0		CDAARO
CNC(=O)NC(=O)[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1OC	ZINC000024865247	171442682	/nfs/dbraw/zinc/44/26/82/171442682.db2.gz	IKPIKVIWHDZQKS-GHMZBOCLSA-N	1	0	293.367	1.498	50	0		CDAARO
O=C(CCc1ccco1)NC1CC[NH+](C2CC2)CC1	ZINC000029094310	171585817	/nfs/dbraw/zinc/58/58/17/171585817.db2.gz	DEGLKERFTLWMCU-UHFFFAOYSA-N	1	0	262.353	1.955	50	0		CDAARO
[NH3+]CCC1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000034927280	171895270	/nfs/dbraw/zinc/89/52/70/171895270.db2.gz	ATCDPNMGAFSJST-UHFFFAOYSA-N	1	0	286.372	1.575	50	0		CDAARO
CCNC(=O)C[NH2+]Cc1csc(Br)c1	ZINC000035251364	172081515	/nfs/dbraw/zinc/08/15/15/172081515.db2.gz	NQJMUIQTDCJPJU-UHFFFAOYSA-N	1	0	277.187	1.736	50	0		CDAARO
CCOC(=O)C1=C(N)CC[N@H+](Cc2ccccc2)C1	ZINC000035287647	172105905	/nfs/dbraw/zinc/10/59/05/172105905.db2.gz	ULARACKZXVBXJF-UHFFFAOYSA-N	1	0	260.337	1.668	50	0		CDAARO
COc1ccccc1CN(C)C(=O)C1CC[NH2+]CC1	ZINC000038059142	174069597	/nfs/dbraw/zinc/06/95/97/174069597.db2.gz	PNXWDQXWUHBAJQ-UHFFFAOYSA-N	1	0	262.353	1.653	50	0		CDAARO
COc1ccccc1-c1nnc2ccc(OCC[NH3+])nn21	ZINC000038478040	174142228	/nfs/dbraw/zinc/14/22/28/174142228.db2.gz	FJVZHJOGTXZTEX-UHFFFAOYSA-N	1	0	285.307	1.137	50	0		CDAARO
COCC(C)(C)CNC(=O)[C@H]([NH3+])c1ccccc1	ZINC000071403932	176155339	/nfs/dbraw/zinc/15/53/39/176155339.db2.gz	WJEZAISEBYAWKX-GFCCVEGCSA-N	1	0	250.342	1.475	50	0		CDAARO
[NH3+]CC(=O)N1CCC[C@@H](CCc2ccc(F)cc2)C1	ZINC000071750999	176260364	/nfs/dbraw/zinc/26/03/64/176260364.db2.gz	JHWQRWIWEIUTPK-ZDUSSCGKSA-N	1	0	264.344	1.956	50	0		CDAARO
OC[C@H]1CC[N@H+](Cc2cccc(-c3ccccn3)c2)C[C@@H]1O	ZINC000072121094	176319637	/nfs/dbraw/zinc/31/96/37/176319637.db2.gz	SEDRMPRZHYAAJJ-AEFFLSMTSA-N	1	0	298.386	1.924	50	0		CDAARO
Cc1ccccc1C(=O)N1CCOC[C@H]1C[NH+](C)C	ZINC000085469784	292626219	/nfs/dbraw/zinc/62/62/19/292626219.db2.gz	BPIYIDFELUOTAJ-CYBMUJFWSA-N	1	0	262.353	1.398	50	0		CDAARO
Fc1ccc(N2CCC(N[C@@H]3CC[NH2+]C3)CC2)cc1F	ZINC000426602552	260881336	/nfs/dbraw/zinc/88/13/36/260881336.db2.gz	SJNUZBLPMHLWKG-GFCCVEGCSA-N	1	0	281.350	1.885	50	0		CDAARO
COc1ccc(OC)c(COC[C@H](O)C[NH+](C)C)c1	ZINC000012420253	424377072	/nfs/dbraw/zinc/37/70/72/424377072.db2.gz	JDLJMJQQOOHSLS-GFCCVEGCSA-N	1	0	269.341	1.143	50	0		CDAARO
C[C@@H]1CN(C(=O)C[N@H+](C)C2CCCC2)C[C@@]1(O)C1CCC1	ZINC000091656477	274323463	/nfs/dbraw/zinc/32/34/63/274323463.db2.gz	WHVXNLQXDLFQMW-DYVFJYSZSA-N	1	0	294.439	1.870	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1cc(Cl)c(Cl)n1C	ZINC000125225080	274375931	/nfs/dbraw/zinc/37/59/31/274375931.db2.gz	UXOFYZKDNOWEGV-SSDOTTSWSA-N	1	0	276.167	1.766	50	0		CDAARO
CC[NH+](CC)C[C@@H](O)CN1CCC[C@H](c2ccnn2C)C1	ZINC000089967915	276331362	/nfs/dbraw/zinc/33/13/62/276331362.db2.gz	VHTQDULUWSOZAR-LSDHHAIUSA-N	1	0	294.443	1.302	50	0		CDAARO
CN1CCC([N@@H+]2CCC[C@H](C(=O)NC(C)(C)C)C2)CC1	ZINC000020542330	277027221	/nfs/dbraw/zinc/02/72/21/277027221.db2.gz	XETHINUHJAPLBL-ZDUSSCGKSA-N	1	0	281.444	1.707	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)c2cc3ccccc3[nH]c2=O)C1	ZINC000178337062	277275326	/nfs/dbraw/zinc/27/53/26/277275326.db2.gz	QMQBGQAJQXUZKV-LBPRGKRZSA-N	1	0	299.374	1.600	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2CC23CC[NH2+]CC3)[C@H](C)CO1	ZINC000251756818	278674472	/nfs/dbraw/zinc/67/44/72/278674472.db2.gz	SXYLEHVVKOQWMR-IJLUTSLNSA-N	1	0	252.358	1.012	50	0		CDAARO
CC1CCN(C(=O)C[N@@H+]2CCCSCC2)CC1	ZINC000089983859	279272263	/nfs/dbraw/zinc/27/22/63/279272263.db2.gz	BMONLHZPLQDDJB-UHFFFAOYSA-N	1	0	256.415	1.684	50	0		CDAARO
C[C@H]1CCCN(C(=O)c2ncncc2Cl)[C@@H]1C[NH3+]	ZINC000179222210	279665558	/nfs/dbraw/zinc/66/55/58/279665558.db2.gz	MFVATGFOGLJSML-WCBMZHEXSA-N	1	0	268.748	1.329	50	0		CDAARO
CCS[C@H]1CCCC[N@@H+]([C@H](C)C(=O)NC(=O)NC)C1	ZINC000106851317	280056329	/nfs/dbraw/zinc/05/63/29/280056329.db2.gz	XVKRTURGZUEBJH-MNOVXSKESA-N	1	0	287.429	1.438	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)/C=C\c2ccc3c(c2)CCO3)C1	ZINC000255195920	289360472	/nfs/dbraw/zinc/36/04/72/289360472.db2.gz	HLDPLAFFVBHGKT-PKXJPQMGSA-N	1	0	286.375	1.703	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)/C=C\c2ccccc2OC)C1	ZINC000255174384	289360623	/nfs/dbraw/zinc/36/06/23/289360623.db2.gz	VIBSDUFTVKOOJD-MEJMFZKBSA-N	1	0	274.364	1.776	50	0		CDAARO
CNC(=O)[C@@H]([NH2+]C1CCC(C(=O)OC)CC1)C(C)C	ZINC000190460386	290542763	/nfs/dbraw/zinc/54/27/63/290542763.db2.gz	HXHFFLKTMWFBNQ-MCIGGMRASA-N	1	0	270.373	1.078	50	0		CDAARO
COC[C@@H]1[C@H]([NH2+]C2CSCCSC2)[C@@H]2CCO[C@H]12	ZINC000219892209	292940007	/nfs/dbraw/zinc/94/00/07/292940007.db2.gz	YVXKFYDCFKNPNP-LOWDOPEQSA-N	1	0	289.466	1.475	50	0		CDAARO
CO[C@@H](C(=O)N(C)CC[NH+]1CCCC1)c1ccccc1	ZINC000103117341	293378161	/nfs/dbraw/zinc/37/81/61/293378161.db2.gz	URHBMKCURBYSSN-OAHLLOKOSA-N	1	0	276.380	1.928	50	0		CDAARO
Cc1cc(S(=O)(=O)N2CC[C@@H]([NH3+])C[C@H]2C)c(C)o1	ZINC000299748285	301391823	/nfs/dbraw/zinc/39/18/23/301391823.db2.gz	GRNXGOHZPMWYGD-LDYMZIIASA-N	1	0	272.370	1.397	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)C[C@H]2CCCOC2)CC1	ZINC000534581208	328311852	/nfs/dbraw/zinc/31/18/52/328311852.db2.gz	GWAGMFUYQHECBB-CYBMUJFWSA-N	1	0	268.401	1.794	50	0		CDAARO
c1sc(-c2cnccn2)nc1CN[C@@H]1CCOC1	ZINC000534584999	328315002	/nfs/dbraw/zinc/31/50/02/328315002.db2.gz	NHHBHXVYQGACBU-SECBINFHSA-N	1	0	262.338	1.479	50	0		CDAARO
c1[nH][nH]c2ncnc(=NC[C@H]3CC[N@@H+](C4CCCC4)C3)c1-2	ZINC000534588917	328317030	/nfs/dbraw/zinc/31/70/30/328317030.db2.gz	LIPSNASLCMCIHO-LLVKDONJSA-N	1	0	286.383	1.403	50	0		CDAARO
CO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)CCCc1cccs1	ZINC000534629730	328328517	/nfs/dbraw/zinc/32/85/17/328328517.db2.gz	LBXVBZKFCJBSLY-STQMWFEESA-N	1	0	282.409	1.516	50	0		CDAARO
O=C(NCc1ccccc1)N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000534644762	328330366	/nfs/dbraw/zinc/33/03/66/328330366.db2.gz	YZLSZZVNSLYUAE-NMWPEEMBSA-N	1	0	271.364	1.578	50	0		CDAARO
COc1ccc(CNC(=O)[C@@H]2CCC[NH2+]CC2)cc1OC	ZINC000534637063	328334323	/nfs/dbraw/zinc/33/43/23/328334323.db2.gz	JWSXKSPLZXRIQX-CYBMUJFWSA-N	1	0	292.379	1.710	50	0		CDAARO
NC(=O)c1cccc(NCC2(C[NH+]3CCCC3)CC2)n1	ZINC000534653661	328338520	/nfs/dbraw/zinc/33/85/20/328338520.db2.gz	MTQYLWCZFLFYDC-UHFFFAOYSA-N	1	0	274.368	1.468	50	0		CDAARO
CCOc1ccnc(N2CCC[C@]3(CC[NH2+]C3)C2)n1	ZINC000534652968	328338244	/nfs/dbraw/zinc/33/82/44/328338244.db2.gz	BKGBSPWNHWWMQN-CQSZACIVSA-N	1	0	262.357	1.455	50	0		CDAARO
CCCCN(C(=O)C[NH2+][C@H](C(N)=O)[C@H](C)CC)[C@H](C)CC	ZINC000108056965	482449415	/nfs/dbraw/zinc/44/94/15/482449415.db2.gz	SLDJXPORQCVWFB-NFAWXSAZSA-N	1	0	299.459	1.903	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]Cc1ccc(Cn2cncn2)cc1	ZINC000097159216	482458998	/nfs/dbraw/zinc/45/89/98/482458998.db2.gz	CUCXVZFRDSGCST-UHFFFAOYSA-N	1	0	296.378	1.956	50	0		CDAARO
CCOc1ccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)cc1OC	ZINC000084810550	482508218	/nfs/dbraw/zinc/50/82/18/482508218.db2.gz	PQCBLWJZJRMNGC-CYBMUJFWSA-N	1	0	292.379	1.791	50	0		CDAARO
COc1ccc(CN(C)C(=O)[C@@H]2CC[C@@H]([NH3+])C2)cc1F	ZINC000091540229	482569753	/nfs/dbraw/zinc/56/97/53/482569753.db2.gz	TUTUUSPWKFPXDU-VXGBXAGGSA-N	1	0	280.343	1.920	50	0		CDAARO
COC(=O)N1CC[C@@H]([NH2+]Cc2ccc([S@@](C)=O)cc2)C1	ZINC000085329590	482575824	/nfs/dbraw/zinc/57/58/24/482575824.db2.gz	PWXZVSREIKPBLO-ODXCJYRJSA-N	1	0	296.392	1.354	50	0		CDAARO
COC[C@@H](C)NC(=O)C1CC[NH+](Cc2[nH]cnc2C)CC1	ZINC000670447768	483001781	/nfs/dbraw/zinc/00/17/81/483001781.db2.gz	NDHQSAMGKSVPPO-LLVKDONJSA-N	1	0	294.399	1.081	50	0		CDAARO
CN(C(=O)C[NH2+]C1(CCO)CCOCC1)c1ccccc1	ZINC000083869564	483216069	/nfs/dbraw/zinc/21/60/69/483216069.db2.gz	BWEZBWPLILXTBM-UHFFFAOYSA-N	1	0	292.379	1.171	50	0		CDAARO
COc1cc(C)sc1C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178581726	522298004	/nfs/dbraw/zinc/29/80/04/522298004.db2.gz	ZRAHTGPOZPMBGT-VIFPVBQESA-N	1	0	254.355	1.486	50	0		CDAARO
Cc1occc1C(=O)NCCC[NH2+]Cc1cccnc1	ZINC000036279216	526808699	/nfs/dbraw/zinc/80/86/99/526808699.db2.gz	LGZXRXBRLDPIHO-UHFFFAOYSA-N	1	0	273.336	1.893	50	0		CDAARO
CC[N@H+](CCC(=O)NC)C[C@@H](O)c1ccc(C)cc1	ZINC000096441673	528398875	/nfs/dbraw/zinc/39/88/75/528398875.db2.gz	KKZCRNRVHJPTPO-CQSZACIVSA-N	1	0	264.369	1.486	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OCCCC(=O)N(C)C	ZINC000408525634	528502737	/nfs/dbraw/zinc/50/27/37/528502737.db2.gz	MGQLIIBCYPBFGD-LBPRGKRZSA-N	1	0	272.389	1.409	50	0		CDAARO
CC(C)[C@H](C(=O)N1CC[C@@H](O)C1)[NH+]1CCCCC1	ZINC000098016203	528912915	/nfs/dbraw/zinc/91/29/15/528912915.db2.gz	CFXCZBKRZHQYDN-CHWSQXEVSA-N	1	0	254.374	1.090	50	0		CDAARO
CCOC(=O)N1CCC([NH2+][C@H](CO)c2ccco2)CC1	ZINC000096494307	528958563	/nfs/dbraw/zinc/95/85/63/528958563.db2.gz	QSWMDYPTZTWFRP-GFCCVEGCSA-N	1	0	282.340	1.524	50	0		CDAARO
Cc1noc([C@@H]2CCCN(C(=O)[C@@H]3CCC[C@H]3[NH3+])C2)n1	ZINC000247335278	567901590	/nfs/dbraw/zinc/90/15/90/567901590.db2.gz	VWCDVGVPUIXXLM-IJLUTSLNSA-N	1	0	278.356	1.211	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1C(=O)CN1CCc2sccc2C1	ZINC000097019535	567903263	/nfs/dbraw/zinc/90/32/63/567903263.db2.gz	NSMUZRUWZRUJLL-CYBMUJFWSA-N	1	0	293.436	1.446	50	0		CDAARO
CC(C)[N@@H+]1CCCN(C(=O)[C@H](N)c2ccccc2)CC1	ZINC000097049155	567903661	/nfs/dbraw/zinc/90/36/61/567903661.db2.gz	RQDDIQPKAZVNQM-OAHLLOKOSA-N	1	0	275.396	1.629	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@](O)([C@@H]([NH3+])C(C)(C)C)C1	ZINC000958528546	613979062	/nfs/dbraw/zinc/97/90/62/613979062.db2.gz	QFGDSVRKXYGAKX-HZMBPMFUSA-N	1	0	272.389	1.732	50	0		CDAARO
CCCCN(Cc1ccncc1)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000952982112	614961030	/nfs/dbraw/zinc/96/10/30/614961030.db2.gz	VJYQEQPRPLQNIP-AWEZNQCLSA-N	1	0	259.353	1.738	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1nccnc1OC	ZINC000952963670	615116327	/nfs/dbraw/zinc/11/63/27/615116327.db2.gz	HWOJSEHTCDLROF-NSHDSACASA-N	1	0	250.346	1.772	50	0		CDAARO
C[N@@H+]1CCN(c2ncc(F)cn2)C[C@H]1C(C)(C)C	ZINC000874435558	632388584	/nfs/dbraw/zinc/38/85/84/632388584.db2.gz	XMJCTXWQSFXWPU-NSHDSACASA-N	1	0	252.337	1.782	50	0		CDAARO
C[NH+]1CCC(N2CCN(c3ccccc3)CC2)CC1	ZINC000000279544	696024145	/nfs/dbraw/zinc/02/41/45/696024145.db2.gz	RPGOORCKNRWNAK-UHFFFAOYSA-N	1	0	259.397	1.903	50	0		CDAARO
CCc1nnc(CN2CCC([NH+]3CCSCC3)CC2)[nH]1	ZINC000244678675	1159707921	/nfs/dbraw/zinc/70/79/21/1159707921.db2.gz	IHZPWSVBEQETNE-UHFFFAOYSA-N	1	0	295.456	1.380	50	0		CDAARO
Cc1cc(C[C@@H]2CN(c3cc[nH+]cc3)C[C@H]2O)on1	ZINC001704315503	1177686045	/nfs/dbraw/zinc/68/60/45/1177686045.db2.gz	HQEXDNMPYPTGKD-BXUZGUMPSA-N	1	0	259.309	1.418	50	0		CDAARO
COc1cccc2c1C1(CCN(C(=O)C[NH3+])CC1)OCC2	ZINC001704325416	1177689831	/nfs/dbraw/zinc/68/98/31/1177689831.db2.gz	LGXVEFAQBFCEJH-UHFFFAOYSA-N	1	0	290.363	1.044	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)CC/C=C\c1ccccc1	ZINC000885978720	724415548	/nfs/dbraw/zinc/41/55/48/724415548.db2.gz	JHBRNYDEDNAXRU-PWIQMMQFSA-N	1	0	274.364	1.583	50	0		CDAARO
[NH3+]C[C@H](C(=O)N1CC(OCC(F)F)C1)c1ccccc1	ZINC000707215326	724424643	/nfs/dbraw/zinc/42/46/43/724424643.db2.gz	JSODIVCYZBPTGY-LBPRGKRZSA-N	1	0	284.306	1.221	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](CNC(=O)c2ccn(CC)n2)C1	ZINC000067689295	724507763	/nfs/dbraw/zinc/50/77/63/724507763.db2.gz	WDLIFWIMYSPGKX-CYBMUJFWSA-N	1	0	278.400	1.755	50	0		CDAARO
Cn1cc(-c2ccnc(N3CCC[C@H]([NH+](C)C)C3)n2)cn1	ZINC000023505137	724625231	/nfs/dbraw/zinc/62/52/31/724625231.db2.gz	CJNAIZFNIKIQIY-ZDUSSCGKSA-N	1	0	286.383	1.408	50	0		CDAARO
C[C@@H]1CN(C(=O)c2csc(Cl)n2)C[C@H](C)[NH2+]1	ZINC000864096083	724343379	/nfs/dbraw/zinc/34/33/79/724343379.db2.gz	ZRSVOPLSFDJULF-KNVOCYPGSA-N	1	0	259.762	1.619	50	0		CDAARO
C[C@H](CC(F)(F)F)[NH2+]CC1(CO)CCOCC1	ZINC000090661834	725068798	/nfs/dbraw/zinc/06/87/98/725068798.db2.gz	HHMNFRMPTAVESW-SECBINFHSA-N	1	0	255.280	1.706	50	0		CDAARO
COCCn1cncc1CN1CCC[C@@H]([NH+](C)C)C1	ZINC000252488633	725073355	/nfs/dbraw/zinc/07/33/55/725073355.db2.gz	IVXXQQDYKRWNFW-CYBMUJFWSA-N	1	0	266.389	1.056	50	0		CDAARO
Cc1ncc(C[NH2+][C@H]2CC(=O)N(CC3CCCCC3)C2)[nH]1	ZINC000012314233	725330880	/nfs/dbraw/zinc/33/08/80/725330880.db2.gz	CWXHZRGECGWSSG-AWEZNQCLSA-N	1	0	290.411	1.989	50	0		CDAARO
CN(C)c1ccnc(C(=O)N[C@H]2C[C@@H]([NH3+])C2(C)C)c1	ZINC000864091917	725397307	/nfs/dbraw/zinc/39/73/07/725397307.db2.gz	JJPURZDWXFGCHD-NEPJUHHUSA-N	1	0	262.357	1.003	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000864097326	725428843	/nfs/dbraw/zinc/42/88/43/725428843.db2.gz	STKOQDUZSWJHSA-ZIAGYGMSSA-N	1	0	264.369	1.110	50	0		CDAARO
Cc1cccc(CN2CCO[C@@H](CC[NH+](C)C)C2)n1	ZINC000012449533	725431318	/nfs/dbraw/zinc/43/13/18/725431318.db2.gz	CKMUVABIOHPQLY-HNNXBMFYSA-N	1	0	263.385	1.543	50	0		CDAARO
COc1ccc2ncn([C@@H]3CCC[NH2+]C3)c(=O)c2c1	ZINC000258097577	725636584	/nfs/dbraw/zinc/63/65/84/725636584.db2.gz	GVYQNEFJGVUMPV-SNVBAGLBSA-N	1	0	259.309	1.330	50	0		CDAARO
c1sc(-c2cnccn2)nc1C[NH2+]C[C@@H]1CCOC1	ZINC000952860014	910412350	/nfs/dbraw/zinc/41/23/50/910412350.db2.gz	SEQCNAAIQFZQFU-JTQLQIEISA-N	1	0	276.365	1.726	50	0		CDAARO
CN(Cc1nc(-c2ccco2)n[nH]1)C1CC[NH2+]CC1	ZINC000952871929	910425265	/nfs/dbraw/zinc/42/52/65/910425265.db2.gz	HDVGGQLHMGFEDR-UHFFFAOYSA-N	1	0	261.329	1.249	50	0		CDAARO
Cc1cc(C[N@@H+]2CC3(C[C@H]2C(=O)[O-])CC[NH2+]CC3)oc1C	ZINC000072146592	936652974	/nfs/dbraw/zinc/65/29/74/936652974.db2.gz	GNKAQWSXXCGFJM-AWEZNQCLSA-N	1	0	292.379	1.925	50	0		CDAARO
Cc1nncn1CCN1CCO[C@@H](CC(C)C)C1	ZINC000821035084	925560343	/nfs/dbraw/zinc/56/03/43/925560343.db2.gz	HXMSPBZQTPVFFT-ZDUSSCGKSA-N	1	0	252.362	1.333	50	0		CDAARO
Cc1nccn1C[C@@H](C)N1CCC[N@@H+](C(C)C)CC1	ZINC000821751102	925594919	/nfs/dbraw/zinc/59/49/19/925594919.db2.gz	FVOCEUJMMVOGSE-CQSZACIVSA-N	1	0	264.417	1.996	50	0		CDAARO
Cc1nncn1CC[N@@H+](C)CCC1(O)CCCC1	ZINC000823693038	925723046	/nfs/dbraw/zinc/72/30/46/925723046.db2.gz	GUDRKONNHBKRBA-UHFFFAOYSA-N	1	0	252.362	1.214	50	0		CDAARO
COCCOC1CCN(Cc2nc(C)c(C)n2C)CC1	ZINC000824445095	925823459	/nfs/dbraw/zinc/82/34/59/925823459.db2.gz	URYZUQSNHNKKDF-UHFFFAOYSA-N	1	0	281.400	1.664	50	0		CDAARO
Cc1cc(N(C)Cc2ncon2)nc(N2CCCC2)[nH+]1	ZINC000825149722	925854340	/nfs/dbraw/zinc/85/43/40/925854340.db2.gz	RPUNZHOQAWWCKK-UHFFFAOYSA-N	1	0	274.328	1.405	50	0		CDAARO
CN(Cc1cnccc1Cl)C[C@@H]1CCC[N@H+](CCO)C1	ZINC000828760436	926187387	/nfs/dbraw/zinc/18/73/87/926187387.db2.gz	OCIQDBAQRPXWBB-ZDUSSCGKSA-N	1	0	297.830	1.871	50	0		CDAARO
CCC[C@H]1CN(Cc2ccccc2OCCO)C[C@@H]1[NH3+]	ZINC000219593664	930890753	/nfs/dbraw/zinc/89/07/53/930890753.db2.gz	LOHXLOYKBURVNZ-ZFWWWQNUSA-N	1	0	278.396	1.617	50	0		CDAARO
C[C@H]1[C@H](C)OC[C@H]1[NH2+]Cc1nncn1-c1ccccc1	ZINC000585117589	930985495	/nfs/dbraw/zinc/98/54/95/930985495.db2.gz	MBONKBOJZTUFAQ-SGMGOOAPSA-N	1	0	272.352	1.780	50	0		CDAARO
COCC[NH+]1CCC(C(=O)Nc2cnn(C)c2C)CC1	ZINC001529100717	968980872	/nfs/dbraw/zinc/98/08/72/968980872.db2.gz	XKXWTMFPWSGOOJ-UHFFFAOYSA-N	1	0	280.372	1.025	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNc2nc(C)cnc2C)C1	ZINC001529111285	968983962	/nfs/dbraw/zinc/98/39/62/968983962.db2.gz	UWEVMUZXMOGNCX-ZDUSSCGKSA-N	1	0	264.373	1.474	50	0		CDAARO
Cc1nc(CN2CCC[N@@H+](C3CCCC3)CC2)cc(=O)[nH]1	ZINC001529139688	968991244	/nfs/dbraw/zinc/99/12/44/968991244.db2.gz	QCELJMGXVGLBRU-UHFFFAOYSA-N	1	0	290.411	1.941	50	0		CDAARO
CCn1ncc(NC(=O)[C@@]2(C)CC[N@H+](C)C2)c1C	ZINC001529146397	968995293	/nfs/dbraw/zinc/99/52/93/968995293.db2.gz	OEAULUASNCUJLQ-ZDUSSCGKSA-N	1	0	250.346	1.492	50	0		CDAARO
CC(=O)NC(C)(C)C[C@@H](C)[NH2+]Cc1nc(C)cc(C)n1	ZINC001506408282	975153147	/nfs/dbraw/zinc/15/31/47/975153147.db2.gz	WTZNLTLHUDIWEQ-GFCCVEGCSA-N	1	0	278.400	1.876	50	0		CDAARO
C[C@@H](CN(C)CCO)[NH2+]Cc1cc2cc(F)ccc2[nH]1	ZINC001506413206	975154163	/nfs/dbraw/zinc/15/41/63/975154163.db2.gz	HZOTWHPTFQTVKW-NSHDSACASA-N	1	0	279.359	1.709	50	0		CDAARO
CN(Cc1nc2cc(F)ccc2[nH]1)C(=O)C1([NH3+])CCCC1	ZINC001506412240	975154267	/nfs/dbraw/zinc/15/42/67/975154267.db2.gz	AWXSKIWTSPAECC-UHFFFAOYSA-N	1	0	290.342	1.932	50	0		CDAARO
CC[NH+](CC)[C@@H]1CCN(CCc2nccn2C)C1	ZINC001506416639	975155317	/nfs/dbraw/zinc/15/53/17/975155317.db2.gz	HTTGNZTXHQOSSQ-CYBMUJFWSA-N	1	0	250.390	1.379	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](CN(C)C(=O)c2cc(O)ccc2N)C1	ZINC001506420584	975158406	/nfs/dbraw/zinc/15/84/06/975158406.db2.gz	KHYLTACREILFOL-LBPRGKRZSA-N	1	0	291.395	1.778	50	0		CDAARO
O=C(C[C@H]1C[NH2+]CCO1)NCc1cccc(Cl)c1F	ZINC000215258178	1163269527	/nfs/dbraw/zinc/26/95/27/1163269527.db2.gz	FCJVZMVLVZKZOM-JTQLQIEISA-N	1	0	286.734	1.474	50	0		CDAARO
Cc1nccn1CCC[N@@H+]1CCC[C@H](C2OCCO2)C1	ZINC000096485954	230381547	/nfs/dbraw/zinc/38/15/47/230381547.db2.gz	ITJWYANNOVRAHR-AWEZNQCLSA-N	1	0	279.384	1.667	50	0		CDAARO
CC(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1Cc1cnc(C)cn1	ZINC000106668264	349446238	/nfs/dbraw/zinc/44/62/38/349446238.db2.gz	RYFBXIFVWJGKAM-HZPDHXFCSA-N	1	0	288.395	1.760	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)COc2ccccc2Cl)C1	ZINC000195107502	230396321	/nfs/dbraw/zinc/39/63/21/230396321.db2.gz	VLHSFHDUHIXTMC-JTQLQIEISA-N	1	0	268.744	1.669	50	0		CDAARO
C[NH+](C)[C@H]1CN(C(=O)CCCc2ccc(F)cc2)C[C@@H]1O	ZINC000222806584	230398692	/nfs/dbraw/zinc/39/86/92/230398692.db2.gz	COAXLRBZLFGBFV-GJZGRUSLSA-N	1	0	294.370	1.282	50	0		CDAARO
[NH3+]CCC(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000269131887	190470753	/nfs/dbraw/zinc/47/07/53/190470753.db2.gz	VOQHVMPHQQEOTA-KGLIPLIRSA-N	1	0	262.353	1.450	50	0		CDAARO
COc1ccc2[nH]c(CN[C@@H](C)CS(C)(=O)=O)nc2c1	ZINC000584903869	341994013	/nfs/dbraw/zinc/99/40/13/341994013.db2.gz	NWEOFILGEGTEAP-VIFPVBQESA-N	1	0	297.380	1.094	50	0		CDAARO
C[C@@H]1COCC[C@@H]1CNC(=O)NC[C@H]1CCCC[N@H+](C)C1	ZINC000624048511	342003485	/nfs/dbraw/zinc/00/34/85/342003485.db2.gz	NMKPLCHOVHEICF-RBSFLKMASA-N	1	0	297.443	1.690	50	0		CDAARO
CC1(c2ccccc2)CC[NH+](CCS(N)(=O)=O)CC1	ZINC000095973428	185049348	/nfs/dbraw/zinc/04/93/48/185049348.db2.gz	OCECNYACQGCCJO-UHFFFAOYSA-N	1	0	282.409	1.329	50	0		CDAARO
c1cnc(N2CC[C@@H](OCC[NH+]3CCCCC3)C2)nc1	ZINC000095974192	185049963	/nfs/dbraw/zinc/04/99/63/185049963.db2.gz	OJWRUQUSLZWRHO-CQSZACIVSA-N	1	0	276.384	1.558	50	0		CDAARO
CC(C)[C@H](C(=O)NCc1nccc(N)n1)[NH+]1CCCCC1	ZINC000095993387	185059313	/nfs/dbraw/zinc/05/93/13/185059313.db2.gz	PMDLOCHQBRUEPJ-CQSZACIVSA-N	1	0	291.399	1.186	50	0		CDAARO
C[C@@H]1CC[NH2+]C[C@H]1NS(=O)(=O)CCc1cccs1	ZINC000241277709	361752001	/nfs/dbraw/zinc/75/20/01/361752001.db2.gz	LILLJUFVGRCLPS-ZYHUDNBSSA-N	1	0	288.438	1.208	50	0		CDAARO
O=c1c2cccnc2[nH]c(=S)n1CCC[NH+]1CCCC1	ZINC000020618247	342048875	/nfs/dbraw/zinc/04/88/75/342048875.db2.gz	HFEYDPNIWCDCKX-UHFFFAOYSA-N	1	0	290.392	1.566	50	0		CDAARO
CCOC(=O)c1nn(CCc2ccccc2)c2c1C[NH2+]CC2	ZINC000082810595	178312962	/nfs/dbraw/zinc/31/29/62/178312962.db2.gz	FHTURHVDVNMGRW-UHFFFAOYSA-N	1	0	299.374	1.948	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)CC/C=C/c1ccccc1	ZINC000195553978	342625812	/nfs/dbraw/zinc/62/58/12/342625812.db2.gz	JHBRNYDEDNAXRU-LTBMOJJQSA-N	1	0	274.364	1.583	50	0		CDAARO
[NH3+][C@@H](C(=O)N1CC[C@H](Oc2cccnc2)C1)c1ccccc1	ZINC000195554353	342625911	/nfs/dbraw/zinc/62/59/11/342625911.db2.gz	KGKJWSXOONSLGA-JKSUJKDBSA-N	1	0	297.358	1.761	50	0		CDAARO
CC(C)COC[C@@H](C)NC(=O)[C@@]1(C)CCCC[NH2+]1	ZINC000195556992	342626646	/nfs/dbraw/zinc/62/66/46/342626646.db2.gz	OHLZHJGMGXSHLZ-TZMCWYRMSA-N	1	0	256.390	1.696	50	0		CDAARO
CC(C)C[N@H+](CCc1cn[nH]c1)Cc1cnn(C)c1	ZINC000244602096	361853408	/nfs/dbraw/zinc/85/34/08/361853408.db2.gz	DXKNFZLAHMVUIJ-UHFFFAOYSA-N	1	0	261.373	1.844	50	0		CDAARO
Cc1nnc(CNc2cc([C@H]3C[C@@H]([NH3+])C3)nc(C)n2)s1	ZINC000244874141	361867071	/nfs/dbraw/zinc/86/70/71/361867071.db2.gz	WVFZTDLIZMFDOQ-AOOOYVTPSA-N	1	0	290.396	1.762	50	0		CDAARO
COC[C@@H]1CCC[N@@H+]1CCC(=O)Nc1nccs1	ZINC000244873471	361867355	/nfs/dbraw/zinc/86/73/55/361867355.db2.gz	WQZTWULFACGEGU-JTQLQIEISA-N	1	0	269.370	1.583	50	0		CDAARO
Cc1ccc(C)c(NC(=O)CN2C[C@H]3CC[C@@H](C2)[C@H]3[NH3+])c1	ZINC000244708047	361858479	/nfs/dbraw/zinc/85/84/79/361858479.db2.gz	KMOMPMWARBTAFQ-HALDLXJZSA-N	1	0	287.407	1.911	50	0		CDAARO
CS[C@@H](C)CNC(=O)C[C@H](C)C1CC[NH2+]CC1	ZINC000125432433	187184728	/nfs/dbraw/zinc/18/47/28/187184728.db2.gz	ZPGCZKZWHYQHIT-QWRGUYRKSA-N	1	0	258.431	1.880	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@H]1NC(=O)C[C@H](O)c1ccccc1	ZINC000585136735	342216060	/nfs/dbraw/zinc/21/60/60/342216060.db2.gz	QYLBBEAQZSIIMX-HLSYRSCKSA-N	1	0	276.380	1.613	50	0		CDAARO
Cc1ccoc1CN1C[C@@H]([NH+](C)C)[C@@H](n2ccnn2)C1	ZINC000685940080	539045843	/nfs/dbraw/zinc/04/58/43/539045843.db2.gz	LMRYISJOUKBCNJ-OLZOCXBDSA-N	1	0	275.356	1.167	50	0		CDAARO
NC(=O)[C@@H]1CC[N@H+](C[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC000585140649	342218679	/nfs/dbraw/zinc/21/86/79/342218679.db2.gz	HXAPIPIDIYPYEL-DYEKYZERSA-N	1	0	262.328	1.736	50	0		CDAARO
O=C(Cc1cccs1)N1CC[NH+]([C@H]2CCC[C@H]2O)CC1	ZINC000084442209	342262925	/nfs/dbraw/zinc/26/29/25/342262925.db2.gz	QMXDIABSLMXMQG-UONOGXRCSA-N	1	0	294.420	1.348	50	0		CDAARO
C[C@H]([NH2+][C@@H]1CCCNC(=O)C1)[C@H](c1ccccc1)N(C)C	ZINC000585116907	362045241	/nfs/dbraw/zinc/04/52/41/362045241.db2.gz	MCGGYGOXRBGGHZ-YSVLISHTSA-N	1	0	289.423	1.936	50	0		CDAARO
CO[C@@H](C[NH2+]CCc1ccncc1C)[C@@H]1CCOC1	ZINC000585117410	362046782	/nfs/dbraw/zinc/04/67/82/362046782.db2.gz	BKKSGWQSUHKYSX-CABCVRRESA-N	1	0	264.369	1.574	50	0		CDAARO
Cc1cc(C(=O)N[C@@H]2C[C@H]([NH+](C)C)C2(C)C)ns1	ZINC000585130415	362055686	/nfs/dbraw/zinc/05/56/86/362055686.db2.gz	PKTBUHZHECDVIO-MNOVXSKESA-N	1	0	267.398	1.910	50	0		CDAARO
Cc1ccc(C)c(CC(=O)N2CCO[C@@H]([C@H](C)[NH3+])C2)c1	ZINC000127868693	187337987	/nfs/dbraw/zinc/33/79/87/187337987.db2.gz	MCRWVYRTFWGVLE-DZGCQCFKSA-N	1	0	276.380	1.421	50	0		CDAARO
C[C@H]1CN(C(=O)CCc2nc3ccccc3[nH]2)C[C@H](C)[NH2+]1	ZINC000179160965	362253755	/nfs/dbraw/zinc/25/37/55/362253755.db2.gz	JESMJWNZGNQNBC-RYUDHWBXSA-N	1	0	286.379	1.704	50	0		CDAARO
COc1ccccc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C[NH3+]	ZINC000089108046	362308228	/nfs/dbraw/zinc/30/82/28/362308228.db2.gz	OOHOAQVFRBISSO-NWDGAFQWSA-N	1	0	298.408	1.491	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@]2(C1)[NH2+]CCn1cccc12	ZINC000211569001	344158045	/nfs/dbraw/zinc/15/80/45/344158045.db2.gz	YSJLEROPYPYPID-HNNXBMFYSA-N	1	0	277.368	1.927	50	0		CDAARO
Cc1nc2c(c(=O)[nH]1)CC[N@H+](CCOc1ccccc1)CC2	ZINC000253537086	362435556	/nfs/dbraw/zinc/43/55/56/362435556.db2.gz	WZLQAGQZOUWOPJ-UHFFFAOYSA-N	1	0	299.374	1.970	50	0		CDAARO
CC[NH+](CC)CCCn1c(=O)onc1-c1cccnc1	ZINC000194533814	362467798	/nfs/dbraw/zinc/46/77/98/362467798.db2.gz	NIQXMUDNYFZFBK-UHFFFAOYSA-N	1	0	276.340	1.630	50	0		CDAARO
CO[C@@]1(C[NH2+]CCc2ccncc2C)CCOC1	ZINC000397547635	345221605	/nfs/dbraw/zinc/22/16/05/345221605.db2.gz	OUHFOMXMNMLLCX-CQSZACIVSA-N	1	0	250.342	1.328	50	0		CDAARO
COC(=O)C1CCC([NH2+][C@H]2CCC[C@H](C(N)=O)C2)CC1	ZINC000192443081	362627082	/nfs/dbraw/zinc/62/70/82/362627082.db2.gz	HCKPNJHIVPOGLZ-MVKMKZAISA-N	1	0	282.384	1.352	50	0		CDAARO
O=C([C@H]1CCC[NH2+]1)N1CCC(OCc2ccccc2)CC1	ZINC000192941935	346006418	/nfs/dbraw/zinc/00/64/18/346006418.db2.gz	ZNKCTICMDUNXGM-MRXNPFEDSA-N	1	0	288.391	1.946	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000085467904	179073585	/nfs/dbraw/zinc/07/35/85/179073585.db2.gz	PQKASHOHKJZUBS-UHFFFAOYSA-N	1	0	276.380	1.836	50	0		CDAARO
C[C@@H](CCCO)NC(=O)NC[C@@]1([NH+](C)C)CCC[C@@H](C)C1	ZINC000088505829	347233536	/nfs/dbraw/zinc/23/35/36/347233536.db2.gz	LALSGSIABHABLH-IJEWVQPXSA-N	1	0	299.459	1.957	50	0		CDAARO
COCCn1cncc1C[NH2+][C@H](C)CC(F)(F)F	ZINC000584893588	349353573	/nfs/dbraw/zinc/35/35/73/349353573.db2.gz	SPPUBTBUSUGUHN-SECBINFHSA-N	1	0	265.279	1.960	50	0		CDAARO
C[N@@H+]1CCOC[C@H](Cn2cnc3ccc(F)cc3c2=O)C1	ZINC000584898001	349359567	/nfs/dbraw/zinc/35/95/67/349359567.db2.gz	OQDSNSSQIRSQBK-NSHDSACASA-N	1	0	291.326	1.114	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC000091496688	180172627	/nfs/dbraw/zinc/17/26/27/180172627.db2.gz	PUUVSVOPWBUDRQ-RDDDGLTNSA-N	1	0	272.270	1.974	50	0		CDAARO
CCC[C@H]1CN(C(=O)Cc2nc3ccccc3[nH]2)C[C@@H]1[NH3+]	ZINC000091644612	180214993	/nfs/dbraw/zinc/21/49/93/180214993.db2.gz	IIPHMTZVBRSXBF-RYUDHWBXSA-N	1	0	286.379	1.691	50	0		CDAARO
Cn1ccnc1C[N@@H+]1CC[C@H](Cc2cccc(CO)c2)C1	ZINC000091624778	180209373	/nfs/dbraw/zinc/20/93/73/180209373.db2.gz	VEBSNVKUAGULII-OAHLLOKOSA-N	1	0	285.391	1.977	50	0		CDAARO
CN1CCO[C@@H](C[NH2+]Cc2ccccc2Cl)C1	ZINC000105472056	186059251	/nfs/dbraw/zinc/05/92/51/186059251.db2.gz	NUTWCCHIDYTXCT-LBPRGKRZSA-N	1	0	254.761	1.760	50	0		CDAARO
CC[C@@H](O)Cn1ncnc1CC1CC[NH+](C(C)C)CC1	ZINC000091847452	180271205	/nfs/dbraw/zinc/27/12/05/180271205.db2.gz	VTPUAOMQNSCTLE-CQSZACIVSA-N	1	0	280.416	1.712	50	0		CDAARO
C[C@H]1c2ccsc2CC[N@H+]1C[C@@H](O)Cn1cccn1	ZINC000106826290	186137564	/nfs/dbraw/zinc/13/75/64/186137564.db2.gz	WJQZGKKNRYVILN-NWDGAFQWSA-N	1	0	277.393	1.925	50	0		CDAARO
O=C(NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cn[nH]c1	ZINC000194753005	363116758	/nfs/dbraw/zinc/11/67/58/363116758.db2.gz	LSTNZWMAXCFYEY-AWEZNQCLSA-N	1	0	284.363	1.662	50	0		CDAARO
CN1CCC[C@H]([NH2+][C@@H]2CCN(CC(F)(F)F)C2)C1	ZINC000088687420	366153113	/nfs/dbraw/zinc/15/31/13/366153113.db2.gz	HULNCOUMAWUBCT-WDEREUQCSA-N	1	0	265.323	1.307	50	0		CDAARO
CCN(CC)C(=O)CSc1nnc(CCCC[NH3+])o1	ZINC000001883977	366200182	/nfs/dbraw/zinc/20/01/82/366200182.db2.gz	WRTLDRVUCAHRBG-UHFFFAOYSA-N	1	0	286.401	1.312	50	0		CDAARO
COC(=O)c1ccc(NC(=O)CSC2=[NH+]CCN2)cc1	ZINC000002597801	355976970	/nfs/dbraw/zinc/97/69/70/355976970.db2.gz	VPTFERHPEZEOSK-UHFFFAOYSA-N	1	0	293.348	1.104	50	0		CDAARO
COc1cccc(OC)c1OCCC[NH2+]C[C@@H](C)O	ZINC000002880970	355986547	/nfs/dbraw/zinc/98/65/47/355986547.db2.gz	KYTHIKNEZDLFAM-LLVKDONJSA-N	1	0	269.341	1.443	50	0		CDAARO
C[C@@H](CCc1cccc(F)c1)[N@@H+]1CCNC(=O)CC1	ZINC000097370749	356089474	/nfs/dbraw/zinc/08/94/74/356089474.db2.gz	XBYATSKDWOOZOT-LBPRGKRZSA-N	1	0	264.344	1.969	50	0		CDAARO
C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cn1)[C@H]1CCCO1	ZINC000097374148	356094696	/nfs/dbraw/zinc/09/46/96/356094696.db2.gz	UCKIOGAVCQKVRI-GXSJLCMTSA-N	1	0	283.759	1.831	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](Cn2cnc3ccncc3c2=O)C1	ZINC000032573442	356280455	/nfs/dbraw/zinc/28/04/55/356280455.db2.gz	QPEDLPIPHBWWRE-GFCCVEGCSA-N	1	0	272.352	1.523	50	0		CDAARO
C[C@@H]1C[C@@H](C)C[NH+](CC(=O)N(C)CC(=O)NC(C)(C)C)C1	ZINC000012797008	356325564	/nfs/dbraw/zinc/32/55/64/356325564.db2.gz	ACBPUPVYUOZDKA-CHWSQXEVSA-N	1	0	297.443	1.337	50	0		CDAARO
Cc1ccsc1C(=O)[C@@H]1CCC[N@H+](CCO)C1	ZINC000012587886	356310221	/nfs/dbraw/zinc/31/02/21/356310221.db2.gz	RNZNFAQDQMEXNK-LLVKDONJSA-N	1	0	253.367	1.944	50	0		CDAARO
CCOC(=O)[C@@H]1CC2(CC[NH+](C)CC2)[N@@H+]2CCC[C@@H]12	ZINC000014987426	356403321	/nfs/dbraw/zinc/40/33/21/356403321.db2.gz	IQJCIKOQCJLDKT-OLZOCXBDSA-N	1	0	266.385	1.498	50	0		CDAARO
COCCNC(=O)C1CC[NH+](Cc2cccc(C)c2)CC1	ZINC000016606743	356442937	/nfs/dbraw/zinc/44/29/37/356442937.db2.gz	SSXVORIYQOENPZ-UHFFFAOYSA-N	1	0	290.407	1.970	50	0		CDAARO
CCOc1ccc(Cl)cc1CNCC[NH2+]CCO	ZINC000019370615	356483093	/nfs/dbraw/zinc/48/30/93/356483093.db2.gz	VGMZDDQZSADADO-UHFFFAOYSA-N	1	0	272.776	1.410	50	0		CDAARO
COc1ccc(C(=O)N2CCC([NH3+])CC2)c(OC)c1	ZINC000019401641	356483923	/nfs/dbraw/zinc/48/39/23/356483923.db2.gz	CPUXUVQXKATVAN-UHFFFAOYSA-N	1	0	264.325	1.267	50	0		CDAARO
O[C@H](COc1cccc2ccccc21)CN1CC[NH2+]CC1	ZINC000019229532	356478026	/nfs/dbraw/zinc/47/80/26/356478026.db2.gz	PODKTVHURWLQLF-HNNXBMFYSA-N	1	0	286.375	1.485	50	0		CDAARO
Cc1nonc1C(=O)NCc1cccc(C[NH+](C)C)c1	ZINC000019837156	356508347	/nfs/dbraw/zinc/50/83/47/356508347.db2.gz	KZRFCRPNDLOSHU-UHFFFAOYSA-N	1	0	274.324	1.370	50	0		CDAARO
CC[N@H+](CCNC(=O)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C)C1CC1	ZINC000246967841	356563076	/nfs/dbraw/zinc/56/30/76/356563076.db2.gz	OORQDLFNZISJDB-BFHYXJOUSA-N	1	0	295.427	1.583	50	0		CDAARO
O=C(CC1CC1)NCC1(C(F)(F)F)CC[NH2+]CC1	ZINC000725264721	538455647	/nfs/dbraw/zinc/45/56/47/538455647.db2.gz	NDUJFEDNSQWCMD-UHFFFAOYSA-N	1	0	264.291	1.835	50	0		CDAARO
COc1ccc(C[NH+](CCO)CCO)c2ccccc12	ZINC000023281220	356638949	/nfs/dbraw/zinc/63/89/49/356638949.db2.gz	XQPQZJRORXGUCR-UHFFFAOYSA-N	1	0	275.348	1.635	50	0		CDAARO
Cc1ccccc1CNC(=O)NC[C@@H]1C[NH2+]CCOC1	ZINC000072172670	356639871	/nfs/dbraw/zinc/63/98/71/356639871.db2.gz	ZZYJLBNWQKKSQJ-ZDUSSCGKSA-N	1	0	277.368	1.030	50	0		CDAARO
CN(C(=O)[C@@H]1Cc2ccccc2O1)C1CC[NH+](C)CC1	ZINC000032780618	356668020	/nfs/dbraw/zinc/66/80/20/356668020.db2.gz	IOCFKPPIFVYCJU-HNNXBMFYSA-N	1	0	274.364	1.543	50	0		CDAARO
O=C(N1CC[NH2+]CC1)C(O)(c1ccccc1)c1ccccc1	ZINC000026421396	356692324	/nfs/dbraw/zinc/69/23/24/356692324.db2.gz	FKDXYPUBGQSSJL-UHFFFAOYSA-N	1	0	296.370	1.354	50	0		CDAARO
C[C@H](O)C[NH+](CCCc1ccccc1)C[C@H](C)O	ZINC000000214305	356813213	/nfs/dbraw/zinc/81/32/13/356813213.db2.gz	ADYPLABQYHBYFG-KBPBESRZSA-N	1	0	251.370	1.683	50	0		CDAARO
CN(CCCNC(=O)[C@H]1CC[C@@H]([NH3+])C1)c1ccccc1	ZINC000072439005	356929960	/nfs/dbraw/zinc/92/99/60/356929960.db2.gz	IIKUFHVUJGGZNK-UONOGXRCSA-N	1	0	275.396	1.757	50	0		CDAARO
CC(C)CNC(=O)NC(=O)[C@@H](C)[N@H+](C)Cc1ccccc1	ZINC000011127617	357249814	/nfs/dbraw/zinc/24/98/14/357249814.db2.gz	NYMZNJJVRJEJGY-CYBMUJFWSA-N	1	0	291.395	1.989	50	0		CDAARO
COc1cccc(S(=O)(=O)N2[C@@H]3CC[C@H]2C[NH2+]CC3)c1	ZINC000065370523	357531639	/nfs/dbraw/zinc/53/16/39/357531639.db2.gz	NCNYYJANSYMIIB-NEPJUHHUSA-N	1	0	296.392	1.210	50	0		CDAARO
CC1CCN(C(=O)CC[NH2+][C@H]2CCSC2)CC1	ZINC000065370795	357532351	/nfs/dbraw/zinc/53/23/51/357532351.db2.gz	FQGGDCKNSCZRTR-LBPRGKRZSA-N	1	0	256.415	1.730	50	0		CDAARO
c1nc(N2CCCC2)ncc1CN1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065373097	357533602	/nfs/dbraw/zinc/53/36/02/357533602.db2.gz	HWHRXIGLLXAWCO-CABCVRRESA-N	1	0	287.411	1.403	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CCN(C)c1cc(N(C)C)ncn1	ZINC000065530275	357547759	/nfs/dbraw/zinc/54/77/59/357547759.db2.gz	DDIFJBQSJQNAAA-CYBMUJFWSA-N	1	0	277.416	1.853	50	0		CDAARO
OCC[C@H]1C[NH2+]CCN1CCc1c(F)cccc1Cl	ZINC000066275280	357561075	/nfs/dbraw/zinc/56/10/75/357561075.db2.gz	MMEUVVAXXZVWNA-NSHDSACASA-N	1	0	286.778	1.678	50	0		CDAARO
Cc1nc(C(C)C)ncc1C(=O)N[C@@H]1CC[C@@H]([NH3+])C1	ZINC000067723910	357621668	/nfs/dbraw/zinc/62/16/68/357621668.db2.gz	DBVTWLCWYDMNCP-GHMZBOCLSA-N	1	0	262.357	1.518	50	0		CDAARO
CCCCOC(=O)N1CCC2(CC1)C[N@H+](C)CCN2C	ZINC000067805853	357628409	/nfs/dbraw/zinc/62/84/09/357628409.db2.gz	COVJCALTYGFXJL-UHFFFAOYSA-N	1	0	283.416	1.635	50	0		CDAARO
CN(CCC(F)(F)F)C[C@@H]1CCC[N@H+](CCO)C1	ZINC000067804123	357628471	/nfs/dbraw/zinc/62/84/71/357628471.db2.gz	YTERNYBKHGNKLP-NSHDSACASA-N	1	0	268.323	1.575	50	0		CDAARO
Cc1nccn1-c1ccccc1C[NH2+][C@@H](C)Cn1cncn1	ZINC000067676507	357617856	/nfs/dbraw/zinc/61/78/56/357617856.db2.gz	OHKZLTHVAFFTPC-ZDUSSCGKSA-N	1	0	296.378	1.951	50	0		CDAARO
CCN(Cc1ccc(C)o1)c1cc(CC[NH3+])ncn1	ZINC000067921493	357637212	/nfs/dbraw/zinc/63/72/12/357637212.db2.gz	ZFXHZHVAUBTNON-UHFFFAOYSA-N	1	0	260.341	1.906	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)CC[NH2+]1	ZINC000188456837	357689110	/nfs/dbraw/zinc/68/91/10/357689110.db2.gz	ZHQLSTPEPTZABL-CDMKHQONSA-N	1	0	280.318	1.889	50	0		CDAARO
CCc1cc(N2CCC[C@H]([NH3+])C2)n2nc(C)c(C)c2n1	ZINC000072447337	357835933	/nfs/dbraw/zinc/83/59/33/357835933.db2.gz	GZKLKHKTRRBGIN-LBPRGKRZSA-N	1	0	273.384	1.836	50	0		CDAARO
Nc1ncccc1CN1CCC([N@@H+]2CCC[C@@H](O)C2)CC1	ZINC000072463070	357837213	/nfs/dbraw/zinc/83/72/13/357837213.db2.gz	YUIZSJMNEZBSPC-OAHLLOKOSA-N	1	0	290.411	1.085	50	0		CDAARO
Cc1noc(C)c1CCNc1ncnc2c1CC[NH2+]CC2	ZINC000072480789	357838827	/nfs/dbraw/zinc/83/88/27/357838827.db2.gz	GKKCOAGWBCLYNP-UHFFFAOYSA-N	1	0	287.367	1.424	50	0		CDAARO
CCCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@H]([NH3+])CN1C	ZINC000067691178	283296570	/nfs/dbraw/zinc/29/65/70/283296570.db2.gz	PEEATACNJUBSPO-ZFWWWQNUSA-N	1	0	293.386	1.596	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)CNc2cc[nH+]cc2C(N)=O)n1	ZINC000097140630	357995563	/nfs/dbraw/zinc/99/55/63/357995563.db2.gz	ODAREPJHSMPNFX-JTQLQIEISA-N	1	0	287.367	1.742	50	0		CDAARO
CC(C)Oc1ccc(S(=O)(=O)N[C@@H]2CCC[NH2+]C2)cc1	ZINC000097234930	358050490	/nfs/dbraw/zinc/05/04/90/358050490.db2.gz	BDEPWAPYNWCKGV-GFCCVEGCSA-N	1	0	298.408	1.504	50	0		CDAARO
CN(C)C(=O)N1CCn2nc(C[NH2+]C3CCCC3)cc2C1	ZINC000082109263	358146687	/nfs/dbraw/zinc/14/66/87/358146687.db2.gz	DMOYIDTZBQPHFG-UHFFFAOYSA-N	1	0	291.399	1.413	50	0		CDAARO
CC[C@H]1CN(C(=O)c2cnc(C)cn2)CC[N@@H+]1C(C)C	ZINC000082116529	358147570	/nfs/dbraw/zinc/14/75/70/358147570.db2.gz	QAFWBGJJWMGLKG-ZDUSSCGKSA-N	1	0	276.384	1.730	50	0		CDAARO
O=C(NC[C@@H]1CCC[NH2+]C1)c1ccncc1Cl	ZINC000082164547	358150533	/nfs/dbraw/zinc/15/05/33/358150533.db2.gz	DYPRVMNQHJPTMU-SECBINFHSA-N	1	0	253.733	1.464	50	0		CDAARO
Cc1cccc(O[C@@H](C)C(=O)N2CCC[C@H]([NH3+])C2)c1	ZINC000195109927	358551441	/nfs/dbraw/zinc/55/14/41/358551441.db2.gz	VAISZUWMUPEBKS-STQMWFEESA-N	1	0	262.353	1.712	50	0		CDAARO
CCOCCC[N@@H+]1CC[C@H](NC(=O)[C@@H]2CCCO2)[C@@H](C)C1	ZINC000195530329	358559196	/nfs/dbraw/zinc/55/91/96/358559196.db2.gz	LGJWVIAKXMVFNP-KKUMJFAQSA-N	1	0	298.427	1.419	50	0		CDAARO
CC[N@@H+]1CC[C@H](N(C)Cc2c[nH]c(C(=O)OC)c2)[C@@H](C)C1	ZINC000195548295	358560792	/nfs/dbraw/zinc/56/07/92/358560792.db2.gz	KQLCPLWCBAMGBO-WFASDCNBSA-N	1	0	293.411	1.963	50	0		CDAARO
Cc1ncnc(N2CCC[C@@](O)(C[NH+](C)C)CC2)c1C	ZINC000095373858	358688779	/nfs/dbraw/zinc/68/87/79/358688779.db2.gz	UUDMWLCENGRHCC-HNNXBMFYSA-N	1	0	278.400	1.376	50	0		CDAARO
COCCCCN1CCN(C(=O)c2ncoc2C)CC1	ZINC000097137559	358752939	/nfs/dbraw/zinc/75/29/39/358752939.db2.gz	PIQDLBQPFMUQET-UHFFFAOYSA-N	1	0	281.356	1.167	50	0		CDAARO
c1cc2nonc2c(CN2CC([NH+]3CCCCC3)C2)c1	ZINC000097334340	358767926	/nfs/dbraw/zinc/76/79/26/358767926.db2.gz	LZYBXKRJBIMAAC-UHFFFAOYSA-N	1	0	272.352	1.893	50	0		CDAARO
C[N@@H+]1CCC2(CCN(C(=O)C3(C)CC3)CC2)[C@H](CO)C1	ZINC000097425718	358775123	/nfs/dbraw/zinc/77/51/23/358775123.db2.gz	LMXNZAKNNYTBCB-ZDUSSCGKSA-N	1	0	280.412	1.339	50	0		CDAARO
O=C([C@@H]1CC[NH2+]C1)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000097619282	358788180	/nfs/dbraw/zinc/78/81/80/358788180.db2.gz	DEYZAGFLZIAJJL-BBOMDTFKSA-N	1	0	299.418	1.454	50	0		CDAARO
Cc1n[nH]c(CCC(=O)NCC[NH+]2CCCC2)c1C	ZINC000097797344	358799830	/nfs/dbraw/zinc/79/98/30/358799830.db2.gz	HHTXPASPXWNXNW-UHFFFAOYSA-N	1	0	264.373	1.171	50	0		CDAARO
CN(C)c1ccc(CN2CC([NH+]3CCCCC3)C2)cn1	ZINC000215330619	358884748	/nfs/dbraw/zinc/88/47/48/358884748.db2.gz	ZPSBVJYWKFZLHL-UHFFFAOYSA-N	1	0	274.412	1.818	50	0		CDAARO
COc1cc2c(cc1CNC(=O)C[C@H]1CC[NH2+]C1)CCC2	ZINC000216485527	358947268	/nfs/dbraw/zinc/94/72/68/358947268.db2.gz	ATYWOCKLVXZYIN-GFCCVEGCSA-N	1	0	288.391	1.800	50	0		CDAARO
CN(C1CC[NH+](C)CC1)S(=O)(=O)c1ccc(F)cc1	ZINC000000111161	359105733	/nfs/dbraw/zinc/10/57/33/359105733.db2.gz	ABIQOIQMOXNLQX-UHFFFAOYSA-N	1	0	286.372	1.540	50	0		CDAARO
CC(C)C[N@H+](C)[C@H]1CCc2nn(CC3CC3)c(=O)n2CC1	ZINC000257178278	359140370	/nfs/dbraw/zinc/14/03/70/359140370.db2.gz	ZUVXPPPGEUPDBO-AWEZNQCLSA-N	1	0	292.427	1.748	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)c1ccncc1	ZINC000220139117	359153423	/nfs/dbraw/zinc/15/34/23/359153423.db2.gz	RSIASGWFOIJUIS-UHFFFAOYSA-N	1	0	256.309	1.627	50	0		CDAARO
Cc1ccc(F)c(C(=O)N[C@H]2[C@@H]3OCC[C@@H]3[C@@H]2[NH3+])c1Cl	ZINC000220147075	359154006	/nfs/dbraw/zinc/15/40/06/359154006.db2.gz	XANRWXWSNVQICV-SZOBPAOMSA-N	1	0	298.745	1.632	50	0		CDAARO
CC(C)[NH+](CCNC(=O)c1ccc(=O)[nH]n1)C(C)C	ZINC000023179510	359204959	/nfs/dbraw/zinc/20/49/59/359204959.db2.gz	VLYDXACZKKEETO-UHFFFAOYSA-N	1	0	266.345	1.031	50	0		CDAARO
Cc1nnc(CN2CCC([N@@H+]3CCC[C@@H](CO)C3)CC2)o1	ZINC000223479701	359429233	/nfs/dbraw/zinc/42/92/33/359429233.db2.gz	PCSSFLKPMQDZGR-CYBMUJFWSA-N	1	0	294.399	1.047	50	0		CDAARO
COC[C@@H]1C[N@H+](Cc2cccnc2)C[C@H]1C(=O)NC1CC1	ZINC000257192857	359594623	/nfs/dbraw/zinc/59/46/23/359594623.db2.gz	RAWKXNNPLQFCCN-DZGCQCFKSA-N	1	0	289.379	1.055	50	0		CDAARO
Cc1nnc(CNC(=O)c2cccc(OCC[NH3+])c2)s1	ZINC000426658337	360693145	/nfs/dbraw/zinc/69/31/45/360693145.db2.gz	KMRMCJCQOAGGPG-UHFFFAOYSA-N	1	0	292.364	1.114	50	0		CDAARO
Cc1ccc(OCCS(=O)(=O)NC[C@@H]2CCC[NH2+]2)cc1	ZINC000426360029	360658623	/nfs/dbraw/zinc/65/86/23/360658623.db2.gz	XQBHOJUYWQEVKF-ZDUSSCGKSA-N	1	0	298.408	1.045	50	0		CDAARO
Cc1cc(=O)cc(C(=O)NCCC[N@@H+](C)C2CCCC2)[nH]1	ZINC000426383413	360661395	/nfs/dbraw/zinc/66/13/95/360661395.db2.gz	WUEVHXRVASDACN-UHFFFAOYSA-N	1	0	291.395	1.678	50	0		CDAARO
Cc1nnc(SCCCNC(=O)[C@H](C)[NH+](C)C)s1	ZINC000426424394	360668199	/nfs/dbraw/zinc/66/81/99/360668199.db2.gz	SDBAWIQMKOFBOG-QMMMGPOBSA-N	1	0	288.442	1.395	50	0		CDAARO
CN(Cc1ccoc1)C(=O)NCC1CC[NH+](CCO)CC1	ZINC000426431050	360669696	/nfs/dbraw/zinc/66/96/96/360669696.db2.gz	KDTIGEKTRDSIQS-UHFFFAOYSA-N	1	0	295.383	1.125	50	0		CDAARO
CN(C(=O)c1nc2ccccc2[nH]1)[C@H]1CC[N@H+](C)C1	ZINC000426497157	360676034	/nfs/dbraw/zinc/67/60/34/360676034.db2.gz	HQIFHUCHKPDLDY-JTQLQIEISA-N	1	0	258.325	1.339	50	0		CDAARO
CSc1ccc(S(=O)(=O)NCC[C@H](C)[NH3+])cc1	ZINC000178915081	189154615	/nfs/dbraw/zinc/15/46/15/189154615.db2.gz	NYJMBRVUECEWLB-VIFPVBQESA-N	1	0	274.411	1.424	50	0		CDAARO
CCn1nc(C)c(C(=O)N(C)[C@H]2CC[NH2+]C2)c1Cl	ZINC000179126050	189171265	/nfs/dbraw/zinc/17/12/65/189171265.db2.gz	ITRDGUYVDFFBDL-VIFPVBQESA-N	1	0	270.764	1.299	50	0		CDAARO
COCC[C@@H](C)NC(=O)N1CC[C@H](C[NH+](C)C)C1	ZINC000129815345	360885141	/nfs/dbraw/zinc/88/51/41/360885141.db2.gz	VGCJGTBMYWVQOJ-VXGBXAGGSA-N	1	0	257.378	1.005	50	0		CDAARO
COCCCSc1nnc([C@@H]2CCC[NH2+]C2)n1C	ZINC000426537494	360997318	/nfs/dbraw/zinc/99/73/18/360997318.db2.gz	MWUKSFCLPNBSBG-SNVBAGLBSA-N	1	0	270.402	1.411	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)[C@@H]2CSc3ccccc3O2)C1	ZINC000299739004	200849564	/nfs/dbraw/zinc/84/95/64/200849564.db2.gz	JJVOGNINPXWDHL-YPMHNXCESA-N	1	0	292.404	1.608	50	0		CDAARO
Cc1ccc(C)c(OC[C@H](O)C[N@@H+]2CCC[C@H](O)C2)c1C	ZINC000036264147	361375329	/nfs/dbraw/zinc/37/53/29/361375329.db2.gz	SMYHTMOTIUNERN-JKSUJKDBSA-N	1	0	293.407	1.808	50	0		CDAARO
Cc1cccnc1NCCNC(=O)C(C)(C)[NH+]1CCCC1	ZINC000426722321	361673987	/nfs/dbraw/zinc/67/39/87/361673987.db2.gz	ARCJTQBHNAKERY-UHFFFAOYSA-N	1	0	290.411	1.793	50	0		CDAARO
COc1ncccc1C[N@@H+]1CC[C@@H](C)[C@H](OC)C1	ZINC000248735327	364381248	/nfs/dbraw/zinc/38/12/48/364381248.db2.gz	NOCAKIYTRXPEDZ-DGCLKSJQSA-N	1	0	250.342	1.947	50	0		CDAARO
C[C@@H](Cc1ccccc1)C[N@H+](C)[C@H]1CCS(=O)(=O)C1	ZINC000249392948	364651211	/nfs/dbraw/zinc/65/12/11/364651211.db2.gz	AMHRAJYPBBKZIT-ZFWWWQNUSA-N	1	0	281.421	1.984	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1cccc(C(=O)NC)n1	ZINC000089977245	366993383	/nfs/dbraw/zinc/99/33/83/366993383.db2.gz	CALWYSNKPVLHNG-GFCCVEGCSA-N	1	0	276.384	1.728	50	0		CDAARO
CNC(=O)c1cccc(NCC[N@@H+]2CCC[C@@H](C)C2)n1	ZINC000089929806	366971139	/nfs/dbraw/zinc/97/11/39/366971139.db2.gz	SKFSEARULBTPQT-GFCCVEGCSA-N	1	0	276.384	1.585	50	0		CDAARO
CCOCCC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1	ZINC000089986738	367002941	/nfs/dbraw/zinc/00/29/41/367002941.db2.gz	GECNANNJQUHQDR-STQMWFEESA-N	1	0	254.374	1.356	50	0		CDAARO
O=C1C(O)C[C@@H]2CC[N@@H+]3Cc4cc5c(cc4[C@H]1[C@@H]23)OCO5	ZINC000252596537	368356788	/nfs/dbraw/zinc/35/67/88/368356788.db2.gz	CKAXXGPMLYVWQI-VCVMDOMWSA-N	1	0	287.315	1.519	50	0		CDAARO
COCC(=O)N(CC[NH+](C)C)Cc1ccccc1C	ZINC000063846382	370114080	/nfs/dbraw/zinc/11/40/80/370114080.db2.gz	XWUOKOKZXBKTMP-UHFFFAOYSA-N	1	0	264.369	1.532	50	0		CDAARO
CCCCC[NH+]1CCC(Cn2cc(CCO)nn2)CC1	ZINC000063883092	371047908	/nfs/dbraw/zinc/04/79/08/371047908.db2.gz	HLGOLGCSCPMAJP-UHFFFAOYSA-N	1	0	280.416	1.715	50	0		CDAARO
COc1ccc(OCCCCN2CC[NH2+]CC2)cc1	ZINC000019831609	372353767	/nfs/dbraw/zinc/35/37/67/372353767.db2.gz	XQJUXMWLLLMGRY-UHFFFAOYSA-N	1	0	264.369	1.759	50	0		CDAARO
Cn1cncc1C(=O)N[C@H](CC[NH+](C)C)c1ccccc1	ZINC000299790901	372764386	/nfs/dbraw/zinc/76/43/86/372764386.db2.gz	CQDNIZAYUYNRPA-CQSZACIVSA-N	1	0	286.379	1.843	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@H]([NH3+])CN1Cc1ccccc1Cl	ZINC000299789028	372764544	/nfs/dbraw/zinc/76/45/44/372764544.db2.gz	ZRFYSZDYQGKMOB-AAEUAGOBSA-N	1	0	281.787	1.378	50	0		CDAARO
CN(C[C@@H]1CC[N@H+](C)C1(C)C)C(=O)CCc1cn[nH]c1	ZINC000299797029	372768277	/nfs/dbraw/zinc/76/82/77/372768277.db2.gz	PEUMSQARNVWZCW-ZDUSSCGKSA-N	1	0	278.400	1.531	50	0		CDAARO
O=C(Nc1ccn(Cc2ccccc2)n1)[C@H]1CCC[NH2+]C1	ZINC000195187574	372946294	/nfs/dbraw/zinc/94/62/94/372946294.db2.gz	MBAAKVSNRWBMNH-AWEZNQCLSA-N	1	0	284.363	1.870	50	0		CDAARO
CN(Cc1ccccc1Cl)C(=O)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000037798675	373115987	/nfs/dbraw/zinc/11/59/87/373115987.db2.gz	DHTAFAAUTDCRCT-JQWIXIFHSA-N	1	0	268.744	1.021	50	0		CDAARO
CCc1cccc(NC(=O)C[N@@H+]2CC[C@H](CC(N)=O)C2)c1	ZINC000368575175	373843779	/nfs/dbraw/zinc/84/37/79/373843779.db2.gz	IOZDZNYKNSENCG-CYBMUJFWSA-N	1	0	289.379	1.385	50	0		CDAARO
C(CN1CCOCC12CCC2)C[N@@H+]1CCOCC12CCC2	ZINC000104329488	374282371	/nfs/dbraw/zinc/28/23/71/374282371.db2.gz	AIYXBMHIICGMEE-UHFFFAOYSA-N	1	0	294.439	1.886	50	0		CDAARO
CC(C)=CC[NH+]1CCC(NC(=O)NC2CCOCC2)CC1	ZINC000095393132	374899912	/nfs/dbraw/zinc/89/99/12/374899912.db2.gz	YBGOPMJVMOQBQO-UHFFFAOYSA-N	1	0	295.427	1.895	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H]1C(=O)NC[C@H](O)Cc1ccccc1	ZINC000095417039	374918462	/nfs/dbraw/zinc/91/84/62/374918462.db2.gz	ULUWZSFNSSRVJB-HZPDHXFCSA-N	1	0	290.407	1.581	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)Nc1nc2c(s1)C(=O)CCC2	ZINC000095996128	375050385	/nfs/dbraw/zinc/05/03/85/375050385.db2.gz	BQQLNAWIIXKYRQ-ZCFIWIBFSA-N	1	0	253.327	1.338	50	0		CDAARO
Cn1cc(C[NH2+]CC(=O)N2CCCC2)c(-c2ccncc2)n1	ZINC000097159894	375150341	/nfs/dbraw/zinc/15/03/41/375150341.db2.gz	ULQKJSVJBQNHCC-UHFFFAOYSA-N	1	0	299.378	1.194	50	0		CDAARO
CC[NH+](CC)CCNC(=O)COc1ccccc1O	ZINC000002466331	375161226	/nfs/dbraw/zinc/16/12/26/375161226.db2.gz	NCSBBWXZYWTPRZ-UHFFFAOYSA-N	1	0	266.341	1.229	50	0		CDAARO
Cc1nc(C[C@@H]2CCCN(C(=O)[C@H]3CC[C@H]([NH3+])C3)C2)no1	ZINC000299740328	375201093	/nfs/dbraw/zinc/20/10/93/375201093.db2.gz	YMSZFGQUBMNJRV-AVGNSLFASA-N	1	0	292.383	1.287	50	0		CDAARO
O=C(NC[C@H](O)c1ccccc1Cl)[C@@H]1CC[NH2+]C1	ZINC000299740134	375201466	/nfs/dbraw/zinc/20/14/66/375201466.db2.gz	WDSJZOBWBABXAG-SKDRFNHKSA-N	1	0	268.744	1.099	50	0		CDAARO
COCc1cc(C(=O)N2CC[C@@H](C[NH3+])C2)ccc1F	ZINC000299740395	375202441	/nfs/dbraw/zinc/20/24/41/375202441.db2.gz	ZGKHAPRGMDBCAK-JTQLQIEISA-N	1	0	266.316	1.393	50	0		CDAARO
O=C1NC(=O)C(=CNCCC[NH+]2CCCC2)c2ccccc21	ZINC000029185581	375389887	/nfs/dbraw/zinc/38/98/87/375389887.db2.gz	IZMPWZPWEMAPIJ-NTCAYCPXSA-N	1	0	299.374	1.373	50	0		CDAARO
CCC[C@H]([NH2+]CCCn1cc(CO)nn1)[C@@H]1CC1(C)C	ZINC000417324561	375781081	/nfs/dbraw/zinc/78/10/81/375781081.db2.gz	ALXARJJPRNBFAO-KBPBESRZSA-N	1	0	280.416	1.965	50	0		CDAARO
C[C@@H]([NH3+])CONC(=O)/C=C\c1c(F)cccc1F	ZINC000606445132	375825854	/nfs/dbraw/zinc/82/58/54/375825854.db2.gz	UHFYAXUZWYZVNJ-RPSMYOMKSA-N	1	0	256.252	1.373	50	0		CDAARO
C[N@H+](CC(=O)Nc1cccnc1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C	ZINC000241644548	376019480	/nfs/dbraw/zinc/01/94/80/376019480.db2.gz	PRQQPRIPAUFXED-BPLDGKMQSA-N	1	0	289.379	1.765	50	0		CDAARO
C[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)CCCn1ccnc1	ZINC000242389381	376021092	/nfs/dbraw/zinc/02/10/92/376021092.db2.gz	ZWRNOUPGVGKTED-KBPBESRZSA-N	1	0	276.384	1.358	50	0		CDAARO
Cc1nc(CC[NH3+])cc(N(C)[C@@H](C)c2ccncn2)n1	ZINC000067894169	377284639	/nfs/dbraw/zinc/28/46/39/377284639.db2.gz	XRICEXZCUUQFHY-JTQLQIEISA-N	1	0	272.356	1.274	50	0		CDAARO
COc1cc(/C=C/C(=O)NCCCC[NH3+])ccc1O	ZINC000001531868	377999785	/nfs/dbraw/zinc/99/97/85/377999785.db2.gz	SFUVCMKSYKHYLD-FNORWQNLSA-N	1	0	264.325	1.269	50	0	biogenic,in-vitro	CDAARO
Cc1nnc([C@H](C)N2CCCC[C@H]2CN2CCOCC2)o1	ZINC000245289572	378045875	/nfs/dbraw/zinc/04/58/75/378045875.db2.gz	CTIXUAKXMOYDNX-JSGCOSHPSA-N	1	0	294.399	1.626	50	0		CDAARO
O=C(C1CCCC1)N1CCN(c2cc[nH+]cc2)CC1	ZINC000040464824	378097323	/nfs/dbraw/zinc/09/73/23/378097323.db2.gz	FIGQNBHQTJZQAO-UHFFFAOYSA-N	1	0	259.353	1.920	50	0		CDAARO
CCCc1noc(CN2CC[C@@H]([NH+](CC)CC)C2)n1	ZINC000022926436	378672488	/nfs/dbraw/zinc/67/24/88/378672488.db2.gz	PQMGDFKSPLFMQC-GFCCVEGCSA-N	1	0	266.389	1.938	50	0		CDAARO
O=c1[nH]c(-c2ccc(Cl)cc2)nc2c1CC[NH2+]C2	ZINC000077424027	285194187	/nfs/dbraw/zinc/19/41/87/285194187.db2.gz	IHZMNLYZHTZIDI-UHFFFAOYSA-N	1	0	261.712	1.736	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](N2C(=O)OC(C)(C)[C@]2(C)O)C1	ZINC000245257282	285229485	/nfs/dbraw/zinc/22/94/85/285229485.db2.gz	YNKAKTJZJSXZAA-MFKMUULPSA-N	1	0	256.346	1.410	50	0		CDAARO
COC[C@H](C)[NH2+]CC1(Cn2nc(C)cc2C)CC1	ZINC000065374630	285352508	/nfs/dbraw/zinc/35/25/08/285352508.db2.gz	NGYRRMWRINPUAI-LBPRGKRZSA-N	1	0	251.374	1.905	50	0		CDAARO
CCc1nnc2sc(-c3ccc(C[NH3+])cc3)nn12	ZINC000004512590	390154273	/nfs/dbraw/zinc/15/42/73/390154273.db2.gz	AJJJOLBNHUDSAC-UHFFFAOYSA-N	1	0	259.338	1.874	50	0		CDAARO
C[NH+](C)CCn1ccc(NC(=O)NC[C@H]2CC=CCC2)n1	ZINC000096424054	390516045	/nfs/dbraw/zinc/51/60/45/390516045.db2.gz	BUHJXTLHWVTLST-ZDUSSCGKSA-N	1	0	291.399	1.923	50	0		CDAARO
NC(=[NH2+])[C@H]1CN(c2ccc(Cl)cc2)C(=O)NC1=O	ZINC000072115188	390601258	/nfs/dbraw/zinc/60/12/58/390601258.db2.gz	RPKUPZRLDUMIPN-MRVPVSSYSA-N	1	0	266.688	1.789	50	0		CDAARO
Cc1cc(C(=O)N2CCC[NH2+]CC2)c(F)cc1F	ZINC000095971474	390911862	/nfs/dbraw/zinc/91/18/62/390911862.db2.gz	GGCNDTDZDXKCKW-UHFFFAOYSA-N	1	0	254.280	1.709	50	0		CDAARO
O=C1c2ccccc2C(=O)N1CC[n+]1ccccc1	ZINC000001668273	391152827	/nfs/dbraw/zinc/15/28/27/391152827.db2.gz	XVDIEJYYIWOISR-UHFFFAOYSA-N	1	0	253.281	1.270	50	0		CDAARO
COc1cccc(CSc2nnc(CC[NH3+])n2C)c1	ZINC000426651981	533534851	/nfs/dbraw/zinc/53/48/51/533534851.db2.gz	HVZDQVOLQHAMJK-UHFFFAOYSA-N	1	0	278.381	1.617	50	0		CDAARO
CSC[C@@H](C)[N@H+]1CCC(=O)N(CC(C)C)CC1	ZINC000012218984	391417150	/nfs/dbraw/zinc/41/71/50/391417150.db2.gz	AXALMBQLVQQDHV-GFCCVEGCSA-N	1	0	258.431	1.928	50	0		CDAARO
C[N@H+](Cc1ccc2c(c1)OCCO2)[C@H]1CCCCNC1=O	ZINC000009962079	392016914	/nfs/dbraw/zinc/01/69/14/392016914.db2.gz	QYVDSIJKSPOHER-ZDUSSCGKSA-N	1	0	290.363	1.558	50	0		CDAARO
C[C@H]([NH2+][C@@H](CO)[C@H]1CCCOC1)[C@@H]1C[C@H]1C1CC1	ZINC000527722887	392125656	/nfs/dbraw/zinc/12/56/56/392125656.db2.gz	ZHUPBHJAEIEGIH-PSWFKFNGSA-N	1	0	253.386	1.798	50	0		CDAARO
Cc1cc(C(=O)NCCC[NH2+]Cc2cccnc2)no1	ZINC000036279143	392409108	/nfs/dbraw/zinc/40/91/08/392409108.db2.gz	ZAXBQHMMZYOHCX-UHFFFAOYSA-N	1	0	274.324	1.288	50	0		CDAARO
CC[C@H](C)[N@H+](C)CCNC(=O)c1sc(N(C)C)nc1C	ZINC000095453127	393148464	/nfs/dbraw/zinc/14/84/64/393148464.db2.gz	YSJDVCBGLMRPQB-JTQLQIEISA-N	1	0	298.456	1.978	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC[C@@H](C)[NH3+])cc1Cl	ZINC000195300161	393163124	/nfs/dbraw/zinc/16/31/24/393163124.db2.gz	VOMWSNCMSZLAPC-MRVPVSSYSA-N	1	0	262.762	1.274	50	0		CDAARO
c1cnc(N2CC[NH+](C[C@H]3CC=CCC3)CC2)nc1	ZINC000000217809	285546442	/nfs/dbraw/zinc/54/64/42/285546442.db2.gz	VHDFZDXXWMVDMW-AWEZNQCLSA-N	1	0	258.369	1.955	50	0		CDAARO
O=C([C@@H]1C[NH2+]CCN1c1ccccc1)N1CCCCO1	ZINC000020995021	304369747	/nfs/dbraw/zinc/36/97/47/304369747.db2.gz	ORWMVJDPCSYWFW-AWEZNQCLSA-N	1	0	275.352	1.019	50	0		CDAARO
Cc1nc2ccc(C(=O)NCCC[NH+](C)C)cc2nc1C	ZINC000003040141	169850666	/nfs/dbraw/zinc/85/06/66/169850666.db2.gz	NPRFEAHMJGAMSW-UHFFFAOYSA-N	1	0	286.379	1.928	50	0		CDAARO
CCNC(=S)NC[C@@H](c1ccccc1)[NH+](C)C	ZINC000006612585	170218848	/nfs/dbraw/zinc/21/88/48/170218848.db2.gz	VYECNTXGRKHEDW-LBPRGKRZSA-N	1	0	251.399	1.773	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCC[NH+](C)C)c(C)c1	ZINC000007612660	170294020	/nfs/dbraw/zinc/29/40/20/170294020.db2.gz	OPHVHFNJEHXUKT-UHFFFAOYSA-N	1	0	256.371	1.143	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNc1nc(Cl)nc2nc[nH]c21	ZINC000009420076	170376365	/nfs/dbraw/zinc/37/63/65/170376365.db2.gz	REOZDSCREGBQIL-MRVPVSSYSA-N	1	0	280.763	1.903	50	0		CDAARO
c1cn([C@@H]2COC[C@@H]2[NH2+]CC2=Cc3ccccc3OC2)nn1	ZINC000284523595	196076518	/nfs/dbraw/zinc/07/65/18/196076518.db2.gz	DTDCLMCPNIAJLY-LSDHHAIUSA-N	1	0	298.346	1.284	50	0		CDAARO
CC[NH+]1CCN(CCCOc2cccc(C=O)c2)CC1	ZINC000020390421	171179154	/nfs/dbraw/zinc/17/91/54/171179154.db2.gz	BSFNLMFPDWSXHA-UHFFFAOYSA-N	1	0	276.380	1.906	50	0		CDAARO
COc1cccc(C=O)c1OCCN1C[C@H](C)O[C@@H](C)C1	ZINC000020652613	171268933	/nfs/dbraw/zinc/26/89/33/171268933.db2.gz	BLJGUMXPDNDKPL-STQMWFEESA-N	1	0	293.363	1.996	50	0		CDAARO
CC[NH2+]C[C@H](O)COc1ccc(CCOC)cc1	ZINC000022056328	171350988	/nfs/dbraw/zinc/35/09/88/171350988.db2.gz	HYRRKPFGZHWUPQ-ZDUSSCGKSA-N	1	0	253.342	1.225	50	0	in-vitro	CDAARO
COc1ccccc1OCCCN1CC[NH2+][C@@H](C)C1	ZINC000040456406	174267399	/nfs/dbraw/zinc/26/73/99/174267399.db2.gz	UYAJBGAPEWLSDM-ZDUSSCGKSA-N	1	0	264.369	1.758	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)CCc1c(C)noc1C	ZINC000044867924	175268031	/nfs/dbraw/zinc/26/80/31/175268031.db2.gz	ZJQRYMLUODKSRP-ZDUSSCGKSA-N	1	0	279.384	1.825	50	0		CDAARO
COC(=O)C(=C/C=C/[NH+](C(C)C)C(C)C)C(=O)OC	ZINC000055450667	175578765	/nfs/dbraw/zinc/57/87/65/175578765.db2.gz	VEVHASBECVJALD-VQHVLOKHSA-N	1	0	269.341	1.891	50	0		CDAARO
COc1ccc(OC[C@@H](O)CN2CCC[N@H+](C)CC2)cc1	ZINC000071284411	176109094	/nfs/dbraw/zinc/10/90/94/176109094.db2.gz	SEFMBSHIRBZFEX-AWEZNQCLSA-N	1	0	294.395	1.072	50	0		CDAARO
OC[C@@]1(O)CCC[N@H+](Cc2cc(-c3ccccn3)no2)C1	ZINC000072145453	176325023	/nfs/dbraw/zinc/32/50/23/176325023.db2.gz	RHNASZOIFOBRHY-OAHLLOKOSA-N	1	0	289.335	1.056	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]1NC(=O)c1c[nH]nc1-c1cccc(F)c1	ZINC000072172802	176333757	/nfs/dbraw/zinc/33/37/57/176333757.db2.gz	IBTVBXSZTQFSEZ-NEPJUHHUSA-N	1	0	274.299	1.435	50	0		CDAARO
CC[C@@H]1COCCN1C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C	ZINC000074791650	176615282	/nfs/dbraw/zinc/61/52/82/176615282.db2.gz	XKEQQEXSQCTSBT-NUDNTCICSA-N	1	0	295.427	1.822	50	0		CDAARO
Cc1c[nH]c(C[N@@H+](C)[C@@H]2CCOC3(CCOCC3)C2)n1	ZINC000077504825	177275884	/nfs/dbraw/zinc/27/58/84/177275884.db2.gz	MSZORWYRKDLSRQ-CYBMUJFWSA-N	1	0	279.384	1.878	50	0		CDAARO
Cc1cc2c(cc1C)O[C@@H](C(=O)NC1(C)CC[NH2+]CC1)C2	ZINC000193364012	267299275	/nfs/dbraw/zinc/29/92/75/267299275.db2.gz	ZMFIELCJVBOOAF-OAHLLOKOSA-N	1	0	288.391	1.865	50	0		CDAARO
C[C@H]1CN(C(=O)[C@H]2CCC[NH2+]C2)c2ccc(F)cc2O1	ZINC000118962224	274575085	/nfs/dbraw/zinc/57/50/85/274575085.db2.gz	SSFMDHJDQXQEFO-QWRGUYRKSA-N	1	0	278.327	1.939	50	0		CDAARO
c1nc2sc3c(c2c(N2CC[NH2+]CC2)n1)CCC3	ZINC000031813981	275076920	/nfs/dbraw/zinc/07/69/20/275076920.db2.gz	MFSBJNOISFKTFC-UHFFFAOYSA-N	1	0	260.366	1.590	50	0		CDAARO
Brc1cccc(O[C@@H]2CCC[NH2+]C2)n1	ZINC000040434949	275373397	/nfs/dbraw/zinc/37/33/97/275373397.db2.gz	AQFZXAYKITWKCY-MRVPVSSYSA-N	1	0	257.131	1.975	50	0		CDAARO
C[N@@H+]1CCC[C@H](c2n[nH]c(=O)n2C2CCCCC2)C1	ZINC000065470425	277074701	/nfs/dbraw/zinc/07/47/01/277074701.db2.gz	NGOHOUJYXNPKMZ-NSHDSACASA-N	1	0	264.373	1.886	50	0		CDAARO
CO[C@H]1CN(C(=O)c2cc3cccc(C)c3o2)CC[C@H]1[NH3+]	ZINC000071479618	277749279	/nfs/dbraw/zinc/74/92/79/277749279.db2.gz	DWQJYTNRDBIEPN-OCCSQVGLSA-N	1	0	288.347	1.929	50	0		CDAARO
C[C@H]1CCC[C@@H]([NH+]2CCN(S(C)(=O)=O)CC2)C1	ZINC000019841819	278347594	/nfs/dbraw/zinc/34/75/94/278347594.db2.gz	FINFRFMKIIFPAO-NWDGAFQWSA-N	1	0	260.403	1.142	50	0		CDAARO
C[C@H]1Cc2ccccc2N(C(=O)[C@H]2C[NH2+]CCO2)C1	ZINC000105569034	280029574	/nfs/dbraw/zinc/02/95/74/280029574.db2.gz	NLCPQTGQHASCJJ-SMDDNHRTSA-N	1	0	260.337	1.200	50	0		CDAARO
CC1(C)C[C@@H]([NH2+][C@H]2CC(=O)N(C3CC3)C2)C(C)(C)O1	ZINC000090181388	281319656	/nfs/dbraw/zinc/31/96/56/281319656.db2.gz	KASGNWRGEGBPHC-CMPLNLGQSA-N	1	0	266.385	1.685	50	0		CDAARO
NC(=O)N1CCC([NH2+][C@H]2CCC[C@H]2n2ccnc2)CC1	ZINC000037314055	295061524	/nfs/dbraw/zinc/06/15/24/295061524.db2.gz	XCYRZWGSEXYOKU-QWHCGFSZSA-N	1	0	277.372	1.109	50	0		CDAARO
[NH3+][C@@H]1CCCC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1	ZINC000031892856	295300630	/nfs/dbraw/zinc/30/06/30/295300630.db2.gz	LDPGWSGWABYNGR-VXGBXAGGSA-N	1	0	288.800	1.888	50	0		CDAARO
CC[N@H+](C)C1(CNC(=O)c2cnc(N)s2)CCCC1	ZINC000534646447	328329422	/nfs/dbraw/zinc/32/94/22/328329422.db2.gz	MXWUNMDLFSJQCF-UHFFFAOYSA-N	1	0	282.413	1.550	50	0		CDAARO
COc1ccnc(CN2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)c1OC	ZINC000534658126	328341152	/nfs/dbraw/zinc/34/11/52/328341152.db2.gz	JZZUFAXRRLVVKS-WVKUQDAKSA-N	1	0	289.379	1.281	50	0		CDAARO
CCc1nc(CC[NH2+][C@@H](C)Cn2cncn2)cs1	ZINC000534666173	328345297	/nfs/dbraw/zinc/34/52/97/328345297.db2.gz	FAJAMIOICCPCTF-JTQLQIEISA-N	1	0	265.386	1.518	50	0		CDAARO
Fc1ccc(-n2cccn2)c([C@H]2[NH2+]CCc3nc[nH]c32)c1	ZINC000065380459	724384471	/nfs/dbraw/zinc/38/44/71/724384471.db2.gz	ZCCCGBSNRXILJZ-CQSZACIVSA-N	1	0	283.310	1.970	50	0		CDAARO
CCO[C@@H](CC[NH+](C)C)CNC(=O)NCc1ccco1	ZINC000084800652	482507141	/nfs/dbraw/zinc/50/71/41/482507141.db2.gz	LCXSLSMVGLBODH-ZDUSSCGKSA-N	1	0	283.372	1.436	50	0		CDAARO
NC(=O)C1(C[NH2+]Cc2cccs2)CCOCC1	ZINC000086250650	482706642	/nfs/dbraw/zinc/70/66/42/482706642.db2.gz	LQZXWAMIAREPDH-UHFFFAOYSA-N	1	0	254.355	1.120	50	0		CDAARO
C[NH+](C)[C@H]1CN(c2nnc(-c3ccccc3)s2)C[C@@H]1O	ZINC000670435038	482971582	/nfs/dbraw/zinc/97/15/82/482971582.db2.gz	VYWNREYYFCTPCJ-RYUDHWBXSA-N	1	0	290.392	1.316	50	0		CDAARO
CC(C)n1cnnc1[C@@H](C)NC(=O)C[N@H+](C)C1CCCC1	ZINC000670436353	482975116	/nfs/dbraw/zinc/97/51/16/482975116.db2.gz	XOAMZBQYKGWVDR-GFCCVEGCSA-N	1	0	293.415	1.911	50	0		CDAARO
COc1ccc2[nH]c(CNC(=O)[C@H]3C=CC[NH2+]3)cc2c1	ZINC000670446556	482998192	/nfs/dbraw/zinc/99/81/92/482998192.db2.gz	MOXCYKWNAJXPRQ-CQSZACIVSA-N	1	0	271.320	1.321	50	0		CDAARO
Cc1nc2c([nH]1)CN(Cc1noc([C@H]3CCCO3)n1)CC2	ZINC000670450039	483011042	/nfs/dbraw/zinc/01/10/42/483011042.db2.gz	BJNBOBVIGSQASY-GFCCVEGCSA-N	1	0	289.339	1.511	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]CCCn1ccccc1=O	ZINC000670455472	483032253	/nfs/dbraw/zinc/03/22/53/483032253.db2.gz	TZDIYDAAZCOEHC-AWEZNQCLSA-N	1	0	288.395	1.676	50	0		CDAARO
Cc1cc(C[N@H+](C)CC[C@H]2CCS(=O)(=O)C2)ccn1	ZINC000670462934	483051829	/nfs/dbraw/zinc/05/18/29/483051829.db2.gz	WWGKQNYAELDCLC-ZDUSSCGKSA-N	1	0	282.409	1.647	50	0		CDAARO
C[N@H+](CCC(=O)NC1CCCC1)CC1(CO)CCCC1	ZINC000670467793	483060264	/nfs/dbraw/zinc/06/02/64/483060264.db2.gz	VMGPCWOJMLZPCS-UHFFFAOYSA-N	1	0	282.428	1.920	50	0		CDAARO
C[NH+](C)C[C@@]1(CO)CCCN(C(=O)CC2CCCC2)C1	ZINC000670469209	483063295	/nfs/dbraw/zinc/06/32/95/483063295.db2.gz	DUGYVEPFZIBCMJ-INIZCTEOSA-N	1	0	282.428	1.729	50	0		CDAARO
Cc1ncc(C[N@H+](C)CCC2(O)CCCC2)n1C	ZINC000670472616	483081826	/nfs/dbraw/zinc/08/18/26/483081826.db2.gz	YOLHMIBHYPHEJX-UHFFFAOYSA-N	1	0	251.374	1.856	50	0		CDAARO
OCc1ccc(C[NH2+]C[C@H](O)c2ccc(F)cc2F)o1	ZINC000084344264	483272898	/nfs/dbraw/zinc/27/28/98/483272898.db2.gz	YIJAOIWSMFUSFG-AWEZNQCLSA-N	1	0	283.274	1.873	50	0		CDAARO
CCC(=O)N1CC[C@H]([NH2+]Cc2c[nH]nc2C)[C@@H](CC)C1	ZINC000084736281	483320524	/nfs/dbraw/zinc/32/05/24/483320524.db2.gz	ZGNYSJSCJZNGMM-JSGCOSHPSA-N	1	0	278.400	1.845	50	0		CDAARO
C[C@@H](Cc1cccs1)[N@H+](C)CC(=O)N1CCOCC1	ZINC000096448427	534255226	/nfs/dbraw/zinc/25/52/26/534255226.db2.gz	QRANLSJDONHBKN-LBPRGKRZSA-N	1	0	282.409	1.470	50	0		CDAARO
C[NH2+]CC(=O)N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000178430248	521957990	/nfs/dbraw/zinc/95/79/90/521957990.db2.gz	IXFKVQUTSKYBOJ-UHFFFAOYSA-N	1	0	284.306	1.554	50	0		CDAARO
Cc1nn(C)cc1[C@H](C)NC(=O)[C@H]1CCCC[NH2+]1	ZINC000096481204	534849104	/nfs/dbraw/zinc/84/91/04/534849104.db2.gz	SASKUWYYGOHGHE-JOYOIKCWSA-N	1	0	250.346	1.048	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1ccc2c(c1)OCO2	ZINC000006416306	528136020	/nfs/dbraw/zinc/13/60/20/528136020.db2.gz	XAENJVAZFPDKMC-UHFFFAOYSA-N	1	0	264.325	1.487	50	0		CDAARO
Cc1nnc(N2C[C@@H]3COC[C@H](C2)[N@H+](C)C3)c2ccccc12	ZINC001772702189	1159438249	/nfs/dbraw/zinc/43/82/49/1159438249.db2.gz	AKBBWWLIHGERHH-KGLIPLIRSA-N	1	0	298.390	1.705	50	0		CDAARO
CC[C@H]1CN(c2nnc(COC)o2)CC[N@@H+]1C(C)C	ZINC001772703246	1159438258	/nfs/dbraw/zinc/43/82/58/1159438258.db2.gz	KGGBVXOVVXPGBV-NSHDSACASA-N	1	0	268.361	1.525	50	0		CDAARO
CC(C)CCC[N@H+]1C[C@@H](Cc2cnccn2)[C@H](O)C1	ZINC001704340797	1177695721	/nfs/dbraw/zinc/69/57/21/1177695721.db2.gz	MLWZZHYGMGLRNZ-UKRRQHHQSA-N	1	0	263.385	1.748	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CCNc1nccnc1N(C)C	ZINC000302187956	1186478345	/nfs/dbraw/zinc/47/83/45/1186478345.db2.gz	JIGFHHUJDMTWKR-GFCCVEGCSA-N	1	0	263.389	1.829	50	0		CDAARO
CCCc1nnc(C(=O)N(C)C[C@@]2(C)CC[N@H+](C)C2)o1	ZINC000071750981	726020503	/nfs/dbraw/zinc/02/05/03/726020503.db2.gz	JPAZEXBBVPCAEF-AWEZNQCLSA-N	1	0	280.372	1.436	50	0		CDAARO
Cc1nccn1CCC[NH+]1CCC2(CC1)OCCC[C@@H]2O	ZINC000299777954	726205033	/nfs/dbraw/zinc/20/50/33/726205033.db2.gz	CVUQGOPCPWLDQU-HNNXBMFYSA-N	1	0	293.411	1.588	50	0		CDAARO
COc1cc(CN2CCC[N@H+](C)CC2)ccc1O	ZINC000019537605	727445906	/nfs/dbraw/zinc/44/59/06/727445906.db2.gz	WATNPWQQUDTQDH-UHFFFAOYSA-N	1	0	250.342	1.538	50	0		CDAARO
Cc1cnc(NC[C@H]2CC[N@H+](C)C2)nc1-c1cnn(C)c1	ZINC000063846171	728242722	/nfs/dbraw/zinc/24/27/22/728242722.db2.gz	WKTNNEYCELQAQU-GFCCVEGCSA-N	1	0	286.383	1.549	50	0		CDAARO
CC(C)[N@@H+]1CCCN(C(=O)C[C@@H]2CCCOC2)CC1	ZINC000793390200	728256382	/nfs/dbraw/zinc/25/63/82/728256382.db2.gz	LUCLSPXNRYKVBE-AWEZNQCLSA-N	1	0	268.401	1.746	50	0		CDAARO
c1c(COCc2ccccc2)nnn1[C@H]1CC[NH2+]C1	ZINC000675018350	899870952	/nfs/dbraw/zinc/87/09/52/899870952.db2.gz	QTWMTSGUFSQKHE-AWEZNQCLSA-N	1	0	258.325	1.529	50	0		CDAARO
C(C[C@H]1CCC[NH2+]C1)c1noc(C2CCOCC2)n1	ZINC000675024447	899883348	/nfs/dbraw/zinc/88/33/48/899883348.db2.gz	HBYOFBBYCJBINR-LLVKDONJSA-N	1	0	265.357	1.896	50	0		CDAARO
Cc1cccc(-n2nc(CC(C)C)nc2CC[NH3+])n1	ZINC000952872390	910427953	/nfs/dbraw/zinc/42/79/53/910427953.db2.gz	NOOQSNLJKWKWGH-UHFFFAOYSA-N	1	0	259.357	1.670	50	0		CDAARO
CCCN(CCC)C(=O)CN1C=NC2=[NH+][C@H](C)CCN21	ZINC000952882729	910452680	/nfs/dbraw/zinc/45/26/80/910452680.db2.gz	JAWJUGMHJXVKSA-GFCCVEGCSA-N	1	0	279.388	1.344	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCCC[NH2+][C@@H]2CCOC2)cc1	ZINC000952981390	910540411	/nfs/dbraw/zinc/54/04/11/910540411.db2.gz	WKDKIDUHZVQJNC-CYBMUJFWSA-N	1	0	298.408	1.042	50	0		CDAARO
COCC1(CNC(=O)[C@@H](C)[NH+]2CCCCC2)CCC1	ZINC000824347215	925817357	/nfs/dbraw/zinc/81/73/57/925817357.db2.gz	SGLOSJNWDKVJNP-CYBMUJFWSA-N	1	0	268.401	1.794	50	0		CDAARO
Cn1ccnc1CC[N@@H+]1CCCN(C(=O)C2CCC2)CC1	ZINC000827939049	926006114	/nfs/dbraw/zinc/00/61/14/926006114.db2.gz	DZMGKNZVBRVMMR-UHFFFAOYSA-N	1	0	290.411	1.297	50	0		CDAARO
O=C(NCC1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccon1	ZINC000828228830	926088595	/nfs/dbraw/zinc/08/85/95/926088595.db2.gz	YKQOLSLCIICCRV-ZDUSSCGKSA-N	1	0	293.367	1.153	50	0		CDAARO
CC(=O)N1CC([N@@H+](Cc2cccnc2)CC(C)C)C1	ZINC000581776601	927194073	/nfs/dbraw/zinc/19/40/73/927194073.db2.gz	VIZKDENEVQYKFJ-UHFFFAOYSA-N	1	0	261.369	1.770	50	0		CDAARO
CCOCC(=O)N1CCC(Cn2c(C)c[nH+]c2C)CC1	ZINC000581808648	927206298	/nfs/dbraw/zinc/20/62/98/927206298.db2.gz	VXADSZWZLOHYHJ-UHFFFAOYSA-N	1	0	279.384	1.775	50	0		CDAARO
CC[N@@H+]1CCC[C@H](CNc2nc(N)nc3n[nH]cc32)C1	ZINC000200527806	929259923	/nfs/dbraw/zinc/25/99/23/929259923.db2.gz	RDPUNJZLNYKNIS-SECBINFHSA-N	1	0	275.360	1.079	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)c1cc(C2CC2)no1	ZINC000885938851	931467150	/nfs/dbraw/zinc/46/71/50/931467150.db2.gz	BMLPLHHBVBLNRV-UHFFFAOYSA-N	1	0	286.335	1.519	50	0		CDAARO
COc1cc(C[NH2+][C@@H]2CN3CCC2CC3)cc(OC)c1	ZINC000019948350	935725395	/nfs/dbraw/zinc/72/53/95/935725395.db2.gz	AITUAHIRCSIPTC-MRXNPFEDSA-N	1	0	276.380	1.888	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CNc2nc(C)cnc2C)C1	ZINC001529111279	968983875	/nfs/dbraw/zinc/98/38/75/968983875.db2.gz	UWEVMUZXMOGNCX-CYBMUJFWSA-N	1	0	264.373	1.474	50	0		CDAARO
Cn1ccnc1-c1ccc(NC[C@@]2(C)CC[N@H+](C)C2)nn1	ZINC001506401321	975150397	/nfs/dbraw/zinc/15/03/97/975150397.db2.gz	IRVHCECXNWMDID-OAHLLOKOSA-N	1	0	286.383	1.631	50	0		CDAARO
COCCN1C[C@@H](CNc2cc[nH+]c3ccccc23)CC1=O	ZINC001506406853	975151278	/nfs/dbraw/zinc/15/12/78/975151278.db2.gz	KBXVMPYPFZECIK-CYBMUJFWSA-N	1	0	299.374	1.564	50	0		CDAARO
Cc1nn(CCC[NH2+][C@@H](C)CN(C)CCO)c(C)c1C	ZINC001506406893	975151988	/nfs/dbraw/zinc/15/19/88/975151988.db2.gz	HDXQRYFZBWBXCR-LBPRGKRZSA-N	1	0	282.432	1.101	50	0		CDAARO
Cc1nncn1CC[N@@H+]1CCC[C@H](Cn2ccnc2)C1	ZINC001506420710	975158150	/nfs/dbraw/zinc/15/81/50/975158150.db2.gz	BTFBVQKXHSMSDI-AWEZNQCLSA-N	1	0	274.372	1.195	50	0		CDAARO
COCc1cc(C(=O)N2CC[NH2+]C[C@H]2C)ccc1F	ZINC000124343971	187133224	/nfs/dbraw/zinc/13/32/24/187133224.db2.gz	IKWOXFNIEDBBKC-SNVBAGLBSA-N	1	0	266.316	1.406	50	0		CDAARO
COC[C@@H](C)[NH2+]CC(=O)N[C@@H](C)CCc1ccccc1	ZINC000002632892	230367426	/nfs/dbraw/zinc/36/74/26/230367426.db2.gz	QBNZJZNDRPVDEX-UONOGXRCSA-N	1	0	278.396	1.748	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)NCC[C@H]1CC[NH2+]C1	ZINC000110797223	230394045	/nfs/dbraw/zinc/39/40/45/230394045.db2.gz	NVWAEUWVCGHUEM-LLVKDONJSA-N	1	0	286.372	1.412	50	0		CDAARO
CCO[C@H]1CCCN(C(=O)[C@H](C2CC2)[NH+]2CCCC2)C1	ZINC000095939782	185035164	/nfs/dbraw/zinc/03/51/64/185035164.db2.gz	ANZCHLXPDCBAHP-GJZGRUSLSA-N	1	0	280.412	1.888	50	0		CDAARO
O=C(CNC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2[NH2+]1)N1CCCCC1	ZINC000095956842	185042680	/nfs/dbraw/zinc/04/26/80/185042680.db2.gz	WLNFUCYBFSGRBD-RDBSUJKOSA-N	1	0	293.411	1.036	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@@H](C)c1cccc(C)c1C	ZINC000095985241	185055299	/nfs/dbraw/zinc/05/52/99/185055299.db2.gz	WOXNTSBCLAVGHW-ZDUSSCGKSA-N	1	0	284.425	1.893	50	0		CDAARO
CNC(=O)c1cccc(CC[NH2+][C@H]2CCO[C@@H](C)C2)c1	ZINC000095983908	185055607	/nfs/dbraw/zinc/05/56/07/185055607.db2.gz	JAMKRJZZBLBZTF-WFASDCNBSA-N	1	0	276.380	1.746	50	0		CDAARO
CCC(=O)NCc1ccccc1C[N@@H+]1CC[C@@H](O)C1	ZINC000096006291	185063276	/nfs/dbraw/zinc/06/32/76/185063276.db2.gz	FSQLZTSDSXOSRE-CQSZACIVSA-N	1	0	262.353	1.279	50	0		CDAARO
Fc1ccccc1OCCOCCN1CCOCC1	ZINC000016663401	342088928	/nfs/dbraw/zinc/08/89/28/342088928.db2.gz	HPIWNWRHNQLXPA-UHFFFAOYSA-N	1	0	269.316	1.553	50	0		CDAARO
O=C(NCCCc1cc(F)cc(F)c1)[C@H]1CCC[NH2+]1	ZINC000195554998	342626116	/nfs/dbraw/zinc/62/61/16/342626116.db2.gz	GZOSHXDJQBNCKA-CYBMUJFWSA-N	1	0	268.307	1.766	50	0		CDAARO
CC(C)c1nc(C(=O)N2CC[NH2+]C[C@H]2C)cs1	ZINC000095427894	539087954	/nfs/dbraw/zinc/08/79/54/539087954.db2.gz	MJBMBTDSWYQLIX-SECBINFHSA-N	1	0	253.371	1.700	50	0		CDAARO
CC[C@@H](C(=O)N(C)Cc1noc(C2CC2)n1)[NH+]1CCCC1	ZINC000243892354	361829053	/nfs/dbraw/zinc/82/90/53/361829053.db2.gz	AGRLOMJJPMWGPL-LBPRGKRZSA-N	1	0	292.383	1.780	50	0		CDAARO
Cc1noc(C)c1CN(C)[C@H](C)C(=O)Nc1nncs1	ZINC000244831575	361865052	/nfs/dbraw/zinc/86/50/52/361865052.db2.gz	UGKQNBRAMAEYAJ-MRVPVSSYSA-N	1	0	295.368	1.602	50	0		CDAARO
CC[C@@H]1CCCCN1C(=O)CSc1nc(N)cc(N)[nH+]1	ZINC000000418001	361898148	/nfs/dbraw/zinc/89/81/48/361898148.db2.gz	UZNQPMOFAJHIET-SECBINFHSA-N	1	0	295.412	1.524	50	0		CDAARO
C[C@H](CC(=O)N1CCCCCC1)[NH2+][C@]1(C)CCOC1	ZINC000097231651	342205271	/nfs/dbraw/zinc/20/52/71/342205271.db2.gz	YLXOPQJUXHMDTF-UKRRQHHQSA-N	1	0	268.401	1.936	50	0		CDAARO
CCN1C[C@H](COC(=O)c2ccn3c[nH+]cc3c2)CC1=O	ZINC000097034316	185157526	/nfs/dbraw/zinc/15/75/26/185157526.db2.gz	ALNPKEPIIGXITG-LLVKDONJSA-N	1	0	287.319	1.360	50	0		CDAARO
O=C(NC12CC[NH+](CC1)C2)c1noc2c1CCCC2	ZINC000585134565	342215534	/nfs/dbraw/zinc/21/55/34/342215534.db2.gz	ZTCWKUMSQWKQAO-UHFFFAOYSA-N	1	0	261.325	1.131	50	0		CDAARO
Cc1nc(C[NH2+][C@H]2CCCC[C@H]2C(N)=O)cs1	ZINC000097375142	342220224	/nfs/dbraw/zinc/22/02/24/342220224.db2.gz	PKEUZMLNHMVIFL-MNOVXSKESA-N	1	0	253.371	1.585	50	0		CDAARO
CSCCC[N@@H+]1C[C@H](C)[C@H](N2CCN(C(C)=O)CC2)C1	ZINC000107323415	349698947	/nfs/dbraw/zinc/69/89/47/349698947.db2.gz	MFLUMRARBCPHCN-DZGCQCFKSA-N	1	0	299.484	1.224	50	0		CDAARO
COC(=O)[C@@H]1[C@H]2CCC[N@@H+]2C2(CCCCC2)[C@H]1C(=O)OC	ZINC000100871969	362036574	/nfs/dbraw/zinc/03/65/74/362036574.db2.gz	YLAUEXHRCZFZSL-JHJVBQTASA-N	1	0	295.379	1.746	50	0		CDAARO
O=C(COC1CC[NH2+]CC1)N[C@H]1C[C@@H]1c1ccccc1	ZINC000111797106	365755076	/nfs/dbraw/zinc/75/50/76/365755076.db2.gz	ZJLRJVUUOZSKCQ-CABCVRRESA-N	1	0	274.364	1.427	50	0		CDAARO
CCOC(=O)[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1O	ZINC000252487412	362386787	/nfs/dbraw/zinc/38/67/87/362386787.db2.gz	XEPZKCVKBIJDII-UONOGXRCSA-N	1	0	263.337	1.433	50	0		CDAARO
CC(=O)NC[C@@H]1C[N@H+](C[C@@H]2C(C)=CCC[C@@H]2C)CCO1	ZINC000191073467	362398827	/nfs/dbraw/zinc/39/88/27/362398827.db2.gz	NECLUUSXMKWBHS-NUEKZKHPSA-N	1	0	280.412	1.816	50	0		CDAARO
CCS(=O)(=O)NCC[NH2+]C/C(C)=C\c1ccccc1	ZINC000098052681	185677726	/nfs/dbraw/zinc/67/77/26/185677726.db2.gz	LOUGWHNQUORKDP-QBFSEMIESA-N	1	0	282.409	1.619	50	0		CDAARO
O[C@@H](C[NH+]1CCN(Cc2ccccc2F)CC1)C1CC1	ZINC000085436863	179063225	/nfs/dbraw/zinc/06/32/25/179063225.db2.gz	KIKYIBRIWGBIET-INIZCTEOSA-N	1	0	278.371	1.714	50	0		CDAARO
CCn1cc([C@@H]2OCC[C@H]2C[NH2+]Cc2ncc[nH]2)cn1	ZINC000089305968	346756061	/nfs/dbraw/zinc/75/60/61/346756061.db2.gz	QOHIVJOZJNBKFQ-SMDDNHRTSA-N	1	0	275.356	1.494	50	0		CDAARO
CN1CCN(C(=O)[C@@H]2CCCC[N@@H+]2C)Cc2ccccc21	ZINC000089382825	346764295	/nfs/dbraw/zinc/76/42/95/346764295.db2.gz	WLKMRCQMHJZMGA-INIZCTEOSA-N	1	0	287.407	1.949	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccc3ncccc3c2)CC[NH2+]1	ZINC000088059255	179542706	/nfs/dbraw/zinc/54/27/06/179542706.db2.gz	BPBZMDIXXLJMRQ-LLVKDONJSA-N	1	0	255.321	1.669	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2c(F)cccc2F)C[C@@H]1C1CC1	ZINC000091254855	180114946	/nfs/dbraw/zinc/11/49/46/180114946.db2.gz	GJCWJXIQURAAJX-SKDRFNHKSA-N	1	0	266.291	1.774	50	0		CDAARO
Cc1cc(C)n(CCN(C)C(=O)[C@H]2CCCCC[N@@H+]2C)n1	ZINC000091321865	180134674	/nfs/dbraw/zinc/13/46/74/180134674.db2.gz	JTEDHPRSERBATI-OAHLLOKOSA-N	1	0	292.427	1.833	50	0		CDAARO
CCOc1ccccc1C(=O)N[C@@H]1CCC[NH2+][C@H]1C	ZINC000091496538	180172073	/nfs/dbraw/zinc/17/20/73/180172073.db2.gz	BTLWXOCQCOWUON-WCQYABFASA-N	1	0	262.353	1.956	50	0		CDAARO
CC(C)c1cc(C(=O)NCC[N@@H+]2CCCC[C@H]2CO)on1	ZINC000091585586	180199799	/nfs/dbraw/zinc/19/97/99/180199799.db2.gz	KLWFZXOBCINWLX-LBPRGKRZSA-N	1	0	295.383	1.375	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCC(=O)NCCn2cccc2)C1	ZINC000091644486	180214624	/nfs/dbraw/zinc/21/46/24/180214624.db2.gz	BGYYKIDELRYNLD-AWEZNQCLSA-N	1	0	263.385	1.726	50	0		CDAARO
CCOc1ccc(C[N@@H+]2CC[C@]3(C2)CCCNC3=O)cn1	ZINC000091691680	180227217	/nfs/dbraw/zinc/22/72/17/180227217.db2.gz	NTIDJOCOINYFCV-INIZCTEOSA-N	1	0	289.379	1.582	50	0		CDAARO
COCC(=O)N[C@H]1C[N@H+](CCCSC)C[C@@H]1C(C)C	ZINC000091794441	180258235	/nfs/dbraw/zinc/25/82/35/180258235.db2.gz	HCQXZFQACUDKKE-OLZOCXBDSA-N	1	0	288.457	1.459	50	0		CDAARO
CN1CCO[C@H](C[NH2+]Cc2ccc(Cl)cc2)C1	ZINC000105472074	186058893	/nfs/dbraw/zinc/05/88/93/186058893.db2.gz	ZKLYCPWTVSHGAL-CYBMUJFWSA-N	1	0	254.761	1.760	50	0		CDAARO
CCc1cnc(N)nc1NCCC[N@@H+]1CCCC[C@@H]1CO	ZINC000091819431	180263225	/nfs/dbraw/zinc/26/32/25/180263225.db2.gz	JPGQFGPCNBGDHS-CYBMUJFWSA-N	1	0	293.415	1.270	50	0		CDAARO
C[C@H](NC(=O)CCc1ccncc1)[C@H]1CCCC[NH2+]1	ZINC000583651205	366009081	/nfs/dbraw/zinc/00/90/81/366009081.db2.gz	GYXDMLQLCVANAD-GXTWGEPZSA-N	1	0	261.369	1.661	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1ccc2c(c1)C[C@H](C)O2	ZINC000124919161	351385781	/nfs/dbraw/zinc/38/57/81/351385781.db2.gz	OTGLZHXRWPQFTE-JQWIXIFHSA-N	1	0	298.408	1.416	50	0		CDAARO
CC(C)n1ccc(C(=O)NC[C@H](C)C[NH+](C)C)n1	ZINC000292332833	198247422	/nfs/dbraw/zinc/24/74/22/198247422.db2.gz	JWXMREFFLVQFFT-NSHDSACASA-N	1	0	252.362	1.392	50	0		CDAARO
Cc1ccc(C(=O)NCCC[NH+]2C[C@@H](C)O[C@H](C)C2)cn1	ZINC000036831044	363267194	/nfs/dbraw/zinc/26/71/94/363267194.db2.gz	IFTKYBHOAJHXFM-ZIAGYGMSSA-N	1	0	291.395	1.619	50	0		CDAARO
CCn1cc(Cl)cc1C(=O)N(C)C1CC[NH2+]CC1	ZINC000036856593	363276931	/nfs/dbraw/zinc/27/69/31/363276931.db2.gz	YNFXRXBILRBIGT-UHFFFAOYSA-N	1	0	269.776	1.985	50	0		CDAARO
C[C@H](NC(=O)[C@@H]1C[C@H](O)C[NH2+]1)c1cc2ccccc2o1	ZINC000037030709	363316324	/nfs/dbraw/zinc/31/63/24/363316324.db2.gz	MEQCBFDXUMIDRU-DLOVCJGASA-N	1	0	274.320	1.333	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]CCCNS(C)(=O)=O)C[C@H]1C	ZINC000248648557	363451580	/nfs/dbraw/zinc/45/15/80/363451580.db2.gz	QTTDZFPKQLOFEQ-UTUOFQBUSA-N	1	0	262.419	1.340	50	0		CDAARO
COc1ccc(C[NH2+]C[C@H]2CCCO2)cc1OC	ZINC000000299724	355902105	/nfs/dbraw/zinc/90/21/05/355902105.db2.gz	ZPKUANIUQZWSSL-GFCCVEGCSA-N	1	0	251.326	1.972	50	0		CDAARO
C/C=C/C(=O)Nc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000000128589	355890079	/nfs/dbraw/zinc/89/00/79/355890079.db2.gz	DGZQNLFWBKUAMR-ONEGZZNKSA-N	1	0	259.353	1.953	50	0		CDAARO
COC(=O)C[C@@]1(C)OC[C@@H](C[NH+]2CCCCC2)O1	ZINC000000191960	355894679	/nfs/dbraw/zinc/89/46/79/355894679.db2.gz	GMGIMSPSNKVNFU-YPMHNXCESA-N	1	0	257.330	1.167	50	0		CDAARO
C[NH2+]CC(=O)Nc1ccc(Br)cc1C	ZINC000002641109	355978245	/nfs/dbraw/zinc/97/82/45/355978245.db2.gz	MQXZQWZUFBPCKD-UHFFFAOYSA-N	1	0	257.131	1.915	50	0		CDAARO
Cc1ccc(CNC(=S)NCC[NH+](C)C)cc1	ZINC000002853981	355984725	/nfs/dbraw/zinc/98/47/25/355984725.db2.gz	OVYAMHVRQUWWTE-UHFFFAOYSA-N	1	0	251.399	1.521	50	0		CDAARO
CCOC(=O)[C@@H]1CC2(CC[NH+](C)CC2)[N@@H+]2CCC[C@H]12	ZINC000004342650	356028283	/nfs/dbraw/zinc/02/82/83/356028283.db2.gz	IQJCIKOQCJLDKT-CHWSQXEVSA-N	1	0	266.385	1.498	50	0		CDAARO
CCCCc1nc(C)cc(N2CCC([NH3+])(CO)CC2)n1	ZINC000097377470	356102832	/nfs/dbraw/zinc/10/28/32/356102832.db2.gz	TZKCJGNASSINAB-UHFFFAOYSA-N	1	0	278.400	1.418	50	0		CDAARO
Cc1ccc(C(=O)C[n+]2ccc(N(C)C)cc2)cc1	ZINC000012406973	356298552	/nfs/dbraw/zinc/29/85/52/356298552.db2.gz	JCGRRCGNXUAPEU-UHFFFAOYSA-N	1	0	255.341	1.711	50	0		CDAARO
O=C(COc1ccc(Cl)cc1)N1CC[NH2+]CC1	ZINC000019335744	356481249	/nfs/dbraw/zinc/48/12/49/356481249.db2.gz	TYCJFZIWSCJVJW-UHFFFAOYSA-N	1	0	254.717	1.151	50	0		CDAARO
[NH3+]CCS[C@H]1CC(=O)N(c2cccc(Cl)c2)C1=O	ZINC000019765764	356501293	/nfs/dbraw/zinc/50/12/93/356501293.db2.gz	UFQLMUNSFFZSNH-JTQLQIEISA-N	1	0	284.768	1.664	50	0		CDAARO
COC(=O)[C@H](c1ccccc1Cl)N1CC[NH2+]CC1	ZINC000020268629	356533563	/nfs/dbraw/zinc/53/35/63/356533563.db2.gz	GYRDXASVBKXBHG-LBPRGKRZSA-N	1	0	268.744	1.459	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C	ZINC000020303290	356535585	/nfs/dbraw/zinc/53/55/85/356535585.db2.gz	VFHVHFHRDSQHTJ-VPOLOUISSA-N	1	0	255.362	1.245	50	0		CDAARO
Cc1cc(NC(=O)[C@@H](C)N(C)Cc2cnn(C)c2)on1	ZINC000022911379	356624132	/nfs/dbraw/zinc/62/41/32/356624132.db2.gz	SWPHOEJDBXBPTQ-SNVBAGLBSA-N	1	0	277.328	1.176	50	0		CDAARO
O=C(NCC1CC[NH+](CCO)CC1)c1ccncc1Cl	ZINC000330488511	356822275	/nfs/dbraw/zinc/82/22/75/356822275.db2.gz	KDSVPVOFJROPFY-UHFFFAOYSA-N	1	0	297.786	1.169	50	0		CDAARO
CC[NH+]1CCN(C(C)(C)CNC(=O)c2ccncc2)CC1	ZINC000036090079	356858342	/nfs/dbraw/zinc/85/83/42/356858342.db2.gz	AXRAVIJVTYCTRN-UHFFFAOYSA-N	1	0	290.411	1.228	50	0		CDAARO
[NH3+][C@@H]1CCCC[C@@H]1NC(=O)c1cccnc1Cl	ZINC000079440104	356996800	/nfs/dbraw/zinc/99/68/00/356996800.db2.gz	FQRIPXUPVIYTSF-ZJUUUORDSA-N	1	0	253.733	1.735	50	0		CDAARO
CCc1nnc(SCC(=O)NCC(C)(C)C[NH+](C)C)[nH]1	ZINC000055327307	357331595	/nfs/dbraw/zinc/33/15/95/357331595.db2.gz	NKONBHITGKIFOP-UHFFFAOYSA-N	1	0	299.444	1.163	50	0		CDAARO
C[N@@H+]1CC[C@@H](CNC(=O)COCc2ccccc2)C1	ZINC000066652972	357575908	/nfs/dbraw/zinc/57/59/08/357575908.db2.gz	SNACYYKNAXUOEJ-AWEZNQCLSA-N	1	0	262.353	1.271	50	0		CDAARO
CCOC(=O)N1CCC([NH2+][C@H](C)c2ncnn2CC)CC1	ZINC000065405643	357539109	/nfs/dbraw/zinc/53/91/09/357539109.db2.gz	FXMFTDAQOPUMIF-LLVKDONJSA-N	1	0	295.387	1.570	50	0		CDAARO
COCC(=O)N[C@H](CC(C)C)C1=CCC[N@H+](C)C1	ZINC000067771445	357626498	/nfs/dbraw/zinc/62/64/98/357626498.db2.gz	VYSRBBKKVAYDRA-CYBMUJFWSA-N	1	0	254.374	1.426	50	0		CDAARO
CCCCCC(=O)N1C[C@H]([NH3+])C[C@H]1C(=O)NC(C)C	ZINC000067790485	357627899	/nfs/dbraw/zinc/62/78/99/357627899.db2.gz	HLIQIGLFJRSSPY-NEPJUHHUSA-N	1	0	269.389	1.020	50	0		CDAARO
C[NH+]1CCC(CNS(=O)(=O)CCc2ccccc2)CC1	ZINC000022999747	357581829	/nfs/dbraw/zinc/58/18/29/357581829.db2.gz	GBTLTBGEVFRUKX-UHFFFAOYSA-N	1	0	296.436	1.490	50	0		CDAARO
C[N@@H+]1CCN2CCN(Cc3ccc4[nH]ccc4c3)C[C@@H]2C1	ZINC000067818798	357628802	/nfs/dbraw/zinc/62/88/02/357628802.db2.gz	WXNUPSQUGQXIEI-INIZCTEOSA-N	1	0	284.407	1.600	50	0		CDAARO
COc1ccccc1C(=O)NCC1CC[NH+](C)CC1	ZINC000023013654	357646565	/nfs/dbraw/zinc/64/65/65/357646565.db2.gz	LWPVVYUTGABBPZ-UHFFFAOYSA-N	1	0	262.353	1.767	50	0		CDAARO
CCCN1C[C@H]([NH2+]C2CSCCSC2)CC1=O	ZINC000067866781	357633406	/nfs/dbraw/zinc/63/34/06/357633406.db2.gz	DVCPCDCEULHHJP-SNVBAGLBSA-N	1	0	274.455	1.436	50	0		CDAARO
COc1ccc(-c2n[nH]cc2C[NH2+][C@H](C)CO)cc1	ZINC000067946238	357638664	/nfs/dbraw/zinc/63/86/64/357638664.db2.gz	IGFYNJGWZRIFOL-SNVBAGLBSA-N	1	0	261.325	1.556	50	0		CDAARO
CCOc1ccc(C[NH+]2CCC(C(N)=O)CC2)cc1OC	ZINC000004681937	357742127	/nfs/dbraw/zinc/74/21/27/357742127.db2.gz	JMLBQNTVJNGXLM-UHFFFAOYSA-N	1	0	292.379	1.791	50	0		CDAARO
Cc1cc(C2CCC2)nc(N2CCO[C@H](CC[NH3+])C2)n1	ZINC000071738692	357776544	/nfs/dbraw/zinc/77/65/44/357776544.db2.gz	ADLZXMMLWAGOQT-CYBMUJFWSA-N	1	0	276.384	1.607	50	0		CDAARO
COC(=O)c1ccc(C(=O)NC[C@@H](C(C)C)[NH+](C)C)cc1	ZINC000033244205	357806457	/nfs/dbraw/zinc/80/64/57/357806457.db2.gz	MUMRSGDJWGFOIQ-AWEZNQCLSA-N	1	0	292.379	1.789	50	0		CDAARO
C[N@@H+]1CCN(c2nccc(C3CCCC3)n2)C[C@@H]1CCO	ZINC000072433699	357835879	/nfs/dbraw/zinc/83/58/79/357835879.db2.gz	GNDOIOJMZRZDBZ-AWEZNQCLSA-N	1	0	290.411	1.637	50	0		CDAARO
O=C(c1ccc(F)c(F)c1)N1CC[N@@H+]2CCC[C@@H]2C1	ZINC000027932399	357946751	/nfs/dbraw/zinc/94/67/51/357946751.db2.gz	LQXRWIPBQPCNAH-LLVKDONJSA-N	1	0	266.291	1.885	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@@]2(C)CO)cc2c1OCCO2	ZINC000097105385	357968006	/nfs/dbraw/zinc/96/80/06/357968006.db2.gz	HRVHZNYRPYGGIJ-INIZCTEOSA-N	1	0	293.363	1.813	50	0		CDAARO
CC(C)[C@@H]1C[N@H+](C)CCN1Cc1cnc2cnccn12	ZINC000097139309	358185462	/nfs/dbraw/zinc/18/54/62/358185462.db2.gz	IORODTOPLZXVDA-AWEZNQCLSA-N	1	0	273.384	1.501	50	0		CDAARO
C[C@@H]1COCC[C@@H]1Nc1cc(C(N)=O)ccc1C[NH+](C)C	ZINC000195104703	358410803	/nfs/dbraw/zinc/41/08/03/358410803.db2.gz	BGRXQOKUDNGFGR-RISCZKNCSA-N	1	0	291.395	1.684	50	0		CDAARO
c1cc(N2CCCO[C@@H](C[NH+]3CCCCC3)C2)ncn1	ZINC000091594402	358519120	/nfs/dbraw/zinc/51/91/20/358519120.db2.gz	ZYVDRRAFUZVCMY-AWEZNQCLSA-N	1	0	276.384	1.558	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC([NH2+]CCCO)CC1	ZINC000036878925	358618294	/nfs/dbraw/zinc/61/82/94/358618294.db2.gz	YPKGICGAJFACJX-UHFFFAOYSA-N	1	0	258.362	1.358	50	0		CDAARO
Cc1ncnc(NC[C@@H](C)N2CC[NH+](C)CC2)c1C	ZINC000095381423	358690402	/nfs/dbraw/zinc/69/04/02/358690402.db2.gz	SRNJJOYEKLGICC-LLVKDONJSA-N	1	0	263.389	1.141	50	0		CDAARO
Cc1cc(C)nc(CNC(=O)CC[C@@H]2CCC[N@@H+](C)C2)n1	ZINC000095387655	358691187	/nfs/dbraw/zinc/69/11/87/358691187.db2.gz	AJNWRFMJQAQYAH-AWEZNQCLSA-N	1	0	290.411	1.832	50	0		CDAARO
CCc1cnc(N(C)C[C@@H]2CC[N@H+](CCOC)C2)nc1	ZINC000095388918	358692174	/nfs/dbraw/zinc/69/21/74/358692174.db2.gz	GMJFKIBGKPIQTD-AWEZNQCLSA-N	1	0	278.400	1.444	50	0		CDAARO
[NH3+]C[C@H]1CC[C@@H](C(=O)N[C@H]2C[C@H]2c2c(F)cccc2F)O1	ZINC000261998286	358725141	/nfs/dbraw/zinc/72/51/41/358725141.db2.gz	NGWPQOOVUIEPJD-PNZRWIHMSA-N	1	0	296.317	1.443	50	0		CDAARO
COc1cccc(NC(=O)NCCN2CC[NH+]=C2C)c1	ZINC000100228462	358823308	/nfs/dbraw/zinc/82/33/08/358823308.db2.gz	RJOBYBCBGUGMPD-UHFFFAOYSA-N	1	0	276.340	1.551	50	0		CDAARO
Cc1nc(C)c(CC(=O)N2[C@@H]3CC[C@H]2C[NH2+]CC3)s1	ZINC000097475671	358779269	/nfs/dbraw/zinc/77/92/69/358779269.db2.gz	CMNLRGVYKHTWCT-NEPJUHHUSA-N	1	0	279.409	1.655	50	0		CDAARO
CCc1nc(C)c(C(=O)N2[C@@H]3CC[C@H]2C[NH2+]CC3)o1	ZINC000097637896	358789479	/nfs/dbraw/zinc/78/94/79/358789479.db2.gz	VBCXNACJFNQMAQ-MNOVXSKESA-N	1	0	263.341	1.512	50	0		CDAARO
O=C(C1CCOCC1)N1CCN(c2cc[nH+]cc2)CC1	ZINC000097660385	358791015	/nfs/dbraw/zinc/79/10/15/358791015.db2.gz	YICMAVGWCUOPBI-UHFFFAOYSA-N	1	0	275.352	1.157	50	0		CDAARO
O[C@H]1CN(Cc2ccco2)C[C@@H]1[NH+]1CCCCC1	ZINC000097679960	358792917	/nfs/dbraw/zinc/79/29/17/358792917.db2.gz	JFNXTLSZEGBUGK-KBPBESRZSA-N	1	0	250.342	1.311	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1C(=O)NCCOCc1ccccc1	ZINC000097759335	358797318	/nfs/dbraw/zinc/79/73/18/358797318.db2.gz	KMRFAUGLSIZUGI-OAHLLOKOSA-N	1	0	276.380	1.804	50	0		CDAARO
O=C(C[C@H]1C[NH2+]CCO1)NCc1ccc2sccc2c1	ZINC000215944836	358911529	/nfs/dbraw/zinc/91/15/29/358911529.db2.gz	PJAQRHWJNIYTGE-ZDUSSCGKSA-N	1	0	290.388	1.896	50	0		CDAARO
CCNc1ncc(C[N@H+](C)CCc2ccccn2)cn1	ZINC000215095571	358874889	/nfs/dbraw/zinc/87/48/89/358874889.db2.gz	XEHYIQQPFVYFMO-UHFFFAOYSA-N	1	0	271.368	1.978	50	0		CDAARO
Cc1cc(CN2CCCO[C@H](Cn3cccn3)C2)on1	ZINC000215683988	358899331	/nfs/dbraw/zinc/89/93/31/358899331.db2.gz	GDUFXOWFIPJANU-AWEZNQCLSA-N	1	0	276.340	1.471	50	0		CDAARO
c1cncc(OC2CC[NH+](C[C@H]3CCOC3)CC2)c1	ZINC000215785847	358903266	/nfs/dbraw/zinc/90/32/66/358903266.db2.gz	NFTJJOQBIIHMFH-CYBMUJFWSA-N	1	0	262.353	1.961	50	0		CDAARO
CS[C@@H](C)CC[NH+]1CCN(Cc2noc(C)n2)CC1	ZINC000215806244	358904627	/nfs/dbraw/zinc/90/46/27/358904627.db2.gz	IEZOPCMOPDTJGQ-NSHDSACASA-N	1	0	284.429	1.637	50	0		CDAARO
CCNc1ncc(CN2CC[NH+](CCSC)CC2)cn1	ZINC000216346264	358938221	/nfs/dbraw/zinc/93/82/21/358938221.db2.gz	HZUULXFGHCMRER-UHFFFAOYSA-N	1	0	295.456	1.389	50	0		CDAARO
C[NH2+][C@H](C(=O)N(C)Cc1cc[nH]n1)c1ccccc1	ZINC000221338906	359237578	/nfs/dbraw/zinc/23/75/78/359237578.db2.gz	SIFGCALKPSZXCS-ZDUSSCGKSA-N	1	0	258.325	1.329	50	0		CDAARO
COc1cc(C[NH2+][C@@H]2CCCNC2=O)ccc1SC	ZINC000089429313	359909000	/nfs/dbraw/zinc/90/90/00/359909000.db2.gz	WRKAPYITLHZAOG-LLVKDONJSA-N	1	0	280.393	1.785	50	0		CDAARO
COC(=O)C[C@@H]1CN(Cc2cccc(N)c2)CCO1	ZINC000408519026	359911226	/nfs/dbraw/zinc/91/12/26/359911226.db2.gz	SSVSHNMPKLWXSX-CYBMUJFWSA-N	1	0	264.325	1.033	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)O[C@@H](C(=O)N(C)C)C(C)C	ZINC000408525644	359935922	/nfs/dbraw/zinc/93/59/22/359935922.db2.gz	NLQFVRDPQWXXCB-GXTWGEPZSA-N	1	0	286.416	1.654	50	0		CDAARO
CCOc1ccc(S(=O)(=O)N[C@H]2C[N@H+](C)C[C@H]2C)cc1	ZINC000257366166	359945342	/nfs/dbraw/zinc/94/53/42/359945342.db2.gz	MBJHXTYYLQUTOM-RISCZKNCSA-N	1	0	298.408	1.314	50	0		CDAARO
Cc1nnc([C@H](C)N2CCC[C@H]2Cn2cccn2)o1	ZINC000257365776	359945768	/nfs/dbraw/zinc/94/57/68/359945768.db2.gz	MCSQZTOYIQRHOU-JQWIXIFHSA-N	1	0	261.329	1.800	50	0		CDAARO
C[NH2+][C@H](CO)c1cc(OC)ccc1Br	ZINC000229296738	360070279	/nfs/dbraw/zinc/07/02/79/360070279.db2.gz	FBVIFOVPPRDLJE-SNVBAGLBSA-N	1	0	260.131	1.711	50	0		CDAARO
CCC(=O)N1CCC2(C[N@@H+](C3CCC3)C[C@@H]2CO)CC1	ZINC000409419825	360227100	/nfs/dbraw/zinc/22/71/00/360227100.db2.gz	SJICMASGQSVODM-CYBMUJFWSA-N	1	0	280.412	1.482	50	0		CDAARO
CC[N@H+](C1CN(C(=O)c2ccco2)C1)C1CCN(C)CC1	ZINC000409419963	360227689	/nfs/dbraw/zinc/22/76/89/360227689.db2.gz	FFSOUXOPWDPEIV-UHFFFAOYSA-N	1	0	291.395	1.520	50	0		CDAARO
C[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)COc1cccnc1	ZINC000248150743	360406796	/nfs/dbraw/zinc/40/67/96/360406796.db2.gz	UBARREXRIDERRP-LSDHHAIUSA-N	1	0	289.379	1.546	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000426389659	360662808	/nfs/dbraw/zinc/66/28/08/360662808.db2.gz	MGPZALJKKHYTGT-XLHUXQDVSA-N	1	0	285.391	1.632	50	0		CDAARO
Cc1c[nH]c([C@@H](C)NC(=O)c2cccc(OCC[NH3+])c2)n1	ZINC000426662453	360694301	/nfs/dbraw/zinc/69/43/01/360694301.db2.gz	QQOMSFDRGBNTEZ-LLVKDONJSA-N	1	0	288.351	1.547	50	0		CDAARO
Cc1nnc(SCCCNC(=O)[C@@H](C)[NH+](C)C)s1	ZINC000426424393	360668072	/nfs/dbraw/zinc/66/80/72/360668072.db2.gz	SDBAWIQMKOFBOG-MRVPVSSYSA-N	1	0	288.442	1.395	50	0		CDAARO
CCc1nnc(CNC(=O)C(C)(C)[NH+]2CCCC2)s1	ZINC000426667530	360694562	/nfs/dbraw/zinc/69/45/62/360694562.db2.gz	QIRCYLGCKVZKML-UHFFFAOYSA-N	1	0	282.413	1.591	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)CCCOc2ccccc2F)C1	ZINC000178570507	189127365	/nfs/dbraw/zinc/12/73/65/189127365.db2.gz	OHROSPFFAAPVMH-GFCCVEGCSA-N	1	0	280.343	1.792	50	0		CDAARO
Cc1cc(Cl)ccc1OCC(=O)NC[C@@H]1CCC[NH2+]1	ZINC000178714438	189139546	/nfs/dbraw/zinc/13/95/46/189139546.db2.gz	AAMDSAXHNZVJJW-LBPRGKRZSA-N	1	0	282.771	1.895	50	0		CDAARO
COc1cccc([C@@H](O)C[NH2+]Cc2cnn(C)c2)c1	ZINC000096481067	360862273	/nfs/dbraw/zinc/86/22/73/360862273.db2.gz	JIAFTBPSLOZTMD-AWEZNQCLSA-N	1	0	261.325	1.252	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)CCCc2ccc(Cl)cc2)C[C@H]1O	ZINC000426506010	360931530	/nfs/dbraw/zinc/93/15/30/360931530.db2.gz	ZDTBTRHNDIUTIA-ZIAGYGMSSA-N	1	0	296.798	1.583	50	0		CDAARO
O=C(Nc1cccc2c[nH]nc21)N1CC[C@H]2C[NH2+]C[C@H]21	ZINC000299794626	200875729	/nfs/dbraw/zinc/87/57/29/200875729.db2.gz	LSVZJQWTUPGREW-JOYOIKCWSA-N	1	0	271.324	1.389	50	0		CDAARO
C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NS(=O)(=O)c1cccnc1	ZINC000189149899	361254432	/nfs/dbraw/zinc/25/44/32/361254432.db2.gz	ZHHNCXTZCOTKBL-CHWSQXEVSA-N	1	0	297.424	1.480	50	0		CDAARO
Cn1c(C[NH3+])nnc1SCCCc1ccccc1	ZINC000109404163	361594228	/nfs/dbraw/zinc/59/42/28/361594228.db2.gz	LARIPIHMBBMUII-UHFFFAOYSA-N	1	0	262.382	1.999	50	0		CDAARO
COc1ccccc1CCNC(=O)[C@@H]1CC12CC[NH2+]CC2	ZINC000231327078	361599377	/nfs/dbraw/zinc/59/93/77/361599377.db2.gz	PXDHWNKSQQVQLS-AWEZNQCLSA-N	1	0	288.391	1.744	50	0		CDAARO
O=C(Nc1cnns1)N1CC[C@H](C[NH+]2CCCCC2)C1	ZINC000192355259	361656426	/nfs/dbraw/zinc/65/64/26/361656426.db2.gz	YUVZGVUMNWCWIX-LLVKDONJSA-N	1	0	295.412	1.878	50	0		CDAARO
CCn1c(C)[n+](CC)c2cc(S(=O)(=O)NC)ccc21	ZINC000015961613	364733354	/nfs/dbraw/zinc/73/33/54/364733354.db2.gz	HTRSQZKPDHFSJY-UHFFFAOYSA-N	1	0	282.389	1.185	50	0		CDAARO
NC(=O)c1ccc(C[NH2+]C[C@@H](O)c2ccccc2)s1	ZINC000089826357	366940968	/nfs/dbraw/zinc/94/09/68/366940968.db2.gz	TYMSAKNBNAXNCG-GFCCVEGCSA-N	1	0	276.361	1.670	50	0		CDAARO
C[C@H](O)[C@@H]1CCC[N@H+](C[C@H](O)c2ccc(F)cc2)C1	ZINC000089933491	366970467	/nfs/dbraw/zinc/97/04/67/366970467.db2.gz	XSSUNARJBJSOIC-LNSITVRQSA-N	1	0	267.344	1.952	50	0		CDAARO
Cc1cc(C(=O)NCCC[NH2+]Cc2cccnc2)n(C)n1	ZINC000090121823	367017204	/nfs/dbraw/zinc/01/72/04/367017204.db2.gz	OYIRSVBUXUCFCR-UHFFFAOYSA-N	1	0	287.367	1.033	50	0		CDAARO
CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1CCCN1CCOCC1	ZINC000245442410	367273540	/nfs/dbraw/zinc/27/35/40/367273540.db2.gz	WGQBRMVSMXMOIC-CVEARBPZSA-N	1	0	281.444	1.267	50	0		CDAARO
CCc1cc(N2CC[N@@H+]3CCCC[C@H]3C2)n2nccc2n1	ZINC000252139981	367277803	/nfs/dbraw/zinc/27/78/03/367277803.db2.gz	GNMJPRQHZGGWDA-AWEZNQCLSA-N	1	0	285.395	1.966	50	0		CDAARO
CC(C)c1ccc(CN2CC[NH+](CCO)CC2)cc1	ZINC000019606845	367347699	/nfs/dbraw/zinc/34/76/99/367347699.db2.gz	GNYZZGGDDFSNFI-UHFFFAOYSA-N	1	0	262.397	1.920	50	0		CDAARO
C[C@@H]1C[N@H+](C[C@H]2CCCO2)CC[C@@H]1NC(=O)NC(C)(C)C	ZINC000252477250	367545011	/nfs/dbraw/zinc/54/50/11/367545011.db2.gz	KVWQMJHJSBYUBJ-MCIONIFRSA-N	1	0	297.443	1.974	50	0		CDAARO
CC[C@H](C(=O)[O-])[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(C)C	ZINC000263569566	367964965	/nfs/dbraw/zinc/96/49/65/367964965.db2.gz	HNVHNBKCBFHQHL-FRRDWIJNSA-N	1	0	254.374	1.797	50	0		CDAARO
COC[C@@H]1CC[N@H+](Cc2ccc3c(c2)nnn3C)C1	ZINC000020352371	369961729	/nfs/dbraw/zinc/96/17/29/369961729.db2.gz	LSADPVDHHPVLJR-GFCCVEGCSA-N	1	0	260.341	1.437	50	0		CDAARO
O[C@@H](C[NH+]1CCC(c2nnc[nH]2)CC1)c1ccccc1F	ZINC000370235268	369988230	/nfs/dbraw/zinc/98/82/30/369988230.db2.gz	FIRXXKMKZIINAW-AWEZNQCLSA-N	1	0	290.342	1.857	50	0		CDAARO
Cc1n[nH]c(C)c1CCC(=O)N1CC[C@@H]2[NH2+]CCC[C@@H]2C1	ZINC000299771902	372750555	/nfs/dbraw/zinc/75/05/55/372750555.db2.gz	ZTNFHKMGZMGZDZ-HIFRSBDPSA-N	1	0	290.411	1.560	50	0		CDAARO
CO[C@]12CC[N@H+](Cc3ccc(CO)o3)[C@H]1C[C@H](O)CC2	ZINC000299770089	372750838	/nfs/dbraw/zinc/75/08/38/372750838.db2.gz	ZHNNHKNPDRAZKQ-BYCMXARLSA-N	1	0	281.352	1.276	50	0		CDAARO
COCCC[N@@H+]1CC[C@@H](CNC(=O)Cc2cc(C)no2)C1	ZINC000299778387	372755538	/nfs/dbraw/zinc/75/55/38/372755538.db2.gz	RUDUGWPLMIEXCK-ZDUSSCGKSA-N	1	0	295.383	1.000	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)N[C@H](c1nccn1C)C1CC1	ZINC000299800085	372770982	/nfs/dbraw/zinc/77/09/82/372770982.db2.gz	VRYZLWMIJMPUAN-AWEZNQCLSA-N	1	0	287.367	1.570	50	0		CDAARO
c1nnn2c1CO[C@H]1CCN(Cc3ccccn3)C[C@@H]12	ZINC000299800527	372771376	/nfs/dbraw/zinc/77/13/76/372771376.db2.gz	WRWRIBZMYYZZHL-KBPBESRZSA-N	1	0	271.324	1.019	50	0		CDAARO
CC[N@H+](C)C[C@]1(O)CCCN(CC2CCCCC2)C1=O	ZINC000012205489	284354111	/nfs/dbraw/zinc/35/41/11/284354111.db2.gz	AGWUNTCOTMTNGO-MRXNPFEDSA-N	1	0	282.428	1.872	50	0		CDAARO
CC(=O)Nc1ccc(OC[C@H](O)C[NH2+]C2CCCC2)cc1	ZINC000004320502	373672254	/nfs/dbraw/zinc/67/22/54/373672254.db2.gz	JBQPSRMRWULQNY-OAHLLOKOSA-N	1	0	292.379	1.917	50	0		CDAARO
CC[N@@H+]1CC[C@H]2[C@@H](C1)OCCN2C(=O)CC(F)(F)F	ZINC000253416357	373725222	/nfs/dbraw/zinc/72/52/22/373725222.db2.gz	IIEQZEFGDMADIB-VHSXEESVSA-N	1	0	280.290	1.260	50	0		CDAARO
CC(C)N1CCN(C(=O)c2cc3nc[nH]c3cc2F)CC1	ZINC000253419177	373728003	/nfs/dbraw/zinc/72/80/03/373728003.db2.gz	CMKLXXOCNRFDDQ-UHFFFAOYSA-N	1	0	290.342	1.868	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1C[C@@H](C)OC[C@@H]1c1ccccc1	ZINC000253432747	373748662	/nfs/dbraw/zinc/74/86/62/373748662.db2.gz	NKALIXWFNBCPJQ-KWCYVHTRSA-N	1	0	262.353	1.712	50	0		CDAARO
O=C1CCCN1C[C@@H](O)C[N@@H+]1CCC[C@H]1c1cccs1	ZINC000111682098	374199145	/nfs/dbraw/zinc/19/91/45/374199145.db2.gz	CSEQHERRWPUWGN-STQMWFEESA-N	1	0	294.420	1.868	50	0		CDAARO
OC1(C[NH2+]Cc2ccc3c(c2)OCCO3)CCOCC1	ZINC000112717008	374228065	/nfs/dbraw/zinc/22/80/65/374228065.db2.gz	CWRMMQDGEXXUPT-UHFFFAOYSA-N	1	0	279.336	1.089	50	0		CDAARO
CN(Cc1ccc(-n2cccn2)cc1)C(=O)[C@@H]1CCC[N@@H+]1C	ZINC000019770685	374786432	/nfs/dbraw/zinc/78/64/32/374786432.db2.gz	FQCVEYJKOIZPSZ-INIZCTEOSA-N	1	0	298.390	1.925	50	0		CDAARO
CS(=O)(=O)[C@H]1CCCC[C@@H]1[NH2+]Cc1cccnc1	ZINC000095427023	374927058	/nfs/dbraw/zinc/92/70/58/374927058.db2.gz	LNJMPFOYXYKXKJ-STQMWFEESA-N	1	0	268.382	1.527	50	0		CDAARO
CCN(Cc1ccccc1)C(=O)[C@@H](C)[N@@H+]1CC[C@@](C)(O)C1	ZINC000095431460	374932911	/nfs/dbraw/zinc/93/29/11/374932911.db2.gz	BCKSAFNNSDBULF-RHSMWYFYSA-N	1	0	290.407	1.880	50	0		CDAARO
Cc1cnn(-c2cc[nH+]cc2NCc2ncc[nH]2)c1	ZINC000095988532	375048704	/nfs/dbraw/zinc/04/87/04/375048704.db2.gz	RMJOMYFOKIJJGT-UHFFFAOYSA-N	1	0	254.297	1.911	50	0		CDAARO
COc1ccc(CNC(=O)C[NH2+][C@@H]2CCCSC2)cc1	ZINC000097084503	375146166	/nfs/dbraw/zinc/14/61/66/375146166.db2.gz	DTIXNKNKTGHZLK-CYBMUJFWSA-N	1	0	294.420	1.797	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C[C@H](O)CO[C@H](C)c1ccccc1	ZINC000097160007	375150325	/nfs/dbraw/zinc/15/03/25/375150325.db2.gz	QGUQJSCGBZWWNI-CJNGLKHVSA-N	1	0	289.379	1.946	50	0		CDAARO
CC(C)OCCC[NH2+]C[C@@H](O)COc1ccccc1F	ZINC000002639010	375281315	/nfs/dbraw/zinc/28/13/15/375281315.db2.gz	JCCXOADOTPWIRW-CYBMUJFWSA-N	1	0	285.359	1.970	50	0		CDAARO
CCOc1cc(/C=C\C(=O)N2CC[C@H]([NH3+])C2)ccc1OC	ZINC000493236310	375428151	/nfs/dbraw/zinc/42/81/51/375428151.db2.gz	GSEIHNWMSZNIHE-VGVVRCBHSA-N	1	0	290.363	1.667	50	0		CDAARO
COc1ccc(OCCOC[C@@H](O)C[NH2+]C(C)C)cc1	ZINC000003055219	375523479	/nfs/dbraw/zinc/52/34/79/375523479.db2.gz	GNUILBHUSDZDSY-ZDUSSCGKSA-N	1	0	283.368	1.450	50	0		CDAARO
COc1cc(C(=O)NCC[NH+](C)C)cc(OC)c1C	ZINC000003304483	375636073	/nfs/dbraw/zinc/63/60/73/375636073.db2.gz	OPZOZYAVZSSZEJ-UHFFFAOYSA-N	1	0	266.341	1.304	50	0		CDAARO
C[C@@H](Cn1cccn1)[NH2+]CC1(N(C)C)CCCC1	ZINC000347211549	375823782	/nfs/dbraw/zinc/82/37/82/375823782.db2.gz	SSYGZBAZWSYPFI-ZDUSSCGKSA-N	1	0	250.390	1.736	50	0		CDAARO
O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)C1CCC1	ZINC000032247964	375922321	/nfs/dbraw/zinc/92/23/21/375922321.db2.gz	GATVOHRMOMNXEC-INIZCTEOSA-N	1	0	288.391	1.804	50	0		CDAARO
CCNC(=O)NC(=O)C[N@@H+]1CC[C@@H]2CCCC[C@H]2C1	ZINC000242389256	376021431	/nfs/dbraw/zinc/02/14/31/376021431.db2.gz	ZVNGGNLCNZEFBK-RYUDHWBXSA-N	1	0	267.373	1.344	50	0		CDAARO
Cc1ccc(CC(=O)N2CCCC[C@@H]2[C@H](C)[NH3+])cn1	ZINC000262749560	190061688	/nfs/dbraw/zinc/06/16/88/190061688.db2.gz	MCZSCKWEJQOHIS-GXTWGEPZSA-N	1	0	261.369	1.661	50	0		CDAARO
C[C@@H]1CN(Cc2cncs2)CC[N@@H+]1CC(C)(C)O	ZINC000188888104	377102328	/nfs/dbraw/zinc/10/23/28/377102328.db2.gz	HUBQMJXAXHABDM-LLVKDONJSA-N	1	0	269.414	1.420	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CNC(=O)c2cnc3ccccc3n2)C1	ZINC000170981316	378074058	/nfs/dbraw/zinc/07/40/58/378074058.db2.gz	NTATWGMGUYWZGN-LBPRGKRZSA-N	1	0	284.363	1.701	50	0		CDAARO
CNC(=O)c1cccc(CC[NH2+][C@H]2CCOC[C@@H]2C)c1	ZINC000192593839	378207913	/nfs/dbraw/zinc/20/79/13/378207913.db2.gz	PVROWHDGBXUMMR-WFASDCNBSA-N	1	0	276.380	1.603	50	0		CDAARO
O=C1CCCN1C[C@@H](O)C[NH2+]Cc1ccc(Cl)cc1	ZINC000001391316	284790010	/nfs/dbraw/zinc/79/00/10/284790010.db2.gz	PXTWJOJJTKNJBO-ZDUSSCGKSA-N	1	0	282.771	1.413	50	0		CDAARO
COc1ncc(C(=O)N2CC[C@@H]([NH+]3CCCCC3)C2)cn1	ZINC000426359551	533198238	/nfs/dbraw/zinc/19/82/38/533198238.db2.gz	LPHANEAJFLAKDH-CYBMUJFWSA-N	1	0	290.367	1.186	50	0		CDAARO
CC(C)=CCC[C@@H](C)[NH2+]CC(=O)N1CCOCC1	ZINC000095988826	256882118	/nfs/dbraw/zinc/88/21/18/256882118.db2.gz	QKTRJUKFYINVTN-CYBMUJFWSA-N	1	0	254.374	1.570	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CC[NH2+]C[C@H]2C)cc1C	ZINC000094345759	184786125	/nfs/dbraw/zinc/78/61/25/184786125.db2.gz	LPKFTHHJNNUUHS-TZMCWYRMSA-N	1	0	282.409	1.580	50	0		CDAARO
Cc1cnn(CCCNC(=O)CCC[NH+]2CCCCC2)c1	ZINC000095364281	184954884	/nfs/dbraw/zinc/95/48/84/184954884.db2.gz	GFHASVPLOLKYDB-UHFFFAOYSA-N	1	0	292.427	1.964	50	0		CDAARO
CCn1ncnc1[C@H](C)NC(=O)CC1CC[NH+](CC)CC1	ZINC000095387854	184962156	/nfs/dbraw/zinc/96/21/56/184962156.db2.gz	IDRMNYVLFBSWSD-LBPRGKRZSA-N	1	0	293.415	1.597	50	0		CDAARO
Cc1cn2nc(N3CCC[N@@H+](C)CC3)sc2n1	ZINC000026691439	390250038	/nfs/dbraw/zinc/25/00/38/390250038.db2.gz	ZSYCQIQZXVZPCO-UHFFFAOYSA-N	1	0	251.359	1.241	50	0		CDAARO
O[C@@H](C[NH2+]CCCN1CCOCC1)c1ccccc1	ZINC000001602639	169723291	/nfs/dbraw/zinc/72/32/91/169723291.db2.gz	JPEWJEYYSKQDIB-HNNXBMFYSA-N	1	0	264.369	1.032	50	0		CDAARO
COCCC(=O)N[C@@H]1CC[N@H+](CC2CCCC2)C1	ZINC000096431849	390520384	/nfs/dbraw/zinc/52/03/84/390520384.db2.gz	KNLYSNSTEJJBBP-CYBMUJFWSA-N	1	0	254.374	1.404	50	0		CDAARO
CCCC(=O)N1CCC2(CC1)[NH2+]CCc1nc[nH]c12	ZINC000067884935	390577269	/nfs/dbraw/zinc/57/72/69/390577269.db2.gz	IURFGNWUUZKXLB-UHFFFAOYSA-N	1	0	262.357	1.173	50	0		CDAARO
CC(C)[N@H+](C)CCNS(=O)(=O)c1cccc(F)c1	ZINC000097103200	390791386	/nfs/dbraw/zinc/79/13/86/390791386.db2.gz	VEQVNTNLMNIZJF-UHFFFAOYSA-N	1	0	274.361	1.444	50	0		CDAARO
CC(C)NC(=O)C[NH2+]Cc1cn(C)nc1-c1ccncc1	ZINC000097159689	390800986	/nfs/dbraw/zinc/80/09/86/390800986.db2.gz	XKBLXHXDRLPIKN-UHFFFAOYSA-N	1	0	287.367	1.096	50	0		CDAARO
Cc1cnc(N2CCN(C[C@H]3CCC[N@@H+](C)C3)CC2)nc1	ZINC000095357009	390910812	/nfs/dbraw/zinc/91/08/12/390910812.db2.gz	UXXDDNGXXXOFGC-HNNXBMFYSA-N	1	0	289.427	1.249	50	0		CDAARO
COC(=O)[C@@]1(C)CCN(C(=O)[C@@H](C)[NH+]2CCCCCC2)C1	ZINC000089420055	392724634	/nfs/dbraw/zinc/72/46/34/392724634.db2.gz	JGBGDARDYKHYAG-CJNGLKHVSA-N	1	0	296.411	1.663	50	0		CDAARO
COCC[N@H+](C)C[C@@H]1CCCN1c1nccc(OC)n1	ZINC000095944991	393154494	/nfs/dbraw/zinc/15/44/94/393154494.db2.gz	DLYMNYSETDKNPA-LBPRGKRZSA-N	1	0	280.372	1.032	50	0		CDAARO
CNC(=O)[C@@H]1CCCC[C@@H]1[NH2+]CCCCCOC	ZINC000097165602	397981988	/nfs/dbraw/zinc/98/19/88/397981988.db2.gz	MXPQGYVWEFYRFN-OLZOCXBDSA-N	1	0	256.390	1.698	50	0		CDAARO
Cc1n[nH]cc1C[N@@H+]1CCC[C@H](CN2CCOCC2)C1	ZINC000093042520	147032469	/nfs/dbraw/zinc/03/24/69/147032469.db2.gz	WXOQPYJDFUUHPF-CQSZACIVSA-N	1	0	278.400	1.262	50	0		CDAARO
Cn1cc(CCC[NH2+][C@H]2CCCC[C@H]2S(C)(=O)=O)cn1	ZINC000182768014	148265841	/nfs/dbraw/zinc/26/58/41/148265841.db2.gz	WLNSXVGBLRFKGU-UONOGXRCSA-N	1	0	299.440	1.298	50	0		CDAARO
COc1cc2c(cc1OC)[C@@](C)(C(C)(C)O)[NH2+]CC2	ZINC000000129466	286260116	/nfs/dbraw/zinc/26/01/16/286260116.db2.gz	HEBRQFXLIJBZQU-HNNXBMFYSA-N	1	0	265.353	1.836	50	0		CDAARO
CCO[C@H]1C[C@H](O)C12CCN(C(=O)C1([NH3+])CCCC1)CC2	ZINC000262477401	286543271	/nfs/dbraw/zinc/54/32/71/286543271.db2.gz	QKNQMCAIJVEOQQ-STQMWFEESA-N	1	0	296.411	1.036	50	0		CDAARO
CC(C)CC[NH+](CCC(C)C)C(CO)(CO)CO	ZINC000002334905	169786521	/nfs/dbraw/zinc/78/65/21/169786521.db2.gz	FBEJXAVMTLUBOC-UHFFFAOYSA-N	1	0	261.406	1.096	50	0		CDAARO
O=S(=O)(CC[C@H]1CCCC[NH2+]1)c1ccccc1	ZINC000003882657	169919897	/nfs/dbraw/zinc/91/98/97/169919897.db2.gz	ACPAJXSEQAMCLG-GFCCVEGCSA-N	1	0	253.367	1.993	50	0		CDAARO
CCS(=O)(=O)N1CCC([N@H+]2C[C@H](C)C[C@H](C)C2)CC1	ZINC000004745382	170010059	/nfs/dbraw/zinc/01/00/59/170010059.db2.gz	BAXBNFXLWWMJOV-BETUJISGSA-N	1	0	288.457	1.778	50	0		CDAARO
Cn1nnnc1SCCC[NH2+]Cc1cccs1	ZINC000004993800	170051539	/nfs/dbraw/zinc/05/15/39/170051539.db2.gz	JMDVEQSZDLZFJT-UHFFFAOYSA-N	1	0	269.399	1.544	50	0		CDAARO
CC[N@@H+]1CCC[C@H](NC(=O)c2cc(N)ccc2OC)C1	ZINC000005509794	170105876	/nfs/dbraw/zinc/10/58/76/170105876.db2.gz	DLIRWCUMIAJQJA-LBPRGKRZSA-N	1	0	277.368	1.492	50	0		CDAARO
[NH3+]CCCCC[C@@]1(c2ccc(Cl)cc2)NC(=O)NC1=O	ZINC000006658168	170223272	/nfs/dbraw/zinc/22/32/72/170223272.db2.gz	SSGGLJNBVJJIDW-AWEZNQCLSA-N	1	0	295.770	1.894	50	0		CDAARO
CCOC(=O)c1ccc(OC[C@@H](O)C[NH+]2CCCC2)cc1	ZINC000007003923	170261397	/nfs/dbraw/zinc/26/13/97/170261397.db2.gz	QSIJDHUHRZXWCM-AWEZNQCLSA-N	1	0	293.363	1.699	50	0		CDAARO
COc1cc(OC)c(OC)cc1C[NH2+]C[C@H](C)O	ZINC000008497911	170338043	/nfs/dbraw/zinc/33/80/43/170338043.db2.gz	QFSGNPGPNXEZOJ-VIFPVBQESA-N	1	0	255.314	1.183	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2ccc(C)c(C)c2)CC1	ZINC000020608825	171267489	/nfs/dbraw/zinc/26/74/89/171267489.db2.gz	JFVVGCVZFMGUEL-UHFFFAOYSA-N	1	0	275.396	1.879	50	0		CDAARO
Cc1cc(CNC(=O)N[C@H](C)C2=CC[N@H+](C)CC2)n(C)n1	ZINC000285411464	196276355	/nfs/dbraw/zinc/27/63/55/196276355.db2.gz	MSDCBRPAOQSTPM-GFCCVEGCSA-N	1	0	291.399	1.178	50	0		CDAARO
Cc1cc([C@@H]2CCCN2C(=O)[C@H]2CCC[NH2+]C2)on1	ZINC000037820268	173772166	/nfs/dbraw/zinc/77/21/66/173772166.db2.gz	IKWLZMPEZQXATI-RYUDHWBXSA-N	1	0	263.341	1.646	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1cc(=O)[nH]c2ccccc21	ZINC000039975619	174180427	/nfs/dbraw/zinc/18/04/27/174180427.db2.gz	LMNSBMUUWLZQPY-LBPRGKRZSA-N	1	0	299.374	1.742	50	0		CDAARO
c1ccc(-n2nnnc2SC2CC[NH2+]CC2)cc1	ZINC000043501254	175058494	/nfs/dbraw/zinc/05/84/94/175058494.db2.gz	OQKJGZUOJDNYKF-UHFFFAOYSA-N	1	0	261.354	1.506	50	0		CDAARO
CNc1ccccc1C(=O)NC[C@H]1CCC[N@H+](C)C1	ZINC000044559393	175204049	/nfs/dbraw/zinc/20/40/49/175204049.db2.gz	SQGFDXDOPPRBQH-GFCCVEGCSA-N	1	0	261.369	1.800	50	0		CDAARO
Cc1nsc(NC(=O)N2CCC[C@H](C[NH3+])C2)n1	ZINC000055119698	175570600	/nfs/dbraw/zinc/57/06/00/175570600.db2.gz	YZJDZCUUZDUXTK-MRVPVSSYSA-N	1	0	255.347	1.049	50	0		CDAARO
CC(C)C[C@@H]([NH3+])C(=O)NCc1cn2ccccc2n1	ZINC000071755098	176260717	/nfs/dbraw/zinc/26/07/17/176260717.db2.gz	GFYMIKIQJWJFBS-GFCCVEGCSA-N	1	0	260.341	1.324	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(C(=O)c2cc(C3CC3)n[nH]2)CC1	ZINC000072147727	176325817	/nfs/dbraw/zinc/32/58/17/176325817.db2.gz	QRDOIOWRQSMEDB-LBPRGKRZSA-N	1	0	276.384	1.843	50	0		CDAARO
Cc1ccsc1CN(CC[NH+](C)C)C(=O)c1cn[nH]n1	ZINC000072151593	176327369	/nfs/dbraw/zinc/32/73/69/176327369.db2.gz	QNPWJBXWVLEJEX-UHFFFAOYSA-N	1	0	293.396	1.379	50	0		CDAARO
O[C@@H]1C[NH2+]CC[C@H]1CNc1ncccc1C(F)(F)F	ZINC000072457468	176405764	/nfs/dbraw/zinc/40/57/64/176405764.db2.gz	GLVRVFGNMVEUQT-WCBMZHEXSA-N	1	0	275.274	1.483	50	0		CDAARO
Cc1ccc2[nH]c(SC[C@H](O)C[NH+](C)C)nc2c1	ZINC000076556455	177037756	/nfs/dbraw/zinc/03/77/56/177037756.db2.gz	DLQIXZCOFLFBME-SNVBAGLBSA-N	1	0	265.382	1.886	50	0		CDAARO
C[N@@H+]1CC[C@H]2CN(C(=O)Cc3ccc(O)c(Cl)c3)C[C@H]21	ZINC000077407914	177264178	/nfs/dbraw/zinc/26/41/78/177264178.db2.gz	FDDOLQGOISSOIX-WCQYABFASA-N	1	0	294.782	1.751	50	0		CDAARO
COCCC[NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000008698518	260033178	/nfs/dbraw/zinc/03/31/78/260033178.db2.gz	VBSWFLDDFIIMGJ-NSHDSACASA-N	1	0	258.362	1.622	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]C[C@@H]2COC3(CCOCC3)O2)C1	ZINC000095991133	287791135	/nfs/dbraw/zinc/79/11/35/287791135.db2.gz	NZKLOQYHBFZNMP-FRRDWIJNSA-N	1	0	255.358	1.687	50	0		CDAARO
c1coc(C[NH2+][C@H]2CCCN(c3ncccn3)C2)c1	ZINC000011710982	275074781	/nfs/dbraw/zinc/07/47/81/275074781.db2.gz	UHSWGXPLTREWQR-LBPRGKRZSA-N	1	0	258.325	1.828	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[NH+]([C@H]2CCCC[C@H]2O)CC1	ZINC000049882562	275825064	/nfs/dbraw/zinc/82/50/64/275825064.db2.gz	HPEUFZJDMPYRGN-QWHCGFSZSA-N	1	0	284.400	1.843	50	0		CDAARO
CCOC(=O)N(C)C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1	ZINC000095976554	276281507	/nfs/dbraw/zinc/28/15/07/276281507.db2.gz	UQUUYHUOTSPQLV-KGLIPLIRSA-N	1	0	284.400	1.843	50	0		CDAARO
CN1C[C@@]2(CCC[N@H+](Cc3cnc[nH]3)CC2)OC1=O	ZINC000072168092	277201211	/nfs/dbraw/zinc/20/12/11/277201211.db2.gz	YDSBGQHPLBSSRB-ZDUSSCGKSA-N	1	0	264.329	1.216	50	0		CDAARO
CC(C)n1cnnc1CN(C)C[C@@H]1CCC[NH2+]C1	ZINC000077487171	278140597	/nfs/dbraw/zinc/14/05/97/278140597.db2.gz	FDQZWRMGOIXBRW-GFCCVEGCSA-N	1	0	251.378	1.290	50	0		CDAARO
CC(C)Cn1nc(C(=O)NC2CCCC2)c2c1CC[NH2+]C2	ZINC000299786276	279260457	/nfs/dbraw/zinc/26/04/57/279260457.db2.gz	QCNBQCWNIGQWHV-UHFFFAOYSA-N	1	0	290.411	1.857	50	0		CDAARO
Cc1cccc(N2CCC([N@@H+]3CCC[C@H]3C(N)=O)CC2)n1	ZINC000097096587	281224609	/nfs/dbraw/zinc/22/46/09/281224609.db2.gz	RSMPATXQWGSWGC-AWEZNQCLSA-N	1	0	288.395	1.309	50	0		CDAARO
C[NH+](C)C(C)(C)CNC(=O)N[C@@H]1CCC[C@@H]2OCC[C@@H]21	ZINC000089761763	289035225	/nfs/dbraw/zinc/03/52/25/289035225.db2.gz	MJZJAAIRQXMNAI-UPJWGTAASA-N	1	0	283.416	1.583	50	0		CDAARO
COc1cc([C@@H](C)[NH2+][C@H]2CCCN(C)C2=O)ccn1	ZINC000558149285	290381423	/nfs/dbraw/zinc/38/14/23/290381423.db2.gz	WDUHOCTWJYPJQA-PWSUYJOCSA-N	1	0	263.341	1.362	50	0		CDAARO
[NH3+]CC[C@H]1CN(Cc2cnc(-c3ccco3)nc2)CCO1	ZINC000426491572	295240747	/nfs/dbraw/zinc/24/07/47/295240747.db2.gz	RVEHQQRCCUWVIP-ZDUSSCGKSA-N	1	0	288.351	1.286	50	0		CDAARO
COc1cc(NCC[C@@H]2CCCOC2)nc(N)n1	ZINC000534579786	328311391	/nfs/dbraw/zinc/31/13/91/328311391.db2.gz	KIFPJVRRNLOEON-VIFPVBQESA-N	1	0	252.318	1.126	50	0		CDAARO
COCC1(CNC(=O)CC[C@@H]2CCCC[N@@H+]2C)CC1	ZINC000534586313	328315555	/nfs/dbraw/zinc/31/55/55/328315555.db2.gz	ZNMBJDCYQBFLIG-ZDUSSCGKSA-N	1	0	268.401	1.794	50	0		CDAARO
CCC[C@H](CNc1cc(OC)nc(N)n1)[NH+](C)C	ZINC000534587718	328316181	/nfs/dbraw/zinc/31/61/81/328316181.db2.gz	BWIYYCDAQYHGSN-SECBINFHSA-N	1	0	253.350	1.040	50	0		CDAARO
C[C@H]1CN(C(=O)c2ccc(-c3ccc(O)cn3)cc2)CC[NH2+]1	ZINC000534588319	328316526	/nfs/dbraw/zinc/31/65/26/328316526.db2.gz	MPQOZLVXAISSJT-LBPRGKRZSA-N	1	0	297.358	1.888	50	0		CDAARO
O=C([C@H]1CC[C@@H](O)CC1)N1CCC[C@@]2(CC[NH2+]C2)C1	ZINC000534589627	328317535	/nfs/dbraw/zinc/31/75/35/328317535.db2.gz	ZGDBMAWECNBMDR-GUTXKFCHSA-N	1	0	266.385	1.140	50	0		CDAARO
C[NH+](C)C1(CNC(=O)Cn2nccn2)CCCCCC1	ZINC000534643563	328329420	/nfs/dbraw/zinc/32/94/20/328329420.db2.gz	QSNPQQLZGJOFFT-UHFFFAOYSA-N	1	0	279.388	1.049	50	0		CDAARO
c1cnc2c(c1)cccc2OCC[NH2+][C@H]1CCOC1	ZINC000534652942	328338330	/nfs/dbraw/zinc/33/83/30/328338330.db2.gz	HOPPVQRBQZKNST-ZDUSSCGKSA-N	1	0	258.321	1.992	50	0		CDAARO
Cc1cccc2c1C(=O)N1C[C@H]([NH+](C)C)C[C@H]1C(=O)N2	ZINC000534658851	328341691	/nfs/dbraw/zinc/34/16/91/328341691.db2.gz	JNESBIXINHBCIQ-PWSUYJOCSA-N	1	0	273.336	1.092	50	0		CDAARO
O=C(CN1Cc2ccccc2C1)NC[C@@H]1CC[N@@H+](C2CC2)C1	ZINC000534659649	328342175	/nfs/dbraw/zinc/34/21/75/328342175.db2.gz	DEYUPVXLJWNRIV-AWEZNQCLSA-N	1	0	299.418	1.603	50	0		CDAARO
Cc1ccccc1N1CCC([NH2+][C@@H]2CCNC2=O)CC1	ZINC000534654320	328338891	/nfs/dbraw/zinc/33/88/91/328338891.db2.gz	QOCKLYNEPRTNBT-CQSZACIVSA-N	1	0	273.380	1.442	50	0		CDAARO
C[C@H](CCC(=O)NCc1cscn1)[NH+]1CCOCC1	ZINC000534673809	328349083	/nfs/dbraw/zinc/34/90/83/328349083.db2.gz	YBXUCJZFPACOFV-LLVKDONJSA-N	1	0	283.397	1.260	50	0		CDAARO
[NH3+]C[C@@H]1CCN(CC(=O)NCCc2cccc(Cl)c2)C1	ZINC000050248797	328392729	/nfs/dbraw/zinc/39/27/29/328392729.db2.gz	PRWSTNFPEQODDP-ZDUSSCGKSA-N	1	0	295.814	1.279	50	0		CDAARO
O=S1(=O)CCCN1c1cccc(C[NH2+][C@@H]2CCOC2)c1	ZINC000185090315	323381658	/nfs/dbraw/zinc/38/16/58/323381658.db2.gz	NJRHAAYTXKMAIF-CYBMUJFWSA-N	1	0	296.392	1.105	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(OCCC[NH3+])CC1	ZINC000032919543	326898533	/nfs/dbraw/zinc/89/85/33/326898533.db2.gz	YGIWHMMPMLSJEC-UHFFFAOYSA-N	1	0	258.362	1.751	50	0		CDAARO
[NH3+]CCCNC(=O)CCCNC(=O)OCc1ccccc1	ZINC001772575823	1159123249	/nfs/dbraw/zinc/12/32/49/1159123249.db2.gz	ILTUXNGLBPTQQX-UHFFFAOYSA-N	1	0	293.367	1.158	50	0		CDAARO
CCOc1cccc(OCC[N@H+]2C[C@@H]3[C@H](O)C[C@@H]3C2)c1	ZINC001772710631	1159444429	/nfs/dbraw/zinc/44/44/29/1159444429.db2.gz	YTEXLNDGWFLZPE-UHOFOFEASA-N	1	0	277.364	1.777	50	0		CDAARO
C[NH+](C)[C@H]1[C@@H]2OCC[C@@H]2[C@@H]1NC(=O)c1ccsc1	ZINC000219167095	482489094	/nfs/dbraw/zinc/48/90/94/482489094.db2.gz	LUBCHRLDGIOGOV-WRWGMCAJSA-N	1	0	266.366	1.195	50	0		CDAARO
CC(C)[C@@H](NC(=O)NCC1CC[NH2+]CC1)c1nccn1C	ZINC000670442970	482989307	/nfs/dbraw/zinc/98/93/07/482989307.db2.gz	HMTDTUAEQWRFQS-CYBMUJFWSA-N	1	0	293.415	1.416	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CC2(CO)CCC2)n1	ZINC000670456664	483035689	/nfs/dbraw/zinc/03/56/89/483035689.db2.gz	FEHZVUTYOILMNE-GFCCVEGCSA-N	1	0	251.374	1.641	50	0		CDAARO
Cc1ncn(CC[NH2+][C@H](C)CN(C)C(C)C)c1C	ZINC000670457314	483036213	/nfs/dbraw/zinc/03/62/13/483036213.db2.gz	ZGTHVUQOZGMSGU-GFCCVEGCSA-N	1	0	252.406	1.818	50	0		CDAARO
COc1coc(C[N@H+](C)CCC2(O)CCCC2)cc1=O	ZINC000670457198	483037399	/nfs/dbraw/zinc/03/73/99/483037399.db2.gz	ADXMNRRADCMEFX-UHFFFAOYSA-N	1	0	281.352	1.775	50	0		CDAARO
CCn1nc(C)c(C[NH2+]CCCNc2ncccn2)c1C	ZINC000083474380	483172831	/nfs/dbraw/zinc/17/28/31/483172831.db2.gz	HIUXRZIFNSYFRD-UHFFFAOYSA-N	1	0	288.399	1.902	50	0		CDAARO
COc1cc(CNC(=O)[C@H]2CCCC[NH2+]2)ccc1C	ZINC000096481212	533862655	/nfs/dbraw/zinc/86/26/55/533862655.db2.gz	RGJRZJPRTIEAMD-CYBMUJFWSA-N	1	0	262.353	1.762	50	0		CDAARO
C[C@@H](Cn1cccn1)NC(=O)C[N@H+](C)C1CCCC1	ZINC000222861842	534269292	/nfs/dbraw/zinc/26/92/92/534269292.db2.gz	VYBPLEKNBKGRDX-LBPRGKRZSA-N	1	0	264.373	1.262	50	0		CDAARO
Fc1cc(C[NH2+]CCN2CCOCC2)cc(F)c1F	ZINC000062705684	526296984	/nfs/dbraw/zinc/29/69/84/526296984.db2.gz	DONZMDCLDMMKJV-UHFFFAOYSA-N	1	0	274.286	1.526	50	0		CDAARO
Cc1nnc(NC[C@@H]2C[N@@H+](C)CCN2C)c2ccccc12	ZINC000068806716	526370332	/nfs/dbraw/zinc/37/03/32/526370332.db2.gz	SDXJTSRVBLNNCT-CYBMUJFWSA-N	1	0	285.395	1.596	50	0		CDAARO
Cn1nnnc1SCCC[NH2+]Cc1ccsc1	ZINC000004993854	527659892	/nfs/dbraw/zinc/65/98/92/527659892.db2.gz	JNDXPTLXJAWTTN-UHFFFAOYSA-N	1	0	269.399	1.544	50	0		CDAARO
C[C@@H]1C[C@H](c2ccc(NS(C)(=O)=O)cc2)CC[NH2+]1	ZINC000757211106	577036237	/nfs/dbraw/zinc/03/62/37/577036237.db2.gz	JFOKFYSYWJAASD-ZYHUDNBSSA-N	1	0	268.382	1.914	50	0		CDAARO
C[C@@]1([NH3+])CCCC[C@@H]1C(=O)NCCCc1cc(=O)[nH][nH]1	ZINC000888096791	617759542	/nfs/dbraw/zinc/75/95/42/617759542.db2.gz	QWIRLWFPQLTZKE-BXUZGUMPSA-N	1	0	280.372	1.072	50	0		CDAARO
C=CC(=O)NCC1CC[NH+](C2CCOCC2)CC1	ZINC000863971511	620885237	/nfs/dbraw/zinc/88/52/37/620885237.db2.gz	WGDCELLOBFMIFK-UHFFFAOYSA-N	1	0	252.358	1.180	50	0		CDAARO
Cc1scc(C(=O)N2CCC(O)(C[NH+](C)C)CC2)c1C	ZINC000585135342	1164216075	/nfs/dbraw/zinc/21/60/75/1164216075.db2.gz	COJPZKKSNQOTBY-UHFFFAOYSA-N	1	0	296.436	1.894	50	0		CDAARO
CNc1nc(N[C@H]2COC[C@H]2Cc2ccncc2)cc(C)[nH+]1	ZINC001704298661	1177678944	/nfs/dbraw/zinc/67/89/44/1177678944.db2.gz	AXTNVYIRLZCWJF-KGLIPLIRSA-N	1	0	299.378	1.891	50	0		CDAARO
CO[C@@H]1CCC[C@]12CCCN(C(=O)C1CC[NH2+]CC1)C2	ZINC001704297914	1177679372	/nfs/dbraw/zinc/67/93/72/1177679372.db2.gz	YMFGLPLPZNQBFS-GDBMZVCRSA-N	1	0	280.412	1.794	50	0		CDAARO
CSCC[NH+]1CCN(Cc2ccc(CO)o2)CC1	ZINC000952990587	729032149	/nfs/dbraw/zinc/03/21/49/729032149.db2.gz	ZPGRLHQVZWXWDZ-UHFFFAOYSA-N	1	0	270.398	1.253	50	0		CDAARO
CC(C)CC[N@@H+]1CCN(C2CCOCC2)C[C@H]1CCO	ZINC000299872903	728379516	/nfs/dbraw/zinc/37/95/16/728379516.db2.gz	CZDTVCJXOSLUGI-MRXNPFEDSA-N	1	0	284.444	1.580	50	0		CDAARO
C[NH+](C)CC1(CO)CCN(C(=O)[C@H]2CC2(C)C)CC1	ZINC000952989318	728473695	/nfs/dbraw/zinc/47/36/95/728473695.db2.gz	UQARXOPVZXHXIE-GFCCVEGCSA-N	1	0	268.401	1.195	50	0		CDAARO
OCCN(Cc1cccnc1)Cc1cccc2c1OCO2	ZINC000093085850	728473818	/nfs/dbraw/zinc/47/38/18/728473818.db2.gz	QPVZDRBCTIIDNX-UHFFFAOYSA-N	1	0	286.331	1.805	50	0		CDAARO
COc1c[nH]c(CN2C[C@H]([NH+](C)C)[C@@H](C3CC3)C2)cc1=O	ZINC000091255230	728591803	/nfs/dbraw/zinc/59/18/03/728591803.db2.gz	XIIHAZDSNBYWEC-KGLIPLIRSA-N	1	0	291.395	1.156	50	0		CDAARO
COc1ccc2ncn([C@H]3CCC[NH2+]C3)c(=O)c2c1	ZINC000258097572	729121628	/nfs/dbraw/zinc/12/16/28/729121628.db2.gz	GVYQNEFJGVUMPV-JTQLQIEISA-N	1	0	259.309	1.330	50	0		CDAARO
OC[C@H]1CCC[N@H+](CCNCc2cccc(O)c2Cl)C1	ZINC000952976177	729133985	/nfs/dbraw/zinc/13/39/85/729133985.db2.gz	USTFRNIOSIXXJU-LBPRGKRZSA-N	1	0	298.814	1.840	50	0		CDAARO
COc1ccc(C[C@@H](C)[NH+]2CCC(C(N)=O)CC2)cc1	ZINC000023282798	729145113	/nfs/dbraw/zinc/14/51/13/729145113.db2.gz	IYVDVINPGQXXBD-GFCCVEGCSA-N	1	0	276.380	1.824	50	0		CDAARO
Cc1nc(CNCc2cccc(CO)c2)n(C)c1C	ZINC000952984410	729351357	/nfs/dbraw/zinc/35/13/57/729351357.db2.gz	UXDRYWRJBZBZJE-UHFFFAOYSA-N	1	0	259.353	1.819	50	0		CDAARO
C[C@@H](O)C[NH+](Cc1ccc(F)c(F)c1)C[C@@H](C)O	ZINC000000757413	729805207	/nfs/dbraw/zinc/80/52/07/729805207.db2.gz	VTCDSSQEVGFXPI-NXEZZACHSA-N	1	0	259.296	1.528	50	0		CDAARO
CN(C)c1ccnc(C(=O)N[C@@H]2C[C@H]([NH3+])C2(C)C)c1	ZINC000864091918	729841413	/nfs/dbraw/zinc/84/14/13/729841413.db2.gz	JJPURZDWXFGCHD-NWDGAFQWSA-N	1	0	262.357	1.003	50	0		CDAARO
COc1ccc(CN2CCO[C@@H](CC[NH+](C)C)C2)c(F)c1	ZINC000012750453	730348344	/nfs/dbraw/zinc/34/83/44/730348344.db2.gz	LNLJEROAHRADAB-HNNXBMFYSA-N	1	0	296.386	1.987	50	0		CDAARO
CNc1nc(N[C@H]2COc3ccccc3C2)cc(C)[nH+]1	ZINC000380819815	730389937	/nfs/dbraw/zinc/38/99/37/730389937.db2.gz	BJDKHBXCYJEBJV-GFCCVEGCSA-N	1	0	270.336	1.086	50	0		CDAARO
CCN1CCCn2nc([C@H]3CCC[NH2+]C3)cc2C1=O	ZINC000675008695	899861797	/nfs/dbraw/zinc/86/17/97/899861797.db2.gz	IOCZNBPRSGDQQI-NSHDSACASA-N	1	0	262.357	1.216	50	0		CDAARO
COc1ccc(C[N@@H+]2CC[C@@]3(CCC(=O)N3)C2)c(OC)c1	ZINC000675017115	899872371	/nfs/dbraw/zinc/87/23/71/899872371.db2.gz	KBWMZGSOICICEB-INIZCTEOSA-N	1	0	290.363	1.558	50	0		CDAARO
Cc1nc[nH]c1CNC(=O)[C@H](C)[NH+]1CCCCC1	ZINC000426424207	902562403	/nfs/dbraw/zinc/56/24/03/902562403.db2.gz	GJWOETOZVPYHCX-NSHDSACASA-N	1	0	250.346	1.209	50	0		CDAARO
O=C(/C=C/c1c(F)cccc1F)N[C@@H]1COC2(C[NH2+]C2)C1	ZINC000952832846	910401127	/nfs/dbraw/zinc/40/11/27/910401127.db2.gz	SNXALYQQXVZJFH-YEZKRMTDSA-N	1	0	294.301	1.225	50	0		CDAARO
CCSc1ccccc1NC(=O)[C@@H]([NH3+])[C@@H](C)O	ZINC000952861723	910416917	/nfs/dbraw/zinc/41/69/17/910416917.db2.gz	JFIHPOKNWQTDIK-KCJUWKMLSA-N	1	0	254.355	1.445	50	0		CDAARO
Cc1csc(CN2C[C@H](C)O[C@]3(CC[NH2+]C3)C2)n1	ZINC000952881797	910447793	/nfs/dbraw/zinc/44/77/93/910447793.db2.gz	MZRYPVMOLHSCBM-AAEUAGOBSA-N	1	0	267.398	1.404	50	0		CDAARO
Cc1cc(N2CCC(C[N@@H+](CCO)C(C)C)CC2)ncn1	ZINC000952883741	910453788	/nfs/dbraw/zinc/45/37/88/910453788.db2.gz	XJBULQXUOYOXAT-UHFFFAOYSA-N	1	0	292.427	1.704	50	0		CDAARO
CC[C@H](O)C[NH+]1CCC(CNC(=O)c2ccoc2)CC1	ZINC000952867540	910463095	/nfs/dbraw/zinc/46/30/95/910463095.db2.gz	OITQUMUNNHLJAZ-AWEZNQCLSA-N	1	0	280.368	1.492	50	0		CDAARO
CC(C)=CC[NH+]1CCC(CNC(=O)[C@@H]2CCOC2)CC1	ZINC000952961859	910471307	/nfs/dbraw/zinc/47/13/07/910471307.db2.gz	DFUDSZFWQNKOJR-OAHLLOKOSA-N	1	0	280.412	1.817	50	0		CDAARO
C[N@@H+]1CC[C@@](C)(CNS(=O)(=O)CC2CCCC2)C1	ZINC000823754913	923551961	/nfs/dbraw/zinc/55/19/61/923551961.db2.gz	ACNNUAQFEOLLHM-ZDUSSCGKSA-N	1	0	274.430	1.438	50	0		CDAARO
CC[N@@H+]1CC[C@H](CNS(=O)(=O)CC2CCCC2)C1	ZINC000823104901	925673478	/nfs/dbraw/zinc/67/34/78/925673478.db2.gz	QSZFXRPUKBGOJU-CYBMUJFWSA-N	1	0	274.430	1.438	50	0		CDAARO
Cc1cc(C)n(CC[NH2+]C2Cc3ccccc3C2)c(=O)n1	ZINC000825130927	925853547	/nfs/dbraw/zinc/85/35/47/925853547.db2.gz	VVSUVKNJKAJISM-UHFFFAOYSA-N	1	0	283.375	1.617	50	0		CDAARO
CC1(C)C[N@H+](Cc2cccc(OCC(N)=O)c2)C[C@]1(C)O	ZINC000219576842	930883069	/nfs/dbraw/zinc/88/30/69/930883069.db2.gz	CSFPYACPFNENAY-INIZCTEOSA-N	1	0	292.379	1.144	50	0		CDAARO
CC(C)(C(=O)N1CC[C@H](CCO)C1)[NH+]1CCCCC1	ZINC000585129301	931014616	/nfs/dbraw/zinc/01/46/16/931014616.db2.gz	FDPWHICCCYXJSG-CYBMUJFWSA-N	1	0	268.401	1.482	50	0		CDAARO
O=c1ccncn1CC1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1	ZINC000585636801	932834304	/nfs/dbraw/zinc/83/43/04/932834304.db2.gz	NIDHMZWSMMDAKM-GJZGRUSLSA-N	1	0	291.395	1.259	50	0		CDAARO
COc1ccc(CN2CCO[C@H](CC[NH+](C)C)C2)c(F)c1	ZINC000012750459	935370552	/nfs/dbraw/zinc/37/05/52/935370552.db2.gz	LNLJEROAHRADAB-OAHLLOKOSA-N	1	0	296.386	1.987	50	0		CDAARO
C[N@H+](Cc1nc(C2CC2)no1)[C@@H]1C[C@@H]2C[C@H](O)C[C@@H]2C1	ZINC001529109960	968983286	/nfs/dbraw/zinc/98/32/86/968983286.db2.gz	HQEDBRCTJXHUGD-MPZDIEGVSA-N	1	0	277.368	1.928	50	0		CDAARO
C[NH2+]CC(=O)N1C[C@@H](c2ccccc2)O[C@@H](C(C)C)C1	ZINC001529159693	968997423	/nfs/dbraw/zinc/99/74/23/968997423.db2.gz	XQHTVAGRIBQNSW-CABCVRRESA-N	1	0	276.380	1.831	50	0		CDAARO
C[C@@H](C[N@H+](C)CCOCc1ccccc1)N1CCOCC1	ZINC001529168156	969001898	/nfs/dbraw/zinc/00/18/98/969001898.db2.gz	XBTDLXFEFVFFMU-INIZCTEOSA-N	1	0	292.423	1.856	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]C2(C(N)=O)CCCC2)n1	ZINC001506402061	975149991	/nfs/dbraw/zinc/14/99/91/975149991.db2.gz	HVWIHTVTRGVURD-LLVKDONJSA-N	1	0	264.373	1.276	50	0		CDAARO
CC[NH+](CC)C[C@@H]1CCCN1CCn1ccnc1	ZINC001506403667	975150157	/nfs/dbraw/zinc/15/01/57/975150157.db2.gz	UUZJUWRXRWUAAU-AWEZNQCLSA-N	1	0	250.390	1.689	50	0		CDAARO
CC(C)C[N@@H+]1CCN(c2ccncc2F)C[C@H]1CCO	ZINC001506416046	975155748	/nfs/dbraw/zinc/15/57/48/975155748.db2.gz	DBHMOTCFMOKFLW-CYBMUJFWSA-N	1	0	281.375	1.750	50	0		CDAARO
CC[C@@H](O)C[NH2+][C@H](CO)c1cc(F)c(F)c(F)c1	ZINC000096006505	185062970	/nfs/dbraw/zinc/06/29/70/185062970.db2.gz	FYZLTFMRGZHOMW-LDYMZIIASA-N	1	0	263.259	1.498	50	0		CDAARO
CC(C)(C)C(=O)NCc1ccccc1C[N@@H+]1CC[C@H](O)C1	ZINC000096006298	185063218	/nfs/dbraw/zinc/06/32/18/185063218.db2.gz	GBPKJYPUDXSDBN-HNNXBMFYSA-N	1	0	290.407	1.916	50	0		CDAARO
OCc1ccc(Cn2cc([C@H]3CCC[NH2+]C3)nn2)cc1	ZINC000095370306	398228915	/nfs/dbraw/zinc/22/89/15/398228915.db2.gz	ZDVGBCFIPPPMAT-AWEZNQCLSA-N	1	0	272.352	1.286	50	0		CDAARO
COc1ccc(C[C@@H](C)N2CC[NH+](C)CC2)c(OC)c1	ZINC000023280033	342088863	/nfs/dbraw/zinc/08/88/63/342088863.db2.gz	HGKPHBAXCFGQQU-CYBMUJFWSA-N	1	0	278.396	1.882	50	0		CDAARO
Cc1cccc(Cl)c1OCCOCC[N@H+](C)CCO	ZINC000022079111	342088921	/nfs/dbraw/zinc/08/89/21/342088921.db2.gz	BEPGSDDOQCFQHA-UHFFFAOYSA-N	1	0	287.787	1.968	50	0		CDAARO
COc1ccccc1N1CCN(C2CC[NH+](C)CC2)CC1	ZINC000004981280	342089085	/nfs/dbraw/zinc/08/90/85/342089085.db2.gz	HWHMLQYBEPTOHT-UHFFFAOYSA-N	1	0	289.423	1.911	50	0		CDAARO
O=C(CCN1CC[N@@H+]2CCCC[C@H]2C1)Nc1nccs1	ZINC000244874654	361867988	/nfs/dbraw/zinc/86/79/88/361867988.db2.gz	XFANRMMNJAONHR-LBPRGKRZSA-N	1	0	294.424	1.642	50	0		CDAARO
CO[C@H](C[NH3+])CC(=O)N(CC1CC1)c1ccccc1	ZINC000262811057	361876639	/nfs/dbraw/zinc/87/66/39/361876639.db2.gz	ULRSKKDTSAPFIK-AWEZNQCLSA-N	1	0	262.353	1.793	50	0		CDAARO
C[C@@H](C(=O)NC1CCCC1)[N@H+](C)CC1(C)COC1	ZINC000625788366	342198894	/nfs/dbraw/zinc/19/88/94/342198894.db2.gz	PLHDIXBTRMSAHZ-NSHDSACASA-N	1	0	254.374	1.402	50	0		CDAARO
c1ccc(NC[C@H]2CC[N@H+](C[C@@H]3CCOC3)C2)nc1	ZINC000065563930	361917155	/nfs/dbraw/zinc/91/71/55/361917155.db2.gz	SABUSLIXTPSIGI-KGLIPLIRSA-N	1	0	261.369	1.852	50	0		CDAARO
CC[C@H](C)[C@H]([NH3+])C(=O)N(C)Cc1cn(C)nc1C(C)C	ZINC000097234200	342205503	/nfs/dbraw/zinc/20/55/03/342205503.db2.gz	SWYRNDAZVAEZOZ-AAEUAGOBSA-N	1	0	280.416	1.875	50	0		CDAARO
Cc1ccnc(N2CCC[C@@H]2C[NH+]2C[C@@H](C)O[C@H](C)C2)n1	ZINC000253370826	361925331	/nfs/dbraw/zinc/92/53/31/361925331.db2.gz	WTYYIPVLLQOVJH-RBSFLKMASA-N	1	0	290.411	1.863	50	0		CDAARO
[NH2+]=C1c2c3c(sc2N[C@@H]2CCCCCN12)CCCC3	ZINC000000280793	342289825	/nfs/dbraw/zinc/28/98/25/342289825.db2.gz	ZRQFHFYNZCLUPJ-LBPRGKRZSA-N	1	0	275.421	1.487	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)c1cccc(N)n1	ZINC000221256378	342297849	/nfs/dbraw/zinc/29/78/49/342297849.db2.gz	LKSNJXWUEXPTRZ-UHFFFAOYSA-N	1	0	271.324	1.209	50	0		CDAARO
C[C@@H]1C[NH+](CCCNC(=O)c2ccncc2)C[C@@H](C)O1	ZINC000036391938	362048508	/nfs/dbraw/zinc/04/85/08/362048508.db2.gz	PGIRNMBDMYXKDG-CHWSQXEVSA-N	1	0	277.368	1.311	50	0		CDAARO
CC[C@@H](C)c1cc(C(=O)N2CC[C@H](C[NH3+])C2)on1	ZINC000178532380	362245901	/nfs/dbraw/zinc/24/59/01/362245901.db2.gz	GOXNRPXVIBQZBE-NXEZZACHSA-N	1	0	251.330	1.609	50	0		CDAARO
CC[C@@H]1COCCN1C(=O)NCc1nccn1CC(C)C	ZINC000084736531	362270691	/nfs/dbraw/zinc/27/06/91/362270691.db2.gz	HFYDRLXTJMHVQW-CYBMUJFWSA-N	1	0	294.399	1.860	50	0		CDAARO
C[N@@H+]1CC[C@@H](CN2CCN(c3ccccc3F)CC2)C1	ZINC000252488620	362387267	/nfs/dbraw/zinc/38/72/67/362387267.db2.gz	IVQLVIVGZQXYNI-CQSZACIVSA-N	1	0	277.387	1.899	50	0		CDAARO
Cc1cc(=O)n(CC[N@H+]2C[C@@H]3[C@@H]4CC[C@@H](C4)[C@@H]3C2)c(=O)[nH]1	ZINC000253536661	362435153	/nfs/dbraw/zinc/43/51/53/362435153.db2.gz	JQBVYYKZWXESKL-KPWCQOOUSA-N	1	0	289.379	1.235	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)N(CCO)Cc1ccccc1	ZINC000038075808	344988861	/nfs/dbraw/zinc/98/88/61/344988861.db2.gz	BYOLKGMQIZEQEE-UHFFFAOYSA-N	1	0	276.380	1.397	50	0		CDAARO
Cc1ccc(F)cc1C[NH2+]C[C@@H]1CN(C)CCN1C	ZINC000129072889	362498403	/nfs/dbraw/zinc/49/84/03/362498403.db2.gz	UKVHAJAPDKIUSB-OAHLLOKOSA-N	1	0	265.376	1.470	50	0		CDAARO
CC[NH+](CC)CCNC(=O)Nc1cc(C)ccn1	ZINC000097372760	185591169	/nfs/dbraw/zinc/59/11/69/185591169.db2.gz	GZORJIFKODCRLJ-UHFFFAOYSA-N	1	0	250.346	1.853	50	0		CDAARO
[NH3+][C@@H]1CCN(c2ccc3cccc(Cl)c3n2)C[C@H]1O	ZINC000082160868	136510404	/nfs/dbraw/zinc/51/04/04/136510404.db2.gz	PRWLGYIZNKNFBL-VXGBXAGGSA-N	1	0	277.755	1.787	50	0		CDAARO
CC[C@H]1COCCN1C(=O)N[C@H](C)C(C)(C)C[NH+](C)C	ZINC000085425490	179059588	/nfs/dbraw/zinc/05/95/88/179059588.db2.gz	CUXBSKDVLHMOAG-OLZOCXBDSA-N	1	0	285.432	1.783	50	0		CDAARO
C[C@@H](c1nc2ccccc2c(=O)[nH]1)N1CC[NH2+][C@@H](C)C1	ZINC000019927480	348746222	/nfs/dbraw/zinc/74/62/22/348746222.db2.gz	RSFRCTXPXJXUMD-QWRGUYRKSA-N	1	0	272.352	1.278	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N1CCC[C@H]1C[NH3+]	ZINC000104309911	185962786	/nfs/dbraw/zinc/96/27/86/185962786.db2.gz	AQUXTJZTGSIESX-NSHDSACASA-N	1	0	272.345	1.246	50	0		CDAARO
Cc1nc(C)c(C[NH2+]C2(CCO)CCOCC2)s1	ZINC000089559225	179816832	/nfs/dbraw/zinc/81/68/32/179816832.db2.gz	TVUXRTJPZNYAQU-UHFFFAOYSA-N	1	0	270.398	1.781	50	0		CDAARO
COCC[N@@H+]1CC[C@H](C(=O)N2C[C@@H]3CC=CC[C@@H]3C2)C1	ZINC000065376240	362948293	/nfs/dbraw/zinc/94/82/93/362948293.db2.gz	XXPUGQRCHBVYJJ-ZNMIVQPWSA-N	1	0	278.396	1.379	50	0		CDAARO
Cc1cc(NC[C@H](O)c2ccc(O)cc2)nc(N)[nH+]1	ZINC000091440831	180156935	/nfs/dbraw/zinc/15/69/35/180156935.db2.gz	LAZLWBBOIFQRLC-NSHDSACASA-N	1	0	260.297	1.218	50	0		CDAARO
COCCC[N@@H+]1CC[C@@H](Cc2cccc(C(N)=O)c2)C1	ZINC000091440208	180157048	/nfs/dbraw/zinc/15/70/48/180157048.db2.gz	IRPPIMAGEKBTTA-AWEZNQCLSA-N	1	0	276.380	1.686	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@@H]1NC(=O)c1cc(F)ccc1F	ZINC000091496490	180172147	/nfs/dbraw/zinc/17/21/47/180172147.db2.gz	MKIJMIQMGVEXRM-PELKAZGASA-N	1	0	254.280	1.835	50	0		CDAARO
CC/C(C)=C/CC[NH+]1CCC2(CC1)[C@H](O)C[C@@H]2OCCO	ZINC000091602999	180203018	/nfs/dbraw/zinc/20/30/18/180203018.db2.gz	NSFVPVJQTOFRFB-HFWZVKQJSA-N	1	0	297.439	1.957	50	0		CDAARO
COC(C)(C)C(=O)N1C[C@H]([NH+](C)C)[C@@H](C(C)C)C1	ZINC000091644660	180214640	/nfs/dbraw/zinc/21/46/40/180214640.db2.gz	JHLDLLUPFBTZAQ-NEPJUHHUSA-N	1	0	256.390	1.456	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCC(=O)NCCn2cccc2)C1	ZINC000091644485	180214703	/nfs/dbraw/zinc/21/47/03/180214703.db2.gz	BGYYKIDELRYNLD-CQSZACIVSA-N	1	0	263.385	1.726	50	0		CDAARO
CN(CC1([NH+]2CCOCC2)CCCCC1)c1ccncn1	ZINC000091649954	180216404	/nfs/dbraw/zinc/21/64/04/180216404.db2.gz	OBPUEFYLUDWKJA-UHFFFAOYSA-N	1	0	290.411	1.948	50	0		CDAARO
Cc1ccc(NCCCNc2cc(C)[nH+]c(N)n2)nc1	ZINC000091745240	180244253	/nfs/dbraw/zinc/24/42/53/180244253.db2.gz	DXRNPJNZFXAIHI-UHFFFAOYSA-N	1	0	272.356	1.985	50	0		CDAARO
Cc1cnn(CCC(=O)N2CCC([C@@H](C)[NH+](C)C)CC2)c1	ZINC000091860407	180275114	/nfs/dbraw/zinc/27/51/14/180275114.db2.gz	MZEANHWQIBINMZ-CQSZACIVSA-N	1	0	292.427	1.770	50	0		CDAARO
CCc1ccc(C[NH+]2CCC3(CC2)[C@H](O)C[C@@H]3O)o1	ZINC000091964802	180294180	/nfs/dbraw/zinc/29/41/80/180294180.db2.gz	NBHIYNVBRZFOOJ-OKILXGFUSA-N	1	0	265.353	1.550	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)NCCCOc1cccnc1	ZINC000091871446	180277088	/nfs/dbraw/zinc/27/70/88/180277088.db2.gz	KFQOOGSVUHDRQW-OAHLLOKOSA-N	1	0	291.395	1.841	50	0		CDAARO
COc1ccccc1C[C@@H]1CCC[N@@H+]([C@H](C)C(N)=O)C1	ZINC000106650559	186130491	/nfs/dbraw/zinc/13/04/91/186130491.db2.gz	WJTUHWFZJVXOFR-OLZOCXBDSA-N	1	0	276.380	1.824	50	0		CDAARO
O=C(NC[C@H]1CC[N@@H+](C2CC2)C1)c1cncc(O)c1	ZINC000109042541	186240646	/nfs/dbraw/zinc/24/06/46/186240646.db2.gz	DJUJGPJFFAGTRM-SNVBAGLBSA-N	1	0	261.325	1.001	50	0		CDAARO
O=S(=O)(NC[C@H]1CCC[NH2+]C1)c1ccc(F)cc1F	ZINC000036905541	363288510	/nfs/dbraw/zinc/28/85/10/363288510.db2.gz	KCUYQQWRLDANFQ-VIFPVBQESA-N	1	0	290.335	1.243	50	0		CDAARO
COCC1CC[NH+](CC[C@H]2CCS(=O)(=O)C2)CC1	ZINC000677686018	482749541	/nfs/dbraw/zinc/74/95/41/482749541.db2.gz	WGCNMHHBJUXWTM-ZDUSSCGKSA-N	1	0	275.414	1.170	50	0		CDAARO
[NH3+]CCS[C@H]1CC(=O)N(c2ccccc2)C1=O	ZINC000002816273	355983545	/nfs/dbraw/zinc/98/35/45/355983545.db2.gz	BPLRIIWVDGMZTA-JTQLQIEISA-N	1	0	250.323	1.010	50	0		CDAARO
OCC[NH2+]CCNc1ccnc2cc(Cl)ccc21	ZINC000001700328	355947967	/nfs/dbraw/zinc/94/79/67/355947967.db2.gz	XIVJRGMWNFYEQO-UHFFFAOYSA-N	1	0	265.744	1.882	50	0		CDAARO
COc1cccc(C[NH2+]CCCN2CCOCC2)c1OC	ZINC000002198671	355963275	/nfs/dbraw/zinc/96/32/75/355963275.db2.gz	OHLMZBLSLLSREM-UHFFFAOYSA-N	1	0	294.395	1.516	50	0		CDAARO
CCC(=O)N(c1ccccc1)C1(C(=O)OC)CC[NH2+]CC1	ZINC000006661542	356080624	/nfs/dbraw/zinc/08/06/24/356080624.db2.gz	HFNFODVRYCEIQL-UHFFFAOYSA-N	1	0	290.363	1.725	50	0	in-vitro	CDAARO
C[C@@H]([NH2+][C@@H](C)C(=O)NCc1cccs1)[C@@H]1CCCO1	ZINC000097374216	356094700	/nfs/dbraw/zinc/09/47/00/356094700.db2.gz	ZJBZFEDVJDBBQK-MDZLAQPJSA-N	1	0	282.409	1.910	50	0		CDAARO
CS(=O)(=O)NCC[NH2+]C1(Cc2ccccc2)CCCC1	ZINC000097374704	356095630	/nfs/dbraw/zinc/09/56/30/356095630.db2.gz	IKPWOSLDHVLASB-UHFFFAOYSA-N	1	0	296.436	1.681	50	0		CDAARO
COC1CCN(CC(=O)N(C)CC(F)(F)F)CC1	ZINC000097476329	356163682	/nfs/dbraw/zinc/16/36/82/356163682.db2.gz	FZCJKVCZVFYVJX-UHFFFAOYSA-N	1	0	268.279	1.118	50	0		CDAARO
CNC(=O)NC(=O)[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1C	ZINC000014190363	356379454	/nfs/dbraw/zinc/37/94/54/356379454.db2.gz	DKLBPLAMIHXGIV-VXGBXAGGSA-N	1	0	277.368	1.798	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1ccc(NC(C)=O)cc1	ZINC000014022472	356370653	/nfs/dbraw/zinc/37/06/53/356370653.db2.gz	VIJBXOVJEVAACW-OAHLLOKOSA-N	1	0	289.379	1.859	50	0		CDAARO
COc1ccc(C(=O)NCC[NH+]2CCCCC2)cc1	ZINC000016216338	356433673	/nfs/dbraw/zinc/43/36/73/356433673.db2.gz	FXRZLFCGRINXOW-UHFFFAOYSA-N	1	0	262.353	1.911	50	0		CDAARO
C[C@@H](Cn1cccn1)[NH2+]Cc1cccc2c1OCCO2	ZINC000037154730	363492677	/nfs/dbraw/zinc/49/26/77/363492677.db2.gz	HEOZPMXUXPEZNN-LBPRGKRZSA-N	1	0	273.336	1.833	50	0		CDAARO
FC(F)(F)c1ccc(OCCN2CC[NH2+]CC2)nc1	ZINC000022942400	356625435	/nfs/dbraw/zinc/62/54/35/356625435.db2.gz	ZVFRHRVMTKRPPX-UHFFFAOYSA-N	1	0	275.274	1.384	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@H](C(N)=O)C2)cc2c1OCO2	ZINC000023281694	356638637	/nfs/dbraw/zinc/63/86/37/356638637.db2.gz	YFPBFMBQHWUFTF-NSHDSACASA-N	1	0	292.335	1.121	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@H]([NH2+][C@H]2CCOC2)C1	ZINC000088724583	366322612	/nfs/dbraw/zinc/32/26/12/366322612.db2.gz	DQCWXLJEMIMTFP-RYUDHWBXSA-N	1	0	270.373	1.764	50	0		CDAARO
CCNC(=O)CN(Cc1cc(OC)ccc1OC)C1CC1	ZINC000028980148	356729009	/nfs/dbraw/zinc/72/90/09/356729009.db2.gz	ZCBVFTCJNVBMOG-UHFFFAOYSA-N	1	0	292.379	1.804	50	0		CDAARO
CCOC(=O)CC1=C[NH2+]C2=CC=C(Br)CN12	ZINC000030678367	356752010	/nfs/dbraw/zinc/75/20/10/356752010.db2.gz	QGTULHRVMSMPIE-UHFFFAOYSA-N	1	0	285.141	1.820	50	0		CDAARO
COc1cc(OC)c([C@H]2CC[N@H+](C)C[C@@H]2O)c(OC)c1	ZINC000034202119	356810627	/nfs/dbraw/zinc/81/06/27/356810627.db2.gz	MGNNDUKLPNLAFW-RYUDHWBXSA-N	1	0	281.352	1.492	50	0		CDAARO
O=S1(=O)CCC([NH2+][C@H]2CCN(c3ccccc3)C2)CC1	ZINC000291101236	356822152	/nfs/dbraw/zinc/82/21/52/356822152.db2.gz	JHYOZSGDJVFXGX-AWEZNQCLSA-N	1	0	294.420	1.432	50	0		CDAARO
CC1(C(=O)NCc2ccc(F)cc2F)CC[NH2+]CC1	ZINC000034928775	356824643	/nfs/dbraw/zinc/82/46/43/356824643.db2.gz	OFOXWCLPPWKEOA-UHFFFAOYSA-N	1	0	268.307	1.971	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(C[C@H](O)c2ccccc2F)C[C@H]1C	ZINC000247245506	356964642	/nfs/dbraw/zinc/96/46/42/356964642.db2.gz	SSGNZJTYUPBOKE-WWGRRREGSA-N	1	0	296.386	1.246	50	0		CDAARO
Cc1cc(C(=O)NCC[N@H+]2CCC[C@@H](C)C2)[nH]n1	ZINC000048963391	357201376	/nfs/dbraw/zinc/20/13/76/357201376.db2.gz	LQWLFZCZJPNENN-SNVBAGLBSA-N	1	0	250.346	1.180	50	0		CDAARO
CC(C)[C@H](C(=O)Nc1cccc2c1OCC(=O)N2)[NH+](C)C	ZINC000290529425	357210417	/nfs/dbraw/zinc/21/04/17/357210417.db2.gz	HUHQYJJHRQVQPI-CYBMUJFWSA-N	1	0	291.351	1.542	50	0		CDAARO
CCCc1cc(C(=O)N2CCC([NH2+]C)CC2)[nH]n1	ZINC000055041989	357327473	/nfs/dbraw/zinc/32/74/73/357327473.db2.gz	VFKYUQVAMZLWRA-UHFFFAOYSA-N	1	0	250.346	1.186	50	0		CDAARO
CC[NH+]1CCN(C(=O)/C=C/c2ccc3c(c2)OCO3)CC1	ZINC000055378639	357332217	/nfs/dbraw/zinc/33/22/17/357332217.db2.gz	NRCKMILNOSXQBK-GQCTYLIASA-N	1	0	288.347	1.593	50	0		CDAARO
C[C@@H](c1nc(-c2cccs2)no1)N1CC[NH2+]CC1	ZINC000055460260	357333841	/nfs/dbraw/zinc/33/38/41/357333841.db2.gz	PXHCKHNTCUSXSA-VIFPVBQESA-N	1	0	264.354	1.764	50	0		CDAARO
C[C@@H]([NH3+])c1nnnn1-c1ccc(Br)cc1	ZINC000062494063	357475093	/nfs/dbraw/zinc/47/50/93/357475093.db2.gz	BFVKRBXIEDSSSR-ZCFIWIBFSA-N	1	0	268.118	1.445	50	0		CDAARO
Cc1ccccc1CS(=O)(=O)N[C@H](C[NH3+])CC(C)C	ZINC000095432093	357514476	/nfs/dbraw/zinc/51/44/76/357514476.db2.gz	VCTUFYCJGLUATH-AWEZNQCLSA-N	1	0	284.425	1.788	50	0		CDAARO
Cc1[nH]c(=O)[nH]c(=O)c1-c1cccc([C@@H](C)[NH+](C)C)c1	ZINC000065464775	357543523	/nfs/dbraw/zinc/54/35/23/357543523.db2.gz	KIDMLJFWMNQGPC-SNVBAGLBSA-N	1	0	273.336	1.661	50	0		CDAARO
CCc1ccccc1NC(=O)C(=O)NC[C@@H]1CC[N@H+](C)C1	ZINC000067559542	357612940	/nfs/dbraw/zinc/61/29/40/357612940.db2.gz	XELLVUDMMYZLEC-LBPRGKRZSA-N	1	0	289.379	1.255	50	0		CDAARO
COCC[NH+]1CCC(CNC(=O)c2ccccc2F)CC1	ZINC000023014190	357646272	/nfs/dbraw/zinc/64/62/72/357646272.db2.gz	JHYJFBDODLUCMX-UHFFFAOYSA-N	1	0	294.370	1.914	50	0		CDAARO
O=C(NCCc1ccc2c(c1)OCCO2)[C@H]1CCC[NH2+]C1	ZINC000019408367	358058293	/nfs/dbraw/zinc/05/82/93/358058293.db2.gz	IPMDRCKWFSHAMP-ZDUSSCGKSA-N	1	0	290.363	1.116	50	0		CDAARO
C[NH+]1CCN(C[C@H](O)c2ccccc2Cl)CC1	ZINC000019785052	358141289	/nfs/dbraw/zinc/14/12/89/358141289.db2.gz	MVWQUQFWZWEKDC-ZDUSSCGKSA-N	1	0	254.761	1.621	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+]Cc1cnc2c(C)cccn12	ZINC000097081563	358160817	/nfs/dbraw/zinc/16/08/17/358160817.db2.gz	GKHJGDIWWOJFHE-UHFFFAOYSA-N	1	0	275.352	1.932	50	0		CDAARO
NC(=O)[C@@]12CCC[C@@H](C[N@@H+](C3CCCCC3)C1)C2=O	ZINC000170626191	283340844	/nfs/dbraw/zinc/34/08/44/283340844.db2.gz	BNJKTRMYROUBFJ-NHYWBVRUSA-N	1	0	264.369	1.476	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+][C@H]1C[C@@H](C)N(C2CC2)C1	ZINC000097081556	358160251	/nfs/dbraw/zinc/16/02/51/358160251.db2.gz	DSJQXTFZCMWRTL-MNOVXSKESA-N	1	0	254.374	1.400	50	0		CDAARO
Cc1cc(CN(C)c2ncnc(N)c2Cl)no1	ZINC000277332409	366411223	/nfs/dbraw/zinc/41/12/23/366411223.db2.gz	FFCVGOQUKWPTOO-UHFFFAOYSA-N	1	0	253.693	1.645	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CCC[C@@H]2C[NH3+])c(F)c1	ZINC000195544555	358559855	/nfs/dbraw/zinc/55/98/55/358559855.db2.gz	CPTNCKMMCALMKZ-ZYHUDNBSSA-N	1	0	286.372	1.540	50	0		CDAARO
COc1ccc(Cl)cc1CNCC[NH2+]C[C@@H](C)O	ZINC000095098701	358677988	/nfs/dbraw/zinc/67/79/88/358677988.db2.gz	HRXVASVBRNYBHQ-SNVBAGLBSA-N	1	0	272.776	1.409	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)N(C)Cc2ncc[nH]2)CC1	ZINC000095372041	358687425	/nfs/dbraw/zinc/68/74/25/358687425.db2.gz	KSVLMTGPRIUHNZ-UHFFFAOYSA-N	1	0	264.373	1.489	50	0		CDAARO
CCc1cc(NCC2(C[NH+]3CCN(C)CC3)CC2)ncn1	ZINC000095389201	358691899	/nfs/dbraw/zinc/69/18/99/358691899.db2.gz	BVPSIBRFAVAORE-UHFFFAOYSA-N	1	0	289.427	1.479	50	0		CDAARO
CC(C)c1ccnc(NC[C@@H](C)N2CC[NH+](C)CC2)n1	ZINC000095390685	358692085	/nfs/dbraw/zinc/69/20/85/358692085.db2.gz	DGFMYOUHZOLGCK-CYBMUJFWSA-N	1	0	277.416	1.648	50	0		CDAARO
Cc1cc(C)n2ncc(CN3C[C@H]4CC[C@@H](C3)NC4=O)c2n1	ZINC000097288764	358765180	/nfs/dbraw/zinc/76/51/80/358765180.db2.gz	MOOMMEDTCTVGJG-OCCSQVGLSA-N	1	0	299.378	1.057	50	0		CDAARO
COCCc1noc(CC[C@H]2CCC[N@H+](C)C2)n1	ZINC000096137124	358709434	/nfs/dbraw/zinc/70/94/34/358709434.db2.gz	HSMKLIUUVBUEHY-LLVKDONJSA-N	1	0	253.346	1.533	50	0		CDAARO
C[N@@H+]1CCC[C@H]1CC(=O)NCCNc1cccnc1	ZINC000097394015	358773180	/nfs/dbraw/zinc/77/31/80/358773180.db2.gz	VNINAVWPEKPVBA-ZDUSSCGKSA-N	1	0	262.357	1.094	50	0		CDAARO
Cc1ncc(C[N@@H+]2CC[C@](O)(c3ccccc3)C2)n1C	ZINC000097527319	358782328	/nfs/dbraw/zinc/78/23/28/358782328.db2.gz	NAUVFAMBLDGFAW-MRXNPFEDSA-N	1	0	271.364	1.822	50	0		CDAARO
CN(C(=O)c1cnc2c(c1)CCC2)C1CC[NH2+]CC1	ZINC000097551475	358784488	/nfs/dbraw/zinc/78/44/88/358784488.db2.gz	BOELXCQIQPAJMB-UHFFFAOYSA-N	1	0	259.353	1.394	50	0		CDAARO
O[C@H]1COC2(C1)CC[NH+](Cc1cccc3nonc31)CC2	ZINC000097696170	358793733	/nfs/dbraw/zinc/79/37/33/358793733.db2.gz	KCNSBFIBRZPACH-GFCCVEGCSA-N	1	0	289.335	1.339	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH+]1CCC(c2ncon2)CC1	ZINC000215001761	358867885	/nfs/dbraw/zinc/86/78/85/358867885.db2.gz	BQSRYFOIXLHWOX-UHFFFAOYSA-N	1	0	261.329	1.789	50	0		CDAARO
[NH3+]CCc1cc(=O)oc2c1cc1c3c2CCCN3CCC1	ZINC000100765427	358835062	/nfs/dbraw/zinc/83/50/62/358835062.db2.gz	SKTIZSRPCXRDHX-UHFFFAOYSA-N	1	0	284.359	1.993	50	0	in-vitro	CDAARO
Cc1nc2cc(CNC(=O)c3ccc(CO)o3)ccc2[nH]1	ZINC000215163231	358877486	/nfs/dbraw/zinc/87/74/86/358877486.db2.gz	PGHVOXFBEPUUTD-UHFFFAOYSA-N	1	0	285.303	1.887	50	0		CDAARO
O=C1NCCCC[C@H]1[NH2+]Cc1ccc2c(c1)OCCO2	ZINC000084459191	358881127	/nfs/dbraw/zinc/88/11/27/358881127.db2.gz	LIYWJZLMMXEKJM-GFCCVEGCSA-N	1	0	276.336	1.216	50	0		CDAARO
COc1cc2c(cc1CN1CC[C@@H](O)C1)OCCCO2	ZINC000216321875	358936995	/nfs/dbraw/zinc/93/69/95/358936995.db2.gz	JMLASKZZVIJIAT-GFCCVEGCSA-N	1	0	279.336	1.423	50	0		CDAARO
Cc1ncn(CCNC(=O)c2ccc(O)c(C)c2)c1C	ZINC000216317147	358937285	/nfs/dbraw/zinc/93/72/85/358937285.db2.gz	VDRLTFRXXXSPFB-UHFFFAOYSA-N	1	0	273.336	1.944	50	0		CDAARO
Cc1nn(CC(=O)NCC[C@H]2CCC[N@H+]2C)c(C)c1C	ZINC000216447459	358945918	/nfs/dbraw/zinc/94/59/18/358945918.db2.gz	CRQSWYRWDPBYEM-CQSZACIVSA-N	1	0	278.400	1.409	50	0		CDAARO
O=C(Nc1cnn(CC(F)F)c1)C12CCC[NH+]1CCC2	ZINC000290480646	366529262	/nfs/dbraw/zinc/52/92/62/366529262.db2.gz	LWNSOAJGDLYMOF-UHFFFAOYSA-N	1	0	284.310	1.715	50	0		CDAARO
COc1cc(C(=O)NCCC[NH+](C)C)cc(OC)c1OC	ZINC000003182232	359050314	/nfs/dbraw/zinc/05/03/14/359050314.db2.gz	ZKPDTRSZIILDMM-UHFFFAOYSA-N	1	0	296.367	1.394	50	0		CDAARO
Cn1nc2n(c1=O)CC[N@@H+](CC1CCCCC1)CC2	ZINC000257175324	359053347	/nfs/dbraw/zinc/05/33/47/359053347.db2.gz	ARQRFDMXOVZGKX-UHFFFAOYSA-N	1	0	264.373	1.020	50	0		CDAARO
CCC[C@@H](NC(=O)c1ncccc1O)c1nccn1C	ZINC000220358130	359167398	/nfs/dbraw/zinc/16/73/98/359167398.db2.gz	AHPNNYADLSEJBJ-SNVBAGLBSA-N	1	0	274.324	1.792	50	0		CDAARO
CN(C[C@@]1(C)CC[N@H+](C)C1)C(=O)CSc1ccncc1	ZINC000221445902	359249344	/nfs/dbraw/zinc/24/93/44/359249344.db2.gz	XCRRWGANKWDPLO-HNNXBMFYSA-N	1	0	293.436	1.974	50	0		CDAARO
O=C1CC[N@H+](Cc2cccc(F)c2)CCOCCN1	ZINC000257180424	359216867	/nfs/dbraw/zinc/21/68/67/359216867.db2.gz	DNMRXUXNMLWGCW-UHFFFAOYSA-N	1	0	266.316	1.164	50	0		CDAARO
CCc1cnc(N[C@H]2[C@H]3CCO[C@H]3[C@@H]2[NH+](C)C)nc1	ZINC000223674152	359446396	/nfs/dbraw/zinc/44/63/96/359446396.db2.gz	AIFVOTAXASTWCE-YVECIDJPSA-N	1	0	262.357	1.168	50	0		CDAARO
Cc1noc(C)c1C[NH+]1CCC2(CC1)C[C@@H](O)CCO2	ZINC000257191068	359537209	/nfs/dbraw/zinc/53/72/09/359537209.db2.gz	OVOBDFLPVQFAGB-ZDUSSCGKSA-N	1	0	280.368	1.797	50	0		CDAARO
Nc1cc(N)[nH+]c(SCC(=O)NCc2ccccc2)n1	ZINC000000379439	359645105	/nfs/dbraw/zinc/64/51/05/359645105.db2.gz	VVFNLMRYMHBQCR-UHFFFAOYSA-N	1	0	289.364	1.050	50	0		CDAARO
O=C(C1CC1)N1CCC2(C[N@H+](C3CCC3)C[C@@H]2CO)CC1	ZINC000409419526	360226784	/nfs/dbraw/zinc/22/67/84/360226784.db2.gz	QMLGXQSCKSZLDF-CQSZACIVSA-N	1	0	292.423	1.482	50	0		CDAARO
Cc1nnc2n1CC[C@H]([N@H+](C)Cc1ccncc1)CC2	ZINC000409421258	360230677	/nfs/dbraw/zinc/23/06/77/360230677.db2.gz	YBRCJVGKIVFPQI-CQSZACIVSA-N	1	0	271.368	1.818	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1C(=O)NCc1cccnc1-n1ccnc1	ZINC000011819174	360333162	/nfs/dbraw/zinc/33/31/62/360333162.db2.gz	FABUJICTSTXQHT-AWEZNQCLSA-N	1	0	299.378	1.368	50	0		CDAARO
CO[C@H](C)CC(=O)N1CCC[C@H]1[C@H]1CCC[N@@H+]1C	ZINC000248157277	360416472	/nfs/dbraw/zinc/41/64/72/360416472.db2.gz	WAKQZSROWCVAAJ-UPJWGTAASA-N	1	0	254.374	1.497	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2nc(C)cs2)n1C	ZINC000426526437	360680277	/nfs/dbraw/zinc/68/02/77/360680277.db2.gz	PHNCECMIQASBLC-UHFFFAOYSA-N	1	0	269.399	1.592	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](NC(=O)N(C)Cc2nc(C)c[nH]2)C1	ZINC000426701321	360697833	/nfs/dbraw/zinc/69/78/33/360697833.db2.gz	ALDLWZOMYHDHTG-ZDUSSCGKSA-N	1	0	293.415	1.734	50	0		CDAARO
CC(C)(C)OC(=O)N1CCn2nc(C[NH3+])cc2C1	ZINC000238150116	360976918	/nfs/dbraw/zinc/97/69/18/360976918.db2.gz	WJSWOUUSRDNKIJ-UHFFFAOYSA-N	1	0	252.318	1.093	50	0		CDAARO
CN(CC(=O)NC(N)=O)C(c1ccccc1)c1ccccc1	ZINC000012819573	361238792	/nfs/dbraw/zinc/23/87/92/361238792.db2.gz	XEHOTRZHZAHMGK-UHFFFAOYSA-N	1	0	297.358	1.903	50	0		CDAARO
Cc1ccccc1CNC(=O)C[NH2+][C@@H](C)[C@@H]1CCCO1	ZINC000183086561	189346021	/nfs/dbraw/zinc/34/60/21/189346021.db2.gz	AOVOGUFCVXVSDS-ZFWWWQNUSA-N	1	0	276.380	1.768	50	0		CDAARO
CC(C)C[N@@H+]1CCN(Cc2ccc(CO)o2)C[C@H]1CCO	ZINC000104394501	361586728	/nfs/dbraw/zinc/58/67/28/361586728.db2.gz	YPRFIFCEQQMYLW-CQSZACIVSA-N	1	0	296.411	1.297	50	0		CDAARO
Cc1nc[nH]c1C[NH2+][C@@H]1CC(=O)N(CCc2ccccc2)C1	ZINC000012445736	361671595	/nfs/dbraw/zinc/67/15/95/361671595.db2.gz	JTPFPRUFGGQLJF-OAHLLOKOSA-N	1	0	298.390	1.651	50	0		CDAARO
COC(=O)CC[C@H](C)[NH2+]Cc1cccc(CO)c1	ZINC000089895313	366957914	/nfs/dbraw/zinc/95/79/14/366957914.db2.gz	RPEPMWQGMXLGQX-NSHDSACASA-N	1	0	251.326	1.610	50	0		CDAARO
COc1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)[NH2+]3)c(OC)n1	ZINC000222300966	189730313	/nfs/dbraw/zinc/73/03/13/189730313.db2.gz	FCEWPSCFPTUTCO-MNOVXSKESA-N	1	0	291.351	1.065	50	0		CDAARO
C[NH+]1CCN(c2ccccc2NC(=O)[C@@H]2CCCO2)CC1	ZINC000007779275	369261652	/nfs/dbraw/zinc/26/16/52/369261652.db2.gz	SESMRFKJLTTZTN-HNNXBMFYSA-N	1	0	289.379	1.556	50	0		CDAARO
COCC[NH+]1[C@@H](C)CN(Cc2ccnc(N)c2)C[C@@H]1C	ZINC000193446392	370493906	/nfs/dbraw/zinc/49/39/06/370493906.db2.gz	ZXCFLQMKDMIRQY-STQMWFEESA-N	1	0	278.400	1.205	50	0		CDAARO
COc1ccccc1C[NH2+]C[C@]1(OC)CCOC1	ZINC000122936428	371167766	/nfs/dbraw/zinc/16/77/66/371167766.db2.gz	XMBKFXTYUAZGCQ-CQSZACIVSA-N	1	0	251.326	1.590	50	0		CDAARO
CCc1nc(CN2C[C@H](O)[C@@H]([NH+]3CCCCC3)C2)cs1	ZINC000299767110	372749253	/nfs/dbraw/zinc/74/92/53/372749253.db2.gz	CRNWKARACGXCIZ-KBPBESRZSA-N	1	0	295.452	1.737	50	0		CDAARO
CC[N@H+](C)C(C)(C)CNC(=O)[C@H](C)n1cc(Cl)cn1	ZINC000299767642	372750868	/nfs/dbraw/zinc/75/08/68/372750868.db2.gz	IOPVHBPVEDEBME-JTQLQIEISA-N	1	0	286.807	1.944	50	0		CDAARO
C[C@H](c1nc2ccccc2c(=O)[nH]1)N1CC[NH2+][C@@H](C)C1	ZINC000299804312	372772477	/nfs/dbraw/zinc/77/24/77/372772477.db2.gz	RSFRCTXPXJXUMD-WDEREUQCSA-N	1	0	272.352	1.690	50	0		CDAARO
CCN(Cc1ccccc1Cl)C(=O)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000037808800	373375338	/nfs/dbraw/zinc/37/53/38/373375338.db2.gz	AHFSARJUDKKQTB-DGCLKSJQSA-N	1	0	282.771	1.411	50	0		CDAARO
COc1nccnc1C[NH2+][C@@H](CO)Cc1ccccc1	ZINC000253425479	373733033	/nfs/dbraw/zinc/73/30/33/373733033.db2.gz	UCZXWMZGLHBTSS-CYBMUJFWSA-N	1	0	273.336	1.178	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C[NH3+])cc1C	ZINC000111372842	374185080	/nfs/dbraw/zinc/18/50/80/374185080.db2.gz	ZVSGHBMLPSXTKD-GFCCVEGCSA-N	1	0	268.382	1.415	50	0		CDAARO
CC(C)OC[C@H](O)C[NH+]1CCN(c2ccc(F)cc2)CC1	ZINC000019938322	374829743	/nfs/dbraw/zinc/82/97/43/374829743.db2.gz	GNOJFUXZGOGSSY-MRXNPFEDSA-N	1	0	296.386	1.734	50	0		CDAARO
CCC[NH+]1CCN(Cc2cnn(-c3ccccc3)n2)CC1	ZINC000095395493	374901055	/nfs/dbraw/zinc/90/10/55/374901055.db2.gz	LOXOENGBFZHDRC-UHFFFAOYSA-N	1	0	285.395	1.795	50	0		CDAARO
Cn1cccc1C[NH2+][C@@]1(CO)CCc2ccccc21	ZINC000095429770	374930277	/nfs/dbraw/zinc/93/02/77/374930277.db2.gz	FPGSMUIJMNAOQH-MRXNPFEDSA-N	1	0	256.349	1.949	50	0		CDAARO
c1cn(CC2CC[NH+](CCc3ccncc3)CC2)nn1	ZINC000095435419	374936245	/nfs/dbraw/zinc/93/62/45/374936245.db2.gz	FFSGDPVYJGUTNE-UHFFFAOYSA-N	1	0	271.368	1.628	50	0		CDAARO
COC1(CNC(=O)N[C@H]2CC[C@@H]([NH+](C)C)C2)CCC1	ZINC000097055288	375142965	/nfs/dbraw/zinc/14/29/65/375142965.db2.gz	HZIBXRDLVHMJDC-NWDGAFQWSA-N	1	0	269.389	1.337	50	0		CDAARO
C[C@H](CNC(=O)N1CCCC1)[N@@H+]1CCC[C@@H](C)C1	ZINC000227125817	375448967	/nfs/dbraw/zinc/44/89/67/375448967.db2.gz	KFQPFGNDVRAERH-CHWSQXEVSA-N	1	0	253.390	1.912	50	0		CDAARO
COc1cc(C(=O)N2CCC[N@H+](C)CC2)cc(OC)c1C	ZINC000003310182	375637272	/nfs/dbraw/zinc/63/72/72/375637272.db2.gz	HEMRSBBIMGJATR-UHFFFAOYSA-N	1	0	292.379	1.790	50	0		CDAARO
COC[C@H](O)C[NH+]1CCN(c2cccc(C)c2)CC1	ZINC000031659678	375811888	/nfs/dbraw/zinc/81/18/88/375811888.db2.gz	TVXJHRJBMCTVJW-OAHLLOKOSA-N	1	0	264.369	1.124	50	0		CDAARO
COc1ccccc1/C=C\C[NH2+]CCN(C)OC	ZINC000606444630	375826284	/nfs/dbraw/zinc/82/62/84/375826284.db2.gz	OORBTHRUMIPJJZ-VURMDHGXSA-N	1	0	250.342	1.791	50	0		CDAARO
C[NH2+]C[C@H](C)C(=O)NC[C@H](O)c1ccccc1C	ZINC000262674921	190060959	/nfs/dbraw/zinc/06/09/59/190060959.db2.gz	TWGKNRHVDBBDJD-AAEUAGOBSA-N	1	0	250.342	1.000	50	0		CDAARO
Cc1nnc(CNC(=O)C(C)(C)[NH+]2CCCC2)s1	ZINC000426658492	377253873	/nfs/dbraw/zinc/25/38/73/377253873.db2.gz	UTDRTOSQGUGHCY-UHFFFAOYSA-N	1	0	268.386	1.337	50	0		CDAARO
CCCCOC(=O)N1CCN(c2ncccc2N)CC1	ZINC000002576052	378049605	/nfs/dbraw/zinc/04/96/05/378049605.db2.gz	ZUDVNFLWUOLCKR-UHFFFAOYSA-N	1	0	278.356	1.723	50	0		CDAARO
O=C1NC2(CC[NH2+]CC2)Nc2cc(Cl)ccc21	ZINC000034811770	284871997	/nfs/dbraw/zinc/87/19/97/284871997.db2.gz	RSZGETWKFNKOAQ-UHFFFAOYSA-N	1	0	251.717	1.575	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNC(=O)c2cc(F)ccc2O)C1	ZINC000096468338	532973174	/nfs/dbraw/zinc/97/31/74/532973174.db2.gz	WEHMPTJBMMZKKW-NSHDSACASA-N	1	0	296.342	1.229	50	0		CDAARO
O=C(CC[C@H]1CCC[N@H+](Cc2cnc[nH]2)C1)NC1CC1	ZINC000011663477	260050060	/nfs/dbraw/zinc/05/00/60/260050060.db2.gz	TXFJTQRKMJTBPQ-GFCCVEGCSA-N	1	0	276.384	1.681	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CCC(=O)NCCn1cccc1	ZINC000095390391	184964156	/nfs/dbraw/zinc/96/41/56/184964156.db2.gz	MWTMLHMFQSLGDO-AWEZNQCLSA-N	1	0	263.385	1.869	50	0		CDAARO
CC(C)(C)n1cc2c(n1)C(=O)CC1(CC[NH2+]CC1)O2	ZINC000040450074	390422593	/nfs/dbraw/zinc/42/25/93/390422593.db2.gz	SLXKRKVAXHFBEN-UHFFFAOYSA-N	1	0	263.341	1.726	50	0		CDAARO
C[N@H+](CC(=O)NCc1ccco1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C	ZINC000096419607	390513185	/nfs/dbraw/zinc/51/31/85/390513185.db2.gz	DNUXTISCYPNPDM-CFVMTHIKSA-N	1	0	292.379	1.641	50	0		CDAARO
CCS(=O)(=O)CC[NH2+][C@](C)(CO)C1CCCCC1	ZINC000096420071	390514376	/nfs/dbraw/zinc/51/43/76/390514376.db2.gz	PEVPZLZDDOOVEW-CYBMUJFWSA-N	1	0	277.430	1.342	50	0		CDAARO
COC[C@H](O)C[N@H+](C)C[C@H](O)c1ccc(Cl)cc1	ZINC000096424646	390515810	/nfs/dbraw/zinc/51/58/10/390515810.db2.gz	FFIDXSZSAZAVAS-OLZOCXBDSA-N	1	0	273.760	1.313	50	0		CDAARO
[NH3+]Cc1nnc2cc(-c3nc(C4CC4)no3)ccn21	ZINC000096516532	390533928	/nfs/dbraw/zinc/53/39/28/390533928.db2.gz	NEDNETWUPMHKJG-UHFFFAOYSA-N	1	0	256.269	1.115	50	0		CDAARO
CN(C(=O)[C@H](C[NH3+])c1ccc(F)cc1)[C@H]1CCOC1	ZINC000262048654	390543789	/nfs/dbraw/zinc/54/37/89/390543789.db2.gz	HBMDBNFNGXXBKE-QWHCGFSZSA-N	1	0	266.316	1.115	50	0		CDAARO
Cc1cccc(CS(=O)(=O)NCC2CC[NH+](C)CC2)c1	ZINC000022999777	390567353	/nfs/dbraw/zinc/56/73/53/390567353.db2.gz	FFWHMGOSOAHSPF-UHFFFAOYSA-N	1	0	296.436	1.756	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)COc2cccc(F)c2)C1	ZINC000178606804	390805154	/nfs/dbraw/zinc/80/51/54/390805154.db2.gz	XCDGONJRKAHDKV-GFCCVEGCSA-N	1	0	266.316	1.415	50	0		CDAARO
C[C@@H]1CN(C(=O)c2cnc(-c3ccncc3)s2)CC[NH2+]1	ZINC000188425354	390958104	/nfs/dbraw/zinc/95/81/04/390958104.db2.gz	WODZLFCLCYKZFN-SNVBAGLBSA-N	1	0	288.376	1.639	50	0		CDAARO
Cc1nc(CN2C[C@H]([NH3+])[C@@H](C3CC3)C2)c(C)s1	ZINC000091934969	390892429	/nfs/dbraw/zinc/89/24/29/390892429.db2.gz	ZXZZLCLGRSLSGD-NEPJUHHUSA-N	1	0	251.399	1.929	50	0		CDAARO
COC(=O)[C@H]1[C@@H]2CCC[N@@H+]2C[C@]12c1ccccc1NC2=O	ZINC000012296506	391002942	/nfs/dbraw/zinc/00/29/42/391002942.db2.gz	SACUHBGXWYEFEY-ZENOOKHLSA-N	1	0	286.331	1.144	50	0	biogenic	CDAARO
Cc1sc(Br)cc1S(=O)(=O)NCC[NH3+]	ZINC000087308020	391136956	/nfs/dbraw/zinc/13/69/56/391136956.db2.gz	HDZGLHXLCBNPKI-UHFFFAOYSA-N	1	0	299.215	1.056	50	0		CDAARO
O=C(N[C@@H]1CCSc2ccccc21)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000037004297	391455026	/nfs/dbraw/zinc/45/50/26/391455026.db2.gz	ZSZXHLQHZWSGMV-WCQGTBRESA-N	1	0	278.377	1.063	50	0		CDAARO
NC(=O)c1ccc(-c2ccc(F)c3c2O[C@@H](C[NH3+])C3)cc1	ZINC000299799974	391721680	/nfs/dbraw/zinc/72/16/80/391721680.db2.gz	YBJQWECKZANSOB-LLVKDONJSA-N	1	0	286.306	1.854	50	0		CDAARO
Cc1ccncc1NC(=O)C(=O)NCC(C)(C)C[NH+](C)C	ZINC000096411861	393181897	/nfs/dbraw/zinc/18/18/97/393181897.db2.gz	BKNFJNYWKXWDOS-UHFFFAOYSA-N	1	0	292.383	1.033	50	0		CDAARO
O=C(c1ccccc1O)N1CC[NH+](C[C@@H]2CCOC2)CC1	ZINC000096452001	393187106	/nfs/dbraw/zinc/18/71/06/393187106.db2.gz	DUQKULIBTQDQQR-ZDUSSCGKSA-N	1	0	290.363	1.187	50	0		CDAARO
c1cnc(N2CCC[C@@H]([NH2+]C3CCOCC3)C2)nc1	ZINC000037090066	285544929	/nfs/dbraw/zinc/54/49/29/285544929.db2.gz	FZUNIRZLYKCDNO-CYBMUJFWSA-N	1	0	262.357	1.214	50	0		CDAARO
Cc1ccccc1N1CCN([C@@H]2CCC[NH2+]C2)CC1	ZINC000071738639	134975711	/nfs/dbraw/zinc/97/57/11/134975711.db2.gz	VZXANXLMMZVSCE-OAHLLOKOSA-N	1	0	259.397	1.869	50	0		CDAARO
COc1ccc2c(c1)OC[C@@H](C(=O)N1CC[NH2+][C@H](C)C1)C2	ZINC000188431637	140093997	/nfs/dbraw/zinc/09/39/97/140093997.db2.gz	DUHHWFRJGUQNCE-YPMHNXCESA-N	1	0	290.363	1.067	50	0		CDAARO
c1cc(CN2CCN([C@@H]3CC[NH2+]C3)CC2)cs1	ZINC000261557488	140347283	/nfs/dbraw/zinc/34/72/83/140347283.db2.gz	RUNNHIZYJXKICE-CYBMUJFWSA-N	1	0	251.399	1.228	50	0		CDAARO
COC(C[N@@H+]1CCSC2(CCOCC2)C1)OC	ZINC000189222654	292079467	/nfs/dbraw/zinc/07/94/67/292079467.db2.gz	NFAWYKRRERRRJX-UHFFFAOYSA-N	1	0	261.387	1.203	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCC[C@H](c2nncn2C(C)C)C1	ZINC000299749342	397994456	/nfs/dbraw/zinc/99/44/56/397994456.db2.gz	JZWBTGQDTPJYFP-RYUDHWBXSA-N	1	0	279.388	1.302	50	0		CDAARO
C[C@@H](O)C1CC[NH+](CC(=O)N2CCCC[C@H]2C)CC1	ZINC000095395334	147112959	/nfs/dbraw/zinc/11/29/59/147112959.db2.gz	BOHGLRUBKNUXRI-CHWSQXEVSA-N	1	0	268.401	1.480	50	0		CDAARO
CCC[N@H+](CCO)Cc1ccc(NC(C)=O)cc1	ZINC000004987619	170049622	/nfs/dbraw/zinc/04/96/22/170049622.db2.gz	UICODKAJXITPEN-UHFFFAOYSA-N	1	0	250.342	1.849	50	0		CDAARO
O=S1(=O)CC[C@H]([NH2+]Cc2ccc(Cl)cc2)C1	ZINC000006645490	170221979	/nfs/dbraw/zinc/22/19/79/170221979.db2.gz	DESXOIJHQSQDQY-NSHDSACASA-N	1	0	259.758	1.617	50	0		CDAARO
Cc1cnc(CNC(=O)c2csc3c2CC[NH2+]C3)cn1	ZINC000006747715	170239711	/nfs/dbraw/zinc/23/97/11/170239711.db2.gz	RJTYLXMTOZPIQP-UHFFFAOYSA-N	1	0	288.376	1.422	50	0		CDAARO
CCOC(=O)CNC(=O)N1CCC(C[NH+]2CCCC2)CC1	ZINC000006877300	170251688	/nfs/dbraw/zinc/25/16/88/170251688.db2.gz	TUBVQNFPEIMMNN-UHFFFAOYSA-N	1	0	297.399	1.067	50	0		CDAARO
C[C@@H](C(=O)Nc1ccccc1)[N@@H+]1CCC[C@H](C(N)=O)C1	ZINC000008171626	170322833	/nfs/dbraw/zinc/32/28/33/170322833.db2.gz	ROPNVYRSPYBUGY-RYUDHWBXSA-N	1	0	275.352	1.211	50	0		CDAARO
CC(C)(C)CN1CCC[C@@](O)(C[NH2+]CC2CC2)C1=O	ZINC000012582871	170498882	/nfs/dbraw/zinc/49/88/82/170498882.db2.gz	QDSMVWJWXKIYDF-OAHLLOKOSA-N	1	0	268.401	1.386	50	0		CDAARO
c1ccc(C[NH2+]CCc2nnc3ccccn32)nc1	ZINC000020128272	171014290	/nfs/dbraw/zinc/01/42/90/171014290.db2.gz	CTVUJPIGRZZUMZ-UHFFFAOYSA-N	1	0	253.309	1.457	50	0		CDAARO
Cn1cc(C[NH2+]C[C@@H]2COc3ccccc3O2)cn1	ZINC000020138117	171025607	/nfs/dbraw/zinc/02/56/07/171025607.db2.gz	MZQUKFAIUVMYSM-GFCCVEGCSA-N	1	0	259.309	1.350	50	0		CDAARO
CC[NH+]1CCN([C@H](C)C(=O)Nc2ccccc2OC)CC1	ZINC000022785821	171398620	/nfs/dbraw/zinc/39/86/20/171398620.db2.gz	ONLNXPPFLPRQMT-CYBMUJFWSA-N	1	0	291.395	1.660	50	0		CDAARO
CC(C)[C@H]([NH2+]CC(=O)NC(N)=O)c1ccc(F)cc1	ZINC000032764816	171748563	/nfs/dbraw/zinc/74/85/63/171748563.db2.gz	BMHUQSZHYHBHOX-LBPRGKRZSA-N	1	0	267.304	1.307	50	0		CDAARO
[NH3+][C@@H](Cc1ccccc1)C(=O)NCc1ccccn1	ZINC000055368267	175576841	/nfs/dbraw/zinc/57/68/41/175576841.db2.gz	WOXOKVLQAOKFAD-AWEZNQCLSA-N	1	0	255.321	1.268	50	0		CDAARO
CCCCOCC(=O)N1CCC[C@@]2(CC[NH2+]C2)C1	ZINC000067514257	175776548	/nfs/dbraw/zinc/77/65/48/175776548.db2.gz	QUBHRCGOXXCDKR-AWEZNQCLSA-N	1	0	254.374	1.405	50	0		CDAARO
CC[C@@H](O)CNc1cc(C2CC[NH2+]CC2)nc(C)n1	ZINC000067724064	175786822	/nfs/dbraw/zinc/78/68/22/175786822.db2.gz	XRIZIEQWPZYWOT-GFCCVEGCSA-N	1	0	264.373	1.435	50	0		CDAARO
C/C=C/Cc1nnc(C(=O)N2CC[N@@H+]3CCC[C@H]3C2)o1	ZINC000071715219	176249331	/nfs/dbraw/zinc/24/93/31/176249331.db2.gz	LTKYDKBRQOILFR-VUDBWIFFSA-N	1	0	276.340	1.108	50	0		CDAARO
CC[C@@H]1CN(C(=O)CCOc2ccccc2C)CC[NH2+]1	ZINC000071763493	176261739	/nfs/dbraw/zinc/26/17/39/176261739.db2.gz	YBCRAAUIXSQVQF-CQSZACIVSA-N	1	0	276.380	1.974	50	0		CDAARO
O=C(NC[C@@H]1C[NH2+]CCOC1)Nc1ccccc1Cl	ZINC000072129077	176321381	/nfs/dbraw/zinc/32/13/81/176321381.db2.gz	JBHOFGGNNHXAFQ-JTQLQIEISA-N	1	0	283.759	1.698	50	0		CDAARO
Cn1cncc1CN1CCCC[C@@H]1CC[NH+](C)C	ZINC000072163575	176330607	/nfs/dbraw/zinc/33/06/07/176330607.db2.gz	CCPWOIJBJCFJQB-CYBMUJFWSA-N	1	0	250.390	1.726	50	0		CDAARO
Cc1cccc(OCC(=O)N2CCC(C[NH3+])CC2)c1	ZINC000072328570	176369657	/nfs/dbraw/zinc/36/96/57/176369657.db2.gz	WTVNKYKIXDDGQQ-UHFFFAOYSA-N	1	0	262.353	1.571	50	0		CDAARO
Cc1ncsc1CCN(C)C[C@@]1(O)CCC[NH2+]C1	ZINC000077297934	177250029	/nfs/dbraw/zinc/25/00/29/177250029.db2.gz	VWZRMYLOBOVRBD-CYBMUJFWSA-N	1	0	269.414	1.040	50	0		CDAARO
COc1cccc(OC)c1OCC[NH2+]C[C@H]1CCCO1	ZINC000002286890	261267110	/nfs/dbraw/zinc/26/71/10/261267110.db2.gz	OWOYOFVRHLEQJX-GFCCVEGCSA-N	1	0	281.352	1.851	50	0		CDAARO
Cc1nc(N2CC[NH+](C)CC2)ccc1Br	ZINC000095944435	274841227	/nfs/dbraw/zinc/84/12/27/274841227.db2.gz	WHSLCLOMSJQONW-UHFFFAOYSA-N	1	0	270.174	1.904	50	0		CDAARO
Cc1noc2nc3c(c(C(=O)N[C@H]4CC[C@H]4[NH3+])c12)CCC3	ZINC000072148432	274875026	/nfs/dbraw/zinc/87/50/26/274875026.db2.gz	WKTFNYPDACHACZ-KOLCDFICSA-N	1	0	286.335	1.239	50	0		CDAARO
CC(C)c1n[nH]c2c1CN(C(=O)[C@@H](C)[NH+](C)C)CC2	ZINC000426697338	275759688	/nfs/dbraw/zinc/75/96/88/275759688.db2.gz	LZZAKKPIYBCVDN-SNVBAGLBSA-N	1	0	264.373	1.368	50	0		CDAARO
CC1=C[C@@H](C)[C@H]2C(=O)N(c3ccc[n+](C)c3)C(=O)[C@H]2C1	ZINC000085859282	275919527	/nfs/dbraw/zinc/91/95/27/275919527.db2.gz	UYHYCNHHAGZKQZ-KWCYVHTRSA-N	1	0	271.340	1.603	50	0		CDAARO
COC(=O)N1C[C@H]2CC[C@@H]1C[N@H+](Cc1ccncc1)C2	ZINC000091494551	277335456	/nfs/dbraw/zinc/33/54/56/277335456.db2.gz	KBFLLQHTJBWMPN-UONOGXRCSA-N	1	0	275.352	1.744	50	0		CDAARO
Cc1csc(C[NH2+]C[C@H]2COC3(CCOCC3)O2)n1	ZINC000096494779	279040806	/nfs/dbraw/zinc/04/08/06/279040806.db2.gz	BSQRGNWMBOPOFK-NSHDSACASA-N	1	0	284.381	1.463	50	0		CDAARO
CCO[C@H]1C[C@H]([NH2+]C2CCN(C(N)=O)CC2)C12CCC2	ZINC000095423213	279932973	/nfs/dbraw/zinc/93/29/73/279932973.db2.gz	SWZGEPMRPCSIBZ-STQMWFEESA-N	1	0	281.400	1.467	50	0		CDAARO
CC[C@@H]([NH2+][C@H](C)C(=O)NC(N)=O)c1ccc(C)cc1	ZINC000012798228	280195868	/nfs/dbraw/zinc/19/58/68/280195868.db2.gz	VBUXGDAJPNQTCS-ZYHUDNBSSA-N	1	0	263.341	1.619	50	0		CDAARO
Cc1cnc(C(=O)NC[C@@H](c2cccs2)[NH+](C)C)cn1	ZINC000022687761	292879869	/nfs/dbraw/zinc/87/98/69/292879869.db2.gz	NYACTXKHDYMVEH-LBPRGKRZSA-N	1	0	290.392	1.879	50	0		CDAARO
CO[C@@H](C[NH3+])CC(=O)N1CCCN(C)c2ccccc21	ZINC000262906030	293520786	/nfs/dbraw/zinc/52/07/86/293520786.db2.gz	QELUZQHSQMRDQU-GFCCVEGCSA-N	1	0	277.368	1.223	50	0		CDAARO
CS(=O)(=O)NCC1([NH+]2CCCCC2)CCCCC1	ZINC000070238510	295525008	/nfs/dbraw/zinc/52/50/08/295525008.db2.gz	BVABPCUDEUSKPM-UHFFFAOYSA-N	1	0	274.430	1.724	50	0		CDAARO
Cn1nccc1[C@@H]1CCCCN1C[C@H]1CCC[NH2+]C1	ZINC000261629228	303072999	/nfs/dbraw/zinc/07/29/99/303072999.db2.gz	CLLJPKHCJXBMMA-ZFWWWQNUSA-N	1	0	262.401	1.947	50	0		CDAARO
Cc1cc(C)c2c(c1)C(=O)N(CC[NH+](C)C)CC(=O)N2	ZINC000534590862	328317973	/nfs/dbraw/zinc/31/79/73/328317973.db2.gz	FOYHSXVPDBDDMY-UHFFFAOYSA-N	1	0	275.352	1.259	50	0		CDAARO
Cc1ncn(C)c1C(=O)N1CCCC2(CC[NH2+]CC2)CC1	ZINC000534642215	328328802	/nfs/dbraw/zinc/32/88/02/328328802.db2.gz	VUTPVTFEBYVCBE-UHFFFAOYSA-N	1	0	290.411	1.724	50	0		CDAARO
C[C@H]1CCC[N@H+](CCC(=O)NCC2(CO)CCCC2)C1	ZINC000534637115	328334325	/nfs/dbraw/zinc/33/43/25/328334325.db2.gz	YFLXRKIWMXOJDQ-AWEZNQCLSA-N	1	0	282.428	1.777	50	0		CDAARO
CCc1oc(C(N)=O)cc1CN1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000534651528	328337375	/nfs/dbraw/zinc/33/73/75/328337375.db2.gz	MFOYAFZLUMRDQN-MPZDIEGVSA-N	1	0	289.379	1.123	50	0		CDAARO
Cc1cccc(N2CCN(C(=O)[C@H]3C=CC[NH2+]3)CC2)c1C	ZINC000534653043	328338210	/nfs/dbraw/zinc/33/82/10/328338210.db2.gz	QABMGZJSRQMLSJ-OAHLLOKOSA-N	1	0	285.391	1.480	50	0		CDAARO
CCC[C@@H](CNc1nc(C)ccc1C(N)=O)[NH+](C)C	ZINC000534649249	328343774	/nfs/dbraw/zinc/34/37/74/328343774.db2.gz	ATBUEGZITXHDNM-NSHDSACASA-N	1	0	264.373	1.631	50	0		CDAARO
[NH3+][C@@H]1[C@@H]2CC[C@H]1CN(S(=O)(=O)Cc1ccccc1)C2	ZINC000534674801	328344907	/nfs/dbraw/zinc/34/49/07/328344907.db2.gz	ZUFUUYUYZMSBDM-BTTYYORXSA-N	1	0	280.393	1.186	50	0		CDAARO
O=C(c1ccccc1F)N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000534675146	328346655	/nfs/dbraw/zinc/34/66/55/328346655.db2.gz	HHIMCYNIEIMVMW-WVKUQDAKSA-N	1	0	260.312	1.648	50	0		CDAARO
CN(Cc1[nH]nc2c1CCCCC2)C(=O)[C@H]1C=CC[NH2+]1	ZINC000534662695	328350310	/nfs/dbraw/zinc/35/03/10/328350310.db2.gz	DQHAHERATSWMHN-CYBMUJFWSA-N	1	0	274.368	1.165	50	0		CDAARO
Cc1nc(N)nc(NCC[C@H]2CCC[N@@H+](C)C2)c1Cl	ZINC000534662465	328350370	/nfs/dbraw/zinc/35/03/70/328350370.db2.gz	QSTHTJYRDWASPO-SNVBAGLBSA-N	1	0	283.807	1.417	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)N2CCOc3ccccc3C2)C1	ZINC000091543759	482570623	/nfs/dbraw/zinc/57/06/23/482570623.db2.gz	VNARBPZONBSUDR-WCQYABFASA-N	1	0	260.337	1.535	50	0		CDAARO
CN(CCOc1ccccc1F)C(=O)[C@H]1CCC[C@@H]1[NH3+]	ZINC000085367425	482577515	/nfs/dbraw/zinc/57/75/15/482577515.db2.gz	QHSQBPARLJLTJJ-AAEUAGOBSA-N	1	0	280.343	1.790	50	0		CDAARO
Cc1ccc(C[NH2+]CC2(C(N)=O)CCOCC2)s1	ZINC000086250830	482706466	/nfs/dbraw/zinc/70/64/66/482706466.db2.gz	ZQAZSCPMXAYRNY-UHFFFAOYSA-N	1	0	268.382	1.428	50	0		CDAARO
OC[C@H]([NH2+]C1CCN([C@H]2CCOC2)CC1)c1ccsc1	ZINC000585091225	482825813	/nfs/dbraw/zinc/82/58/13/482825813.db2.gz	NUZLOAZZZJXJEW-GJZGRUSLSA-N	1	0	296.436	1.624	50	0		CDAARO
O=C1CC[C@@H]([N@@H+]2CCc3nocc3C2)CCN1CC1CC1	ZINC000670440217	482985426	/nfs/dbraw/zinc/98/54/26/482985426.db2.gz	KHFPKXGMLZSGPL-CQSZACIVSA-N	1	0	289.379	1.824	50	0		CDAARO
C[NH+](C)CC1(CO)CCN(C(=O)CCC(F)(F)F)CC1	ZINC000670457308	483035778	/nfs/dbraw/zinc/03/57/78/483035778.db2.gz	OZSCDPXRNOEJHX-UHFFFAOYSA-N	1	0	296.333	1.492	50	0		CDAARO
Cc1nn(CCO)c(C)c1C[N@H+](C)CCCn1cccn1	ZINC000670457007	483036990	/nfs/dbraw/zinc/03/69/90/483036990.db2.gz	BQJSOSCFNFUZPN-UHFFFAOYSA-N	1	0	291.399	1.211	50	0		CDAARO
OC1(c2ccccn2)CC[NH+]([C@@H]2CCSC2)CC1	ZINC000670458514	483039646	/nfs/dbraw/zinc/03/96/46/483039646.db2.gz	CSZPLGGAZVNDNQ-GFCCVEGCSA-N	1	0	264.394	1.871	50	0		CDAARO
C[N@H+](Cc1cnc2ccccc2n1)[C@H]1CCNC(=O)CC1	ZINC000670468964	483061126	/nfs/dbraw/zinc/06/11/26/483061126.db2.gz	PBKQRFWOSBKXEM-CYBMUJFWSA-N	1	0	284.363	1.730	50	0		CDAARO
O=C(c1ccon1)N1CCCO[C@H](C[NH+]2CCCCC2)C1	ZINC000670473310	483083332	/nfs/dbraw/zinc/08/33/32/483083332.db2.gz	UHHDOQIZFLRCJT-CYBMUJFWSA-N	1	0	293.367	1.392	50	0		CDAARO
Cc1cc([C@@H]2CCCN(C(=O)C[N@@H+](C)C3CC3)C2)[nH]n1	ZINC000084110500	483247115	/nfs/dbraw/zinc/24/71/15/483247115.db2.gz	HVMQOUOSZXBSHV-GFCCVEGCSA-N	1	0	276.384	1.518	50	0		CDAARO
[NH3+]CC[C@@H](NC(=O)N1CCOC2(CCC2)C1)C(F)(F)F	ZINC000667868573	483465795	/nfs/dbraw/zinc/46/57/95/483465795.db2.gz	DWOLWYSPUKXSGJ-SECBINFHSA-N	1	0	295.305	1.231	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)c1ccc(C)c(Cl)c1	ZINC000063022292	524009124	/nfs/dbraw/zinc/00/91/24/524009124.db2.gz	AXJMIAFYFWIDPT-NEPJUHHUSA-N	1	0	268.744	1.365	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)COCc2ccccc2Cl)C1	ZINC000178518286	527237978	/nfs/dbraw/zinc/23/79/78/527237978.db2.gz	YCVCHFQSXGLXNH-LLVKDONJSA-N	1	0	282.771	1.664	50	0		CDAARO
C[NH+]1CCC(Oc2ncc(Br)cn2)CC1	ZINC000104380202	1174693646	/nfs/dbraw/zinc/69/36/46/1174693646.db2.gz	ATFZXAULWFSULK-UHFFFAOYSA-N	1	0	272.146	1.712	50	0		CDAARO
COc1ccc(-c2noc(C[NH2+][C@H](CO)C(C)C)n2)cc1	ZINC000071774454	567902263	/nfs/dbraw/zinc/90/22/63/567902263.db2.gz	SSPFUUQHLGAKJV-CYBMUJFWSA-N	1	0	291.351	1.852	50	0		CDAARO
Cc1ccc2c(ncn([C@H]3CCC[NH2+]C3)c2=O)c1C	ZINC000757177936	577033824	/nfs/dbraw/zinc/03/38/24/577033824.db2.gz	OSNNSSSHGHGHHW-LBPRGKRZSA-N	1	0	257.337	1.938	50	0		CDAARO
CC(C)[C@H]([NH3+])C1(O)CCN(C(=O)OC(C)(C)C)CC1	ZINC000958528836	614225247	/nfs/dbraw/zinc/22/52/47/614225247.db2.gz	WFQSEHNXRWRGCT-NSHDSACASA-N	1	0	272.389	1.732	50	0		CDAARO
COC(=O)c1nccc(N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)n1	ZINC000874435001	632390601	/nfs/dbraw/zinc/39/06/01/632390601.db2.gz	ISHVKZQVBBNJPC-LLVKDONJSA-N	1	0	292.383	1.430	50	0		CDAARO
CCC1=NO[C@H](C[N@H+](CC)CCn2cccn2)C1	ZINC001704354358	1177699423	/nfs/dbraw/zinc/69/94/23/1177699423.db2.gz	AEFCUWXTBBVJCT-ZDUSSCGKSA-N	1	0	250.346	1.760	50	0		CDAARO
CC1(C)C(c2ccccn2)[N+](=O)[C@@H](c2cccnc2)N1O	ZINC000000437401	730696385	/nfs/dbraw/zinc/69/63/85/730696385.db2.gz	HERLXZLGBGRHMD-CQSZACIVSA-N	1	0	284.319	1.958	50	0		CDAARO
CC[C@@H](Nc1nc(N)nc2c1CC[NH2+]CC2)c1ccncc1	ZINC000072426364	730877616	/nfs/dbraw/zinc/87/76/16/730877616.db2.gz	KCFCWKZTCFTETF-CYBMUJFWSA-N	1	0	298.394	1.705	50	0		CDAARO
CCOc1ccc(CN2CC[C@H]3CC[C@@H](C2)[NH2+]3)cc1CO	ZINC000065422519	731562849	/nfs/dbraw/zinc/56/28/49/731562849.db2.gz	MDPCWYQZYLGPRY-CVEARBPZSA-N	1	0	290.407	1.904	50	0		CDAARO
CCc1nccn1CC[N@@H+]1CCC[C@@H](NC(C)=O)C1	ZINC000244695651	731718306	/nfs/dbraw/zinc/71/83/06/731718306.db2.gz	JPVMULNGNBTVJK-CYBMUJFWSA-N	1	0	264.373	1.046	50	0		CDAARO
c1coc(-c2nnc(CN3CC[N@@H+]4CCC[C@H]4C3)o2)c1	ZINC000247158509	732114680	/nfs/dbraw/zinc/11/46/80/732114680.db2.gz	MFIGKTJGYDGAPK-NSHDSACASA-N	1	0	274.324	1.610	50	0		CDAARO
OCC[C@H]1CN(Cc2c[nH]cn2)CC[N@@H+]1C1CCCC1	ZINC000020598574	732222116	/nfs/dbraw/zinc/22/21/16/732222116.db2.gz	AEPPLCBRDDKYBC-HNNXBMFYSA-N	1	0	278.400	1.221	50	0		CDAARO
Cc1cn2c(C[NH2+][C@H]3CCS(=O)(=O)C3)c(C)nc2s1	ZINC000036820455	732421285	/nfs/dbraw/zinc/42/12/85/732421285.db2.gz	VKQZLPCTZMSNNB-JTQLQIEISA-N	1	0	299.421	1.289	50	0		CDAARO
CCC(CC)[C@H]([NH3+])C1(O)C[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000958527717	732732289	/nfs/dbraw/zinc/73/22/89/732732289.db2.gz	FPHVFYSCUAZYLR-FXJUQPSGSA-N	1	0	275.414	1.221	50	0		CDAARO
CC(C)(O)[C@@H]1CC[N@H+](CCn2cc(Cl)cn2)C1	ZINC000721880175	732750582	/nfs/dbraw/zinc/75/05/82/732750582.db2.gz	CYYMRWLXUSXGPK-SNVBAGLBSA-N	1	0	257.765	1.629	50	0		CDAARO
c1cncc([C@H](C[NH+]2CCSCC2)N2CCOCC2)c1	ZINC000020118214	733085432	/nfs/dbraw/zinc/08/54/32/733085432.db2.gz	DHMNSCKKNAJGGA-HNNXBMFYSA-N	1	0	293.436	1.504	50	0		CDAARO
Cc1cc(NC(=O)[C@@H]2C=CC[NH2+]2)cc2sc(N)nc21	ZINC000952972384	733154040	/nfs/dbraw/zinc/15/40/40/733154040.db2.gz	ZWSMSFCEZMEQNT-VIFPVBQESA-N	1	0	274.349	1.653	50	0		CDAARO
COc1ccc(C[N@H+](C)[C@@H](C)CC(N)=O)c(C)c1	ZINC000952860138	910413273	/nfs/dbraw/zinc/41/32/73/910413273.db2.gz	FYNLMVNOFULJCN-NSHDSACASA-N	1	0	250.342	1.699	50	0		CDAARO
CCOc1ccc(C[N@H+](C)[C@H](C)CC(N)=O)cc1CO	ZINC000952872787	910428843	/nfs/dbraw/zinc/42/88/43/910428843.db2.gz	TXQZTMCGVXQFAQ-LLVKDONJSA-N	1	0	280.368	1.273	50	0		CDAARO
CC[C@H](C)C[NH+]1CCC(O)(c2nccn2C)CC1	ZINC000952883022	910452355	/nfs/dbraw/zinc/45/23/55/910452355.db2.gz	SYXFDULLRJQLGF-LBPRGKRZSA-N	1	0	251.374	1.750	50	0		CDAARO
C/C=C/C[NH+]1CCC(CNC(=O)c2cnn(CC)c2)CC1	ZINC000952960019	910469510	/nfs/dbraw/zinc/46/95/10/910469510.db2.gz	DKQVBXBIFWPHOU-HWKANZROSA-N	1	0	290.411	1.921	50	0		CDAARO
CC(C)[N@@H+]1CCCN(CCc2nccn2C)CC1	ZINC000821751203	925595098	/nfs/dbraw/zinc/59/50/98/925595098.db2.gz	RWPJAFOKPYZIPG-UHFFFAOYSA-N	1	0	250.390	1.379	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNC(=O)c1[nH]ncc1Cl	ZINC000823113248	925670487	/nfs/dbraw/zinc/67/04/87/925670487.db2.gz	YLMBYKXUAGMDCA-VIFPVBQESA-N	1	0	270.764	1.667	50	0		CDAARO
C[C@H](NC(=O)CN1CCC[N@H+](C)CC1)C1=CCCCC1	ZINC000823778353	925730458	/nfs/dbraw/zinc/73/04/58/925730458.db2.gz	JIOXDKODKQYXIU-AWEZNQCLSA-N	1	0	279.428	1.629	50	0		CDAARO
Cc1nc(CCCn2cccn2)n(-c2cc[nH+]cc2)n1	ZINC000825292227	925861774	/nfs/dbraw/zinc/86/17/74/925861774.db2.gz	YXPGJAMGDXLQSX-UHFFFAOYSA-N	1	0	268.324	1.800	50	0		CDAARO
CC(C)(O)Cn1ncnc1[C@@H]([NH3+])C1CCCCC1	ZINC000827540273	925944055	/nfs/dbraw/zinc/94/40/55/925944055.db2.gz	SPTIKXNGGNXXJY-NSHDSACASA-N	1	0	252.362	1.629	50	0		CDAARO
COc1ccccc1N1CCN([C@H]2CCC[N@H+](C)C2)CC1	ZINC000200536336	929258520	/nfs/dbraw/zinc/25/85/20/929258520.db2.gz	LDEJZYGLXWHIPX-HNNXBMFYSA-N	1	0	289.423	1.911	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1nc(CCO)c(C)s1	ZINC000585092932	930923414	/nfs/dbraw/zinc/92/34/14/930923414.db2.gz	URLAZTRZYCDUJZ-LBPRGKRZSA-N	1	0	283.441	1.695	50	0		CDAARO
COc1ccccc1CCNC(=O)c1conc1C[NH3+]	ZINC000407349146	941238891	/nfs/dbraw/zinc/23/88/91/941238891.db2.gz	AWGVASLFGVZNLY-UHFFFAOYSA-N	1	0	275.308	1.114	50	0		CDAARO
OCC[N@@H+]1C[C@H](O)[C@H](Cc2ccnc3ccccc23)C1	ZINC001529099106	968980165	/nfs/dbraw/zinc/98/01/65/968980165.db2.gz	QLFFAGLRAXAIQY-CJNGLKHVSA-N	1	0	272.348	1.062	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3cccc(C)n3)C[C@@H]2O)[nH]n1	ZINC001529186837	969006571	/nfs/dbraw/zinc/00/65/71/969006571.db2.gz	KVVASVCLOWWXRG-CJNGLKHVSA-N	1	0	286.379	1.457	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+][C@H]1CC[C@H](O)CC1	ZINC001506396898	975147896	/nfs/dbraw/zinc/14/78/96/975147896.db2.gz	ONUSJHJZNLICPZ-AVGNSLFASA-N	1	0	251.374	1.727	50	0		CDAARO
CC(C)N(C)C[C@H](C)[NH2+]CC1(Cn2cccn2)CC1	ZINC001506405977	975152189	/nfs/dbraw/zinc/15/21/89/975152189.db2.gz	YIXFHJRKPHKVBU-AWEZNQCLSA-N	1	0	264.417	1.982	50	0		CDAARO
Cc1cc(NC[C@@H](O)C[NH+]2CCC(C)CC2)nc(C)n1	ZINC000096456198	230377237	/nfs/dbraw/zinc/37/72/37/230377237.db2.gz	BNMOLNJSNXHCKG-CQSZACIVSA-N	1	0	278.400	1.598	50	0		CDAARO
CC(C)[C@@H]1CN(C(=O)c2ccc(O)cn2)C[C@H]1[NH+](C)C	ZINC000095507561	185000515	/nfs/dbraw/zinc/00/05/15/185000515.db2.gz	PHPAILVFGHSCAW-GXTWGEPZSA-N	1	0	277.368	1.445	50	0		CDAARO
C[C@H](Cn1cccn1)C(=O)N1CCC[C@H]1[C@H]1CCC[N@@H+]1C	ZINC000106661721	349446070	/nfs/dbraw/zinc/44/60/70/349446070.db2.gz	BGJZJDRRCQDOFD-KFWWJZLASA-N	1	0	290.411	1.604	50	0		CDAARO
COc1nccnc1N1CCC[N@H+](Cc2cccnc2)CC1	ZINC000095531447	185004437	/nfs/dbraw/zinc/00/44/37/185004437.db2.gz	KEARSBJODPTMGH-UHFFFAOYSA-N	1	0	299.378	1.593	50	0		CDAARO
Cc1cc(CNC(=O)CN2CC[N@@H+](C)C[C@H]2C)ccc1F	ZINC000107581014	398155981	/nfs/dbraw/zinc/15/59/81/398155981.db2.gz	NZVAFSOAMYNJGL-CYBMUJFWSA-N	1	0	293.386	1.386	50	0		CDAARO
Cc1cc(C)n(CCN2CC[C@@H]3CC[C@H](C2)[N@@H+]3C)n1	ZINC000240203786	361747034	/nfs/dbraw/zinc/74/70/34/361747034.db2.gz	JTHYAEARHURULN-LSDHHAIUSA-N	1	0	262.401	1.668	50	0		CDAARO
CCOC(=O)CNc1ccccc1C[NH+]1CCC(O)CC1	ZINC000194108057	342591526	/nfs/dbraw/zinc/59/15/26/342591526.db2.gz	LQCDPINDFKSQBT-UHFFFAOYSA-N	1	0	292.379	1.618	50	0		CDAARO
[NH3+][C@@H](C(=O)N1CCOC[C@@H]1C1CC1)c1ccccc1	ZINC000195554884	342626157	/nfs/dbraw/zinc/62/61/57/342626157.db2.gz	DZLINGUKWWFQNQ-ZIAGYGMSSA-N	1	0	260.337	1.324	50	0		CDAARO
COCC[N@H+](C)C[C@@H]1CCCN1c1cccc(C)n1	ZINC000195575668	342628800	/nfs/dbraw/zinc/62/88/00/342628800.db2.gz	ZNRIQPVJLYKRCT-AWEZNQCLSA-N	1	0	263.385	1.937	50	0		CDAARO
CC(=O)N(C)[C@H]1CC[N@H+](CCn2cnc3ccccc32)C1	ZINC000244626681	361855587	/nfs/dbraw/zinc/85/55/87/361855587.db2.gz	FQNXEMJDIHBJLQ-AWEZNQCLSA-N	1	0	286.379	1.589	50	0		CDAARO
O[C@H]1CN(CCCc2ccco2)C[C@@H]1[NH+]1CCCCC1	ZINC000244734386	361859659	/nfs/dbraw/zinc/85/96/59/361859659.db2.gz	NEKIAQDBHLSBIU-HOTGVXAUSA-N	1	0	278.396	1.743	50	0		CDAARO
CCc1nnc(CN2CC[N@H+](C(C)C)[C@@H](C)C2)[nH]1	ZINC000244708087	361858752	/nfs/dbraw/zinc/85/87/52/361858752.db2.gz	KNEGNHVHUUODTR-NSHDSACASA-N	1	0	251.378	1.282	50	0		CDAARO
CC[C@@H](O)C[NH+]1CCC(Nc2ncc(Cl)cn2)CC1	ZINC000097033933	185155654	/nfs/dbraw/zinc/15/56/54/185155654.db2.gz	UUSRIFKHMSPRMV-GFCCVEGCSA-N	1	0	284.791	1.777	50	0		CDAARO
Cc1cn2c(n1)CC[C@H](NC(=O)Cc1csc(C)n1)C2	ZINC000097198697	342217129	/nfs/dbraw/zinc/21/71/29/342217129.db2.gz	ODDPZYCQKFBWEM-NSHDSACASA-N	1	0	290.392	1.630	50	0		CDAARO
CC1(CNC(=O)c2cccc3c2OCCO3)CC[NH2+]CC1	ZINC000129084166	342225153	/nfs/dbraw/zinc/22/51/53/342225153.db2.gz	UULLESTXXJIUBQ-UHFFFAOYSA-N	1	0	290.363	1.577	50	0		CDAARO
O=C(NCc1ncccc1F)c1ccn2c[nH+]cc2c1	ZINC000098020658	539095717	/nfs/dbraw/zinc/09/57/17/539095717.db2.gz	FXWXZSDJLWYZIL-UHFFFAOYSA-N	1	0	270.267	1.798	50	0		CDAARO
NC(=O)[C@@H]1CC[N@H+](Cc2nc3cc(F)ccc3o2)C1	ZINC000584907886	539102349	/nfs/dbraw/zinc/10/23/49/539102349.db2.gz	XPIJJZNBDAWEIR-MRVPVSSYSA-N	1	0	263.272	1.274	50	0		CDAARO
[NH3+][C@@H]1CCN(CC(=O)Nc2cccc(Br)c2)C1	ZINC000050242670	539160257	/nfs/dbraw/zinc/16/02/57/539160257.db2.gz	QIAXMUPXVIJSPP-SNVBAGLBSA-N	1	0	298.184	1.421	50	0		CDAARO
O=C(NCCC[N@@H+]1CCc2ccccc2C1)[C@@H]1CCCO1	ZINC000036391875	362050205	/nfs/dbraw/zinc/05/02/05/362050205.db2.gz	WQILFRPYFVTIIN-INIZCTEOSA-N	1	0	288.391	1.730	50	0		CDAARO
[NH3+]C1(C(=O)N2CCO[C@H](c3ccccc3F)C2)CCCC1	ZINC000178105324	362238412	/nfs/dbraw/zinc/23/84/12/362238412.db2.gz	FOTZHSPGSHVPJW-AWEZNQCLSA-N	1	0	292.354	1.997	50	0		CDAARO
CSc1ccccc1C(=O)NC[C@@H]1C[C@H](F)C[NH2+]1	ZINC000252488661	362386271	/nfs/dbraw/zinc/38/62/71/362386271.db2.gz	IWJQZBAQEYBGMF-UWVGGRQHSA-N	1	0	268.357	1.838	50	0		CDAARO
CSc1ncc(CNC(=O)c2ccc(C[NH3+])cc2)n1C	ZINC000252505514	362390195	/nfs/dbraw/zinc/39/01/95/362390195.db2.gz	VSBLFAHECFFBOO-UHFFFAOYSA-N	1	0	290.392	1.531	50	0		CDAARO
CC(=O)NC[C@@H]1C[N@H+](C[C@@H]2C(C)=CCC[C@H]2C)CCO1	ZINC000191073448	362398513	/nfs/dbraw/zinc/39/85/13/362398513.db2.gz	NECLUUSXMKWBHS-FVQBIDKESA-N	1	0	280.412	1.816	50	0		CDAARO
Cc1c[nH]c(CN2CCC[C@@H]([NH+](C)C)C2)c(C)c1=O	ZINC000253537146	362434586	/nfs/dbraw/zinc/43/45/86/362434586.db2.gz	ZPDZNKOJASZQJH-CYBMUJFWSA-N	1	0	263.385	1.930	50	0		CDAARO
Cc1nnc2n1C[C@@H]([NH2+]Cc1c[nH]nc1C(C)(C)C)CC2	ZINC000065565466	282357911	/nfs/dbraw/zinc/35/79/11/282357911.db2.gz	NTVSMIGZXFCSGS-LBPRGKRZSA-N	1	0	288.399	1.712	50	0		CDAARO
COC[C@H](O)CN(C)c1cc[nH+]c2cc(F)ccc21	ZINC000083858985	178755015	/nfs/dbraw/zinc/75/50/15/178755015.db2.gz	FOKOFDRXLKBRBT-LLVKDONJSA-N	1	0	264.300	1.817	50	0		CDAARO
COc1ccc2c(c1)C[C@H]([NH2+]CC(C)(C)C(N)=O)CC2	ZINC000097084672	185526248	/nfs/dbraw/zinc/52/62/48/185526248.db2.gz	WXMXAVIFEQWYPW-CYBMUJFWSA-N	1	0	276.380	1.654	50	0		CDAARO
Cc1cc(N2CCC[C@H]([NH+](C)C)C2)n2nccc2n1	ZINC000072440135	136481380	/nfs/dbraw/zinc/48/13/80/136481380.db2.gz	VPMRHAILHJMFER-LBPRGKRZSA-N	1	0	259.357	1.568	50	0		CDAARO
C[N@@H+]1CCN2CCN(Cc3cc(C(C)(C)C)n[nH]3)C[C@H]2C1	ZINC000215799495	345722673	/nfs/dbraw/zinc/72/26/73/345722673.db2.gz	DNSPDOXKRUZGDJ-CQSZACIVSA-N	1	0	291.443	1.139	50	0		CDAARO
Nc1cc[nH+]cc1C(=O)N1CCO[C@H]2CCCC[C@H]21	ZINC000127555333	187316281	/nfs/dbraw/zinc/31/62/81/187316281.db2.gz	SXXKBZWDRFXKDD-OLZOCXBDSA-N	1	0	261.325	1.447	50	0		CDAARO
O=C1N(Cc2ccc(F)cc2)CCN1[C@@H]1CCC[NH2+]C1	ZINC000085347903	179029018	/nfs/dbraw/zinc/02/90/18/179029018.db2.gz	CSJTVVNQJKQVBT-CQSZACIVSA-N	1	0	277.343	1.815	50	0		CDAARO
Cn1cc([C@H]2OCC[C@H]2C[NH2+]C2CCSCC2)cn1	ZINC000089755278	347612311	/nfs/dbraw/zinc/61/23/11/347612311.db2.gz	CDPJRLBBJYIPRA-FZMZJTMJSA-N	1	0	281.425	1.983	50	0		CDAARO
COCCCn1cnnc1C[NH2+]C1Cc2ccccc2C1	ZINC000584884525	349342592	/nfs/dbraw/zinc/34/25/92/349342592.db2.gz	BSJLNSHOGMHGTA-UHFFFAOYSA-N	1	0	286.379	1.572	50	0		CDAARO
C(Cc1noc(C2CC2)n1)[NH2+]C1CSCCSC1	ZINC000584886452	349345115	/nfs/dbraw/zinc/34/51/15/349345115.db2.gz	SLFGMXCNZQZNJH-UHFFFAOYSA-N	1	0	285.438	1.928	50	0		CDAARO
CC(C)C[N@@H+]1CCN(C(=O)C2CC=CC2)C[C@@H]1CCO	ZINC000584887662	349346374	/nfs/dbraw/zinc/34/63/74/349346374.db2.gz	IGBAURGRLUBSJI-HNNXBMFYSA-N	1	0	280.412	1.504	50	0		CDAARO
O=C(NCC[N@H+]1CCC[C@H](CO)C1)C1CCCCCC1	ZINC000584889069	349348160	/nfs/dbraw/zinc/34/81/60/349348160.db2.gz	NSDLNGDJEIZCMA-AWEZNQCLSA-N	1	0	282.428	1.777	50	0		CDAARO
CCCC(CCC)[NH+]1CCN(c2cc(N)nc(N)n2)CC1	ZINC000065372385	362947368	/nfs/dbraw/zinc/94/73/68/362947368.db2.gz	YVDVSYTXLYNMTH-UHFFFAOYSA-N	1	0	292.431	1.732	50	0		CDAARO
COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@]1(O)CCOC1	ZINC000090849772	180046154	/nfs/dbraw/zinc/04/61/54/180046154.db2.gz	AQLJOPHKDKBOMC-IUODEOHRSA-N	1	0	265.353	1.806	50	0		CDAARO
Cc1ccc([C@H]2CN(C(=O)CCc3cccnc3)C[C@@H]2[NH3+])o1	ZINC000091327132	180135236	/nfs/dbraw/zinc/13/52/36/180135236.db2.gz	WXBTVWFINFWKOY-GJZGRUSLSA-N	1	0	299.374	1.869	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@H]1NS(=O)(=O)c1ccc(F)cc1F	ZINC000091496837	180172454	/nfs/dbraw/zinc/17/24/54/180172454.db2.gz	MQBPSBGQDSAOIF-GZMMTYOYSA-N	1	0	290.335	1.384	50	0		CDAARO
[NH3+]C[C@@H]1CCCCN1Cc1cc(=O)c2cccc(F)c2[nH]1	ZINC000091657020	180217790	/nfs/dbraw/zinc/21/77/90/180217790.db2.gz	MLCGDEPDARVJBU-LBPRGKRZSA-N	1	0	289.354	1.980	50	0		CDAARO
COCC[C@]1(CO)CCC[N@H+](CCCSC)C1	ZINC000091693747	180228794	/nfs/dbraw/zinc/22/87/94/180228794.db2.gz	NPPXAGXXIYTYLM-CYBMUJFWSA-N	1	0	261.431	1.851	50	0		CDAARO
Cc1cc(CC(=O)N2C[C@H]([NH+](C)C)[C@@H](C3CC3)C2)on1	ZINC000091931551	180288122	/nfs/dbraw/zinc/28/81/22/180288122.db2.gz	VJTGLSMFZYRRIL-KGLIPLIRSA-N	1	0	277.368	1.324	50	0		CDAARO
O=C(NCC1CC[NH+](CC2CC2)CC1)c1ccon1	ZINC000620929007	350382943	/nfs/dbraw/zinc/38/29/43/350382943.db2.gz	VSUFRRQGMFODCJ-UHFFFAOYSA-N	1	0	263.341	1.526	50	0		CDAARO
C[NH2+][C@@H]1CCN(C(=O)OCc2ccccc2)C[C@H]1F	ZINC000107272483	186164310	/nfs/dbraw/zinc/16/43/10/186164310.db2.gz	ABMWQTWKPOPMIO-CHWSQXEVSA-N	1	0	266.316	1.955	50	0		CDAARO
CCOc1cc(C[NH2+]CC2(O)CCOCC2)ccc1OC	ZINC000112717098	186524193	/nfs/dbraw/zinc/52/41/93/186524193.db2.gz	ATMNHCWAHVQYOM-UHFFFAOYSA-N	1	0	295.379	1.725	50	0		CDAARO
C[N@H+](C1CCCC1)C(C)(C)C(=O)NC[C@H]1CCC[C@H]1O	ZINC000096488969	351567677	/nfs/dbraw/zinc/56/76/77/351567677.db2.gz	YBZLJOQCGSUENH-TZMCWYRMSA-N	1	0	282.428	1.917	50	0		CDAARO
C[NH2+][C@H]1CCS(=O)(=O)c2ccc(Br)cc21	ZINC000090225633	358467478	/nfs/dbraw/zinc/46/74/78/358467478.db2.gz	AUSXOOHJDFBOTN-VIFPVBQESA-N	1	0	290.182	1.887	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccc(F)c(F)c2F)C[C@@H](C)[NH2+]1	ZINC000094185060	363242257	/nfs/dbraw/zinc/24/22/57/363242257.db2.gz	CUSQYVZFUGHEKB-HTQZYQBOSA-N	1	0	272.270	1.926	50	0		CDAARO
Cn1ncc2c1ncnc2NCCOc1ccccc1F	ZINC000014213429	366133448	/nfs/dbraw/zinc/13/34/48/366133448.db2.gz	UVXKQSDBVRAXJC-UHFFFAOYSA-N	1	0	287.298	1.993	50	0		CDAARO
COc1ccc(/C(C)=C\C(=O)N2CC[C@H](C[NH3+])C2)cc1	ZINC000255034307	355930701	/nfs/dbraw/zinc/93/07/01/355930701.db2.gz	YTUXGPMBHSTNHM-KIWPFMIBSA-N	1	0	274.364	1.906	50	0		CDAARO
COC(=O)C[C@]1(C)OC[C@@H](C[NH+]2CCCCC2)O1	ZINC000000191956	355894721	/nfs/dbraw/zinc/89/47/21/355894721.db2.gz	GMGIMSPSNKVNFU-DGCLKSJQSA-N	1	0	257.330	1.167	50	0		CDAARO
CCOc1ccccc1OCCOCC[NH2+]CCOC	ZINC000002980647	355990313	/nfs/dbraw/zinc/99/03/13/355990313.db2.gz	XLKQHNXUAUVORO-UHFFFAOYSA-N	1	0	283.368	1.717	50	0		CDAARO
CC[NH2+]CCNC(=O)c1cc(Cl)c(N)cc1OC	ZINC000002012717	355957429	/nfs/dbraw/zinc/95/74/29/355957429.db2.gz	RTQMQUZXBADBGJ-UHFFFAOYSA-N	1	0	271.748	1.270	50	0	in-vitro	CDAARO
Cc1nc(C[C@@H]2CCCN(C(=O)[C@@H]3CCC[C@H]3[NH3+])C2)no1	ZINC000299738422	356261314	/nfs/dbraw/zinc/26/13/14/356261314.db2.gz	AQKNJRXWKBYTJP-YNEHKIRRSA-N	1	0	292.383	1.287	50	0		CDAARO
C[NH+](C)[C@@H](CNc1ccc2nnnn2n1)Cc1ccccc1	ZINC000012854379	356327555	/nfs/dbraw/zinc/32/75/55/356327555.db2.gz	PWEJWVRUYKRQKZ-CYBMUJFWSA-N	1	0	297.366	1.104	50	0		CDAARO
C[C@H](Oc1ccc(F)cc1)C(=O)NCC[NH+](C)C	ZINC000013667932	356353197	/nfs/dbraw/zinc/35/31/97/356353197.db2.gz	ZKLJNXDDEYLCCM-JTQLQIEISA-N	1	0	254.305	1.271	50	0		CDAARO
C[N@H+](CCn1nc2ccccn2c1=O)Cc1ccccc1	ZINC000032777967	356363718	/nfs/dbraw/zinc/36/37/18/356363718.db2.gz	ALLUEEBWSORBRC-UHFFFAOYSA-N	1	0	282.347	1.628	50	0		CDAARO
CCCc1ccc(OC[C@H](O)CN2CC[NH+](C)CC2)cc1	ZINC000019338644	356480765	/nfs/dbraw/zinc/48/07/65/356480765.db2.gz	FCQAVEZABJZXRE-MRXNPFEDSA-N	1	0	292.423	1.626	50	0		CDAARO
CC/C=C(\C)C[N@@H+]1CCC[C@@H](Cn2cc(CO)nn2)C1	ZINC000019761024	356501026	/nfs/dbraw/zinc/50/10/26/356501026.db2.gz	IIONNWVKESBWGY-BRRGFWCPSA-N	1	0	278.400	1.839	50	0		CDAARO
Cc1cc(Cl)ccc1OC[C@@H](O)CN1CC[NH+](C)CC1	ZINC000019781592	356503011	/nfs/dbraw/zinc/50/30/11/356503011.db2.gz	GJMGVZHQCMTAAE-AWEZNQCLSA-N	1	0	298.814	1.636	50	0		CDAARO
CCC[NH+]1CCN(C[C@H](O)COCc2cccs2)CC1	ZINC000022030341	356598267	/nfs/dbraw/zinc/59/82/67/356598267.db2.gz	OJEPTLNLMYXFLB-AWEZNQCLSA-N	1	0	298.452	1.653	50	0		CDAARO
Cc1nn(C(C)C)c(C)c1CN1CC[N@H+](C)[C@H](CCO)C1	ZINC000022853369	356622644	/nfs/dbraw/zinc/62/26/44/356622644.db2.gz	XVDZAAABUNDARZ-OAHLLOKOSA-N	1	0	294.443	1.579	50	0		CDAARO
C[C@H]([NH2+]CC1(c2ccccc2)CCCC1)C(=O)NC(N)=O	ZINC000025898367	356685478	/nfs/dbraw/zinc/68/54/78/356685478.db2.gz	GBUJKBHFRNTWDZ-LBPRGKRZSA-N	1	0	289.379	1.671	50	0		CDAARO
CN1CCN(C(=O)CSc2ccccc2)CC1	ZINC000031850676	356770945	/nfs/dbraw/zinc/77/09/45/356770945.db2.gz	MKPXGYCPZNJUMR-UHFFFAOYSA-N	1	0	250.367	1.553	50	0		CDAARO
CCOC(=O)C[C@@H]1[NH2+]CCc2cc(OC)c(OC)cc21	ZINC000034400049	356813834	/nfs/dbraw/zinc/81/38/34/356813834.db2.gz	RLUWHGCQILMZMC-LBPRGKRZSA-N	1	0	279.336	1.844	50	0		CDAARO
COc1cc(OC)c([C@H]2CC[N@H+](C)C[C@H]2O)c(OC)c1	ZINC000034629533	356817559	/nfs/dbraw/zinc/81/75/59/356817559.db2.gz	MGNNDUKLPNLAFW-NWDGAFQWSA-N	1	0	281.352	1.492	50	0		CDAARO
O=C(Nc1ccc(Br)cn1)C1CC[NH2+]CC1	ZINC000034939009	356824450	/nfs/dbraw/zinc/82/44/50/356824450.db2.gz	QZHBVIZQRKHROA-UHFFFAOYSA-N	1	0	284.157	1.782	50	0		CDAARO
Cc1cc2c(ncn(CCN3CC[NH+](C)CC3)c2=O)s1	ZINC000032578117	356782912	/nfs/dbraw/zinc/78/29/12/356782912.db2.gz	HWWAUFVMORVPMJ-UHFFFAOYSA-N	1	0	292.408	1.014	50	0		CDAARO
Clc1ccc2nc(CN3CCC[NH2+]CC3)cn2c1	ZINC000036946412	356891088	/nfs/dbraw/zinc/89/10/88/356891088.db2.gz	FCQYSLIAPORZSU-UHFFFAOYSA-N	1	0	264.760	1.783	50	0		CDAARO
CCOC(=O)c1ccc(N2CC[NH+](C)CC2)c(N)c1	ZINC000041079781	357021306	/nfs/dbraw/zinc/02/13/06/357021306.db2.gz	YHQXIXVKKUCLCW-UHFFFAOYSA-N	1	0	263.341	1.197	50	0		CDAARO
Cn1ncc(C[N@H+]2[C@@H]3CC[C@H]2CNC(=O)C3)c1C1CC1	ZINC000065393854	357535720	/nfs/dbraw/zinc/53/57/20/357535720.db2.gz	YBDUOCKOWXKOAN-OLZOCXBDSA-N	1	0	274.368	1.150	50	0		CDAARO
CCOC(=O)N1CCC([NH2+]CCSc2c[nH]nn2)CC1	ZINC000065399069	357538293	/nfs/dbraw/zinc/53/82/93/357538293.db2.gz	SVAGBKNSDTVHHE-UHFFFAOYSA-N	1	0	299.400	1.107	50	0		CDAARO
COc1cc(NC[C@@H](c2ccccn2)[NH+](C)C)ncn1	ZINC000065409637	357539153	/nfs/dbraw/zinc/53/91/53/357539153.db2.gz	BGMKAXXYYVBQKI-LBPRGKRZSA-N	1	0	273.340	1.595	50	0		CDAARO
COCC[N@@H+]1CC[C@H](c2nc(C)nn2-c2ccccn2)C1	ZINC000065489547	357544009	/nfs/dbraw/zinc/54/40/09/357544009.db2.gz	SJFVEGXSCCUNQG-ZDUSSCGKSA-N	1	0	287.367	1.406	50	0		CDAARO
O=C(NC1CC1)c1ccc(OC[C@H]2CCC[NH2+]C2)cc1	ZINC000066323494	357562155	/nfs/dbraw/zinc/56/21/55/357562155.db2.gz	OLUZGBVUIVZMMK-LBPRGKRZSA-N	1	0	274.364	1.957	50	0		CDAARO
CCNc1cc(N2CCN(C(=O)C(C)C)CC2)nc(C)[nH+]1	ZINC000067601964	357613855	/nfs/dbraw/zinc/61/38/55/357613855.db2.gz	FMZOTSCJRCBRGO-UHFFFAOYSA-N	1	0	291.399	1.521	50	0		CDAARO
NC(=O)CC[N@@H+]1CCc2onc(-c3ccccc3F)c2C1	ZINC000067850845	357632007	/nfs/dbraw/zinc/63/20/07/357632007.db2.gz	CLVRRYOLKCNIAU-UHFFFAOYSA-N	1	0	289.310	1.714	50	0		CDAARO
C[C@@H](Cn1cccn1)c1nc(CC2CC[NH+](C)CC2)no1	ZINC000067856709	357633061	/nfs/dbraw/zinc/63/30/61/357633061.db2.gz	MWHHVMJOGBEJBF-LBPRGKRZSA-N	1	0	289.383	1.954	50	0		CDAARO
CC(C)CO[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2[NH3+])C1	ZINC000299740280	357700257	/nfs/dbraw/zinc/70/02/57/357700257.db2.gz	XZLKCXJEBZHBMP-FRRDWIJNSA-N	1	0	254.374	1.387	50	0		CDAARO
C[NH+](C)CCCNC(=O)C1(c2ccccc2)CCOCC1	ZINC000071753607	357777959	/nfs/dbraw/zinc/77/79/59/357777959.db2.gz	OEPUGWVQMKPJJG-UHFFFAOYSA-N	1	0	290.407	1.803	50	0		CDAARO
OCCC[NH+]1CCN(c2nccc(C3CCCC3)n2)CC1	ZINC000071763615	357780091	/nfs/dbraw/zinc/78/00/91/357780091.db2.gz	MOUVYTHDBQLTLN-UHFFFAOYSA-N	1	0	290.411	1.639	50	0		CDAARO
Cc1nc2cc(CNC(=O)[C@H]3CC[C@@H]([NH3+])C3)ccc2n1C	ZINC000072477009	357837773	/nfs/dbraw/zinc/83/77/73/357837773.db2.gz	LTTRJWKQGIGTES-QWHCGFSZSA-N	1	0	286.379	1.625	50	0		CDAARO
COc1ccc(C[NH2+][C@H]2CCCC[C@@H]2C(N)=O)cc1	ZINC000097113861	357982766	/nfs/dbraw/zinc/98/27/66/357982766.db2.gz	OULPPPPNOYNOFP-KBPBESRZSA-N	1	0	262.353	1.829	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)CNc2cc[nH+]cc2C(N)=O)n1	ZINC000097140632	357995589	/nfs/dbraw/zinc/99/55/89/357995589.db2.gz	ODAREPJHSMPNFX-SNVBAGLBSA-N	1	0	287.367	1.742	50	0		CDAARO
Cn1cc(C2CC[NH+](Cc3ccc(C(N)=O)cc3)CC2)cn1	ZINC000097203376	358034756	/nfs/dbraw/zinc/03/47/56/358034756.db2.gz	OEBSPFRSXCJOMV-UHFFFAOYSA-N	1	0	298.390	1.899	50	0		CDAARO
CCOc1cccc(CCNC(=O)[C@H]2CCC[NH2+]2)c1	ZINC000097234145	358049868	/nfs/dbraw/zinc/04/98/68/358049868.db2.gz	DBXQETFVKXPCKO-CQSZACIVSA-N	1	0	262.353	1.496	50	0		CDAARO
O=c1cc([C@@H]2CCC[NH2+]C2)nc(-c2ccc3c(c2)OCO3)[nH]1	ZINC000023153437	358093331	/nfs/dbraw/zinc/09/33/31/358093331.db2.gz	QJZYOOPDKVBQQE-LLVKDONJSA-N	1	0	299.330	1.633	50	0		CDAARO
Cc1cc(N[C@H]2CCc3nnc(C(C)C)n3C2)nc(N)[nH+]1	ZINC000097199315	358187699	/nfs/dbraw/zinc/18/76/99/358187699.db2.gz	ZXEIILAULUDKHU-JTQLQIEISA-N	1	0	287.371	1.509	50	0		CDAARO
C[N@H+]1C[C@H]2CN(C(=O)c3ccc4c(c3)CCC(=O)N4)C[C@H]2C1	ZINC000192476771	358206245	/nfs/dbraw/zinc/20/62/45/358206245.db2.gz	FNJNMQTYOVGRBU-OKILXGFUSA-N	1	0	299.374	1.205	50	0		CDAARO
S=C1N=NC(c2ccncc2)N1CC[NH+]1CCCC1	ZINC000019897316	358213808	/nfs/dbraw/zinc/21/38/08/358213808.db2.gz	AFBQTVMVQOGWSD-UHFFFAOYSA-N	1	0	275.381	1.725	50	0		CDAARO
COc1cccc(C[NH2+][C@H]2CN3CCC2CC3)c1OC	ZINC000019947886	358226846	/nfs/dbraw/zinc/22/68/46/358226846.db2.gz	YHYGIQDGXVYBQX-AWEZNQCLSA-N	1	0	276.380	1.888	50	0		CDAARO
CCc1nnc(CNc2nc(N)[nH+]c(CC)c2C)o1	ZINC000095357227	358683790	/nfs/dbraw/zinc/68/37/90/358683790.db2.gz	ZHKQPGDJASRMPZ-UHFFFAOYSA-N	1	0	262.317	1.487	50	0		CDAARO
CN(C)c1cnn(CC[C@@H]2CCCC[N@@H+]2C)c(=O)c1	ZINC000095354844	358684020	/nfs/dbraw/zinc/68/40/20/358684020.db2.gz	RIXSLZHQTRGOQQ-LBPRGKRZSA-N	1	0	264.373	1.184	50	0		CDAARO
C[NH+](C)CC(=O)N1CC[C@H](Cc2ccc(CO)cc2)C1	ZINC000095389174	358691959	/nfs/dbraw/zinc/69/19/59/358691959.db2.gz	IWRVQWPDJIAFPF-OAHLLOKOSA-N	1	0	276.380	1.132	50	0		CDAARO
NC(=O)[C@@H](c1ccccc1)[N@@H+]1CCCC[C@H]1Cn1cccn1	ZINC000247707050	358744176	/nfs/dbraw/zinc/74/41/76/358744176.db2.gz	FTRHOVFPOKCKAD-JKSUJKDBSA-N	1	0	298.390	1.964	50	0		CDAARO
O=C(C[C@@H]1COCC[NH2+]1)NCCCc1ccccc1F	ZINC000097463547	358778424	/nfs/dbraw/zinc/77/84/24/358778424.db2.gz	FYSQBHVETDZPMT-CYBMUJFWSA-N	1	0	280.343	1.253	50	0		CDAARO
C[n+]1cccc(/C=C2\N=C(c3ccccc3)OC2=O)c1	ZINC000000509799	366462803	/nfs/dbraw/zinc/46/28/03/366462803.db2.gz	KDMLPZXKICNLKW-UVTDQMKNSA-N	1	0	265.292	1.856	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)c2c[nH]c(=O)c3ccccc23)C1	ZINC000097775779	358798985	/nfs/dbraw/zinc/79/89/85/358798985.db2.gz	KMFBWCIIFALXJB-SNVBAGLBSA-N	1	0	271.320	1.091	50	0		CDAARO
CCCC[C@H]1C=CCN1Cc1cc2n(n1)CC[NH2+]C2	ZINC000216006331	358916969	/nfs/dbraw/zinc/91/69/69/358916969.db2.gz	QMPDGKMOAFXFGG-AWEZNQCLSA-N	1	0	260.385	1.917	50	0		CDAARO
COc1c(F)cccc1CN1C[C@@H]2C[N@@H+](C)C[C@@H]2C1	ZINC000215295279	358882355	/nfs/dbraw/zinc/88/23/55/358882355.db2.gz	COXNZJJNJMEXIS-BETUJISGSA-N	1	0	264.344	1.828	50	0		CDAARO
CCC(=O)N1C[C@@H]2C[N@@H+](C3CCCC3)CC[C@]2(CO)C1	ZINC000257177406	359101282	/nfs/dbraw/zinc/10/12/82/359101282.db2.gz	WXGNHVGGDZTVOA-XJKSGUPXSA-N	1	0	280.412	1.482	50	0		CDAARO
O=C(C[N@H+]1CCC[C@@H](O)C1)N(Cc1ccncc1)C1CC1	ZINC000219519829	359101857	/nfs/dbraw/zinc/10/18/57/359101857.db2.gz	HKPRXJMGBOQLCZ-OAHLLOKOSA-N	1	0	289.379	1.029	50	0		CDAARO
COC[C@@H](C[NH+]1CCN(c2ccccc2)CC1)OC	ZINC000071771406	359105177	/nfs/dbraw/zinc/10/51/77/359105177.db2.gz	RIDXJEOOMOOKEG-OAHLLOKOSA-N	1	0	264.369	1.470	50	0		CDAARO
CN(Cc1ccccc1)c1cc(C2CC([NH3+])C2)nc(N)n1	ZINC000220713290	359192522	/nfs/dbraw/zinc/19/25/22/359192522.db2.gz	MECHXJCNXJCAAD-UHFFFAOYSA-N	1	0	283.379	1.900	50	0		CDAARO
C[N@@H+]1CCOC[C@H]2CCN(C(=O)c3ccco3)C[C@H]21	ZINC000257180327	359204733	/nfs/dbraw/zinc/20/47/33/359204733.db2.gz	KOMMZDUNXHUGKJ-VXGBXAGGSA-N	1	0	264.325	1.072	50	0		CDAARO
[NH3+]Cc1ccc(C(=O)N2CC[C@@](O)(C(F)(F)F)C2)cc1	ZINC000261691828	359552489	/nfs/dbraw/zinc/55/24/89/359552489.db2.gz	HRETXMWVWMSBMI-LBPRGKRZSA-N	1	0	288.269	1.285	50	0		CDAARO
O=C(N1CC[NH2+]CC12CCCCC2)C(F)(F)F	ZINC000088395960	360153037	/nfs/dbraw/zinc/15/30/37/360153037.db2.gz	UDLHMYIYXQOIRQ-UHFFFAOYSA-N	1	0	250.264	1.683	50	0		CDAARO
CCn1ccc(C(=O)N2CC[C@H](n3c(C)c[nH+]c3C)C2)n1	ZINC000409420115	360223077	/nfs/dbraw/zinc/22/30/77/360223077.db2.gz	FLCLUBRIJHAVSP-ZDUSSCGKSA-N	1	0	287.367	1.804	50	0		CDAARO
COCCC(=O)N1CCC(n2c(C)c[nH+]c2C)CC1	ZINC000409421084	360230478	/nfs/dbraw/zinc/23/04/78/360230478.db2.gz	FYETWAULLCFBQE-UHFFFAOYSA-N	1	0	265.357	1.700	50	0		CDAARO
Cc1nc(-c2ccccc2)cc(N2CC[NH2+]CC2)n1	ZINC000011849567	360350018	/nfs/dbraw/zinc/35/00/18/360350018.db2.gz	RFUIDVPXEWEBKK-UHFFFAOYSA-N	1	0	254.337	1.862	50	0		CDAARO
O=C1NCC[C@H]1[NH+]1CCC(COc2ccccc2)CC1	ZINC000178192954	189096866	/nfs/dbraw/zinc/09/68/66/189096866.db2.gz	GEZNEAQQNJNSOD-OAHLLOKOSA-N	1	0	274.364	1.666	50	0		CDAARO
O=C(NCc1cccs1)N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000426549131	360682924	/nfs/dbraw/zinc/68/29/24/360682924.db2.gz	IIGXDAVXIXECMS-MPZDIEGVSA-N	1	0	277.393	1.640	50	0		CDAARO
O=C(c1cccc(-c2c[nH]cn2)c1)N1CC[N@@H+]2CCC[C@@H]2C1	ZINC000426389210	360662131	/nfs/dbraw/zinc/66/21/31/360662131.db2.gz	DVSNCZBLSHQMIV-OAHLLOKOSA-N	1	0	296.374	1.997	50	0		CDAARO
Cc1ccc2cccc(C(=O)N3CC[C@@H](C[NH3+])C3)c2n1	ZINC000178520583	189123346	/nfs/dbraw/zinc/12/33/46/189123346.db2.gz	MXFBTXADRSQTSC-LBPRGKRZSA-N	1	0	269.348	1.964	50	0		CDAARO
Cc1cccc(OCCC(=O)N2CC[C@@H](C[NH3+])C2)c1C	ZINC000178587532	189128643	/nfs/dbraw/zinc/12/86/43/189128643.db2.gz	XSNYYYDFVITBFE-AWEZNQCLSA-N	1	0	276.380	1.880	50	0		CDAARO
COc1ccccc1/C(C)=C/C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179103242	189169993	/nfs/dbraw/zinc/16/99/93/189169993.db2.gz	MCPLYNCXVBIVTG-RSKUSDAESA-N	1	0	274.364	1.919	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)c1ccnc(C2CC2)n1	ZINC000429501515	361068893	/nfs/dbraw/zinc/06/88/93/361068893.db2.gz	ACUOTQOYZOCFIN-LLVKDONJSA-N	1	0	260.341	1.178	50	0		CDAARO
CCc1nnc2ccc(NCC[NH+]3CCCCCC3)nn21	ZINC000267223509	363768893	/nfs/dbraw/zinc/76/88/93/363768893.db2.gz	OMAJAYZIJVATSQ-UHFFFAOYSA-N	1	0	288.399	1.975	50	0		CDAARO
Cc1cc(Cl)ccc1S(=O)(=O)N1CCC[C@@H]([NH3+])C1	ZINC000036297082	361462347	/nfs/dbraw/zinc/46/23/47/361462347.db2.gz	UGRVZQRKZUNBBW-LLVKDONJSA-N	1	0	288.800	1.760	50	0		CDAARO
C[N@@H+]1CCN(Cc2c(F)cccc2F)C[C@H]1CCO	ZINC000104374541	361586984	/nfs/dbraw/zinc/58/69/84/361586984.db2.gz	ZRSAAQRJXWEKCK-LLVKDONJSA-N	1	0	270.323	1.463	50	0		CDAARO
CCNC(=O)NC(=O)C[NH2+][C@H](C)c1cc(C)ccc1C	ZINC000012886349	364142996	/nfs/dbraw/zinc/14/29/96/364142996.db2.gz	YFVCZFCAYSKDTI-GFCCVEGCSA-N	1	0	277.368	1.800	50	0		CDAARO
C[NH+]1CCN(c2ccc(NC(=O)C3CCCC3)cn2)CC1	ZINC000012919122	364433995	/nfs/dbraw/zinc/43/39/95/364433995.db2.gz	PAENWIGXHVLYKC-UHFFFAOYSA-N	1	0	288.395	1.962	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCN(C(=O)[C@H]2COc3ccccc32)C1	ZINC000251672886	366860223	/nfs/dbraw/zinc/86/02/23/366860223.db2.gz	VDDQKABIPCSTSC-OBJOEFQTSA-N	1	0	274.364	1.748	50	0		CDAARO
Cc1cc(C2CCC2)nc(N[C@H]2C[N@H+](C(C)C)C[C@@H]2O)n1	ZINC000071497827	364591685	/nfs/dbraw/zinc/59/16/85/364591685.db2.gz	GIBCQVLLAHGIKE-GJZGRUSLSA-N	1	0	290.411	1.918	50	0		CDAARO
CN(C(=O)/C=C/c1c(F)cccc1F)[C@H]1CC[NH2+]C1	ZINC000179068999	364981087	/nfs/dbraw/zinc/98/10/87/364981087.db2.gz	NGDGWNCYBZPCJT-PORFMDCZSA-N	1	0	266.291	1.798	50	0		CDAARO
COc1ccc(F)c(F)c1C(=O)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000215722684	189696802	/nfs/dbraw/zinc/69/68/02/189696802.db2.gz	JIZCPBMYZDQZCM-JTQLQIEISA-N	1	0	296.317	1.894	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@H]1NC(=O)c1cccc(F)c1F	ZINC000094345237	367428383	/nfs/dbraw/zinc/42/83/83/367428383.db2.gz	RVIOFXNDFATHHU-LDYMZIIASA-N	1	0	254.280	1.693	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC000094345305	367434654	/nfs/dbraw/zinc/43/46/54/367434654.db2.gz	LKMPYOYICALTEG-RDDDGLTNSA-N	1	0	272.270	1.832	50	0		CDAARO
CCOC(=O)N1CCC([NH2+][C@H]2CC[C@@H](CO)CC2)CC1	ZINC000252485813	367572128	/nfs/dbraw/zinc/57/21/28/367572128.db2.gz	AKPXSNCHBQRIEN-BETUJISGSA-N	1	0	284.400	1.748	50	0		CDAARO
CCNC(=O)CN1C[C@@H]2C[N@H+](C)[C@H](c3ccccc3)[C@H]2C1	ZINC000252485899	367572943	/nfs/dbraw/zinc/57/29/43/367572943.db2.gz	BXXHIUKYTMFACF-YQQAZPJKSA-N	1	0	287.407	1.357	50	0		CDAARO
O=C(CC1CC1)NCC1CC[NH+]([C@H]2CCOC2)CC1	ZINC000575609120	370630310	/nfs/dbraw/zinc/63/03/10/370630310.db2.gz	YKJNAFOCMSOSPY-AWEZNQCLSA-N	1	0	266.385	1.404	50	0		CDAARO
O=C(N[C@H]1[C@H]2CCO[C@H]2[C@@H]1[NH+]1CCCCC1)c1ccon1	ZINC000219505958	284265334	/nfs/dbraw/zinc/26/53/34/284265334.db2.gz	SRLSXOXNEVVBNS-YXCITZCRSA-N	1	0	291.351	1.046	50	0		CDAARO
c1nnc(C2CC[NH+](CC[C@@H]3CCOC3)CC2)[nH]1	ZINC000670443351	482988010	/nfs/dbraw/zinc/98/80/10/482988010.db2.gz	JWOQNDMECGPCPE-LLVKDONJSA-N	1	0	250.346	1.411	50	0		CDAARO
NC(=O)c1ccc(-c2cc3c(c(F)c2)O[C@@H](C[NH3+])C3)nc1	ZINC000299770682	372750684	/nfs/dbraw/zinc/75/06/84/372750684.db2.gz	VAPSUGSECGZISA-LLVKDONJSA-N	1	0	287.294	1.249	50	0		CDAARO
CC(C)[N@@H+]1CC[C@@H](CN(C)C(=O)CCCn2cccn2)C1	ZINC000299771432	372751073	/nfs/dbraw/zinc/75/10/73/372751073.db2.gz	WWBXUJOKUZIIMT-HNNXBMFYSA-N	1	0	292.427	1.852	50	0		CDAARO
Cc1nccn1CCC(=O)N(C)C[C@@H]1CC[N@H+](C)C1(C)C	ZINC000299773514	372752787	/nfs/dbraw/zinc/75/27/87/372752787.db2.gz	DPTBRFAQZWLLLY-AWEZNQCLSA-N	1	0	292.427	1.770	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N(C)Cc1cc(C(C)C)no1	ZINC000299785455	372761970	/nfs/dbraw/zinc/76/19/70/372761970.db2.gz	RGEGPQOATGCAKW-NSHDSACASA-N	1	0	285.413	1.837	50	0		CDAARO
Nc1nc(C(=O)N[C@@H]2CCC[N@@H+](C3CCCC3)C2)cs1	ZINC000299794474	372767315	/nfs/dbraw/zinc/76/73/15/372767315.db2.gz	KLCTZOUMNYEROO-SNVBAGLBSA-N	1	0	294.424	1.862	50	0		CDAARO
C[C@@H]1C[NH+](C[C@@H]2CCOC2)C[C@@H](C)N1C[C@H]1CCOC1	ZINC000253396698	373686129	/nfs/dbraw/zinc/68/61/29/373686129.db2.gz	DXKAABMWUJOQEF-LVQVYYBASA-N	1	0	282.428	1.454	50	0		CDAARO
COc1ccc([C@H](C[NH+](C)C)NCc2cnnn2C)cc1	ZINC000253416410	373725809	/nfs/dbraw/zinc/72/58/09/373725809.db2.gz	APVWDOHFFPDSSY-HNNXBMFYSA-N	1	0	289.383	1.216	50	0		CDAARO
CC1(C)CN(C(=O)c2c[nH]c(=O)c3ccccc23)CC[NH2+]1	ZINC000253536899	373892416	/nfs/dbraw/zinc/89/24/16/373892416.db2.gz	NEMOZLFOWBIEHV-UHFFFAOYSA-N	1	0	285.347	1.764	50	0		CDAARO
Cc1cccc(Nc2ccc(N3CC[NH2+]CC3)nn2)n1	ZINC000206578837	374177161	/nfs/dbraw/zinc/17/71/61/374177161.db2.gz	KTIZKOGPKSEFHL-UHFFFAOYSA-N	1	0	270.340	1.333	50	0		CDAARO
CC(C)[C@H]([NH2+]CCc1ccc(S(N)(=O)=O)cc1)C1CC1	ZINC000095419861	374922065	/nfs/dbraw/zinc/92/20/65/374922065.db2.gz	YSEZTMJTZMRMRX-HNNXBMFYSA-N	1	0	296.436	1.901	50	0		CDAARO
Cc1nc(CN2CCCN(C(N)=O)CC2)nc2ccccc12	ZINC000095430659	374932508	/nfs/dbraw/zinc/93/25/08/374932508.db2.gz	JHXWDMLTZAGXKP-UHFFFAOYSA-N	1	0	299.378	1.525	50	0		CDAARO
CCCC[C@@H]([NH3+])C(=O)N1CCC(n2cccn2)CC1	ZINC000095432843	374934127	/nfs/dbraw/zinc/93/41/27/374934127.db2.gz	FVBCUCPGIQUAOG-CYBMUJFWSA-N	1	0	264.373	1.564	50	0		CDAARO
CC[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2)C[C@@H]1O	ZINC000095445094	374946139	/nfs/dbraw/zinc/94/61/39/374946139.db2.gz	NFQZBSHZLRFEQB-IPYPFGDCSA-N	1	0	265.353	1.129	50	0		CDAARO
CC[NH+](CC)CCSc1cnn(C)c(=O)c1Cl	ZINC000095409120	374911391	/nfs/dbraw/zinc/91/13/91/374911391.db2.gz	JVXVHVQWSQJHNB-UHFFFAOYSA-N	1	0	275.805	1.868	50	0		CDAARO
COc1ccc(-c2ncnc(N3CC[NH+](C)CC3)c2N)cc1	ZINC000096282114	375074079	/nfs/dbraw/zinc/07/40/79/375074079.db2.gz	KHAOTFZOEMTIEP-UHFFFAOYSA-N	1	0	299.378	1.486	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1CCN(CCn1cc(Cl)cn1)C2	ZINC000244724481	377793800	/nfs/dbraw/zinc/79/38/00/377793800.db2.gz	MUYLAWKNTFGQQX-QWHCGFSZSA-N	1	0	268.792	1.705	50	0		CDAARO
COCC[N@@H+]1CC[C@H](OC(C)=O)[C@H]2CCCC[C@H]21	ZINC000245254847	285060688	/nfs/dbraw/zinc/06/06/88/285060688.db2.gz	COHAZZNQVVNWKS-MJBXVCDLSA-N	1	0	255.358	1.829	50	0		CDAARO
COCCC[NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000008698519	260033200	/nfs/dbraw/zinc/03/32/00/260033200.db2.gz	VBSWFLDDFIIMGJ-LLVKDONJSA-N	1	0	258.362	1.622	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC000094345303	184785252	/nfs/dbraw/zinc/78/52/52/184785252.db2.gz	LKMPYOYICALTEG-HQJQHLMTSA-N	1	0	272.270	1.832	50	0		CDAARO
COCCN1CC[N@H+](Cc2ccc(C)cc2C)CCC1=O	ZINC000011880710	390201581	/nfs/dbraw/zinc/20/15/81/390201581.db2.gz	OSVKMKKBEUYIRD-UHFFFAOYSA-N	1	0	290.407	1.984	50	0		CDAARO
CC[C@H](CNC(=O)c1cnc(C)cn1)[NH+]1CCCC1	ZINC000032653740	390206569	/nfs/dbraw/zinc/20/65/69/390206569.db2.gz	XBHSDXHPQVVNPA-GFCCVEGCSA-N	1	0	262.357	1.389	50	0		CDAARO
C[C@H]1CN(C(=O)[C@@H]2CCC[NH2+]C2)c2ccc(F)cc2O1	ZINC000118962043	390449093	/nfs/dbraw/zinc/44/90/93/390449093.db2.gz	SSFMDHJDQXQEFO-WDEREUQCSA-N	1	0	278.327	1.939	50	0		CDAARO
Cc1ccccc1[C@@H](O)CNC(=O)[C@@H]([NH3+])C(C)(C)C	ZINC000237625547	131049193	/nfs/dbraw/zinc/04/91/93/131049193.db2.gz	LNVILWAFUMSOHQ-QWHCGFSZSA-N	1	0	264.369	1.518	50	0		CDAARO
C[C@H](Cn1cccn1)[NH2+]Cc1cc(F)ncc1F	ZINC000253426750	131142822	/nfs/dbraw/zinc/14/28/22/131142822.db2.gz	ASZMSEDAPGOLCQ-SECBINFHSA-N	1	0	252.268	1.735	50	0		CDAARO
O=C(c1ccccc1O)N1CC[NH+](C[C@H]2CCOC2)CC1	ZINC000096452002	393187310	/nfs/dbraw/zinc/18/73/10/393187310.db2.gz	DUQKULIBTQDQQR-CYBMUJFWSA-N	1	0	290.363	1.187	50	0		CDAARO
[NH3+]C[C@@H]1CCCCN1Cc1cnc(-c2ncccn2)s1	ZINC000097162631	397981308	/nfs/dbraw/zinc/98/13/08/397981308.db2.gz	VNYMUOPFPRNWSY-NSHDSACASA-N	1	0	289.408	1.913	50	0		CDAARO
O[C@H](C[NH+]1CCC(c2cc[nH]n2)CC1)C(F)(F)F	ZINC000181670546	148217097	/nfs/dbraw/zinc/21/70/97/148217097.db2.gz	FMDDSAJLMXMMNY-SNVBAGLBSA-N	1	0	263.263	1.512	50	0		CDAARO
CC[C@H](C)[C@H]([NH3+])C(=O)N1CCN(CC(F)F)[C@H](CC)C1	ZINC000262538686	149074075	/nfs/dbraw/zinc/07/40/75/149074075.db2.gz	KPAFUXLKODNQTH-LOWVWBTDSA-N	1	0	291.386	1.548	50	0		CDAARO
C[NH+]1CCC(O)(CNC(=O)C2CCCCCC2)CC1	ZINC000336217931	151368041	/nfs/dbraw/zinc/36/80/41/151368041.db2.gz	MWCHLECBCKYRFF-UHFFFAOYSA-N	1	0	268.401	1.530	50	0		CDAARO
COC(=O)[C@H](NC(=O)OC(C)(C)C)C1CC[NH2+]CC1	ZINC000002527603	169803151	/nfs/dbraw/zinc/80/31/51/169803151.db2.gz	YMRAMAYADDQJIS-SNVBAGLBSA-N	1	0	272.345	1.052	50	0		CDAARO
COCC(=O)NC1CC[NH+](Cc2ccccc2)CC1	ZINC000005127202	170068748	/nfs/dbraw/zinc/06/87/48/170068748.db2.gz	WKUFETKGJNDXET-UHFFFAOYSA-N	1	0	262.353	1.414	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1ccc(N)cc1OC	ZINC000005316175	170085116	/nfs/dbraw/zinc/08/51/16/170085116.db2.gz	AQOCQFLDHPSJLR-UHFFFAOYSA-N	1	0	265.357	1.349	50	0		CDAARO
COC(=O)[C@@H]1[C@H](C(=O)OC)[C@@H]2CCC[N@@H+]2C12CCCCC2	ZINC000006657986	170222901	/nfs/dbraw/zinc/22/29/01/170222901.db2.gz	YLAUEXHRCZFZSL-XQQFMLRXSA-N	1	0	295.379	1.746	50	0		CDAARO
C[C@@H](C(=O)N1CCNC1=O)[N@H+](C)Cc1ccccc1	ZINC000007340145	170278009	/nfs/dbraw/zinc/27/80/09/170278009.db2.gz	MHLCSNXJJUANKQ-NSHDSACASA-N	1	0	261.325	1.059	50	0		CDAARO
COc1ccc(F)cc1C[NH+]1CCC(C(N)=O)CC1	ZINC000008317489	170330723	/nfs/dbraw/zinc/33/07/23/170330723.db2.gz	KCTWYNNFUBKPRE-UHFFFAOYSA-N	1	0	266.316	1.532	50	0		CDAARO
COc1cccc(NC(=O)C[NH2+]C[C@H]2CCCO2)c1	ZINC000020055614	170981088	/nfs/dbraw/zinc/98/10/88/170981088.db2.gz	UIONYIXXMOGTLF-CYBMUJFWSA-N	1	0	264.325	1.402	50	0		CDAARO
CN(C)c1ncc(CN2CCO[C@@H](CC[NH+](C)C)C2)s1	ZINC000020200926	171064662	/nfs/dbraw/zinc/06/46/62/171064662.db2.gz	ITZFVCIKJZWISL-LBPRGKRZSA-N	1	0	298.456	1.362	50	0		CDAARO
CC(C)CC[N@@H+]1CCN(Cc2cccnc2)C[C@@H]1CCO	ZINC000020452464	171207209	/nfs/dbraw/zinc/20/72/09/171207209.db2.gz	OZSOKTFZAHRIJX-KRWDZBQOSA-N	1	0	291.439	1.996	50	0		CDAARO
CCOC(=O)C[C@H]([NH3+])c1ccc(OC)cc1OC	ZINC000020577694	171256451	/nfs/dbraw/zinc/25/64/51/171256451.db2.gz	YHMYNMWFMVQBGH-NSHDSACASA-N	1	0	253.298	1.657	50	0		CDAARO
CSc1cccc(CN2CC[N@H+](C)[C@@H](CCO)C2)c1	ZINC000020781211	171272581	/nfs/dbraw/zinc/27/25/81/171272581.db2.gz	OUOIVQCFBYONIT-AWEZNQCLSA-N	1	0	280.437	1.907	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COc2ccccc2OC)CC1	ZINC000020819728	171273598	/nfs/dbraw/zinc/27/35/98/171273598.db2.gz	LTVGEDJHAVOKEW-CQSZACIVSA-N	1	0	294.395	1.072	50	0		CDAARO
COC(=O)c1sc(N2CC[NH+](C(C)C)CC2)nc1N	ZINC000021658450	171318729	/nfs/dbraw/zinc/31/87/29/171318729.db2.gz	PJPGLISWUYNIQG-UHFFFAOYSA-N	1	0	284.385	1.042	50	0		CDAARO
CC(C)(C)OC(=O)C[C@H]1C[C@H](CC[NH3+])OC(C)(C)O1	ZINC000021991754	171346890	/nfs/dbraw/zinc/34/68/90/171346890.db2.gz	HWSHVKNLMBMKSR-WDEREUQCSA-N	1	0	273.373	1.977	50	0		CDAARO
COc1ccc(OC)c2sc(N3CC[NH2+]CC3)nc21	ZINC000026422399	171483393	/nfs/dbraw/zinc/48/33/93/171483393.db2.gz	BNDVLYVPFAUTOT-UHFFFAOYSA-N	1	0	279.365	1.723	50	0		CDAARO
[NH3+][C@@H]1CCCN(S(=O)(=O)Cc2ccc(F)cc2)C1	ZINC000036297247	172590988	/nfs/dbraw/zinc/59/09/88/172590988.db2.gz	KDWMOXQTFQEWFI-GFCCVEGCSA-N	1	0	272.345	1.079	50	0		CDAARO
C[C@H]1CN(CCCOc2ccc(F)cc2)CC[NH2+]1	ZINC000040456418	174267508	/nfs/dbraw/zinc/26/75/08/174267508.db2.gz	CBMYJVACGVUFIQ-LBPRGKRZSA-N	1	0	252.333	1.888	50	0		CDAARO
c1ccc(-n2nnnc2SC[C@@H]2CCC[NH2+]2)cc1	ZINC000043497180	175058299	/nfs/dbraw/zinc/05/82/99/175058299.db2.gz	FTFSIOZMNMTPIK-JTQLQIEISA-N	1	0	261.354	1.506	50	0		CDAARO
CS(=O)(=O)NCC1CC[NH+](Cc2ccsc2)CC1	ZINC000043944330	175126240	/nfs/dbraw/zinc/12/62/40/175126240.db2.gz	UCFIWLNRAQHQEV-UHFFFAOYSA-N	1	0	288.438	1.509	50	0		CDAARO
Cc1cc(NCCC(=O)NC2CCCCC2)nc(N)[nH+]1	ZINC000054124989	175554192	/nfs/dbraw/zinc/55/41/92/175554192.db2.gz	LTCVJSKZJFJZAU-UHFFFAOYSA-N	1	0	277.372	1.618	50	0		CDAARO
CCOC(=O)C1(C[C@H]2CCCCO2)CC[NH2+]CC1	ZINC000067723201	175786835	/nfs/dbraw/zinc/78/68/35/175786835.db2.gz	BUBVWNUKKWLMNE-GFCCVEGCSA-N	1	0	255.358	1.879	50	0		CDAARO
OCC(CO)[N@@H+]1CCC[C@H](CCc2ccc(F)cc2F)C1	ZINC000071748222	176258693	/nfs/dbraw/zinc/25/86/93/176258693.db2.gz	VNGHDMPCVLQFOU-GFCCVEGCSA-N	1	0	299.361	1.963	50	0		CDAARO
C[N@@H+]1CCC[C@H]1CCNS(=O)(=O)NCc1ccccc1	ZINC000071749467	176259468	/nfs/dbraw/zinc/25/94/68/176259468.db2.gz	IDMDWRLQTBWAAY-AWEZNQCLSA-N	1	0	297.424	1.095	50	0		CDAARO
COc1c(C)cc(C(=O)N2CC[C@@H]([NH3+])[C@@H](OC)C2)cc1C	ZINC000071764006	176262055	/nfs/dbraw/zinc/26/20/55/176262055.db2.gz	JYFUDNBJDMEFQE-KGLIPLIRSA-N	1	0	292.379	1.500	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCN(C(=O)c2cccc3cc[nH]c32)C1	ZINC000072156143	176328898	/nfs/dbraw/zinc/32/88/98/176328898.db2.gz	GEVBADFUNHERHU-MRXNPFEDSA-N	1	0	287.363	1.307	50	0		CDAARO
Cc1cc(CCC(=O)N(C)C)nc(C2CC[NH2+]CC2)n1	ZINC000072343980	176372517	/nfs/dbraw/zinc/37/25/17/176372517.db2.gz	SWUHQSAIMXQINS-UHFFFAOYSA-N	1	0	276.384	1.273	50	0		CDAARO
O=c1ccc(-c2ccccc2)nn1C[C@@H]1CCC[NH2+]1	ZINC000077010780	177146519	/nfs/dbraw/zinc/14/65/19/177146519.db2.gz	SMUDEZZTQUUBHL-ZDUSSCGKSA-N	1	0	255.321	1.662	50	0		CDAARO
[NH3+]C[C@H](O)CC(=O)N1CCC(Cc2ccc(F)cc2)CC1	ZINC000077453561	177270158	/nfs/dbraw/zinc/27/01/58/177270158.db2.gz	NBASUJHSFUYIER-OAHLLOKOSA-N	1	0	294.370	1.317	50	0		CDAARO
C[C@H](C1CCN(Cc2ncc[nH]2)CC1)[NH+]1CCN(C)CC1	ZINC000077505087	177276314	/nfs/dbraw/zinc/27/63/14/177276314.db2.gz	YKVXXBRCHRPUHM-CQSZACIVSA-N	1	0	291.443	1.258	50	0		CDAARO
CC(C)c1ccccc1S(=O)(=O)N[C@@H](C[NH3+])C1CC1	ZINC000193293834	275756400	/nfs/dbraw/zinc/75/64/00/275756400.db2.gz	UTGCINIATFERKC-ZDUSSCGKSA-N	1	0	282.409	1.826	50	0		CDAARO
CN1C[C@H]([NH2+][C@H]2CCc3ccccc3C2)CCC1=O	ZINC000084060307	277205286	/nfs/dbraw/zinc/20/52/86/277205286.db2.gz	MSJNOVANOURGMA-LSDHHAIUSA-N	1	0	258.365	1.754	50	0		CDAARO
CC(C)C[N@H+](C)C[C@@]1(O)CCCN(CC(C)(C)C)C1=O	ZINC000012466921	277374370	/nfs/dbraw/zinc/37/43/70/277374370.db2.gz	RXKFTIUOCAVAGH-INIZCTEOSA-N	1	0	284.444	1.974	50	0		CDAARO
CC1(C)Cc2c(sc(N)c2C(N)=O)C(C)(C)[NH2+]1	ZINC000085436316	278394886	/nfs/dbraw/zinc/39/48/86/278394886.db2.gz	NTBCATOACZQZAB-UHFFFAOYSA-N	1	0	253.371	1.589	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1C(=O)N1CCC2(CC1)OC[C@H](C)O2	ZINC000089977242	279275965	/nfs/dbraw/zinc/27/59/65/279275965.db2.gz	LCUKTFFHMNITAY-KBPBESRZSA-N	1	0	296.411	1.615	50	0		CDAARO
Cc1cc(Br)cnc1N1CC[NH2+]CC1	ZINC000019721258	280311410	/nfs/dbraw/zinc/31/14/10/280311410.db2.gz	VBWGQQQDJZLNHR-UHFFFAOYSA-N	1	0	256.147	1.562	50	0		CDAARO
Cc1cc2nc(N3CC[NH+](C)CC3)c3ccccc3n2n1	ZINC000026761428	280704944	/nfs/dbraw/zinc/70/49/44/280704944.db2.gz	JKEUDYMGDQLRPU-UHFFFAOYSA-N	1	0	281.363	1.943	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]CCC(=O)NC1CCCCC1	ZINC000097159385	281768687	/nfs/dbraw/zinc/76/86/87/281768687.db2.gz	KURDNSCOENFPDT-UHFFFAOYSA-N	1	0	278.400	1.955	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(CCO[C@@H]2CCCC[C@@H]2C)C[C@@H]1C	ZINC000106840955	290114097	/nfs/dbraw/zinc/11/40/97/290114097.db2.gz	HJKMFYUHPTUJKZ-LUKYLMHMSA-N	1	0	298.471	1.969	50	0		CDAARO
COc1ccc([C@@H]([NH2+]C(C)C)[C@H]2C[C@H](O)C2)cn1	ZINC000253378484	295215300	/nfs/dbraw/zinc/21/53/00/295215300.db2.gz	GKGWFEKMJKYTPQ-YRGRVCCFSA-N	1	0	250.342	1.900	50	0		CDAARO
COc1ccc([C@@H]([NH2+]CCO)C2CCOCC2)cc1	ZINC000095986087	295215860	/nfs/dbraw/zinc/21/58/60/295215860.db2.gz	YGLCXGKIKROZGG-OAHLLOKOSA-N	1	0	265.353	1.745	50	0		CDAARO
O=C(NC[C@@H]1CC[N@@H+](C2CCCC2)C1)c1cncnc1	ZINC000534588999	328317019	/nfs/dbraw/zinc/31/70/19/328317019.db2.gz	BRYNZQPZXXRQMM-LBPRGKRZSA-N	1	0	274.368	1.471	50	0		CDAARO
Cc1nccn1CC(=O)N[C@@H](C)c1cccc(C)n1	ZINC000534634817	328333287	/nfs/dbraw/zinc/33/32/87/328333287.db2.gz	JYZPEQNLKSXGFB-NSHDSACASA-N	1	0	258.325	1.772	50	0		CDAARO
Cc1ccccc1[C@H](CNC(=O)N1CCOCC1)[NH+](C)C	ZINC000534639243	328335179	/nfs/dbraw/zinc/33/51/79/328335179.db2.gz	GRRFLNZHWSTIKJ-HNNXBMFYSA-N	1	0	291.395	1.640	50	0		CDAARO
Cc1nc(N)nc(NC[C@@H](C(C)C)[NH+](C)C)c1Cl	ZINC000534651141	328337334	/nfs/dbraw/zinc/33/73/34/328337334.db2.gz	PKSZJFHEFNLYKH-VIFPVBQESA-N	1	0	271.796	1.271	50	0		CDAARO
Fc1ccc(N2CC[C@@H]([NH2+]CCn3ccnn3)C2)cc1	ZINC000534648360	328343416	/nfs/dbraw/zinc/34/34/16/328343416.db2.gz	IZXCIDLCTAFFJE-CYBMUJFWSA-N	1	0	275.331	1.286	50	0		CDAARO
Cn1nc(CNC(=O)[C@@H]2C=CC[NH2+]2)c2c1cccc2Cl	ZINC000534657497	328341121	/nfs/dbraw/zinc/34/11/21/328341121.db2.gz	NPKOAYQQSBKHJP-JTQLQIEISA-N	1	0	290.754	1.371	50	0		CDAARO
O=C(NCC1(CO)CC1)C1([NH+]2CCCC2)CCCCC1	ZINC000534658244	328341402	/nfs/dbraw/zinc/34/14/02/328341402.db2.gz	PTSKVAQNKLAPIM-UHFFFAOYSA-N	1	0	280.412	1.674	50	0		CDAARO
C[C@H](NC(=O)C[NH2+][C@H]1CCC(C)(C)C[C@H]1C)C(=O)N(C)C	ZINC000097099861	323207363	/nfs/dbraw/zinc/20/73/63/323207363.db2.gz	UFBRVSPVLCKVAZ-AGIUHOORSA-N	1	0	297.443	1.384	50	0		CDAARO
COc1ccc2[nH]c(C(=O)N3CC[NH2+]CC3)cc2c1OC	ZINC000005489266	326815907	/nfs/dbraw/zinc/81/59/07/326815907.db2.gz	RWDRPEXHNHGSTI-UHFFFAOYSA-N	1	0	289.335	1.231	50	0		CDAARO
CC(C)n1cnnc1[C@H](C)NC(=O)C[N@H+](C)C1CCCC1	ZINC000670436355	482974804	/nfs/dbraw/zinc/97/48/04/482974804.db2.gz	XOAMZBQYKGWVDR-LBPRGKRZSA-N	1	0	293.415	1.911	50	0		CDAARO
CCOc1ccc(C[N@@H+]2CCC[C@H](c3nnc[nH]3)C2)cn1	ZINC000670448438	483004053	/nfs/dbraw/zinc/00/40/53/483004053.db2.gz	DPNWROSIRRFAIG-ZDUSSCGKSA-N	1	0	287.367	1.978	50	0		CDAARO
COCC[C@@H]1C[N@H+](CCCn2cc(C)cn2)CCO1	ZINC000670451744	483014527	/nfs/dbraw/zinc/01/45/27/483014527.db2.gz	PKSILBZRSFMTQA-CQSZACIVSA-N	1	0	267.373	1.319	50	0		CDAARO
C[C@@H](CS(C)(=O)=O)[NH2+]Cc1ccc(-c2ncon2)cc1	ZINC000670461874	483049599	/nfs/dbraw/zinc/04/95/99/483049599.db2.gz	DGAQGRPTCRWRAY-JTQLQIEISA-N	1	0	295.364	1.259	50	0		CDAARO
Nc1ncc(C[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)s1	ZINC000670462605	483050907	/nfs/dbraw/zinc/05/09/07/483050907.db2.gz	BEPHRERMIJPLCD-VIFPVBQESA-N	1	0	263.370	1.828	50	0		CDAARO
CCCc1ncncc1C(=O)N[C@@H]1CCC[C@H]1[NH+](C)C	ZINC000670469080	483061146	/nfs/dbraw/zinc/06/11/46/483061146.db2.gz	QRSOOWVRJIEXTD-ZIAGYGMSSA-N	1	0	276.384	1.642	50	0		CDAARO
O=C(NCC[N@H+]1CCCC[C@@H]1CO)c1ccc(Cl)cn1	ZINC000670473352	483083548	/nfs/dbraw/zinc/08/35/48/483083548.db2.gz	LNPUMFQWZNMHPZ-GFCCVEGCSA-N	1	0	297.786	1.312	50	0		CDAARO
COC[C@H](NC(=O)NC[C@@H]1CCC[N@H+](C)C1)c1ccco1	ZINC000083877730	483216191	/nfs/dbraw/zinc/21/61/91/483216191.db2.gz	RVKWNRGNOKZRIT-STQMWFEESA-N	1	0	295.383	1.608	50	0		CDAARO
Cc1cc([C@@H]2CCC[N@H+](CCn3cncn3)C2)[nH]n1	ZINC000084111276	483247987	/nfs/dbraw/zinc/24/79/87/483247987.db2.gz	GNIUKKHTIWZFDJ-GFCCVEGCSA-N	1	0	260.345	1.189	50	0		CDAARO
[NH3+]CCN1C(=O)O[C@H](Cc2cccc(Cl)c2)C1=O	ZINC000039320078	518197362	/nfs/dbraw/zinc/19/73/62/518197362.db2.gz	MPIMDVJJNDUJPU-SNVBAGLBSA-N	1	0	268.700	1.189	50	0		CDAARO
O=C(NCc1cc2cc(F)ccc2s1)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000299749647	526642920	/nfs/dbraw/zinc/64/29/20/526642920.db2.gz	LDGGVKKZUDIVNB-ZYHUDNBSSA-N	1	0	294.351	1.379	50	0		CDAARO
CC(=O)Nc1cccc(C[N@@H+](C)CC[C@@H](C)O)c1	ZINC000096441473	527051766	/nfs/dbraw/zinc/05/17/66/527051766.db2.gz	ABFLDIXQWTZRGT-LLVKDONJSA-N	1	0	250.342	1.848	50	0		CDAARO
C[C@H](C(=O)N1CC[C@@H]([NH3+])C1)c1ccc(F)c(F)c1	ZINC000299739786	567901510	/nfs/dbraw/zinc/90/15/10/567901510.db2.gz	RIHRUPADCIHTTK-WCBMZHEXSA-N	1	0	254.280	1.628	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@](O)([C@@H]([NH3+])C2CC2)C1	ZINC000958528542	613978714	/nfs/dbraw/zinc/97/87/14/613978714.db2.gz	QEBFZINDPCOVGI-GWCFXTLKSA-N	1	0	256.346	1.096	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@](O)([C@H]([NH3+])C2CC2)C1	ZINC000958528544	613978844	/nfs/dbraw/zinc/97/88/44/613978844.db2.gz	QEBFZINDPCOVGI-MFKMUULPSA-N	1	0	256.346	1.096	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@](O)([C@@H]([NH3+])C2CCCC2)C1	ZINC000958528827	613978997	/nfs/dbraw/zinc/97/89/97/613978997.db2.gz	WBHHXFZINGEEKD-WFASDCNBSA-N	1	0	284.400	1.876	50	0		CDAARO
CC[C@@H]([NH3+])[C@@]1(O)CCCN(C(=O)OC(C)(C)C)C1	ZINC000958528702	615523667	/nfs/dbraw/zinc/52/36/67/615523667.db2.gz	ZNUGSAZMWZVNIU-ZWNOBZJWSA-N	1	0	258.362	1.486	50	0		CDAARO
Cc1cccn2ncc(C(=O)N[C@H]3CCC[N@@H+]4CCC[C@@H]34)c12	ZINC001772702394	1159438148	/nfs/dbraw/zinc/43/81/48/1159438148.db2.gz	BNEYCJKWQWIPKY-GJZGRUSLSA-N	1	0	298.390	1.999	50	0		CDAARO
Oc1ccc(CC[N@H+]2C[C@H](O)[C@H](Cc3ccncc3)C2)cc1	ZINC001704299153	1177679832	/nfs/dbraw/zinc/67/98/32/1177679832.db2.gz	NFQBHMQQHYYUFY-AEFFLSMTSA-N	1	0	298.386	1.865	50	0		CDAARO
CCC[NH+]1CCC(NC(=O)c2nc(C)c[nH]2)CC1	ZINC000020562465	735352055	/nfs/dbraw/zinc/35/20/55/735352055.db2.gz	ZCGDHGQKIFBGCY-UHFFFAOYSA-N	1	0	250.346	1.322	50	0		CDAARO
O[C@H]1COCCN(Cc2cc(C[NH+]3CCCC3)cs2)C1	ZINC000077408213	735415373	/nfs/dbraw/zinc/41/53/73/735415373.db2.gz	KHZSPZGLMRGUIY-CQSZACIVSA-N	1	0	296.436	1.537	50	0		CDAARO
COc1cc(C[NH2+][C@H]2CN3CCC2CC3)cc(OC)c1	ZINC000019948354	735516741	/nfs/dbraw/zinc/51/67/41/735516741.db2.gz	AITUAHIRCSIPTC-INIZCTEOSA-N	1	0	276.380	1.888	50	0		CDAARO
c1nn(-c2ccccc2)cc1C[NH2+]CC1OCCCO1	ZINC000716313431	733285036	/nfs/dbraw/zinc/28/50/36/733285036.db2.gz	BOPSIMMZFZASNV-UHFFFAOYSA-N	1	0	273.336	1.725	50	0		CDAARO
O=C(Cn1cccn1)NC[C@@H]1CCCN(c2cc[nH+]cc2)C1	ZINC000952972368	733832736	/nfs/dbraw/zinc/83/27/36/733832736.db2.gz	GNXKMXDHCKJIHF-AWEZNQCLSA-N	1	0	299.378	1.311	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(NC[C@H](C)n2cncn2)c1C	ZINC000065455627	733913772	/nfs/dbraw/zinc/91/37/72/733913772.db2.gz	YJBPRTVORVUFIP-VIFPVBQESA-N	1	0	275.360	1.424	50	0		CDAARO
COc1ncc(C[NH2+][C@H]2CCCN(C(=O)C(C)C)C2)cn1	ZINC000952985395	734453304	/nfs/dbraw/zinc/45/33/04/734453304.db2.gz	ACGALAWKEJOXJI-ZDUSSCGKSA-N	1	0	292.383	1.222	50	0		CDAARO
CCc1ccccc1S(=O)(=O)NC1(C[NH3+])CCCC1	ZINC000193275384	735123702	/nfs/dbraw/zinc/12/37/02/735123702.db2.gz	XZJSDRFGXDJUSZ-UHFFFAOYSA-N	1	0	282.409	1.799	50	0		CDAARO
Cc1nc(N(C)CC2(CO)CCCC2)cc(N)[nH+]1	ZINC000091321085	736160358	/nfs/dbraw/zinc/16/03/58/736160358.db2.gz	XDYIKNJUQJQPJV-UHFFFAOYSA-N	1	0	250.346	1.356	50	0		CDAARO
CNC(=O)[C@@H]1C[C@H]([NH3+])CN1C(=O)c1cccc2ccccc21	ZINC000067842898	936620226	/nfs/dbraw/zinc/62/02/26/936620226.db2.gz	DESMYCCAECZHGE-WFASDCNBSA-N	1	0	297.358	1.128	50	0		CDAARO
C/C=C/C[NH+]1CCC(CNC(=O)[C@H]2CCCO2)CC1	ZINC000820394970	925521966	/nfs/dbraw/zinc/52/19/66/925521966.db2.gz	AWJUIJXHFCFFPO-BAABZTOOSA-N	1	0	266.385	1.570	50	0		CDAARO
CC(C)[C@@H](CNc1nccnc1N(C)C)[NH+](C)C	ZINC000820694830	925545089	/nfs/dbraw/zinc/54/50/89/925545089.db2.gz	ZBKDSGYUNDSGMN-LLVKDONJSA-N	1	0	251.378	1.541	50	0		CDAARO
C[C@@H](C[NH+]1CCCC1)NC(=O)N1CC(c2ccncc2)C1	ZINC000821793846	925598922	/nfs/dbraw/zinc/59/89/22/925598922.db2.gz	HLUQKDBUZMTGJB-ZDUSSCGKSA-N	1	0	288.395	1.675	50	0		CDAARO
Cc1cc(CN(C)C(=O)C[NH+]2CCCCCC2)on1	ZINC000827887351	925993361	/nfs/dbraw/zinc/99/33/61/925993361.db2.gz	CLRDQEVFLDTQDW-UHFFFAOYSA-N	1	0	265.357	1.817	50	0		CDAARO
Nc1cc(C(=O)NCC[N@@H+]2CC[C@@H](c3ccccc3)C2)[nH]n1	ZINC000828210102	926071848	/nfs/dbraw/zinc/07/18/48/926071848.db2.gz	PTAKDHBPYBFKRT-CYBMUJFWSA-N	1	0	299.378	1.211	50	0		CDAARO
COc1cnc(N(C)CC[N@H+](C)C2CCCC2)nc1	ZINC001529172285	969002272	/nfs/dbraw/zinc/00/22/72/969002272.db2.gz	BYGJCGIEMJYKPM-UHFFFAOYSA-N	1	0	264.373	1.796	50	0		CDAARO
O[C@@H]1C[N@H+](Cc2ccsc2)C[C@H]1Cc1cnccn1	ZINC001529185405	969006225	/nfs/dbraw/zinc/00/62/25/969006225.db2.gz	MNUNASBVKSSUBO-TZMCWYRMSA-N	1	0	275.377	1.574	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]Cc1cnc(C)cn1	ZINC001506405491	975151313	/nfs/dbraw/zinc/15/13/13/975151313.db2.gz	DUXDXPTYQLDSPT-LBPRGKRZSA-N	1	0	259.357	1.722	50	0		CDAARO
CSc1nccc(NCC[N@@H+]2CCC[C@@H](CO)C2)n1	ZINC001506407150	975151561	/nfs/dbraw/zinc/15/15/61/975151561.db2.gz	UKQHVWCWTKBAOL-LLVKDONJSA-N	1	0	282.413	1.315	50	0		CDAARO
COCCN1C[C@H](CNc2cc[nH+]c3ccccc23)CC1=O	ZINC001506406857	975151898	/nfs/dbraw/zinc/15/18/98/975151898.db2.gz	KBXVMPYPFZECIK-ZDUSSCGKSA-N	1	0	299.374	1.564	50	0		CDAARO
c1c[nH]c(CC[NH2+][C@H]2CCN(c3ccccc3)C2)n1	ZINC001506418395	975156701	/nfs/dbraw/zinc/15/67/01/975156701.db2.gz	XNDDXDYHSKOLPQ-ZDUSSCGKSA-N	1	0	256.353	1.821	50	0		CDAARO
CC(=O)N[C@H]1CC[N@H+](CCc2nc3cc(C)ccc3[nH]2)C1	ZINC001506418866	975156816	/nfs/dbraw/zinc/15/68/16/975156816.db2.gz	KFRKUEPKDFIKNE-ZDUSSCGKSA-N	1	0	286.379	1.624	50	0		CDAARO
C[NH+](C)CCc1nnc(NC(=O)c2ccc[nH]2)s1	ZINC001506427790	975160991	/nfs/dbraw/zinc/16/09/91/975160991.db2.gz	NSPBRKHXOKDVEZ-UHFFFAOYSA-N	1	0	265.342	1.223	50	0		CDAARO
CC[C@H]1CN(c2ncc(F)c(NC)n2)CC[N@@H+]1C	ZINC001506430915	975161913	/nfs/dbraw/zinc/16/19/13/975161913.db2.gz	ZENDUFITVJJWJR-VIFPVBQESA-N	1	0	253.325	1.188	50	0		CDAARO
CCc1nccn1CCC(=O)N(C)C[C@@]1(C)CC[N@H+](C)C1	ZINC000584903201	341986629	/nfs/dbraw/zinc/98/66/29/341986629.db2.gz	FFGBPOOJFWZELL-INIZCTEOSA-N	1	0	292.427	1.636	50	0		CDAARO
Cc1nccn1C[C@H](C)[NH2+]CCc1noc(C2CC2)n1	ZINC000584902823	341987021	/nfs/dbraw/zinc/98/70/21/341987021.db2.gz	BCXYOUZERIVZSI-JTQLQIEISA-N	1	0	275.356	1.673	50	0		CDAARO
Cc1cnccc1CN1CC2(CC[NH2+]CC2)OC1=O	ZINC000095521639	185002593	/nfs/dbraw/zinc/00/25/93/185002593.db2.gz	BEPYDETULYQSGS-UHFFFAOYSA-N	1	0	261.325	1.464	50	0		CDAARO
O=C1C[C@H](C[NH2+]C2CSCCSC2)CN1C1CC1	ZINC000584900525	341999633	/nfs/dbraw/zinc/99/96/33/341999633.db2.gz	VOKARVKFKKZRBZ-SNVBAGLBSA-N	1	0	286.466	1.436	50	0		CDAARO
C[N@H+]([C@@H]1CCC[C@@H]1S(C)(=O)=O)[C@@H]1C=CCCC1	ZINC000084093543	539086193	/nfs/dbraw/zinc/08/61/93/539086193.db2.gz	ITBGSKFSEXMHMF-UPJWGTAASA-N	1	0	257.399	1.993	50	0		CDAARO
CC1(C)[C@H]([NH2+]CCOC[C@@H]2CCCO2)[C@H]2CCCO[C@@H]21	ZINC000095987915	185056910	/nfs/dbraw/zinc/05/69/10/185056910.db2.gz	HHEAYRIWFSXUAZ-YJNKXOJESA-N	1	0	283.412	1.975	50	0		CDAARO
CS(=O)(=O)CC[NH2+][C@@H]1CCCc2ccc(F)cc21	ZINC000095987851	185056931	/nfs/dbraw/zinc/05/69/31/185056931.db2.gz	PPAPBXQRZYPLEH-CYBMUJFWSA-N	1	0	271.357	1.837	50	0		CDAARO
COC(=O)[C@]12CCC[C@H]1C[N@H+](Cc1cncs1)C2	ZINC000096009049	185063605	/nfs/dbraw/zinc/06/36/05/185063605.db2.gz	ZJPINNYIJHGJJC-GWCFXTLKSA-N	1	0	266.366	1.918	50	0		CDAARO
Cn1nccc1C[NH2+]C[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000096010199	185064793	/nfs/dbraw/zinc/06/47/93/185064793.db2.gz	FTYKBXRESNNZAX-GFCCVEGCSA-N	1	0	294.399	1.767	50	0		CDAARO
Cn1c(=O)[nH]nc1SCC[N@H+](C)Cc1ccc(F)cc1	ZINC000187396205	342090293	/nfs/dbraw/zinc/09/02/93/342090293.db2.gz	QFRYVQKEEWEOKY-UHFFFAOYSA-N	1	0	296.371	1.472	50	0		CDAARO
C[C@@H]1CCC[C@@H](OCC(=O)N2CC[NH2+]C[C@H]2C)C1	ZINC000125182350	187173404	/nfs/dbraw/zinc/17/34/04/187173404.db2.gz	KKEMQGNZIQXDSG-JHJVBQTASA-N	1	0	254.374	1.402	50	0		CDAARO
[NH3+][C@@H](C(=O)N1CCOC2(CCC2)C1)c1ccccc1	ZINC000195554949	342626214	/nfs/dbraw/zinc/62/62/14/342626214.db2.gz	SVTVHLPLQPYMJC-CYBMUJFWSA-N	1	0	260.337	1.468	50	0		CDAARO
C[NH2+]CCCC(=O)NC1(c2cccc(OC)c2)CC1	ZINC000195543636	342626618	/nfs/dbraw/zinc/62/66/18/342626618.db2.gz	VYHARCNQBVOFIB-UHFFFAOYSA-N	1	0	262.353	1.800	50	0		CDAARO
Cc1cnc(CNc2cc([C@H]3C[C@@H](O)C3)[nH+]c(N)n2)cn1	ZINC000244828581	361864906	/nfs/dbraw/zinc/86/49/06/361864906.db2.gz	TYURKBGIHDQRNQ-JGZJWPJOSA-N	1	0	286.339	1.008	50	0		CDAARO
Cc1cc(C)n(CCC[N@@H+](C)CCC(C)(C)O)n1	ZINC000244873474	361867343	/nfs/dbraw/zinc/86/73/43/361867343.db2.gz	WRBQDWUBCIPIFQ-UHFFFAOYSA-N	1	0	253.390	1.983	50	0		CDAARO
C[NH2+][C@@H]1CCN(C(=O)Cc2cc(F)ccc2F)C1	ZINC000097019443	185152708	/nfs/dbraw/zinc/15/27/08/185152708.db2.gz	LYRBPFSAQMGQSU-LLVKDONJSA-N	1	0	254.280	1.328	50	0		CDAARO
OC[C@@H]1C[NH2+]CCN1Cc1nc2ccccc2s1	ZINC000685943311	539046010	/nfs/dbraw/zinc/04/60/10/539046010.db2.gz	LGLQREDSFGGEQH-JTQLQIEISA-N	1	0	263.366	1.062	50	0		CDAARO
C[C@@H]1CN(C(=O)C2CC2)CC[C@H]1[NH2+]Cc1ccccn1	ZINC000084714961	342267886	/nfs/dbraw/zinc/26/78/86/342267886.db2.gz	NMODUOCAYMNJCQ-IUODEOHRSA-N	1	0	273.380	1.818	50	0		CDAARO
CC(C)S(=O)(=O)NCC1(C(F)(F)F)CC[NH2+]CC1	ZINC000725264797	539161956	/nfs/dbraw/zinc/16/19/56/539161956.db2.gz	YBNIJATTYHXKOJ-UHFFFAOYSA-N	1	0	288.335	1.246	50	0		CDAARO
Cc1nccc(N2CCC[C@@H]2C[NH+]2C[C@@H](C)O[C@H](C)C2)n1	ZINC000253371031	282185936	/nfs/dbraw/zinc/18/59/36/282185936.db2.gz	ZRASOMLHLUMZES-UMVBOHGHSA-N	1	0	290.411	1.863	50	0		CDAARO
COc1cc(F)c(C(=O)N2CC[NH2+]C[C@@H]2C)cc1OC	ZINC000126271816	187229151	/nfs/dbraw/zinc/22/91/51/187229151.db2.gz	OHSTWHSKDJORFP-VIFPVBQESA-N	1	0	282.315	1.277	50	0		CDAARO
Cc1cnccc1CC[NH2+][C@H](C)C[C@@H]1CCCC(=O)N1	ZINC000585117550	362046768	/nfs/dbraw/zinc/04/67/68/362046768.db2.gz	LFRLBLBTBNEXCR-HIFRSBDPSA-N	1	0	275.396	1.969	50	0		CDAARO
C[C@H](C(=O)N1CC[C@@H](C[NH3+])C1)c1ccccc1F	ZINC000178581283	362247282	/nfs/dbraw/zinc/24/72/82/362247282.db2.gz	HKPLZQSDMFZEHQ-QWRGUYRKSA-N	1	0	250.317	1.736	50	0		CDAARO
C[C@@H]1CN(C(=O)COc2ccc(F)cc2F)C[C@H](C)[NH2+]1	ZINC000179151441	362252096	/nfs/dbraw/zinc/25/20/96/362252096.db2.gz	FWGNGZADWNGSEE-AOOOYVTPSA-N	1	0	284.306	1.552	50	0		CDAARO
Cc1noc2ncc(C(=O)NC[C@@H](C3CC3)[NH+](C)C)cc12	ZINC000084067907	362257912	/nfs/dbraw/zinc/25/79/12/362257912.db2.gz	IFAJSHQKMRGKPO-ZDUSSCGKSA-N	1	0	288.351	1.601	50	0		CDAARO
C[C@H](C(=O)Nc1ccccn1)[N@H+](C)CC1(C)COC1	ZINC000252478786	362384012	/nfs/dbraw/zinc/38/40/12/362384012.db2.gz	AVDATUBFEULIEN-LLVKDONJSA-N	1	0	263.341	1.377	50	0		CDAARO
C[C@H]1C[N@H+](CCC(=O)NCc2cccs2)CCCO1	ZINC000252509508	362390032	/nfs/dbraw/zinc/39/00/32/362390032.db2.gz	YOWSOAYSWPIOPV-LBPRGKRZSA-N	1	0	282.409	1.865	50	0		CDAARO
C[NH+](C)[C@H]1CCN(CC(=O)NCc2cccs2)C1	ZINC000252507804	362390245	/nfs/dbraw/zinc/39/02/45/362390245.db2.gz	WUCFOUFYKSZLIK-NSHDSACASA-N	1	0	267.398	1.000	50	0		CDAARO
CC(=O)N1CCC([NH2+][C@H]2C[C@H](c3cc(=O)[nH]cn3)C2)CC1	ZINC000253535151	362434726	/nfs/dbraw/zinc/43/47/26/362434726.db2.gz	DVJUUYQZEVGHMG-AULYBMBSSA-N	1	0	290.367	1.029	50	0		CDAARO
Cc1ccc(-c2noc(-c3cn([C@H]4CC[NH2+]C4)nn3)n2)cc1	ZINC000582468960	346223687	/nfs/dbraw/zinc/22/36/87/346223687.db2.gz	JIIVKXICCOVXRJ-LBPRGKRZSA-N	1	0	296.334	1.838	50	0		CDAARO
CN(CCOc1ccccc1F)C(=O)[C@H]1CCC[C@H]1[NH3+]	ZINC000085367432	179037579	/nfs/dbraw/zinc/03/75/79/179037579.db2.gz	QHSQBPARLJLTJJ-WCQYABFASA-N	1	0	280.343	1.790	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)c2c(F)cccc2F)CC1	ZINC000085467926	179073505	/nfs/dbraw/zinc/07/35/05/179073505.db2.gz	KBIFELNYVFLQAF-UHFFFAOYSA-N	1	0	298.333	1.805	50	0		CDAARO
Cc1csc(CN(C)CCc2cnn(C)c2)n1	ZINC000077317969	348748548	/nfs/dbraw/zinc/74/85/48/348748548.db2.gz	ZUJWKZQNLYJFIE-UHFFFAOYSA-N	1	0	250.371	1.860	50	0		CDAARO
Cc1c(C(=O)NC(C)(C)CN2CC[NH+](C)CC2)ccn1C	ZINC000584896086	349357258	/nfs/dbraw/zinc/35/72/58/349357258.db2.gz	STMNZPQTEUKCFK-UHFFFAOYSA-N	1	0	292.427	1.089	50	0		CDAARO
CC1(C(=O)NCC[N@@H+]2CCC[C@H](CO)C2)CCCCC1	ZINC000584884289	349342270	/nfs/dbraw/zinc/34/22/70/349342270.db2.gz	SFFXMEHGQMACRN-AWEZNQCLSA-N	1	0	282.428	1.777	50	0		CDAARO
C[N@@H+]1CC[C@@](C)(Cn2cnc3cccc(F)c3c2=O)C1	ZINC000584897168	349358248	/nfs/dbraw/zinc/35/82/48/349358248.db2.gz	HAIJTHKWSIFTIZ-OAHLLOKOSA-N	1	0	275.327	1.877	50	0		CDAARO
COc1ccc2ncn(C[C@@H]3CC[N@@H+](C4CC4)C3)c(=O)c2c1	ZINC000584888607	349347455	/nfs/dbraw/zinc/34/74/55/349347455.db2.gz	FACGVPWHDQQTPB-GFCCVEGCSA-N	1	0	299.374	1.889	50	0		CDAARO
C[C@H](NC(=O)CN(C)C1CC[NH2+]CC1)c1ccsc1	ZINC000584900148	349362381	/nfs/dbraw/zinc/36/23/81/349362381.db2.gz	UFRNXKMYSGNUFS-NSHDSACASA-N	1	0	281.425	1.609	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@H]1NC(=O)c1ccc(F)cc1F	ZINC000091496673	180172788	/nfs/dbraw/zinc/17/27/88/180172788.db2.gz	LMXCRDTVFHGTKO-QPUJVOFHSA-N	1	0	254.280	1.835	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNc2nccc(C(C)C)n2)C1	ZINC000091411230	180148915	/nfs/dbraw/zinc/14/89/15/180148915.db2.gz	JRBPZRRGDXXZBI-ZDUSSCGKSA-N	1	0	278.400	1.980	50	0		CDAARO
C[NH+](C)C[C@H]1C[C@H](CO)CN(C(=O)c2ccc(O)cc2)C1	ZINC000091596107	180202011	/nfs/dbraw/zinc/20/20/11/180202011.db2.gz	ODWOICZIPKDQDF-OLZOCXBDSA-N	1	0	292.379	1.024	50	0		CDAARO
C[N@@H+]1C[C@H]2CC[C@@H]1CN(C(=O)Cc1ccsc1)C2	ZINC000091547190	180187642	/nfs/dbraw/zinc/18/76/42/180187642.db2.gz	AQZOSCBTCBILHV-CHWSQXEVSA-N	1	0	264.394	1.843	50	0		CDAARO
CCC[C@]1(CO)CCC[N@H+](CCCn2nnnc2C)C1	ZINC000091656355	180217697	/nfs/dbraw/zinc/21/76/97/180217697.db2.gz	BROVNWILRZVPMK-AWEZNQCLSA-N	1	0	281.404	1.246	50	0		CDAARO
O=C(c1cc(-c2ccccc2O)n[nH]1)N1CC[C@H]2C[NH2+]C[C@H]21	ZINC000091656489	180217762	/nfs/dbraw/zinc/21/77/62/180217762.db2.gz	NVMSUYBYDJKILN-IINYFYTJSA-N	1	0	298.346	1.216	50	0		CDAARO
CN1CCO[C@H](C[NH2+]Cc2cccc3[nH]ccc32)C1	ZINC000105470713	186058649	/nfs/dbraw/zinc/05/86/49/186058649.db2.gz	PXYWBUHVUHZDNP-CYBMUJFWSA-N	1	0	259.353	1.588	50	0		CDAARO
O=C(c1nc2ccccn2c1F)N1C[C@@H]2CCC[NH2+][C@@H]2C1	ZINC000091745527	180244246	/nfs/dbraw/zinc/24/42/46/180244246.db2.gz	GNEOYYSMOHXWAI-WDEREUQCSA-N	1	0	288.326	1.297	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2c(C)cc(C)[nH]c2=O)C[C@@H]1[NH3+]	ZINC000092019412	180308159	/nfs/dbraw/zinc/30/81/59/180308159.db2.gz	RKRCVKZJUQCPEI-RYUDHWBXSA-N	1	0	277.368	1.191	50	0		CDAARO
Cc1cnn(CC[NH2+]Cc2cn3ccccc3n2)c1	ZINC000105881324	186083604	/nfs/dbraw/zinc/08/36/04/186083604.db2.gz	FQWKZDWAQYMGMF-UHFFFAOYSA-N	1	0	255.325	1.629	50	0		CDAARO
C[N@@H+]1CCC[C@@H](NC(=O)[C@H](c2ccccc2)n2cccn2)C1	ZINC000106579747	186127233	/nfs/dbraw/zinc/12/72/33/186127233.db2.gz	CQEWIVOUUALSQY-CVEARBPZSA-N	1	0	298.390	1.683	50	0		CDAARO
C[C@H](NC(=O)C[C@@H]([NH3+])c1ccccc1)[C@@H]1CCCO1	ZINC000107573265	186179264	/nfs/dbraw/zinc/17/92/64/186179264.db2.gz	HNYUXPNMXOUXHN-YUTCNCBUSA-N	1	0	262.353	1.760	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCCNC(=O)[C@H]2CCCOC2)C[C@H](C)O1	ZINC000110674592	186312069	/nfs/dbraw/zinc/31/20/69/186312069.db2.gz	JOEOGIXRYNCBEB-ZNMIVQPWSA-N	1	0	298.427	1.419	50	0		CDAARO
Cc1cnccc1CC[NH2+]CC(C)(C)N1CCOCC1	ZINC000583651595	366016947	/nfs/dbraw/zinc/01/69/47/366016947.db2.gz	PCQMZRUSYOGGEL-UHFFFAOYSA-N	1	0	277.412	1.633	50	0		CDAARO
Cc1ccc(C(=O)N2CCO[C@H]([C@H](C)[NH3+])C2)c(F)c1	ZINC000122866710	187056400	/nfs/dbraw/zinc/05/64/00/187056400.db2.gz	WHDSFAOILQHEJM-GWCFXTLKSA-N	1	0	266.316	1.322	50	0		CDAARO
Cc1ccc(C(=O)N2CCO[C@H]([C@@H](C)[NH3+])C2)c(F)c1	ZINC000122866228	187056617	/nfs/dbraw/zinc/05/66/17/187056617.db2.gz	WHDSFAOILQHEJM-MFKMUULPSA-N	1	0	266.316	1.322	50	0		CDAARO
O=C([C@H]1C[C@@H](O)C[NH2+]1)N1CCC(Cc2ccccc2)CC1	ZINC000036963188	363302273	/nfs/dbraw/zinc/30/22/73/363302273.db2.gz	LRCUBBGXTFLPIY-HZPDHXFCSA-N	1	0	288.391	1.191	50	0		CDAARO
O=C(COc1ccc(Cl)cc1)NCC[NH+]1CCCC1	ZINC000000383102	355907896	/nfs/dbraw/zinc/90/78/96/355907896.db2.gz	LFCHKKPPZPEOPN-UHFFFAOYSA-N	1	0	282.771	1.931	50	0		CDAARO
CC1(C)C[C@@](O)(C[NH2+]Cc2ccc3c(c2)OCO3)CCO1	ZINC000000206543	355895973	/nfs/dbraw/zinc/89/59/73/355895973.db2.gz	YUFGVAYYXDAHKF-MRXNPFEDSA-N	1	0	293.363	1.825	50	0	biogenic	CDAARO
OCC[NH+](CCO)Cc1ccc(F)c(Br)c1	ZINC000000227423	355898047	/nfs/dbraw/zinc/89/80/47/355898047.db2.gz	HGGZXFCYRJRZEE-UHFFFAOYSA-N	1	0	292.148	1.375	50	0		CDAARO
O=S(=O)(CC[NH+]1CCCCC1)Oc1ccccc1	ZINC000002905281	355987620	/nfs/dbraw/zinc/98/76/20/355987620.db2.gz	PIFDRBICYDCFAU-UHFFFAOYSA-N	1	0	269.366	1.881	50	0		CDAARO
COc1ccccc1/C(C)=C\C(=O)N1CC[C@@H]([NH3+])C1	ZINC000255041806	355967817	/nfs/dbraw/zinc/96/78/17/355967817.db2.gz	VLGCKZSOKJQUQU-UCQJPZFISA-N	1	0	260.337	1.658	50	0		CDAARO
CC[NH+]1CCN(c2nc(N)c3ccccc3n2)CC1	ZINC000006690936	356082613	/nfs/dbraw/zinc/08/26/13/356082613.db2.gz	BDWIHIURZZWHEJ-UHFFFAOYSA-N	1	0	257.341	1.354	50	0		CDAARO
C[N@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1COC[C@H]1O	ZINC000286243022	356235688	/nfs/dbraw/zinc/23/56/88/356235688.db2.gz	ZPVXIIPOSYNWEE-VXGBXAGGSA-N	1	0	275.270	1.897	50	0		CDAARO
Cc1cnn(C)c1NC(=O)C[C@H]1CCCC[N@@H+]1C	ZINC000032550909	356250169	/nfs/dbraw/zinc/25/01/69/356250169.db2.gz	UMSFJBYFAYFFAH-LLVKDONJSA-N	1	0	250.346	1.541	50	0		CDAARO
[NH3+]Cc1ccc(CNS(=O)(=O)c2ccccc2)o1	ZINC000012376838	356295365	/nfs/dbraw/zinc/29/53/65/356295365.db2.gz	HUFIZMCNXGEKHP-UHFFFAOYSA-N	1	0	266.322	1.217	50	0		CDAARO
O=C(c1ccc2c(c1)OCO2)[C@H]1CCC[N@@H+](CCO)C1	ZINC000012593939	356310512	/nfs/dbraw/zinc/31/05/12/356310512.db2.gz	DISAUHXHWRZCEE-LBPRGKRZSA-N	1	0	277.320	1.302	50	0		CDAARO
CC(C)NC(=O)NC(=O)C[N@H+](C)C1CCCCC1	ZINC000014138800	356377545	/nfs/dbraw/zinc/37/75/45/356377545.db2.gz	OQLXIFBWFZOGRE-UHFFFAOYSA-N	1	0	255.362	1.485	50	0		CDAARO
C[NH+]1CCC(Oc2ccc(-n3cnnn3)cc2)CC1	ZINC000015085303	356405895	/nfs/dbraw/zinc/40/58/95/356405895.db2.gz	PJFYMWKGPUPTQJ-UHFFFAOYSA-N	1	0	259.313	1.135	50	0		CDAARO
c1ccc(C[NH+]2CCN(c3ncccn3)CC2)cc1	ZINC000019536363	356491646	/nfs/dbraw/zinc/49/16/46/356491646.db2.gz	KPSYTYUUIPYPQX-UHFFFAOYSA-N	1	0	254.337	1.799	50	0		CDAARO
Nc1cccc(C[NH+]2CCN(c3ccccn3)CC2)c1	ZINC000019278897	356478940	/nfs/dbraw/zinc/47/89/40/356478940.db2.gz	RDGHQHDGHYUYIO-UHFFFAOYSA-N	1	0	268.364	1.986	50	0		CDAARO
COc1ccc(OCCCN2CC[NH2+]CC2)cc1	ZINC000019728647	356497839	/nfs/dbraw/zinc/49/78/39/356497839.db2.gz	QCMGYWUAZZLDTG-UHFFFAOYSA-N	1	0	250.342	1.369	50	0		CDAARO
CCCS(=O)(=O)N1CC[NH+](C2CCCCC2)CC1	ZINC000019853657	356510371	/nfs/dbraw/zinc/51/03/71/356510371.db2.gz	GTBCBWVPMKTBQH-UHFFFAOYSA-N	1	0	274.430	1.677	50	0		CDAARO
CC(C)[N@H+](C)CCNC(=O)N[C@@H]1[C@H]2CCO[C@H]2C1(C)C	ZINC000246934191	356510459	/nfs/dbraw/zinc/51/04/59/356510459.db2.gz	NIAVPQOZAALCDC-JHJVBQTASA-N	1	0	283.416	1.439	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COc2c(C)cccc2C)CC1	ZINC000019901378	356515205	/nfs/dbraw/zinc/51/52/05/356515205.db2.gz	HOMSNASLMWMFTE-INIZCTEOSA-N	1	0	292.423	1.681	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@H]1CCCN(C(N)=[NH2+])C1	ZINC000034219178	363531343	/nfs/dbraw/zinc/53/13/43/363531343.db2.gz	IGEJQPQAAYKGLR-SECBINFHSA-N	1	0	256.350	1.117	50	0		CDAARO
C[C@H]1C[C@H](C)C[NH+](C(C)(C)CNS(C)(=O)=O)C1	ZINC000048908211	291113896	/nfs/dbraw/zinc/11/38/96/291113896.db2.gz	GGGWFTKZIBZUKJ-QWRGUYRKSA-N	1	0	262.419	1.292	50	0		CDAARO
Cc1ccc(C[NH+]2CCN(CCOCCO)CC2)cc1	ZINC000023114992	356628603	/nfs/dbraw/zinc/62/86/03/356628603.db2.gz	YXRCREXVPIAZOS-UHFFFAOYSA-N	1	0	278.396	1.122	50	0		CDAARO
CCN(CC(F)(F)F)C(=O)[C@@H]1CC12CC[NH2+]CC2	ZINC000070255777	356742351	/nfs/dbraw/zinc/74/23/51/356742351.db2.gz	OFDNAXLYPLWQQN-VIFPVBQESA-N	1	0	264.291	1.787	50	0		CDAARO
OCC[NH2+]CCNCc1ccc(-c2ccccc2F)o1	ZINC000032497051	356780806	/nfs/dbraw/zinc/78/08/06/356780806.db2.gz	QWBXUONOSWNMMX-UHFFFAOYSA-N	1	0	278.327	1.757	50	0		CDAARO
Cc1cccc(OCCc2nnc(NC(=O)C[NH3+])s2)c1	ZINC000031959244	356772397	/nfs/dbraw/zinc/77/23/97/356772397.db2.gz	OIMFLZMWGYUDGX-UHFFFAOYSA-N	1	0	292.364	1.365	50	0		CDAARO
c1cnc(N2CC[NH+]([C@@H]3CCSC3)CC2)nc1	ZINC000023282616	356816686	/nfs/dbraw/zinc/81/66/86/356816686.db2.gz	SSZODLMWUJPRBQ-LLVKDONJSA-N	1	0	250.371	1.104	50	0		CDAARO
Cc1nc(N(C)C)cc(NCCNC(=O)c2ccccc2)[nH+]1	ZINC000036708043	356877367	/nfs/dbraw/zinc/87/73/67/356877367.db2.gz	IFOLJCKTQDABOG-UHFFFAOYSA-N	1	0	299.378	1.693	50	0		CDAARO
Cc1cccc(CS(=O)(=O)N2CCC[C@@H]([C@H](C)[NH3+])C2)c1	ZINC000269608072	357094890	/nfs/dbraw/zinc/09/48/90/357094890.db2.gz	DHMHMTQVPHPJDA-DZGCQCFKSA-N	1	0	296.436	1.884	50	0		CDAARO
C[NH+]1CCC(NC(=O)CCc2ccc(F)cc2)CC1	ZINC000047829363	357165569	/nfs/dbraw/zinc/16/55/69/357165569.db2.gz	UXKPMVYWLJWAEA-UHFFFAOYSA-N	1	0	264.344	1.969	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)[C@@H]1CCCO1)c1ccccc1	ZINC000033028894	357232069	/nfs/dbraw/zinc/23/20/69/357232069.db2.gz	KESNIGSTNSUANP-KBPBESRZSA-N	1	0	262.353	1.585	50	0		CDAARO
CS(=O)(=O)c1nccn1CCC[NH+]1CCCCC1	ZINC000187691055	357529808	/nfs/dbraw/zinc/52/98/08/357529808.db2.gz	DWGMJDUMOFUDQL-UHFFFAOYSA-N	1	0	271.386	1.163	50	0		CDAARO
O=C(CC[NH2+]C[C@H]1CCCC[C@H]1O)Nc1cccnc1	ZINC000065409085	357538754	/nfs/dbraw/zinc/53/87/54/357538754.db2.gz	CBJPNZKIQNVLPG-TZMCWYRMSA-N	1	0	277.368	1.551	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(NCCCn2ccnc2)c1C	ZINC000065467013	357543636	/nfs/dbraw/zinc/54/36/36/357543636.db2.gz	ZGXJYTUDTHQFTG-UHFFFAOYSA-N	1	0	274.372	1.858	50	0		CDAARO
Cc1cc(C(=O)NCC[C@@H]2C[N@H+](CC(C)C)CCO2)[nH]n1	ZINC000067726061	357621195	/nfs/dbraw/zinc/62/11/95/357621195.db2.gz	PFVHYNPIWAEZFV-CYBMUJFWSA-N	1	0	294.399	1.195	50	0		CDAARO
CCOc1c(CN[C@@H]2CCC[NH2+]C2)cccc1OC	ZINC000067841687	357631333	/nfs/dbraw/zinc/63/13/33/357631333.db2.gz	UBNGIDBNTKDDJB-CYBMUJFWSA-N	1	0	264.369	1.936	50	0		CDAARO
[NH3+]C[C@@H]1Cc2cc(F)cc(-c3cnn4cccnc34)c2O1	ZINC000067855875	357632880	/nfs/dbraw/zinc/63/28/80/357632880.db2.gz	SDVGYNZVWJVUGH-NSHDSACASA-N	1	0	284.294	1.798	50	0		CDAARO
CCC[NH+]1CCC(Cc2noc(C3(C(N)=O)CC3)n2)CC1	ZINC000067884961	357635390	/nfs/dbraw/zinc/63/53/90/357635390.db2.gz	PNIDIOCHEYDUFA-UHFFFAOYSA-N	1	0	292.383	1.251	50	0		CDAARO
CSc1ccc2cc(C[N@H+](C)CCO)c(=O)[nH]c2c1	ZINC000067934594	357638956	/nfs/dbraw/zinc/63/89/56/357638956.db2.gz	SQAWIHVONTTXJV-UHFFFAOYSA-N	1	0	278.377	1.674	50	0		CDAARO
Cc1cc(C2CCC2)nc(N(C)CCN2CCOCC2)n1	ZINC000071763111	357779614	/nfs/dbraw/zinc/77/96/14/357779614.db2.gz	ADJBJDBLNZPNHY-UHFFFAOYSA-N	1	0	290.411	1.821	50	0		CDAARO
COC[C@@H](Nc1ncnc2c1CC[NH2+]CC2)c1ccccn1	ZINC000072436433	357836058	/nfs/dbraw/zinc/83/60/58/357836058.db2.gz	FFXCHKPMKWSGSE-OAHLLOKOSA-N	1	0	299.378	1.359	50	0		CDAARO
Cc1nc2c(c(NCCc3ccco3)n1)CC[NH2+]CC2	ZINC000072478430	357837997	/nfs/dbraw/zinc/83/79/97/357837997.db2.gz	KIVLQQXPYPURBH-UHFFFAOYSA-N	1	0	272.352	1.721	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)OCc2ccccc2)C[C@@H]1F	ZINC000079035475	358058136	/nfs/dbraw/zinc/05/81/36/358058136.db2.gz	SYVUWEZGXXHYPH-RYUDHWBXSA-N	1	0	252.289	1.694	50	0		CDAARO
CCNc1cc[nH+]c(CN2CCN(C(C)=O)CC2)c1	ZINC000082164199	358150443	/nfs/dbraw/zinc/15/04/43/358150443.db2.gz	YEACBLMCSLFGFI-UHFFFAOYSA-N	1	0	262.357	1.178	50	0		CDAARO
Cn1cc(C(=O)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)cn1	ZINC000194736302	358536008	/nfs/dbraw/zinc/53/60/08/358536008.db2.gz	DTSVXHIDFNELRT-OAHLLOKOSA-N	1	0	298.390	1.672	50	0		CDAARO
CC(C)[NH+]1CCC(CC(=O)N[C@H](C)c2nncn2C)CC1	ZINC000095364191	358685965	/nfs/dbraw/zinc/68/59/65/358685965.db2.gz	RJWDRHCWODBGBW-GFCCVEGCSA-N	1	0	293.415	1.503	50	0		CDAARO
CCC[NH+]1CCC(CC(=O)N[C@@H](C)c2nncn2C)CC1	ZINC000095364583	358686837	/nfs/dbraw/zinc/68/68/37/358686837.db2.gz	XWOCKFFFYQQGGH-LBPRGKRZSA-N	1	0	293.415	1.504	50	0		CDAARO
CN(C)[C@@H](C(=O)NCCC[NH+](C)C)c1cccc(F)c1	ZINC000095367301	358686930	/nfs/dbraw/zinc/68/69/30/358686930.db2.gz	WCUZDENHYIRYNR-CQSZACIVSA-N	1	0	281.375	1.496	50	0		CDAARO
O=C(CCO)N1C[C@H]2CC[C@H](C[N@H+]2Cc2ccccc2)C1	ZINC000095370092	358687553	/nfs/dbraw/zinc/68/75/53/358687553.db2.gz	VVUOZCRFZABQDJ-HZPDHXFCSA-N	1	0	288.391	1.492	50	0		CDAARO
CC[NH+]1CCC(NC(=O)c2cn(-c3ccccc3)nn2)CC1	ZINC000037176581	363616283	/nfs/dbraw/zinc/61/62/83/363616283.db2.gz	WLWOYRQZVVWEIH-UHFFFAOYSA-N	1	0	299.378	1.481	50	0		CDAARO
Cn1cnc2cc(C(=O)N[C@@H]3CCC[NH2+]C3)ccc21	ZINC000097334326	358767730	/nfs/dbraw/zinc/76/77/30/358767730.db2.gz	VDQUWYWTIZXYHE-LLVKDONJSA-N	1	0	258.325	1.055	50	0		CDAARO
CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1C[C@]1(C[NH2+]CCO1)C2	ZINC000100295749	358825662	/nfs/dbraw/zinc/82/56/62/358825662.db2.gz	SWXVOKDTXKRXKI-JYAVWHMHSA-N	1	0	282.384	1.907	50	0		CDAARO
O[C@@H]1C[C@H]2C[N@@H+](Cc3cccc4cc[nH]c43)C[C@H]2C[C@@H]1O	ZINC000216000854	358916168	/nfs/dbraw/zinc/91/61/68/358916168.db2.gz	JXKLQAQIZKRHAI-SYMSYNOKSA-N	1	0	286.375	1.732	50	0		CDAARO
C[C@H](C[NH2+][C@H]1CC(C)(C)OC1(C)C)CS(C)(=O)=O	ZINC000119688900	358963742	/nfs/dbraw/zinc/96/37/42/358963742.db2.gz	LAXFCYYZKNBCRH-MNOVXSKESA-N	1	0	277.430	1.603	50	0		CDAARO
Cc1nonc1CC(=O)N1CCC[N@@H+](CC(C)C)CC1	ZINC000222979814	359390117	/nfs/dbraw/zinc/39/01/17/359390117.db2.gz	YCWLQAAIVGUWAH-UHFFFAOYSA-N	1	0	280.372	1.111	50	0		CDAARO
COC[C@@H]1C[N@H+](Cc2ccco2)C[C@H]1c1nc(C)no1	ZINC000257197381	359630081	/nfs/dbraw/zinc/63/00/81/359630081.db2.gz	ZYXTUFPQEYMLBS-WCQYABFASA-N	1	0	277.324	1.833	50	0		CDAARO
CC(C)(C)OC(=O)N[C@H]1CCC[N@H+](C[C@H]2C[C@@H](O)C2)C1	ZINC000408521877	359920600	/nfs/dbraw/zinc/92/06/00/359920600.db2.gz	YARIWQCUOWBGGM-RWMBFGLXSA-N	1	0	284.400	1.746	50	0		CDAARO
Cc1noc(CC[NH2+][C@H](C)c2ccc(-n3cnnn3)cc2)n1	ZINC000089517879	360102669	/nfs/dbraw/zinc/10/26/69/360102669.db2.gz	IIVOLQOPANTZMZ-SNVBAGLBSA-N	1	0	299.338	1.247	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@@H]1CCN(C(=O)c2cc(C)n(C)n2)C1	ZINC000409420735	360224736	/nfs/dbraw/zinc/22/47/36/360224736.db2.gz	VAVKATHKYCZECR-CYBMUJFWSA-N	1	0	287.367	1.629	50	0		CDAARO
Cc1n[nH]c([C@H]2CCN(Cc3ccc[nH]3)C[C@H]2[NH+](C)C)n1	ZINC000409421261	360230415	/nfs/dbraw/zinc/23/04/15/360230415.db2.gz	SBYBZGBXEHMWGV-UONOGXRCSA-N	1	0	288.399	1.361	50	0		CDAARO
[NH3+]CCc1ccc(S(=O)(=O)NC2CCCC2)cc1	ZINC000011849312	360350575	/nfs/dbraw/zinc/35/05/75/360350575.db2.gz	UHOVFBLCEOZROZ-UHFFFAOYSA-N	1	0	268.382	1.409	50	0		CDAARO
CC(C)(C)c1cc(CN2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)[nH]n1	ZINC000426518290	360680097	/nfs/dbraw/zinc/68/00/97/360680097.db2.gz	IORBVYPWEGTPKE-KPWCQOOUSA-N	1	0	274.412	1.889	50	0		CDAARO
C[NH2+]Cc1nnc(SC[C@@H]2CCCCO2)n1C	ZINC000426397316	360663505	/nfs/dbraw/zinc/66/35/05/360663505.db2.gz	ASCYYNNWQGHDGL-VIFPVBQESA-N	1	0	256.375	1.196	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CC(=O)N1CCC(c2cc[nH]n2)CC1	ZINC000426698456	360697322	/nfs/dbraw/zinc/69/73/22/360697322.db2.gz	PQJKVQPYDYBPQJ-CQSZACIVSA-N	1	0	290.411	1.990	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)c2ccc3nccn3c2)C1	ZINC000178598144	189130193	/nfs/dbraw/zinc/13/01/93/189130193.db2.gz	IWXKDMJKGUPSRZ-GFCCVEGCSA-N	1	0	258.325	1.158	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cc(OC)c(C)c(OC)c2)C1	ZINC000179024738	189162417	/nfs/dbraw/zinc/16/24/17/189162417.db2.gz	QRHJOZVRVYRSCO-GFCCVEGCSA-N	1	0	292.379	1.694	50	0		CDAARO
COCC[C@@H](C)NC(=O)N1CC[C@@H](C[NH+](C)C)C1	ZINC000129815732	360885210	/nfs/dbraw/zinc/88/52/10/360885210.db2.gz	VGCJGTBMYWVQOJ-NEPJUHHUSA-N	1	0	257.378	1.005	50	0		CDAARO
COc1cccnc1CSc1nnc(CC[NH3+])n1C	ZINC000426504096	360934869	/nfs/dbraw/zinc/93/48/69/360934869.db2.gz	UZJMTPWVIMUVKK-UHFFFAOYSA-N	1	0	279.369	1.012	50	0		CDAARO
Fc1cccc(CN2CCN([C@@H]3CC[NH2+]C3)CC2)c1F	ZINC000097619248	361015160	/nfs/dbraw/zinc/01/51/60/361015160.db2.gz	DAJGLCSMSPWILN-CYBMUJFWSA-N	1	0	281.350	1.444	50	0		CDAARO
Cn1c(C[NH3+])nnc1SCCCOc1ccc(F)cc1	ZINC000110513587	361595357	/nfs/dbraw/zinc/59/53/57/361595357.db2.gz	FTEQXEDEUBDQTO-UHFFFAOYSA-N	1	0	296.371	1.974	50	0		CDAARO
COc1cccc(C[NH2+]C2CCOCC2)c1OC	ZINC000036319300	361600883	/nfs/dbraw/zinc/60/08/83/361600883.db2.gz	RKQPKNUMLSPOQP-UHFFFAOYSA-N	1	0	251.326	1.972	50	0		CDAARO
O=S1(=O)CCC[C@H]1C[NH2+]Cc1cccc2[nH]ccc21	ZINC000089774350	366932590	/nfs/dbraw/zinc/93/25/90/366932590.db2.gz	XTLQAKKDWKXMCK-LBPRGKRZSA-N	1	0	278.377	1.835	50	0		CDAARO
CCC(=O)N1CC[C@H]([NH2+]Cc2ccc(CO)o2)[C@H](CC)C1	ZINC000089948953	366977474	/nfs/dbraw/zinc/97/74/74/366977474.db2.gz	CSVUMQVHCZBYBH-DOMZBBRYSA-N	1	0	294.395	1.899	50	0		CDAARO
CCOCCO[C@H]1CC[N@@H+]([C@@H]2CCCC[C@@H]2O)C1	ZINC000089933841	366971036	/nfs/dbraw/zinc/97/10/36/366971036.db2.gz	HCWXHEICORCUPU-MJBXVCDLSA-N	1	0	257.374	1.417	50	0		CDAARO
CCOC(=O)[C@]1(COC)CCC[N@H+](Cc2cccnc2)C1	ZINC000252484205	367568662	/nfs/dbraw/zinc/56/86/62/367568662.db2.gz	FRIXJYSUEGTVNM-MRXNPFEDSA-N	1	0	292.379	1.873	50	0		CDAARO
[NH3+]C[C@@H]1CCC[C@@H]1NS(=O)(=O)c1cc(F)cc(F)c1	ZINC000089091613	368831597	/nfs/dbraw/zinc/83/15/97/368831597.db2.gz	OSULEEQSACYXDR-UFBFGSQYSA-N	1	0	290.335	1.371	50	0		CDAARO
Cc1cc(N2CCC[C@H](CN(C)S(C)(=O)=O)C2)cc[nH+]1	ZINC000286569085	368888898	/nfs/dbraw/zinc/88/88/98/368888898.db2.gz	LKWNSWLKZDKQTG-CYBMUJFWSA-N	1	0	297.424	1.498	50	0		CDAARO
C[C@H]([NH2+]CCO)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000003338945	369403846	/nfs/dbraw/zinc/40/38/46/369403846.db2.gz	BUSLATCLOVXRRL-ZETCQYMHSA-N	1	0	277.151	1.902	50	0		CDAARO
Cc1nc(C)c(C(=O)N2CCC([C@@H]3CC[NH2+]C3)CC2)o1	ZINC000290141190	369803120	/nfs/dbraw/zinc/80/31/20/369803120.db2.gz	MMWGSOIIEOXISI-CYBMUJFWSA-N	1	0	277.368	1.753	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCN(c2ccccc2F)CC1	ZINC000037746707	370046793	/nfs/dbraw/zinc/04/67/93/370046793.db2.gz	VKBZIXPNLQQHLK-LBPRGKRZSA-N	1	0	265.332	1.212	50	0		CDAARO
COC(=O)[C@H]1CC12CC[NH+](C[C@@](C)(O)C(F)(F)F)CC2	ZINC000241171039	284313464	/nfs/dbraw/zinc/31/34/64/284313464.db2.gz	KDULBBBZOYIWAJ-MWLCHTKSSA-N	1	0	295.301	1.575	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](CNC(=O)c2ccncc2C)C1	ZINC000299756221	372745066	/nfs/dbraw/zinc/74/50/66/372745066.db2.gz	DVCBKEFSZYBOBB-CQSZACIVSA-N	1	0	291.395	1.478	50	0		CDAARO
c1nnn2c1CO[C@H]1CC[N@@H+](Cc3ccccc3)C[C@@H]12	ZINC000299760067	372747272	/nfs/dbraw/zinc/74/72/72/372747272.db2.gz	UWWYHNBXWANIJP-GJZGRUSLSA-N	1	0	270.336	1.624	50	0		CDAARO
Nc1nc(C(=O)NCC2(C[NH+]3CCCC3)CC2)cs1	ZINC000299773314	372751943	/nfs/dbraw/zinc/75/19/43/372751943.db2.gz	DINHLGJBACZEEO-UHFFFAOYSA-N	1	0	280.397	1.331	50	0		CDAARO
Cc1nn(C(C)C)c(C)c1CNC(=O)[C@H]1C=CC[NH2+]1	ZINC000299779043	372757600	/nfs/dbraw/zinc/75/76/00/372757600.db2.gz	PQABWOAJNYWDMG-CYBMUJFWSA-N	1	0	262.357	1.225	50	0		CDAARO
C[NH+](C)CC[C@@H](NC(=O)C1(CO)CC1)c1ccccc1	ZINC000299794167	372766723	/nfs/dbraw/zinc/76/67/23/372766723.db2.gz	JXJJZRFKVMAEKV-CQSZACIVSA-N	1	0	276.380	1.568	50	0		CDAARO
CC(=O)NC(C)(C)C[C@@H](C)[NH2+]Cc1csc(N)n1	ZINC000670448977	483005236	/nfs/dbraw/zinc/00/52/36/483005236.db2.gz	WYLGHDAYUCNQKX-MRVPVSSYSA-N	1	0	270.402	1.508	50	0		CDAARO
Cc1nc(CN2CCC([NH+]3CCCC3)CC2)cc(=O)[nH]1	ZINC000244774247	189911596	/nfs/dbraw/zinc/91/15/96/189911596.db2.gz	PQNWPHCGMDIORW-UHFFFAOYSA-N	1	0	276.384	1.551	50	0		CDAARO
Fc1ccc(OCCOCC[NH2+]C[C@@H]2CCCO2)cc1	ZINC000002270007	373521045	/nfs/dbraw/zinc/52/10/45/373521045.db2.gz	RHCPJGMOPIMKFS-HNNXBMFYSA-N	1	0	283.343	1.990	50	0		CDAARO
CC(C)(C)NC(=O)CN1CC[NH+](C2CCC2)CC1	ZINC000253395087	373683519	/nfs/dbraw/zinc/68/35/19/373683519.db2.gz	BPAJRJKBVSVISH-UHFFFAOYSA-N	1	0	253.390	1.071	50	0		CDAARO
Cc1noc([C@@H]2C[N@H+](Cc3cccc(C)c3)C[C@H]2CO)n1	ZINC000253414658	373723609	/nfs/dbraw/zinc/72/36/09/373723609.db2.gz	YCXPRBKJGSHGMM-LSDHHAIUSA-N	1	0	287.363	1.894	50	0		CDAARO
Cc1nc2ccc(N[C@@H]3CCC[C@@H]([NH+](C)C)C3)nn2n1	ZINC000253415437	373726299	/nfs/dbraw/zinc/72/62/99/373726299.db2.gz	CPSQSWZENXNGCP-VXGBXAGGSA-N	1	0	274.372	1.717	50	0		CDAARO
COC(=O)C1(Oc2ccccc2OC)CC[NH2+]CC1	ZINC000205360831	374122562	/nfs/dbraw/zinc/12/25/62/374122562.db2.gz	PIMJZKLYWZFFSR-UHFFFAOYSA-N	1	0	265.309	1.369	50	0		CDAARO
OCC[C@@H]1CN(Cc2ncc[nH]2)CC[N@@H+]1C1CCCC1	ZINC000019867805	374815171	/nfs/dbraw/zinc/81/51/71/374815171.db2.gz	FIMYYJCASVNWDA-CQSZACIVSA-N	1	0	278.400	1.221	50	0		CDAARO
O[C@@H](CNc1cc[nH+]c2ccccc12)CN1CCOCC1	ZINC000095428398	374926464	/nfs/dbraw/zinc/92/64/64/374926464.db2.gz	ARXMAQJVDZEODT-ZDUSSCGKSA-N	1	0	287.363	1.340	50	0		CDAARO
O=c1[nH]c2ccccc2nc1C[N@H+](C[C@@H]1CCOC1)C1CC1	ZINC000097201528	375155404	/nfs/dbraw/zinc/15/54/04/375155404.db2.gz	CALDFSMMCHBRII-LBPRGKRZSA-N	1	0	299.374	1.924	50	0		CDAARO
C[NH+](C)CCNC(=O)COc1cccc2ccccc21	ZINC000003255949	375605187	/nfs/dbraw/zinc/60/51/87/375605187.db2.gz	XWVMAQPCPBASQH-UHFFFAOYSA-N	1	0	272.348	1.896	50	0		CDAARO
Cc1nc(/C=C\C(=O)N2CC[NH2+][C@H](C)C2)cs1	ZINC000606441388	375823284	/nfs/dbraw/zinc/82/32/84/375823284.db2.gz	WNNYDJSCTKSSMJ-ZBJFTSOASA-N	1	0	251.355	1.285	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1[nH]nnc1-c1ccccc1	ZINC000188932276	377121850	/nfs/dbraw/zinc/12/18/50/377121850.db2.gz	CMKIJDRYQRSIGE-ZDUSSCGKSA-N	1	0	299.378	1.686	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@@H](CNC(=O)c2cccc(=O)[nH]2)C1	ZINC000067459906	377087671	/nfs/dbraw/zinc/08/76/71/377087671.db2.gz	UFHZHEIJOZKHRN-LBPRGKRZSA-N	1	0	277.368	1.083	50	0		CDAARO
COc1ccc(OC[C@@H](O)C[NH2+]Cc2ccco2)cc1	ZINC000000236750	169582555	/nfs/dbraw/zinc/58/25/55/169582555.db2.gz	PFSWUAFEZYNSIZ-LBPRGKRZSA-N	1	0	277.320	1.818	50	0		CDAARO
C[C@@H](NC(=O)C[NH+]1CCCC1)c1cn2ncsc2n1	ZINC000220531638	533074091	/nfs/dbraw/zinc/07/40/91/533074091.db2.gz	JTSOQPRZLSHKEG-SECBINFHSA-N	1	0	279.369	1.064	50	0		CDAARO
C[NH+](C)[C@@H]1CCN(C(=O)Nc2cncc(F)c2)C1	ZINC000281300833	195188060	/nfs/dbraw/zinc/18/80/60/195188060.db2.gz	DFDPACJPQFFYEN-LLVKDONJSA-N	1	0	252.293	1.389	50	0		CDAARO
CN(C(=O)[C@H]1COc2ccccc2C1)C1CC[NH+](C)CC1	ZINC000032820020	390377884	/nfs/dbraw/zinc/37/78/84/390377884.db2.gz	ZAGLZZAQWNZNLU-CQSZACIVSA-N	1	0	288.391	1.790	50	0		CDAARO
CCC[N@H+](C)C[C@H]1CCN(S(=O)(=O)c2cccnc2)C1	ZINC000096428710	390518492	/nfs/dbraw/zinc/51/84/92/390518492.db2.gz	RYGYTDQWCKYRRL-CYBMUJFWSA-N	1	0	297.424	1.434	50	0		CDAARO
Cc1nc(C(=O)OC[C@H]2C[N@H+](CC(C)C)CCO2)cs1	ZINC000096420386	390514203	/nfs/dbraw/zinc/51/42/03/390514203.db2.gz	WUMVTGJXNGAISP-GFCCVEGCSA-N	1	0	298.408	1.965	50	0		CDAARO
CN(CC[N@H+](C)C1CC1)C(=O)c1ccc(Cl)nc1N	ZINC000408522805	390853677	/nfs/dbraw/zinc/85/36/77/390853677.db2.gz	LXOSQLICOLJOPC-UHFFFAOYSA-N	1	0	282.775	1.483	50	0		CDAARO
O=c1[nH]ccn1CC[N@@H+]1CCCC[C@@H]1c1ccccn1	ZINC000299757997	391721551	/nfs/dbraw/zinc/72/15/51/391721551.db2.gz	JJDRDYRMEWSAGK-CQSZACIVSA-N	1	0	272.352	1.799	50	0		CDAARO
C[NH2+][C@@H](C)CNC(=O)c1cc(C)ccc1-n1ccnc1	ZINC000261802312	391957029	/nfs/dbraw/zinc/95/70/29/391957029.db2.gz	RYCSJXXOSPWCFT-LBPRGKRZSA-N	1	0	272.352	1.518	50	0		CDAARO
CCC[NH+]1CCN(C(=S)NC[C@@H]2CCCO2)CC1	ZINC000002766755	392127740	/nfs/dbraw/zinc/12/77/40/392127740.db2.gz	PQZYHZQRUXZUTF-LBPRGKRZSA-N	1	0	271.430	1.068	50	0		CDAARO
CC[C@@H]1CN([C@H](C)c2cccnc2)CC[N@@H+]1C[C@@H](C)O	ZINC000252504698	131135384	/nfs/dbraw/zinc/13/53/84/131135384.db2.gz	CUZOHBLINTUKTA-IIAWOOMASA-N	1	0	277.412	1.920	50	0		CDAARO
C[NH2+][C@H](C)CNC(=O)c1cc(-c2ccccc2)on1	ZINC000261800480	131169861	/nfs/dbraw/zinc/16/98/61/131169861.db2.gz	RRBSEYUKJOSMLY-SNVBAGLBSA-N	1	0	259.309	1.679	50	0		CDAARO
NC(=O)CCC1CC[NH+](CC[C@@H]2CCOC2)CC1	ZINC000438125758	392535909	/nfs/dbraw/zinc/53/59/09/392535909.db2.gz	XCPKONRWZIOZAT-CYBMUJFWSA-N	1	0	254.374	1.391	50	0		CDAARO
c1ncn(CC[NH2+]C2CCN(CCc3ccccc3)CC2)n1	ZINC000268868755	132080416	/nfs/dbraw/zinc/08/04/16/132080416.db2.gz	XFQRATAMSLQCDW-UHFFFAOYSA-N	1	0	299.422	1.575	50	0		CDAARO
CCCCSCCC(=O)NC[C@@H]1CC[N@H+](C)C1	ZINC000096416921	393183203	/nfs/dbraw/zinc/18/32/03/393183203.db2.gz	QUPXVMPSOMIACF-LBPRGKRZSA-N	1	0	258.431	1.978	50	0		CDAARO
CS(=O)(=O)c1ccc(N2CCC([NH3+])CC2)c(F)c1	ZINC000012953767	134685999	/nfs/dbraw/zinc/68/59/99/134685999.db2.gz	RSLBTHTXDJDLLF-UHFFFAOYSA-N	1	0	272.345	1.157	50	0		CDAARO
Cc1ccc(CNC(=O)[C@@H](C)[NH+]2CCC(O)CC2)cc1	ZINC000027536911	397792155	/nfs/dbraw/zinc/79/21/55/397792155.db2.gz	LXWIGADJUUFRJF-CYBMUJFWSA-N	1	0	276.380	1.456	50	0		CDAARO
COC[C@@H]([NH2+][C@H](C)c1nccn1C)C1CCOCC1	ZINC000658098354	413196446	/nfs/dbraw/zinc/19/64/46/413196446.db2.gz	YCSMOQPPJVASBF-DGCLKSJQSA-N	1	0	267.373	1.512	50	0		CDAARO
CCOC1(OCC)CCN(C(=O)OC(C)(C)C)C[C@H]1[NH3+]	ZINC000072267273	286009295	/nfs/dbraw/zinc/00/92/95/286009295.db2.gz	DXICWTCECGHECU-LLVKDONJSA-N	1	0	288.388	1.724	50	0		CDAARO
CCOc1cc(Cl)c(C[NH2+]CCO)cc1OC	ZINC000004856924	170031755	/nfs/dbraw/zinc/03/17/55/170031755.db2.gz	SICDGYPFKNJBSB-UHFFFAOYSA-N	1	0	259.733	1.829	50	0		CDAARO
Cc1cccn2cc(CSc3nc(N)cc(N)[nH+]3)nc12	ZINC000008705907	170347746	/nfs/dbraw/zinc/34/77/46/170347746.db2.gz	SOHRZGUHQZPDDK-UHFFFAOYSA-N	1	0	286.364	1.889	50	0		CDAARO
COc1ccc(-c2noc(CN3CC[NH2+]CC3)n2)cc1	ZINC000020268703	171124714	/nfs/dbraw/zinc/12/47/14/171124714.db2.gz	WIHPMMXMFPHDSG-UHFFFAOYSA-N	1	0	274.324	1.150	50	0		CDAARO
CN(Cc1cc[nH]n1)CC1([NH+]2CCOCC2)CCCCC1	ZINC000020363573	171162296	/nfs/dbraw/zinc/16/22/96/171162296.db2.gz	WXILJEXLXSJRJJ-UHFFFAOYSA-N	1	0	292.427	1.877	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)Nc2ccccc2F)CC1	ZINC000020595190	171263941	/nfs/dbraw/zinc/26/39/41/171263941.db2.gz	UOQLDHLFCACYLA-UHFFFAOYSA-N	1	0	279.359	1.792	50	0		CDAARO
CC(C)[NH+](CCNc1ncnc2nc[nH]c21)C(C)C	ZINC000021508472	171308942	/nfs/dbraw/zinc/30/89/42/171308942.db2.gz	STCHTVVVLPVNJF-UHFFFAOYSA-N	1	0	262.361	1.884	50	0		CDAARO
CCc1cc(NC[C@@H]2CCC[N@H+]2CC)n2ncnc2n1	ZINC000022321826	171384752	/nfs/dbraw/zinc/38/47/52/171384752.db2.gz	RPYCARHQMJEKQR-LBPRGKRZSA-N	1	0	274.372	1.583	50	0		CDAARO
CN(C)CC[NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000022798661	171399226	/nfs/dbraw/zinc/39/92/26/171399226.db2.gz	QXXLESWYFDJPFJ-LLVKDONJSA-N	1	0	257.378	1.147	50	0		CDAARO
CCCN(C(=O)c1cccc(OC)c1)[C@@H]1CC[NH2+]C1	ZINC000037540143	173261913	/nfs/dbraw/zinc/26/19/13/173261913.db2.gz	JGFYDMSDKXDBRY-CYBMUJFWSA-N	1	0	262.353	1.909	50	0		CDAARO
CN(C)c1ccc(CC(=O)NCC2CC[NH+](C)CC2)cc1	ZINC000067884235	175800054	/nfs/dbraw/zinc/80/00/54/175800054.db2.gz	IMCYGSYNERPZHV-UHFFFAOYSA-N	1	0	289.423	1.753	50	0		CDAARO
C=Cn1cc(C(=O)N(C)CC[N@H+]2CCCC[C@@H]2C)cn1	ZINC000071419472	176160260	/nfs/dbraw/zinc/16/02/60/176160260.db2.gz	DBEMXDYGWKPWRV-ZDUSSCGKSA-N	1	0	276.384	1.930	50	0		CDAARO
O=C1N(Cc2ccccc2F)CCC[C@]12CC[NH2+]C2	ZINC000072128131	176321210	/nfs/dbraw/zinc/32/12/10/176321210.db2.gz	NOUPDKOEUMINCV-OAHLLOKOSA-N	1	0	262.328	1.928	50	0		CDAARO
Fc1cccc(CN2CCN(C[C@@H]3CC[NH2+]C3)CC2)c1	ZINC000072147148	176325705	/nfs/dbraw/zinc/32/57/05/176325705.db2.gz	CZXNNQRFPTYYRB-OAHLLOKOSA-N	1	0	277.387	1.553	50	0		CDAARO
CCn1nc(C(C)C)cc1C(=O)N1CCC[C@H]([NH3+])CC1	ZINC000072156630	176328821	/nfs/dbraw/zinc/32/88/21/176328821.db2.gz	QOCVLXDEQLXEPM-LBPRGKRZSA-N	1	0	278.400	1.980	50	0		CDAARO
Fc1cccc(CN2CC[NH+](C[C@H]3CCOC3)CC2)c1	ZINC000072157596	176329463	/nfs/dbraw/zinc/32/94/63/176329463.db2.gz	BIQDBLSMBUGEOC-OAHLLOKOSA-N	1	0	278.371	1.980	50	0		CDAARO
O=C(NCCc1c[nH]cn1)c1ccccc1[C@H]1CC[NH2+]C1	ZINC000072163439	176330447	/nfs/dbraw/zinc/33/04/47/176330447.db2.gz	SGGBLYCMLGGADP-LBPRGKRZSA-N	1	0	284.363	1.459	50	0		CDAARO
O=C(c1ccccn1)N1CCC[C@](O)(C[NH+]2CCCC2)C1	ZINC000077406623	177263803	/nfs/dbraw/zinc/26/38/03/177263803.db2.gz	MYFSMYUNGLZNDR-INIZCTEOSA-N	1	0	289.379	1.145	50	0		CDAARO
CC(C)n1cc(C(=O)N[C@H]2COC[C@@H]2[NH+]2CCCC2)cn1	ZINC000077488313	177274377	/nfs/dbraw/zinc/27/43/77/177274377.db2.gz	JQBPMZALTPOQNV-KBPBESRZSA-N	1	0	292.383	1.057	50	0		CDAARO
CC[C@H]1CN(C(=O)c2cc(C)n[nH]2)CC[N@@H+]1C(C)C	ZINC000077564334	177281404	/nfs/dbraw/zinc/28/14/04/177281404.db2.gz	AYOUAAXPJWYJOS-LBPRGKRZSA-N	1	0	264.373	1.663	50	0		CDAARO
Nc1cc(C(=O)N[C@@H]2CCC[N@@H+](C3CCCC3)C2)[nH]n1	ZINC000218932127	262347940	/nfs/dbraw/zinc/34/79/40/262347940.db2.gz	WVAWPCXEKRIIHI-SNVBAGLBSA-N	1	0	277.372	1.129	50	0		CDAARO
CN1CCc2ncnc(N3CCC[N@@H+](C4CC4)CC3)c2C1	ZINC000065476326	277189424	/nfs/dbraw/zinc/18/94/24/277189424.db2.gz	IOLVRRLORDYQFS-UHFFFAOYSA-N	1	0	287.411	1.139	50	0		CDAARO
CC(C)(C)c1oc(C(N)=O)cc1CN1CCCC[C@H]([NH3+])C1	ZINC000082096787	277281793	/nfs/dbraw/zinc/28/17/93/277281793.db2.gz	APHGDUNSPYTGPG-LBPRGKRZSA-N	1	0	293.411	1.989	50	0		CDAARO
COc1ccnc(N2CC[NH+]([C@H]3CCSC3)CC2)n1	ZINC000366030924	278066062	/nfs/dbraw/zinc/06/60/62/278066062.db2.gz	DHTZQVNPMAVHQI-NSHDSACASA-N	1	0	280.397	1.113	50	0		CDAARO
CC(C)(C)OC(=O)C[C@@H]1C[C@H](CC[NH3+])OC(C)(C)O1	ZINC000021991751	278376811	/nfs/dbraw/zinc/37/68/11/278376811.db2.gz	HWSHVKNLMBMKSR-QWRGUYRKSA-N	1	0	273.373	1.977	50	0	in-vitro	CDAARO
CC(C)(C)OC(=O)N[C@H]1C[C@H]2COC[C@@H](C1)[C@H]2[NH3+]	ZINC000238855424	278444478	/nfs/dbraw/zinc/44/44/78/278444478.db2.gz	RSUOYMZSXZUASP-BIBSGERRSA-N	1	0	256.346	1.263	50	0		CDAARO
CC(C)(C)c1ccc(S(=O)(=O)N[C@H]2CC[C@H]2[NH3+])cc1	ZINC000072174306	278561243	/nfs/dbraw/zinc/56/12/43/278561243.db2.gz	OQQDISCQSVLQAZ-OLZOCXBDSA-N	1	0	282.409	1.752	50	0		CDAARO
Cc1c(O)cccc1C(=O)N1CCOC[C@@H](C[NH+](C)C)C1	ZINC000216242956	280251153	/nfs/dbraw/zinc/25/11/53/280251153.db2.gz	SRFCCJHFZKSETF-ZDUSSCGKSA-N	1	0	292.379	1.351	50	0		CDAARO
C[C@@H]1COC2(CC[NH+](CC3(O)CCCCC3)CC2)O1	ZINC000089941318	288330307	/nfs/dbraw/zinc/33/03/07/288330307.db2.gz	CFUBNCYXSYOSCN-CYBMUJFWSA-N	1	0	269.385	1.909	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H]1[C@@H]2CCCO[C@H]2C1(C)C	ZINC000248482070	290346097	/nfs/dbraw/zinc/34/60/97/290346097.db2.gz	INYCXPNRCBDPPO-QJPTWQEYSA-N	1	0	268.401	1.552	50	0		CDAARO
COc1ccc(-n2nnnc2C2([NH3+])CCCCC2)cc1	ZINC000022434503	295051946	/nfs/dbraw/zinc/05/19/46/295051946.db2.gz	CNAYIGXYYDMDBH-UHFFFAOYSA-N	1	0	273.340	1.789	50	0		CDAARO
COc1ccccc1N1C(=N)NC(=[NH2+])NC12CCCCC2	ZINC000000146413	295368276	/nfs/dbraw/zinc/36/82/76/295368276.db2.gz	VBDGNAITTIPYBS-UHFFFAOYSA-N	1	0	287.367	1.805	50	0		CDAARO
CS(=O)(=O)[C@H]1CCCC[C@@H]1[NH2+]C1CCOCC1	ZINC000096491580	295551645	/nfs/dbraw/zinc/55/16/45/295551645.db2.gz	DIHOLVIIIOJXNL-RYUDHWBXSA-N	1	0	261.387	1.111	50	0		CDAARO
C[NH+](C)CC[C@@H](NS(=O)(=O)C1CC1)c1ccccc1	ZINC000534581472	328311714	/nfs/dbraw/zinc/31/17/14/328311714.db2.gz	NISWDQNHTPSHLX-CQSZACIVSA-N	1	0	282.409	1.761	50	0		CDAARO
C[C@@H](Cn1cncn1)[NH2+]CCCOC1CCCC1	ZINC000534583296	328312538	/nfs/dbraw/zinc/31/25/38/328312538.db2.gz	JUMGYPNLOXYRJW-LBPRGKRZSA-N	1	0	252.362	1.606	50	0		CDAARO
CC(C)[C@@H](CNc1ncccc1C(N)=O)[NH+](C)C	ZINC000534632208	328331876	/nfs/dbraw/zinc/33/18/76/328331876.db2.gz	SRVASOLHZQEEBC-LLVKDONJSA-N	1	0	250.346	1.179	50	0		CDAARO
Cc1ccn2nc(C(=O)N3CCC[C@]4(CC[NH2+]C4)C3)cc2c1	ZINC000534640008	328335569	/nfs/dbraw/zinc/33/55/69/328335569.db2.gz	PXQWGMMGEYJOIX-QGZVFWFLSA-N	1	0	298.390	1.858	50	0		CDAARO
O=C(NC[C@@H]1CC[NH2+]C[C@H]1O)c1cc(F)ccc1Cl	ZINC000534655049	328339342	/nfs/dbraw/zinc/33/93/42/328339342.db2.gz	KWLSGNKEDNHKDU-QPUJVOFHSA-N	1	0	286.734	1.179	50	0		CDAARO
c1coc(CN2CCC([NH2+]CCn3ccnn3)CC2)c1	ZINC000534665490	328344931	/nfs/dbraw/zinc/34/49/31/328344931.db2.gz	ZMPFVPKMSVIKQM-UHFFFAOYSA-N	1	0	275.356	1.125	50	0		CDAARO
Cc1nnc(CSc2nnc([C@@H]3CCC[NH2+]C3)n2C)[nH]1	ZINC000534661203	328349260	/nfs/dbraw/zinc/34/92/60/328349260.db2.gz	COPATHNZWIBLHT-SECBINFHSA-N	1	0	293.400	1.001	50	0		CDAARO
O=C(NCc1ccc2nonc2c1)[C@H]1CCC[NH2+]CC1	ZINC000534663970	328351392	/nfs/dbraw/zinc/35/13/92/328351392.db2.gz	ZNPKMDWGTSMXSE-NSHDSACASA-N	1	0	274.324	1.229	50	0		CDAARO
CCN(Cc1nc(C)no1)C(=O)NCC[N@H+](C)C(C)C	ZINC000534676258	328351772	/nfs/dbraw/zinc/35/17/72/328351772.db2.gz	FMWORHKTKGVUER-UHFFFAOYSA-N	1	0	283.376	1.250	50	0		CDAARO
CC(C)[NH+]1CCN(c2cccc(NS(C)(=O)=O)c2)CC1	ZINC000130247673	323210616	/nfs/dbraw/zinc/21/06/16/323210616.db2.gz	IFZYXUGMYJVPRY-UHFFFAOYSA-N	1	0	297.424	1.589	50	0		CDAARO
C[C@H](NC(=O)N1CC[C@@H](C[NH+](C)C)C1)[C@@H]1CCOC1	ZINC000195570439	323572497	/nfs/dbraw/zinc/57/24/97/323572497.db2.gz	NUNLYNCOPGGQOX-RWMBFGLXSA-N	1	0	269.389	1.005	50	0		CDAARO
COC(=O)[C@@H](CC[NH2+]Cc1ccc(OC)cc1)[C@@H](C)O	ZINC000043214672	328754209	/nfs/dbraw/zinc/75/42/09/328754209.db2.gz	CEENHDWLURPRQT-RISCZKNCSA-N	1	0	281.352	1.345	50	0		CDAARO
Cc1ccc(OCC(=O)N(C)[C@@H]2CC[NH2+]C2)cc1C	ZINC000179065599	329203856	/nfs/dbraw/zinc/20/38/56/329203856.db2.gz	JOHZPOGLQUTMHP-CYBMUJFWSA-N	1	0	262.353	1.503	50	0		CDAARO
C[NH+](C)C[C@H]1[C@@H]2CN(c3cnc4ccccc4n3)C[C@H]12	ZINC000670436555	482973289	/nfs/dbraw/zinc/97/32/89/482973289.db2.gz	CJZVTSXKDHQPKD-XYYAHUGASA-N	1	0	268.364	1.874	50	0		CDAARO
CC(C)=CCC[N@@H+]1C[C@H](O)[C@@H](N2CCCCC2)C1	ZINC000670453433	483023423	/nfs/dbraw/zinc/02/34/23/483023423.db2.gz	TWBAVMIUMJXRHU-GJZGRUSLSA-N	1	0	252.402	1.874	50	0		CDAARO
Nc1ncc(C[N@@H+]2CCC[C@H](CN3CCCC3=O)C2)s1	ZINC000670460131	483042075	/nfs/dbraw/zinc/04/20/75/483042075.db2.gz	JWBWWFDITGSAHP-NSHDSACASA-N	1	0	294.424	1.560	50	0		CDAARO
C[C@H](CN(C)CCO)[NH2+]C1(c2cc(F)cc(F)c2)CC1	ZINC000670468611	483062280	/nfs/dbraw/zinc/06/22/80/483062280.db2.gz	CGFRQEFSSFIMOV-LLVKDONJSA-N	1	0	284.350	1.856	50	0		CDAARO
CCn1c(C)nnc1CN(C)[C@H]1CC[N@H+](CC2CCC2)C1	ZINC000083836843	483202811	/nfs/dbraw/zinc/20/28/11/483202811.db2.gz	QQJSYMKWVMADDR-HNNXBMFYSA-N	1	0	291.443	1.913	50	0		CDAARO
Cc1cc(N2CCC(c3cn[nH]c3)CC2)nc(N)[nH+]1	ZINC000097201936	518187461	/nfs/dbraw/zinc/18/74/61/518187461.db2.gz	GNJSNRKQFSRNLO-UHFFFAOYSA-N	1	0	258.329	1.474	50	0		CDAARO
Cc1cnc(C(=O)NC[C@H]2CCC[N@@H+](CC(C)C)C2)cn1	ZINC000067490628	518191633	/nfs/dbraw/zinc/19/16/33/518191633.db2.gz	IHJOIUYVLGFVMP-CQSZACIVSA-N	1	0	290.411	1.883	50	0		CDAARO
CCO[C@@H]1C[C@H](O)C12CC[NH+](CC[C@H]1CCCO1)CC2	ZINC000248941686	520441255	/nfs/dbraw/zinc/44/12/55/520441255.db2.gz	CUDRZJMQHPIHLO-QLFBSQMISA-N	1	0	283.412	1.807	50	0		CDAARO
CC[NH+]1CCC(CC(=O)NCc2cc(C)nn2C)CC1	ZINC000095353693	521544671	/nfs/dbraw/zinc/54/46/71/521544671.db2.gz	CFKWDNDLJIIVTF-UHFFFAOYSA-N	1	0	278.400	1.467	50	0		CDAARO
CC[C@@H](C(=O)N1CC[C@@H](Oc2ccccn2)C1)[NH+](C)C	ZINC000096477444	529278695	/nfs/dbraw/zinc/27/86/95/529278695.db2.gz	PIGIQYZJKMFLRA-OLZOCXBDSA-N	1	0	277.368	1.402	50	0		CDAARO
CCOC(C[N@@H+]1CCC[C@H](c2cc[nH]n2)C1)OCC	ZINC000184950910	535737271	/nfs/dbraw/zinc/73/72/71/535737271.db2.gz	UJMNELQBUUAXFL-LBPRGKRZSA-N	1	0	267.373	1.988	50	0		CDAARO
CN1CCN(C2CC[NH+](C[C@@H]3CCCCO3)CC2)C1=O	ZINC000075604002	538371664	/nfs/dbraw/zinc/37/16/64/538371664.db2.gz	ODLALPZYABJQQO-AWEZNQCLSA-N	1	0	281.400	1.387	50	0		CDAARO
C[C@@H](NC(=O)N[C@@H](C)CO)[C@H]1CCC[N@@H+](C2CCC2)C1	ZINC000097080686	538434415	/nfs/dbraw/zinc/43/44/15/538434415.db2.gz	RYXDPNHBGUSMKL-XQQFMLRXSA-N	1	0	283.416	1.319	50	0		CDAARO
CC[N@H+](CCCOC)CC(=O)Nc1cccc(OC)c1	ZINC000097159062	538438061	/nfs/dbraw/zinc/43/80/61/538438061.db2.gz	XUIJALVJYFXQLH-UHFFFAOYSA-N	1	0	280.368	1.992	50	0		CDAARO
Cc1cc(OC(F)F)c(C(=O)N2CC(C)([NH3+])C2)s1	ZINC000888096568	617758479	/nfs/dbraw/zinc/75/84/79/617758479.db2.gz	KGBBOZVMUBNAFG-UHFFFAOYSA-N	1	0	276.308	1.831	50	0		CDAARO
COCCC[N@@H+]1CCC[C@H](CNC(=O)c2ccoc2)C1	ZINC000952988464	616884912	/nfs/dbraw/zinc/88/49/12/616884912.db2.gz	QJVQDZNHBVXHPZ-CYBMUJFWSA-N	1	0	280.368	1.758	50	0		CDAARO
Cc1nc(C)c(C[N@@H+]2C[C@@H]3COCC[C@]3(CO)C2)s1	ZINC001772711050	1159445141	/nfs/dbraw/zinc/44/51/41/1159445141.db2.gz	VXXMYTKOXCEJMN-TZMCWYRMSA-N	1	0	282.409	1.591	50	0		CDAARO
CN(C)c1nccnc1NC[C@@H]1CC2(CO1)CC[NH2+]CC2	ZINC001704331283	1177691514	/nfs/dbraw/zinc/69/15/14/1177691514.db2.gz	LPFPTUCQFWXCSL-LBPRGKRZSA-N	1	0	291.399	1.113	50	0		CDAARO
C[C@H](C[N@H+](C)CCn1cc(Cl)cn1)N1CCOCC1	ZINC001704351978	1177699784	/nfs/dbraw/zinc/69/97/84/1177699784.db2.gz	OGXMZRDQAPDCLN-GFCCVEGCSA-N	1	0	286.807	1.189	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OCC[C@H]1CCOC1=O	ZINC000585123444	1164208864	/nfs/dbraw/zinc/20/88/64/1164208864.db2.gz	JODPUJQMQWIWNQ-RYUDHWBXSA-N	1	0	271.357	1.494	50	0		CDAARO
CCOC(=O)[C@]1(Cc2ccccc2)CCC[N@H+](CCO)C1	ZINC000012578022	736825419	/nfs/dbraw/zinc/82/54/19/736825419.db2.gz	YHGWPDTZYMDCRM-KRWDZBQOSA-N	1	0	291.391	1.867	50	0		CDAARO
CN1CC[N@@H+]([C@@H]2CCc3ccccc3C2)CCC1=O	ZINC000015001435	738686083	/nfs/dbraw/zinc/68/60/83/738686083.db2.gz	UTWWNULLMWJFNU-OAHLLOKOSA-N	1	0	258.365	1.708	50	0		CDAARO
Cc1nnc(CN2CCC([N@@H+]3CCC[C@H](O)C3)CC2)s1	ZINC000299791648	738764301	/nfs/dbraw/zinc/76/43/01/738764301.db2.gz	DXYIDTIMFDNEPZ-ZDUSSCGKSA-N	1	0	296.440	1.268	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](NC(=O)c2cnc(C)nc2C)C1	ZINC000180278770	738816500	/nfs/dbraw/zinc/81/65/00/738816500.db2.gz	RJBZJEZKLJSBGH-GFCCVEGCSA-N	1	0	262.357	1.308	50	0		CDAARO
Cc1nc[nH]c1C(=O)NC[C@H]1CCCN(c2cc[nH+]cc2)C1	ZINC000952974109	736500184	/nfs/dbraw/zinc/50/01/84/736500184.db2.gz	SRSRCKCMDHUJGV-CYBMUJFWSA-N	1	0	299.378	1.760	50	0		CDAARO
C[C@H](C1CCN(C(=O)c2nc[nH]n2)CC1)[NH+]1CCCC1	ZINC000067674131	736771569	/nfs/dbraw/zinc/77/15/69/736771569.db2.gz	AICDGTYSTZZOCF-LLVKDONJSA-N	1	0	277.372	1.141	50	0		CDAARO
C[N@@H+]1CCCN(c2cc([C@H]3CCOC3)ncn2)CC1	ZINC000426405116	737485526	/nfs/dbraw/zinc/48/55/26/737485526.db2.gz	IRICYYHHTGUFKA-LBPRGKRZSA-N	1	0	262.357	1.122	50	0		CDAARO
Cc1nc(-c2ccncc2)ncc1[C@H](C)NC(=O)C[NH+](C)C	ZINC000012442174	737786692	/nfs/dbraw/zinc/78/66/92/737786692.db2.gz	WTWMFLDNFOEZQH-NSHDSACASA-N	1	0	299.378	1.586	50	0		CDAARO
C[C@@H]([NH3+])CNC(=O)c1csc(-c2ccccn2)n1	ZINC000194896870	739011355	/nfs/dbraw/zinc/01/13/55/739011355.db2.gz	PMGVNFDHRPLLQP-MRVPVSSYSA-N	1	0	262.338	1.282	50	0		CDAARO
Cc1nc2ccccc2cc1C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178569297	739032212	/nfs/dbraw/zinc/03/22/12/739032212.db2.gz	XYYJGRRYHLRKSE-LBPRGKRZSA-N	1	0	269.348	1.964	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[N@H+](C)CC2(C)COC2)n1	ZINC001506420529	909177496	/nfs/dbraw/zinc/17/74/96/909177496.db2.gz	HLZQCHSQWJBEAN-ZDUSSCGKSA-N	1	0	251.374	1.857	50	0		CDAARO
Cn1nccc1C(=O)NCC1(C[NH+]2CCCC2)CC1	ZINC000952872373	910428454	/nfs/dbraw/zinc/42/84/54/910428454.db2.gz	MSTWGPGJNLPYNM-UHFFFAOYSA-N	1	0	262.357	1.026	50	0		CDAARO
Cn1cncc1C(=O)NC[C@@H]1CCCN(c2cc[nH+]cc2)C1	ZINC000952987226	910553662	/nfs/dbraw/zinc/55/36/62/910553662.db2.gz	MMWKKDXMCHMLGO-ZDUSSCGKSA-N	1	0	299.378	1.462	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)NCC2(COc3ccccc3)CC2)C1	ZINC000826951618	925925551	/nfs/dbraw/zinc/92/55/51/925925551.db2.gz	MMNBDJAMEVPLJW-CYBMUJFWSA-N	1	0	289.379	1.588	50	0		CDAARO
c1cn(CC2(C[NH2+][C@H]3CN4CCC3CC4)CC2)cn1	ZINC000829078376	926233156	/nfs/dbraw/zinc/23/31/56/926233156.db2.gz	IBQNVPQTOOJUIS-AWEZNQCLSA-N	1	0	260.385	1.347	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@@H](C[N@@H+]2CC[C@H](C(N)=O)C2)C1	ZINC000584907100	930677662	/nfs/dbraw/zinc/67/76/62/930677662.db2.gz	PQTKIJUOLFCAEZ-RYUDHWBXSA-N	1	0	297.399	1.051	50	0		CDAARO
O=C(N1CCSCC1)N1CCC[N@H+](CC2CCC2)CC1	ZINC000585114614	930958755	/nfs/dbraw/zinc/95/87/55/930958755.db2.gz	NDVUVHMPWSLOSQ-UHFFFAOYSA-N	1	0	297.468	1.963	50	0		CDAARO
C[C@@H]1[C@@H]([NH2+]Cc2nncn2-c2ccccc2)CO[C@H]1C	ZINC000585117588	930985431	/nfs/dbraw/zinc/98/54/31/930985431.db2.gz	MBONKBOJZTUFAQ-OBJOEFQTSA-N	1	0	272.352	1.780	50	0		CDAARO
COc1cnc(N(C)CC[N@@H+]2CCCC[C@@H]2C)nc1	ZINC001506414676	975155830	/nfs/dbraw/zinc/15/58/30/975155830.db2.gz	IDECUFCVLOKKQG-LBPRGKRZSA-N	1	0	264.373	1.796	50	0		CDAARO
CCCn1ncc(C)c1NC(=O)C[N@H+](C)C(C)C	ZINC001506415690	975155964	/nfs/dbraw/zinc/15/59/64/975155964.db2.gz	ZKXPSHZTPBHTEJ-UHFFFAOYSA-N	1	0	252.362	1.880	50	0		CDAARO
Cc1cccn2c(CC(=O)Nc3nccn3C)cnc12	ZINC001506420970	975158420	/nfs/dbraw/zinc/15/84/20/975158420.db2.gz	FFFONFTUUXGKDH-UHFFFAOYSA-N	1	0	269.308	1.557	50	0		CDAARO
O=C(NC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CCCO1	ZINC000004750442	230369160	/nfs/dbraw/zinc/36/91/60/230369160.db2.gz	TWMLEMYWGACHBZ-MRXNPFEDSA-N	1	0	288.391	1.946	50	0		CDAARO
C[C@@H](NC(=O)[C@@H]1CCCOC1)C(C)(C)C[NH+](C)C	ZINC000096449596	230375586	/nfs/dbraw/zinc/37/55/86/230375586.db2.gz	LXCAXPVEVGKZDE-VXGBXAGGSA-N	1	0	256.390	1.506	50	0		CDAARO
C[C@@H]1CCC[NH2+][C@H]1CNC(=O)CC[C@@H]1CCOC1	ZINC000401255961	342484331	/nfs/dbraw/zinc/48/43/31/342484331.db2.gz	AOTSVQLDPUHNQO-UPJWGTAASA-N	1	0	254.374	1.307	50	0		CDAARO
Cc1cc(C(N)=O)c(NC[C@H](C(C)C)[NH+](C)C)nc1C	ZINC000584902989	341986523	/nfs/dbraw/zinc/98/65/23/341986523.db2.gz	RBUXIAKWGYYBQW-CYBMUJFWSA-N	1	0	278.400	1.795	50	0		CDAARO
Cc1nc(C[N@H+]2C[C@@H]3[C@@H](C[NH+](C)C)[C@@H]3C2)n(C)c1C	ZINC000584902775	341987028	/nfs/dbraw/zinc/98/70/28/341987028.db2.gz	LYJJYZWXDQWUBH-ZSOGYDGISA-N	1	0	262.401	1.276	50	0		CDAARO
Cc1ccc(OCC(=O)N2CCC[C@H]([NH3+])C2)cc1C	ZINC000195107599	230396193	/nfs/dbraw/zinc/39/61/93/230396193.db2.gz	IYRUUVSMRVQTBI-ZDUSSCGKSA-N	1	0	262.353	1.632	50	0		CDAARO
O=C(NC[C@@H]1C[N@@H+]2CCC[C@@H]2CO1)N1C[C@@H]2CCC[C@@H]2C1	ZINC000084137085	539086222	/nfs/dbraw/zinc/08/62/22/539086222.db2.gz	PBLKBKWJSOBAIQ-LXTVHRRPSA-N	1	0	293.411	1.291	50	0		CDAARO
CC(C)(C)OC(=O)NC[C@@H]([NH2+][C@@H]1CCOC1)C1CC1	ZINC000095968382	185046988	/nfs/dbraw/zinc/04/69/88/185046988.db2.gz	OPAANOLSBPJTJP-VXGBXAGGSA-N	1	0	270.373	1.668	50	0		CDAARO
COc1ccc(CC[C@H](C)[NH+]2CCN(CCO)CC2)cc1	ZINC000023283344	342089287	/nfs/dbraw/zinc/08/92/87/342089287.db2.gz	VZNKOKKAZWZUCT-HNNXBMFYSA-N	1	0	292.423	1.626	50	0		CDAARO
CCOC(=O)N1CCC([N@H+](CC)CCN(C)C)CC1	ZINC000022455517	342089089	/nfs/dbraw/zinc/08/90/89/342089089.db2.gz	KZWVXTYTDDUNGP-UHFFFAOYSA-N	1	0	271.405	1.491	50	0		CDAARO
CC(C)(C)[NH2+][C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1=O	ZINC000004978247	342089163	/nfs/dbraw/zinc/08/91/63/342089163.db2.gz	MPGQXJYIRKWKKA-JTQLQIEISA-N	1	0	290.319	1.435	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)Cc1ccc(F)cc1Cl	ZINC000195554039	342625773	/nfs/dbraw/zinc/62/57/73/342625773.db2.gz	HXNQPSZVAGNVMR-NEPJUHHUSA-N	1	0	286.734	1.125	50	0		CDAARO
C[C@H](Cc1ccc(F)cc1)NC(=O)[C@]1(F)CC[NH2+]C1	ZINC000195543196	342626627	/nfs/dbraw/zinc/62/66/27/342626627.db2.gz	URGUCRVKWWWDBN-YGRLFVJLSA-N	1	0	268.307	1.575	50	0		CDAARO
COC(CN1CCC[C@@H]([NH+]2CCCCC2)C1)OC	ZINC000195572052	342628744	/nfs/dbraw/zinc/62/87/44/342628744.db2.gz	FIPOFJGTKZRYAT-CYBMUJFWSA-N	1	0	256.390	1.556	50	0		CDAARO
c1ccc(COC2CC[NH+](C[C@H]3COCCO3)CC2)nc1	ZINC000244723644	361857956	/nfs/dbraw/zinc/85/79/56/361857956.db2.gz	MEYQQQPFPQEDIR-INIZCTEOSA-N	1	0	292.379	1.478	50	0		CDAARO
O=C(C[NH+]1CCCC1)N[C@@H](c1ccccn1)[C@H]1C[C@H](O)C1	ZINC000244748549	361861925	/nfs/dbraw/zinc/86/19/25/361861925.db2.gz	OJNMGMPPAIJFRA-XJKCOSOUSA-N	1	0	289.379	1.106	50	0		CDAARO
COc1c[nH]c(C[N@H+](C)CC2(CO)CCCC2)cc1=O	ZINC000244882440	361867925	/nfs/dbraw/zinc/86/79/25/361867925.db2.gz	XRRWIHYDSFQTLL-UHFFFAOYSA-N	1	0	280.368	1.780	50	0		CDAARO
c1ccc(NC[C@@H]2CC[N@H+](C[C@@H]3CCOC3)C2)nc1	ZINC000065563928	361916895	/nfs/dbraw/zinc/91/68/95/361916895.db2.gz	SABUSLIXTPSIGI-KBPBESRZSA-N	1	0	261.369	1.852	50	0		CDAARO
C[C@H]([NH2+][C@H]1CCC(=O)N(C)C1)c1cccc(CO)c1	ZINC000097035124	185156919	/nfs/dbraw/zinc/15/69/19/185156919.db2.gz	YIFWYGUIGLDVPA-FZMZJTMJSA-N	1	0	262.353	1.450	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@@H]2CCC[C@H]2CO)cc1	ZINC000097034944	185157337	/nfs/dbraw/zinc/15/73/37/185157337.db2.gz	PYKUSLZVULZWMW-UONOGXRCSA-N	1	0	263.337	1.724	50	0		CDAARO
O=C1NCC[C@@H]1[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1	ZINC000248800093	361948535	/nfs/dbraw/zinc/94/85/35/361948535.db2.gz	ZZTWAMPBWNLWEN-SNPRPXQTSA-N	1	0	274.364	1.632	50	0		CDAARO
C[C@@H]1CN(C(=O)C2CC2)CC[C@@H]1[NH2+]Cc1cccnc1	ZINC000084714964	342267893	/nfs/dbraw/zinc/26/78/93/342267893.db2.gz	PWVVJGQIMULXIL-DOMZBBRYSA-N	1	0	273.380	1.818	50	0		CDAARO
C[N@H+]1CC=C(c2noc(CCC(=O)N3CCCC3)n2)CC1	ZINC000033069124	539135723	/nfs/dbraw/zinc/13/57/23/539135723.db2.gz	ZXIMDVASGNUAGF-UHFFFAOYSA-N	1	0	290.367	1.344	50	0		CDAARO
CC(C)NS(=O)(=O)CC[NH2+][C@@H](C)c1ccccc1	ZINC000173390305	365696536	/nfs/dbraw/zinc/69/65/36/365696536.db2.gz	CJBIORBOAYNJAG-LBPRGKRZSA-N	1	0	270.398	1.665	50	0		CDAARO
CO[C@@H](C[NH2+]Cc1nncn1-c1ccccc1)C1CC1	ZINC000585117676	362046493	/nfs/dbraw/zinc/04/64/93/362046493.db2.gz	RDEKCASSGRIYHH-AWEZNQCLSA-N	1	0	272.352	1.782	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@@H](NC(=O)CCc2ccncc2)C1(C)C	ZINC000585130213	362063239	/nfs/dbraw/zinc/06/32/39/362063239.db2.gz	KMZVAQPUIPNDNE-ZIAGYGMSSA-N	1	0	275.396	1.859	50	0		CDAARO
[NH3+][C@H](C(=O)N1CC[C@@H]2OCCC[C@H]2C1)c1ccccc1	ZINC000252586073	342387279	/nfs/dbraw/zinc/38/72/79/342387279.db2.gz	NGQVWZPTWQUYRU-KKUMJFAQSA-N	1	0	274.364	1.714	50	0		CDAARO
Cc1ccccc1C1(C(=O)N2CC[C@H](C[NH3+])C2)CC1	ZINC000178522461	362242084	/nfs/dbraw/zinc/24/20/84/362242084.db2.gz	NCGMJYDZYLEGDQ-CYBMUJFWSA-N	1	0	258.365	1.834	50	0		CDAARO
COc1cc(C)c(C(=O)N2CC[C@@H](C[NH3+])C2)cc1OC	ZINC000178573311	362246776	/nfs/dbraw/zinc/24/67/76/362246776.db2.gz	CQOOOVPGEPEKAU-NSHDSACASA-N	1	0	278.352	1.433	50	0		CDAARO
CN(C)c1ncnc2c1C[N@H+](CC1(O)CCCCC1)CC2	ZINC000065463026	282330115	/nfs/dbraw/zinc/33/01/15/282330115.db2.gz	NVKDQSJOYADSOU-UHFFFAOYSA-N	1	0	290.411	1.596	50	0		CDAARO
C[NH2+]CCN(C)C(=O)[C@H](C)n1ccnc1C(C)C	ZINC000252478836	362384280	/nfs/dbraw/zinc/38/42/80/362384280.db2.gz	AVRZEYLQMAKOGD-NSHDSACASA-N	1	0	252.362	1.245	50	0		CDAARO
CN(C)C(=O)c1ccc(C[N@H+](C)CC2(CO)CCC2)o1	ZINC000252495562	362388823	/nfs/dbraw/zinc/38/88/23/362388823.db2.gz	OTQOOZOQJFAOAP-UHFFFAOYSA-N	1	0	280.368	1.576	50	0		CDAARO
CSCCCNc1cc([C@H]2C[C@@H](O)C2)[nH+]c(N)n1	ZINC000252535666	362391441	/nfs/dbraw/zinc/39/14/41/362391441.db2.gz	GOHZAZVHWJTBQL-DTORHVGOSA-N	1	0	268.386	1.462	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](Nc2nccc(C)c2[N+](=O)[O-])C1	ZINC000399528251	346134147	/nfs/dbraw/zinc/13/41/47/346134147.db2.gz	SXVBARCGGMGGFK-LBPRGKRZSA-N	1	0	294.355	1.821	50	0		CDAARO
Cc1nccn1C[C@H]1CCC[N@H+]1CCN1CCO[C@H](C)C1	ZINC000192753373	362698782	/nfs/dbraw/zinc/69/87/82/362698782.db2.gz	DIEPXTVZOYWYCS-GDBMZVCRSA-N	1	0	292.427	1.377	50	0		CDAARO
[NH3+]C1(Cc2ccc(F)cc2)CCS(=O)(=O)CC1	ZINC000098213637	185700553	/nfs/dbraw/zinc/70/05/53/185700553.db2.gz	XNMBDRJSRTZOAP-UHFFFAOYSA-N	1	0	257.330	1.274	50	0		CDAARO
COc1ccc(CN2CC[NH+](C3CCOCC3)CC2)cn1	ZINC000085826518	179183722	/nfs/dbraw/zinc/18/37/22/179183722.db2.gz	WWPBSDAZOUKXIL-UHFFFAOYSA-N	1	0	291.395	1.387	50	0		CDAARO
CCc1nnsc1C(=O)NCCC[NH+]1CCC(C)CC1	ZINC000036686483	362827609	/nfs/dbraw/zinc/82/76/09/362827609.db2.gz	BRCUIBHTSJBAPS-UHFFFAOYSA-N	1	0	296.440	1.952	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@@H]2CC(=O)N(C(C)C)C2)C[C@H]1[NH+](C)C	ZINC000089948347	347627938	/nfs/dbraw/zinc/62/79/38/347627938.db2.gz	HGQKWBCUMCHDEJ-MGPQQGTHSA-N	1	0	295.427	1.042	50	0		CDAARO
Cc1ccccc1C[C@H](C)[NH2+]CCN1CCCS1(=O)=O	ZINC000089520024	179808854	/nfs/dbraw/zinc/80/88/54/179808854.db2.gz	YOIKQUPSUMWZSN-AWEZNQCLSA-N	1	0	296.436	1.551	50	0		CDAARO
Cc1ccc2nc(CN3CC[N@@H+](C)C[C@@H]3C)cc(=O)n2c1	ZINC000089665994	179844568	/nfs/dbraw/zinc/84/45/68/179844568.db2.gz	SDIPSFMRZZZOMM-ZDUSSCGKSA-N	1	0	286.379	1.139	50	0		CDAARO
CCc1csc(CC[NH2+][C@@H](C)CN2CCOCC2)n1	ZINC000584896520	349358441	/nfs/dbraw/zinc/35/84/41/349358441.db2.gz	NXUYYOZVYSIHEN-LBPRGKRZSA-N	1	0	283.441	1.558	50	0		CDAARO
CC[N@H+](C)C[C@@H](C)CNC(=O)N1CC(c2ccccn2)C1	ZINC000584889121	349348086	/nfs/dbraw/zinc/34/80/86/349348086.db2.gz	IPSJAYADPGKBIO-ZDUSSCGKSA-N	1	0	290.411	1.778	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2c[nH]c(=O)[nH]2)CCCCC1	ZINC000584891458	349350587	/nfs/dbraw/zinc/35/05/87/349350587.db2.gz	BEJBBUHIUAFXPA-UHFFFAOYSA-N	1	0	266.345	1.110	50	0		CDAARO
CN(CC1(CO)CCCC1)C(=O)[C@@H]1CCC[N@H+](C)C1	ZINC000584891842	349351340	/nfs/dbraw/zinc/35/13/40/349351340.db2.gz	KPIPORZJXGCWBX-CYBMUJFWSA-N	1	0	268.401	1.339	50	0		CDAARO
O=C(NCCC[N@H+]1CCCC[C@@H]1CO)c1ccoc1	ZINC000584892386	349351695	/nfs/dbraw/zinc/35/16/95/349351695.db2.gz	XBODIXDHPXSFDN-CYBMUJFWSA-N	1	0	266.341	1.246	50	0		CDAARO
Cc1cc(C(=O)N2CCC[C@@H]([NH+](C)C)C2)cc(C)n1	ZINC000584892977	349352905	/nfs/dbraw/zinc/35/29/05/349352905.db2.gz	ATMLJOOEPUEKJS-CQSZACIVSA-N	1	0	261.369	1.865	50	0		CDAARO
C[C@H](NC1CC[NH+](Cc2ccco2)CC1)c1nncn1C	ZINC000584894632	349355042	/nfs/dbraw/zinc/35/50/42/349355042.db2.gz	HWHDSQXNXMJEAY-LBPRGKRZSA-N	1	0	289.383	1.723	50	0		CDAARO
COc1ccc([C@@H](C)[NH2+]C[C@@]2(O)CCOC2)c(F)c1	ZINC000090850219	180046200	/nfs/dbraw/zinc/04/62/00/180046200.db2.gz	RXCLZTASSAVEOI-YGRLFVJLSA-N	1	0	269.316	1.636	50	0		CDAARO
Cc1cc(C)n(-c2cncc(SCC[NH+](C)C)n2)n1	ZINC000092675688	482633193	/nfs/dbraw/zinc/63/31/93/482633193.db2.gz	RORALRJDVRRYRX-UHFFFAOYSA-N	1	0	277.397	1.933	50	0		CDAARO
CCC[C@@]1(CO)CCC[N@H+](CCCn2nnnc2C)C1	ZINC000091656356	180217619	/nfs/dbraw/zinc/21/76/19/180217619.db2.gz	BROVNWILRZVPMK-CQSZACIVSA-N	1	0	281.404	1.246	50	0		CDAARO
CC[C@@H]1CN([C@H](C)C(=O)NCC(F)(F)F)CCS1	ZINC000110642233	350228098	/nfs/dbraw/zinc/22/80/98/350228098.db2.gz	JEMIXQRJLSFMKA-RKDXNWHRSA-N	1	0	284.347	1.881	50	0		CDAARO
O[C@@H](CNc1ccncn1)C[NH+]1CCCCCC1	ZINC000091779472	180251850	/nfs/dbraw/zinc/25/18/50/180251850.db2.gz	AQXKRBAXNBDRHJ-LBPRGKRZSA-N	1	0	250.346	1.125	50	0		CDAARO
Cc1nnc(N2C[C@H](CO)C[C@H](C[NH+]3CCCC3)C2)s1	ZINC000091738452	180244111	/nfs/dbraw/zinc/24/41/11/180244111.db2.gz	GZGZOZUZWDUZJG-CHWSQXEVSA-N	1	0	296.440	1.377	50	0		CDAARO
COCC[C@]1(CO)CCC[N@H+](CCCn2ccnc2)C1	ZINC000091877169	180278832	/nfs/dbraw/zinc/27/88/32/180278832.db2.gz	FRMRYJTYLUUVNV-OAHLLOKOSA-N	1	0	281.400	1.384	50	0		CDAARO
CSc1ccccc1C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000092232071	180348770	/nfs/dbraw/zinc/34/87/70/180348770.db2.gz	WWICQALOFUCNSX-SNVBAGLBSA-N	1	0	250.367	1.842	50	0		CDAARO
CC(C)CCCC(=O)N1CCN2CC[N@H+](C)C[C@H]2C1	ZINC000106257501	186106392	/nfs/dbraw/zinc/10/63/92/186106392.db2.gz	ZPPOREOKYFFXEZ-AWEZNQCLSA-N	1	0	267.417	1.271	50	0		CDAARO
CC[C@H]1CN(Cc2cccnc2)CC[N@@H+]1C[C@H](C)O	ZINC000106906803	186149705	/nfs/dbraw/zinc/14/97/05/186149705.db2.gz	AXCGHIDREHNDPV-ZFWWWQNUSA-N	1	0	263.385	1.359	50	0		CDAARO
C[NH2+][C@H]1CCN(C(=O)OCc2ccccc2)C[C@H]1F	ZINC000107272485	186164801	/nfs/dbraw/zinc/16/48/01/186164801.db2.gz	ABMWQTWKPOPMIO-OLZOCXBDSA-N	1	0	266.316	1.955	50	0		CDAARO
CS(=O)(=O)N1C[C@@H]2C[NH+](Cc3ccccc3)C[C@H]2C1	ZINC000390827624	351373796	/nfs/dbraw/zinc/37/37/96/351373796.db2.gz	ZVSCAUDOIDGARS-KBPBESRZSA-N	1	0	280.393	1.010	50	0		CDAARO
Cn1cc([C@@H]2OCC[C@@H]2C[NH2+]Cc2ccccn2)cn1	ZINC000095402036	351396631	/nfs/dbraw/zinc/39/66/31/351396631.db2.gz	BCNWMBAGSMZTMO-IUODEOHRSA-N	1	0	272.352	1.683	50	0		CDAARO
C[C@@H]1C[C@H](CNC(=O)NC[C@@H]2CCCC[N@H+](C)C2)[C@H](C)O1	ZINC000624207760	351481221	/nfs/dbraw/zinc/48/12/21/351481221.db2.gz	PXGYLTIJZICRKH-CBBWQLFWSA-N	1	0	297.443	1.831	50	0		CDAARO
CC(C)(C)c1ccccc1S(=O)(=O)NCC[NH3+]	ZINC000122468124	187033810	/nfs/dbraw/zinc/03/38/10/187033810.db2.gz	SZSSYNXUWVAGSI-UHFFFAOYSA-N	1	0	256.371	1.221	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)Cc1ccc(OC)cc1	ZINC000122581592	187039797	/nfs/dbraw/zinc/03/97/97/187039797.db2.gz	YVPPODHABXREGU-ZDUSSCGKSA-N	1	0	262.353	1.448	50	0		CDAARO
[NH3+][C@@H]1CCCN(S(=O)(=O)c2cccc3cnccc32)C1	ZINC000034274098	363178289	/nfs/dbraw/zinc/17/82/89/363178289.db2.gz	QFYDIQKQRVDWLJ-GFCCVEGCSA-N	1	0	291.376	1.347	50	0		CDAARO
[NH3+][C@@H](CO)c1ccccc1I	ZINC000072199353	303449555	/nfs/dbraw/zinc/44/95/55/303449555.db2.gz	TVWLODOUGJQDKV-QMMMGPOBSA-N	1	0	263.078	1.283	50	0		CDAARO
CC(C)Oc1ccc([C@H](C)NC(=O)[C@H]2C[C@H](O)C[NH2+]2)cc1	ZINC000037007600	363312578	/nfs/dbraw/zinc/31/25/78/363312578.db2.gz	TYQPVPKVUWPXNV-CORIIIEPSA-N	1	0	292.379	1.374	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)NCCCc1nc(C)cs1	ZINC000167245197	188642158	/nfs/dbraw/zinc/64/21/58/188642158.db2.gz	DUEWYRUBCWQLFI-JTQLQIEISA-N	1	0	287.454	1.581	50	0		CDAARO
Ic1cnn([C@@H]2CCC[NH2+]C2)c1	ZINC000070677731	283041368	/nfs/dbraw/zinc/04/13/68/283041368.db2.gz	SRLZBDQBJOWJID-MRVPVSSYSA-N	1	0	277.109	1.412	50	0		CDAARO
COc1ccc(CC(=O)NCCC[NH+](C)C)cc1	ZINC000002742288	355981212	/nfs/dbraw/zinc/98/12/12/355981212.db2.gz	VJUVEEYXIFGLPX-UHFFFAOYSA-N	1	0	250.342	1.306	50	0	biogenic	CDAARO
CC[NH+](CC)CCNC(=O)c1ccc(NC(C)=O)cc1	ZINC000001999404	355957343	/nfs/dbraw/zinc/95/73/43/355957343.db2.gz	KEECCEWTUVWFCV-UHFFFAOYSA-N	1	0	277.368	1.717	50	0	endogenous,in-man	CDAARO
CCCCOc1ccc(C)cc1C[NH+](CCO)CCO	ZINC000002266191	355965831	/nfs/dbraw/zinc/96/58/31/355965831.db2.gz	HYYUUUZWGYJOSU-UHFFFAOYSA-N	1	0	281.396	1.961	50	0		CDAARO
COc1ccccc1C[NH2+]CCCN1CCOCC1	ZINC000002380319	355968278	/nfs/dbraw/zinc/96/82/78/355968278.db2.gz	WWBKAIQMRPAGKO-UHFFFAOYSA-N	1	0	264.369	1.507	50	0		CDAARO
OC[C@H]1C[N@H+](Cc2ccccc2)CCC12OCCO2	ZINC000004566047	356037625	/nfs/dbraw/zinc/03/76/25/356037625.db2.gz	CPBVGVADXUSNKC-CQSZACIVSA-N	1	0	263.337	1.244	50	0		CDAARO
CCCCCc1c(C)nc(N2CC[NH+](C)CC2)[nH]c1=O	ZINC000009196338	356206369	/nfs/dbraw/zinc/20/63/69/356206369.db2.gz	WWJOTHMQXHVDMJ-UHFFFAOYSA-N	1	0	278.400	1.563	50	0		CDAARO
Cc1cnn(C)c1NC(=O)C[C@@H]1CCCC[N@@H+]1C	ZINC000032550910	356250129	/nfs/dbraw/zinc/25/01/29/356250129.db2.gz	UMSFJBYFAYFFAH-NSHDSACASA-N	1	0	250.346	1.541	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1C	ZINC000014190365	356378956	/nfs/dbraw/zinc/37/89/56/356378956.db2.gz	DKLBPLAMIHXGIV-NEPJUHHUSA-N	1	0	277.368	1.798	50	0		CDAARO
C[C@H](c1nc(N)nc(N(C)C)n1)[NH+]1CCCCCCC1	ZINC000032850925	356394712	/nfs/dbraw/zinc/39/47/12/356394712.db2.gz	PSILLBVYHBFUTF-LLVKDONJSA-N	1	0	278.404	1.847	50	0		CDAARO
CC[C@@H](C)[NH+]1CCC2(CC1)C(=O)N(C(C)C)C(=O)N2C	ZINC000014751237	356396771	/nfs/dbraw/zinc/39/67/71/356396771.db2.gz	CLVWFUGBJSTTIN-GFCCVEGCSA-N	1	0	281.400	1.922	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](NC(C)=O)CN1Cc1cccc(C)c1	ZINC000014979942	356402278	/nfs/dbraw/zinc/40/22/78/356402278.db2.gz	OYFUCJGOFAUXSC-GJZGRUSLSA-N	1	0	290.363	1.247	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]C1)N1CCN(Cc2ccccc2)CC1	ZINC000019410977	356485189	/nfs/dbraw/zinc/48/51/89/356485189.db2.gz	KNRYCLCSSAKTCH-MRXNPFEDSA-N	1	0	287.407	1.330	50	0		CDAARO
Cc1cc(OC[C@@H](O)CN2CC[NH2+]CC2)ccc1Cl	ZINC000019668821	356494891	/nfs/dbraw/zinc/49/48/91/356494891.db2.gz	QMRKKKCMCLNBJV-LBPRGKRZSA-N	1	0	284.787	1.293	50	0		CDAARO
CCOc1cccc(OCCN2CC[NH2+]CC2)c1	ZINC000019728613	356498542	/nfs/dbraw/zinc/49/85/42/356498542.db2.gz	OLCQUXYRPXNGNF-UHFFFAOYSA-N	1	0	250.342	1.369	50	0		CDAARO
C[NH+]1CCN(CCCNC(=S)Nc2ccccc2)CC1	ZINC000019830640	356507588	/nfs/dbraw/zinc/50/75/88/356507588.db2.gz	NPVBXQKPFZGBTP-UHFFFAOYSA-N	1	0	292.452	1.611	50	0		CDAARO
[NH3+]Cc1ccc(C(=O)N2CCN(c3ccccc3)CC2)o1	ZINC000011628050	356576070	/nfs/dbraw/zinc/57/60/70/356576070.db2.gz	BCBSSASYSUASSJ-UHFFFAOYSA-N	1	0	285.347	1.701	50	0		CDAARO
O=C(NCC1(C(F)(F)F)CC[NH2+]CC1)C1CCC1	ZINC000725264676	538455625	/nfs/dbraw/zinc/45/56/25/538455625.db2.gz	GHLHZVXTXRACCT-UHFFFAOYSA-N	1	0	264.291	1.835	50	0		CDAARO
CCCn1ncc(CN2CC[N@H+](C)[C@H](CCO)C2)c1C	ZINC000022853436	356622694	/nfs/dbraw/zinc/62/26/94/356622694.db2.gz	WESVWOXCDRPSSD-OAHLLOKOSA-N	1	0	280.416	1.100	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)c1cnccn1)c1ccsc1	ZINC000023133068	356629526	/nfs/dbraw/zinc/62/95/26/356629526.db2.gz	FZFZUFHYSUCALX-GFCCVEGCSA-N	1	0	276.365	1.571	50	0		CDAARO
C[NH+]1CCN(CCCNC(=O)Nc2ccc(F)cc2)CC1	ZINC000024365299	356655610	/nfs/dbraw/zinc/65/56/10/356655610.db2.gz	YYOSGNAIZPVUDY-UHFFFAOYSA-N	1	0	294.374	1.585	50	0		CDAARO
[NH3+][C@H]1CCC[C@@H](C(=O)N2CCN(CC(F)(F)F)CC2)C1	ZINC000061950935	356742114	/nfs/dbraw/zinc/74/21/14/356742114.db2.gz	KFLCNEKFIDCHNN-MNOVXSKESA-N	1	0	293.333	1.210	50	0		CDAARO
Cc1ccc(N2C(=O)C[C@H]([NH+]3CCCC3)C2=O)cc1	ZINC000019794468	356814882	/nfs/dbraw/zinc/81/48/82/356814882.db2.gz	QXHGQUSYOJLVCB-ZDUSSCGKSA-N	1	0	258.321	1.723	50	0		CDAARO
CCN1CCC[C@H]([N@@H+]2CCC[C@@H](CCCO)C2)C1	ZINC000032519452	356781441	/nfs/dbraw/zinc/78/14/41/356781441.db2.gz	IWFICYUSBZVCBY-GJZGRUSLSA-N	1	0	254.418	1.955	50	0		CDAARO
Cc1cc(Br)ccc1C(=O)N1CC[NH2+]CC1	ZINC000037869087	356939580	/nfs/dbraw/zinc/93/95/80/356939580.db2.gz	JPPPZQWQOYPLMW-UHFFFAOYSA-N	1	0	283.169	1.803	50	0		CDAARO
Cc1noc(C)c1[C@H](C)C(=O)N1C[C@H](C)[NH2+][C@@H](C)C1	ZINC000247301649	357395029	/nfs/dbraw/zinc/39/50/29/357395029.db2.gz	PCHVVQCTHYHRHQ-GUBZILKMSA-N	1	0	265.357	1.604	50	0		CDAARO
CCS[C@H]1CC[C@H]([N@H+](C)CCN2C(=O)CCC2=O)C1	ZINC000096441695	357473572	/nfs/dbraw/zinc/47/35/72/357473572.db2.gz	RMRVKXYHKGDTLJ-RYUDHWBXSA-N	1	0	284.425	1.741	50	0		CDAARO
CCc1cc(NCC[C@@H]2CCOC2)nc(N(C)C)[nH+]1	ZINC000065372812	357532889	/nfs/dbraw/zinc/53/28/89/357532889.db2.gz	NBOCWNSBGLECSF-LLVKDONJSA-N	1	0	264.373	1.944	50	0		CDAARO
C[NH+]1CCC(OCCCn2cc3[nH]cccc-3c2=O)CC1	ZINC000065386150	357534280	/nfs/dbraw/zinc/53/42/80/357534280.db2.gz	VDIDPRJPRDOOFD-UHFFFAOYSA-N	1	0	289.379	1.538	50	0		CDAARO
O=C(CNC(=O)C[NH+]1CCCCCC1)Nc1nccs1	ZINC000065497921	357545993	/nfs/dbraw/zinc/54/59/93/357545993.db2.gz	AXSZQGKBKSHEDW-UHFFFAOYSA-N	1	0	296.396	1.074	50	0		CDAARO
C[N@@H+](Cc1cc2cc(F)ccc2[nH]1)C[C@H](O)CO	ZINC000067755170	357624564	/nfs/dbraw/zinc/62/45/64/357624564.db2.gz	YULXZWKDLGIUBZ-LBPRGKRZSA-N	1	0	252.289	1.092	50	0		CDAARO
CCc1ncc(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@@H+]3C)cn1	ZINC000067803139	357628925	/nfs/dbraw/zinc/62/89/25/357628925.db2.gz	FDHACSDZQWWDHD-QWHCGFSZSA-N	1	0	274.368	1.348	50	0		CDAARO
CCc1[nH]nc(C(=O)NCC[C@@H]2CCC[N@H+](C)C2)c1C	ZINC000067821594	357629860	/nfs/dbraw/zinc/62/98/60/357629860.db2.gz	BZYKQMIIMPLXRC-LBPRGKRZSA-N	1	0	278.400	1.742	50	0		CDAARO
Cc1cc(N(C)C)nc(NCCNC(=O)c2ccccc2)[nH+]1	ZINC000067604986	357613586	/nfs/dbraw/zinc/61/35/86/357613586.db2.gz	YMQKZASQDGJPDX-UHFFFAOYSA-N	1	0	299.378	1.693	50	0		CDAARO
CNC(=O)[C@@H]1C[C@H]([NH3+])CN1Cc1ccc(CC(C)C)cc1	ZINC000067650244	357616709	/nfs/dbraw/zinc/61/67/09/357616709.db2.gz	BANHQZOLTIPVGG-HOTGVXAUSA-N	1	0	289.423	1.533	50	0		CDAARO
CCOC(=O)c1n[nH]cc1CN1CCC[C@@]2(CC[NH2+]C2)C1	ZINC000067820048	357630366	/nfs/dbraw/zinc/63/03/66/357630366.db2.gz	HVDHXQDIPJICGM-HNNXBMFYSA-N	1	0	292.383	1.162	50	0		CDAARO
CC(C)[NH+]1CCC(CC(=O)N(C)CCc2cn[nH]c2)CC1	ZINC000067847459	357631610	/nfs/dbraw/zinc/63/16/10/357631610.db2.gz	QUQAJLBSJSCWSN-UHFFFAOYSA-N	1	0	292.427	1.921	50	0		CDAARO
C[C@@H](Cn1cncn1)[NH2+]Cc1[nH]nc2c1CCCCC2	ZINC000067878577	357634284	/nfs/dbraw/zinc/63/42/84/357634284.db2.gz	ONTQMMPMPKGDGX-NSHDSACASA-N	1	0	274.372	1.448	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000097081558	357945011	/nfs/dbraw/zinc/94/50/11/357945011.db2.gz	DSJQXTFZCMWRTL-GHMZBOCLSA-N	1	0	254.374	1.400	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@H]2CCCC[C@@H]2O)s1	ZINC000097102608	357972336	/nfs/dbraw/zinc/97/23/36/357972336.db2.gz	QWRCKNHABXQISK-QWRGUYRKSA-N	1	0	269.366	1.928	50	0		CDAARO
Cc1nc(CN[C@H](CC(N)=O)C2CCCCC2)no1	ZINC000097111045	357986807	/nfs/dbraw/zinc/98/68/07/357986807.db2.gz	RRJOEJBQOOGHGI-LLVKDONJSA-N	1	0	266.345	1.292	50	0		CDAARO
O[C@@]1(C[NH+]2CCCCC2)CCN(Cc2ccccn2)C1	ZINC000077437338	358019062	/nfs/dbraw/zinc/01/90/62/358019062.db2.gz	UVRLBQMZYSUUGG-MRXNPFEDSA-N	1	0	275.396	1.504	50	0		CDAARO
COc1cc(N)c(Cl)cc1C(=O)N1CCC([NH3+])CC1	ZINC000097228867	358043461	/nfs/dbraw/zinc/04/34/61/358043461.db2.gz	FSDHEJJHFWXCOT-UHFFFAOYSA-N	1	0	283.759	1.494	50	0		CDAARO
COC(=O)[C@@H]1CN(CCCc2cccc(F)c2)CCO1	ZINC000097048447	358114673	/nfs/dbraw/zinc/11/46/73/358114673.db2.gz	JNWQEBBRXQHMDM-AWEZNQCLSA-N	1	0	281.327	1.632	50	0		CDAARO
CNC(=O)NC(=O)[C@@H](C)[NH2+][C@@H](c1ccccc1)C(C)C	ZINC000008002961	283361202	/nfs/dbraw/zinc/36/12/02/283361202.db2.gz	MAZKPHBZWATHRH-DGCLKSJQSA-N	1	0	277.368	1.817	50	0		CDAARO
COc1ccccc1/C=C\C(=O)N1CC[N@H+](C)C[C@@H]1C	ZINC000098055864	358344624	/nfs/dbraw/zinc/34/46/24/358344624.db2.gz	VXWNCDJFTYBMHI-YXVBKTCISA-N	1	0	274.364	1.871	50	0		CDAARO
C[C@H](CN1CC2(CC[NH2+]CC2)CCC1=O)n1ccnc1	ZINC000091974273	358533535	/nfs/dbraw/zinc/53/35/35/358533535.db2.gz	LWTPJODKHSAFRC-CYBMUJFWSA-N	1	0	276.384	1.436	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCC(=O)NCCc2c[nH]cn2)C1	ZINC000095356771	358683339	/nfs/dbraw/zinc/68/33/39/358683339.db2.gz	PYYPDJKGVJEYSI-LBPRGKRZSA-N	1	0	264.373	1.190	50	0		CDAARO
CCc1cnc(NCC[N@@H+]2CCC[C@H](CO)C2)nc1	ZINC000095354987	358684037	/nfs/dbraw/zinc/68/40/37/358684037.db2.gz	LQACNSLGVALLHL-ZDUSSCGKSA-N	1	0	264.373	1.155	50	0		CDAARO
CCc1cnc(NCCC[N@@H+]2CCC[C@H](O)C2)nc1	ZINC000095371588	358687355	/nfs/dbraw/zinc/68/73/55/358687355.db2.gz	UJNSCMDZIVLWCE-ZDUSSCGKSA-N	1	0	264.373	1.298	50	0		CDAARO
CC[C@@](O)(CCCO)CNC(=O)Nc1cccc(C[NH3+])c1	ZINC000097117574	358751868	/nfs/dbraw/zinc/75/18/68/358751868.db2.gz	VCBQHNUQKZROBE-OAHLLOKOSA-N	1	0	295.383	1.180	50	0		CDAARO
C[n+]1ccccc1CCN1C(=O)c2ccccc2C1=O	ZINC000096191858	358716065	/nfs/dbraw/zinc/71/60/65/358716065.db2.gz	NULBRFSXLQNIIM-UHFFFAOYSA-N	1	0	267.308	1.350	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1ccc(C(C)C)[nH]c1=O	ZINC000097601081	358787446	/nfs/dbraw/zinc/78/74/46/358787446.db2.gz	QZNURGPQNRLHBM-UHFFFAOYSA-N	1	0	279.384	1.570	50	0		CDAARO
CC(=O)c1cc(C[N@@H+](C)C[C@@H]2CC(=O)N(C)C2)n(C)c1	ZINC000215872591	358906843	/nfs/dbraw/zinc/90/68/43/358906843.db2.gz	XQKKABARBHNHPG-LBPRGKRZSA-N	1	0	277.368	1.138	50	0		CDAARO
C[NH+](C)[C@H]1CN(Cc2ccc(F)c(F)c2F)C[C@@H]1O	ZINC000216113419	358926263	/nfs/dbraw/zinc/92/62/63/358926263.db2.gz	MPFDFBFCCZHXFI-QWRGUYRKSA-N	1	0	274.286	1.211	50	0		CDAARO
C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)NC[C@@H]1CCCO1	ZINC000095467193	358929530	/nfs/dbraw/zinc/92/95/30/358929530.db2.gz	HATHGFYMQLXGHK-JSGCOSHPSA-N	1	0	283.416	1.537	50	0		CDAARO
COCc1cn(C[C@@H]2CCC[N@@H+](C3CCOCC3)C2)nn1	ZINC000257177500	359121394	/nfs/dbraw/zinc/12/13/94/359121394.db2.gz	BEDVIGHBIYQXGR-CYBMUJFWSA-N	1	0	294.399	1.316	50	0		CDAARO
C[NH+](C)[C@H]1[C@@H]2OCC[C@@H]2[C@@H]1NC(=O)c1ccc2cc[nH]c2c1	ZINC000220748445	359193922	/nfs/dbraw/zinc/19/39/22/359193922.db2.gz	BYELRVFPDNXMCO-SLBVQIDZSA-N	1	0	299.374	1.615	50	0		CDAARO
Cc1cc(=O)cc(C(=O)N2CCC([C@@H](C)[NH+](C)C)CC2)o1	ZINC000223708602	359448700	/nfs/dbraw/zinc/44/87/00/359448700.db2.gz	CSLIKNHGNCXSAJ-GFCCVEGCSA-N	1	0	292.379	1.751	50	0		CDAARO
COC[C@@H]1C[N@H+](Cc2cccc(F)c2F)C[C@H]1C(N)=O	ZINC000257192392	359597124	/nfs/dbraw/zinc/59/71/24/359597124.db2.gz	UKWUYVSPSKHNGE-WDEREUQCSA-N	1	0	284.306	1.145	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@H]1CCCN(C(=O)c2cnn(C)c2)C1	ZINC000409421181	360230826	/nfs/dbraw/zinc/23/08/26/360230826.db2.gz	WOESFOOTVSKCJT-AWEZNQCLSA-N	1	0	287.367	1.711	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)NC[C@H]1CC[N@@H+](CC(C)C)C1	ZINC000177283373	189041230	/nfs/dbraw/zinc/04/12/30/189041230.db2.gz	NXSOEYLWHASXLL-CQSZACIVSA-N	1	0	292.427	1.663	50	0		CDAARO
CC(C)c1cc(CSc2nnc(C[NH3+])n2C)no1	ZINC000426487841	360573012	/nfs/dbraw/zinc/57/30/12/360573012.db2.gz	DOHAYYDKQITRRX-UHFFFAOYSA-N	1	0	267.358	1.678	50	0		CDAARO
C[C@H](C(=O)NCC1(Cn2cccn2)CC1)n1ccnc1	ZINC000426534053	360681447	/nfs/dbraw/zinc/68/14/47/360681447.db2.gz	LNLLRXQOEXTWMH-GFCCVEGCSA-N	1	0	273.340	1.237	50	0		CDAARO
CCc1oc2ccccc2c1CN1CC[C@@H]([NH3+])[C@H](O)C1	ZINC000426548878	360683168	/nfs/dbraw/zinc/68/31/68/360683168.db2.gz	TUASGMKNFMJTFD-ZIAGYGMSSA-N	1	0	274.364	1.889	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)C[C@H]1CCCOC1	ZINC000426399071	360663694	/nfs/dbraw/zinc/66/36/94/360663694.db2.gz	RPPCKIGXPUEMLM-CYBMUJFWSA-N	1	0	277.368	1.157	50	0		CDAARO
COCc1cc(CNC(=O)C(C)(C)[NH+]2CCCC2)[nH]n1	ZINC000426740692	360701051	/nfs/dbraw/zinc/70/10/51/360701051.db2.gz	ZUPCVKNYALXSQV-UHFFFAOYSA-N	1	0	280.372	1.047	50	0		CDAARO
COc1ccc(Cl)c(S(=O)(=O)NCC[C@@H](C)[NH3+])c1	ZINC000178911259	189154086	/nfs/dbraw/zinc/15/40/86/189154086.db2.gz	NEBHJSLBBAYALA-MRVPVSSYSA-N	1	0	292.788	1.364	50	0		CDAARO
COCCc1noc(C[NH2+][C@H]2CCCC2(C)C)n1	ZINC000191292574	360857528	/nfs/dbraw/zinc/85/75/28/360857528.db2.gz	PYNTZMMTIPGKBB-JTQLQIEISA-N	1	0	253.346	1.927	50	0		CDAARO
C[NH+](C)CC(C)(C)CNc1cc([C@@H]2CCOC2)ncn1	ZINC000426511511	360933577	/nfs/dbraw/zinc/93/35/77/360933577.db2.gz	BJYOESSTTBDYQO-GFCCVEGCSA-N	1	0	278.400	1.402	50	0		CDAARO
O=C(C1CCC1)N1CCC(N2C[C@@H]3CC[NH2+][C@@H]3C2)CC1	ZINC000426640365	361329223	/nfs/dbraw/zinc/32/92/23/361329223.db2.gz	GOVQYXJMHRANEC-DZGCQCFKSA-N	1	0	277.412	1.071	50	0		CDAARO
Nc1cc(I)cc(C2=[NH+]CCN2)c1	ZINC000004105556	283657994	/nfs/dbraw/zinc/65/79/94/283657994.db2.gz	HDIQCJZXZVTDNU-UHFFFAOYSA-N	1	0	287.104	1.223	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N(C)C2CC[NH2+]CC2)c1	ZINC000036300082	361491139	/nfs/dbraw/zinc/49/11/39/361491139.db2.gz	JFTFKDSJZWTIKE-UHFFFAOYSA-N	1	0	286.372	1.507	50	0		CDAARO
COc1ccc(CNC2CC[NH+](C)CC2)c(OC)c1	ZINC000000182698	364093429	/nfs/dbraw/zinc/09/34/29/364093429.db2.gz	ZKIKCFJGTDQDPM-UHFFFAOYSA-N	1	0	264.369	1.888	50	0		CDAARO
COc1cc(C[NH2+]C2CCN(C(C)=O)CC2)cc(OC)c1	ZINC000000213112	364094632	/nfs/dbraw/zinc/09/46/32/364094632.db2.gz	CGJJWDFSTLXAEK-UHFFFAOYSA-N	1	0	292.379	1.804	50	0		CDAARO
O[C@H]1C[NH2+][C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000049587729	364105437	/nfs/dbraw/zinc/10/54/37/364105437.db2.gz	NMNBXFDHRIEYKX-ZJUUUORDSA-N	1	0	265.700	1.785	50	0	biogenic,in-vitro	CDAARO
CC[C@@H]1CN(C(=O)C2CC2)CC[C@@H]1[NH2+]Cc1nccn1C	ZINC000089949191	366978873	/nfs/dbraw/zinc/97/88/73/366978873.db2.gz	SUGJNMPXUHWHHN-OCCSQVGLSA-N	1	0	290.411	1.547	50	0		CDAARO
CCOC(=O)[C@](C)(O)C[N@H+](C)[C@H]1CC[C@@H](SCC)C1	ZINC000252512147	367683029	/nfs/dbraw/zinc/68/30/29/367683029.db2.gz	NFUOPTAWQCUYHU-OUCADQQQSA-N	1	0	289.441	1.907	50	0		CDAARO
O=C(C[N@H+]1CCC[C@@H](O)CC1)NCC1CCCCC1	ZINC000331897754	204275596	/nfs/dbraw/zinc/27/55/96/204275596.db2.gz	DWTAJSQSIUPANM-CQSZACIVSA-N	1	0	268.401	1.530	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000067801086	372358753	/nfs/dbraw/zinc/35/87/53/372358753.db2.gz	DPPUAIAFWNKMRM-UHFFFAOYSA-N	1	0	258.362	1.622	50	0		CDAARO
O=C(NCCCc1ccncc1)[C@@H]1CC12CC[NH2+]CC2	ZINC000299774039	372751896	/nfs/dbraw/zinc/75/18/96/372751896.db2.gz	FDVMWWOBKQUOJB-AWEZNQCLSA-N	1	0	273.380	1.520	50	0		CDAARO
O=C(Nc1ccc(F)cc1Cl)N[C@@H]1C[NH2+]CC[C@H]1O	ZINC000299785520	372762256	/nfs/dbraw/zinc/76/22/56/372762256.db2.gz	TXIWBHMVLOVDFN-GHMZBOCLSA-N	1	0	287.722	1.323	50	0		CDAARO
c1ccc(C2CCN([C@@H]3C[NH2+]CCOC3)CC2)cc1	ZINC000299804108	372773476	/nfs/dbraw/zinc/77/34/76/372773476.db2.gz	ZTSJOCXYRZHPSP-MRXNPFEDSA-N	1	0	260.381	1.854	50	0		CDAARO
O[C@]1(C[NH2+][C@@H]2CCN(Cc3ccccc3)C2)CCSC1	ZINC000107515681	412800463	/nfs/dbraw/zinc/80/04/63/412800463.db2.gz	VKTZYAJZIOAOCW-CVEARBPZSA-N	1	0	292.448	1.719	50	0		CDAARO
O=C(NCC[NH+]1CCC(O)CC1)Nc1ccc(F)cc1	ZINC000206610036	374179486	/nfs/dbraw/zinc/17/94/86/374179486.db2.gz	XWSNIVTZBZDFJC-UHFFFAOYSA-N	1	0	281.331	1.404	50	0		CDAARO
CNC(=O)C[C@@H]1CC[N@@H+](C2CSCCSC2)C1	ZINC000670457266	483037645	/nfs/dbraw/zinc/03/76/45/483037645.db2.gz	VHGQVMISAKCSHZ-JTQLQIEISA-N	1	0	274.455	1.293	50	0		CDAARO
O=C(Cc1cccc(F)c1F)NCC1CC[NH2+]CC1	ZINC000094712148	374644319	/nfs/dbraw/zinc/64/43/19/374644319.db2.gz	PTILIYQNKPAWLK-UHFFFAOYSA-N	1	0	268.307	1.623	50	0		CDAARO
NC(=O)N1CCC[N@H+](CCSc2ccccc2)CC1	ZINC000118002306	374619467	/nfs/dbraw/zinc/61/94/67/374619467.db2.gz	WSJXTVQIDYQJEW-UHFFFAOYSA-N	1	0	279.409	1.865	50	0		CDAARO
[NH3+]CCCOC1CCN(C(=O)Cc2ccsc2)CC1	ZINC000094070945	374813245	/nfs/dbraw/zinc/81/32/45/374813245.db2.gz	DWFXJJYJAKDWFS-UHFFFAOYSA-N	1	0	282.409	1.647	50	0		CDAARO
CC(C)[C@@H](CO)[NH2+]CC(=O)N[C@H]1CCC[C@@H](C)[C@@H]1C	ZINC000108466086	412829366	/nfs/dbraw/zinc/82/93/66/412829366.db2.gz	NVUJHFTZFMPWQP-ZOBORPQBSA-N	1	0	270.417	1.534	50	0		CDAARO
CC[C@@H](CO)[NH+]1CCN(Cc2ccc(C)s2)CC1	ZINC000093739889	374782649	/nfs/dbraw/zinc/78/26/49/374782649.db2.gz	LXLYTYHFDDLZOF-ZDUSSCGKSA-N	1	0	268.426	1.945	50	0		CDAARO
CC[NH+](CC)CC(=O)NCc1nc2cc(F)ccc2n1C	ZINC000095394921	374902175	/nfs/dbraw/zinc/90/21/75/374902175.db2.gz	YPMYHFCHVVKBLN-UHFFFAOYSA-N	1	0	292.358	1.670	50	0		CDAARO
COc1cc(Cc2ccc(N)[nH+]c2N)cc(OC)c1OC	ZINC000094992744	374856061	/nfs/dbraw/zinc/85/60/61/374856061.db2.gz	PGWJUWRJMQOAER-UHFFFAOYSA-N	1	0	289.335	1.863	50	0		CDAARO
Cc1ccc(C(F)(F)F)cc1S(=O)(=O)NCCC[NH3+]	ZINC000095432009	374932675	/nfs/dbraw/zinc/93/26/75/374932675.db2.gz	FIIDNYQUPORKTL-UHFFFAOYSA-N	1	0	296.314	1.641	50	0		CDAARO
CCn1cc(C[N@@H+]2C[C@H]3CCC[C@@]3(C(=O)OC)C2)cn1	ZINC000108496693	412831041	/nfs/dbraw/zinc/83/10/41/412831041.db2.gz	LTJKLFIWQCAKNF-UKRRQHHQSA-N	1	0	277.368	1.678	50	0		CDAARO
C[NH+](C)CCSCc1noc(C2CCOCC2)n1	ZINC000095441041	374943085	/nfs/dbraw/zinc/94/30/85/374943085.db2.gz	YFYNCWZFKBPVEA-UHFFFAOYSA-N	1	0	271.386	1.758	50	0		CDAARO
CC[C@@H](C(=O)N1CCC2(CC1)OCC(C)(C)CO2)[NH+](C)C	ZINC000096476739	375105466	/nfs/dbraw/zinc/10/54/66/375105466.db2.gz	LBKSYLNXWVZYHY-ZDUSSCGKSA-N	1	0	298.427	1.718	50	0		CDAARO
COCCn1ccc(NC(=O)[C@H](C)[NH+]2[C@@H](C)CC[C@@H]2C)n1	ZINC000097108169	375149288	/nfs/dbraw/zinc/14/92/88/375149288.db2.gz	NCFDLOMEDMOKKI-AVGNSLFASA-N	1	0	294.399	1.729	50	0		CDAARO
COc1ccc(Cl)cc1/C=C\C(=O)N1CC[C@@H]([NH3+])C1	ZINC000493461993	375455035	/nfs/dbraw/zinc/45/50/35/375455035.db2.gz	NKBCRLFLJHWSBE-BXETVTBUSA-N	1	0	280.755	1.921	50	0		CDAARO
CS[C@@H](C)C(=O)N1CCC(C[NH+]2CCN(C)CC2)CC1	ZINC000057066501	375810740	/nfs/dbraw/zinc/81/07/40/375810740.db2.gz	CDMOLSIZRGOBNP-ZDUSSCGKSA-N	1	0	299.484	1.224	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CCC[C@H]2C[NH3+])cc1F	ZINC000606442024	375823090	/nfs/dbraw/zinc/82/30/90/375823090.db2.gz	ZAIMLMJJHWROPJ-HWPRWLFBSA-N	1	0	278.327	1.797	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)/C=C\c2cccc3cccnc23)C1	ZINC000606441228	375822110	/nfs/dbraw/zinc/82/21/10/375822110.db2.gz	APNRATRZTYQONO-LMVHVUTASA-N	1	0	267.332	1.808	50	0		CDAARO
Cc1ccc(CN2CC[NH2+]C[C@H]2[C@H](C)O)cc1F	ZINC000585657559	376361250	/nfs/dbraw/zinc/36/12/50/376361250.db2.gz	ATGXCDYQDUKQRG-FZMZJTMJSA-N	1	0	252.333	1.289	50	0		CDAARO
Cc1nn(C)c(N(C)C)c1CN[C@@H]1CC[N@@H+]2CCCC[C@H]12	ZINC000069444257	376731832	/nfs/dbraw/zinc/73/18/32/376731832.db2.gz	JXDYRIPWIBUNIM-HUUCEWRRSA-N	1	0	291.443	1.511	50	0		CDAARO
CC(=O)N1CCC([NH2+]CCc2ccccc2F)CC1	ZINC000000213192	169577105	/nfs/dbraw/zinc/57/71/05/169577105.db2.gz	PEHPYGBIYRBDOC-UHFFFAOYSA-N	1	0	264.344	1.969	50	0		CDAARO
C[C@H](OC[C@@H]1CCCCO1)C(=O)N1C[C@@H](C)[C@H]([NH+](C)C)C1	ZINC000107057369	299556931	/nfs/dbraw/zinc/55/69/31/299556931.db2.gz	VENIEMXADHKUCK-CBBWQLFWSA-N	1	0	298.427	1.369	50	0		CDAARO
C[C@@H]1COCC[C@H]1[NH2+]Cc1cccc(-n2cncn2)c1	ZINC000281020317	195072667	/nfs/dbraw/zinc/07/26/67/195072667.db2.gz	XNPWEXXQUFAHCZ-IUODEOHRSA-N	1	0	272.352	1.782	50	0		CDAARO
Cc1ncsc1C(=O)N[C@H](CO)C[NH+]1CCCCC1	ZINC000288644408	197135662	/nfs/dbraw/zinc/13/56/62/197135662.db2.gz	XQOYYPFFSHVJHP-NSHDSACASA-N	1	0	283.397	1.028	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](N2C(=O)OC(C)(C)[C@@]2(C)O)C1	ZINC000004125467	285229464	/nfs/dbraw/zinc/22/94/64/285229464.db2.gz	YNKAKTJZJSXZAA-ZWNOBZJWSA-N	1	0	256.346	1.410	50	0		CDAARO
CC(C)CCS(=O)(=O)NC[C@H]1CC[N@@H+](C2CC2)C1	ZINC000096427709	256757813	/nfs/dbraw/zinc/75/78/13/256757813.db2.gz	BGNWAYOMORCDNV-GFCCVEGCSA-N	1	0	274.430	1.436	50	0		CDAARO
Cc1ccc(Cl)c(OCCN2CC[NH+](CCO)CC2)c1	ZINC000033359705	390389390	/nfs/dbraw/zinc/38/93/90/390389390.db2.gz	MKHUVUPXVMALFX-UHFFFAOYSA-N	1	0	298.814	1.637	50	0		CDAARO
CC(C)C[C@@H]([NH3+])C(=O)N(Cc1cnn(C)c1)CC(C)C	ZINC000055153475	390489987	/nfs/dbraw/zinc/48/99/87/390489987.db2.gz	ADZITEXOLOHPNC-CQSZACIVSA-N	1	0	280.416	1.778	50	0		CDAARO
C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNS(C)(=O)=O)C1	ZINC000048908208	390464376	/nfs/dbraw/zinc/46/43/76/390464376.db2.gz	GGGWFTKZIBZUKJ-PHIMTYICSA-N	1	0	262.419	1.292	50	0		CDAARO
NS(=O)(=O)NC[C@H]1CCC[N@H+](CCC2CCCC2)C1	ZINC000096424178	390515760	/nfs/dbraw/zinc/51/57/60/390515760.db2.gz	COXDRBNNHXHYMY-CYBMUJFWSA-N	1	0	289.445	1.072	50	0		CDAARO
COc1ccc(I)cc1C[NH3+]	ZINC000021987630	390561014	/nfs/dbraw/zinc/56/10/14/390561014.db2.gz	WOVHZZTWPMSZNC-UHFFFAOYSA-N	1	0	263.078	1.759	50	0		CDAARO
CC(C)C[C@H]1CCN(c2ncnc3c2CC[NH2+]C3)C1	ZINC000067447353	390571508	/nfs/dbraw/zinc/57/15/08/390571508.db2.gz	ZCRCJMOSPSIJAQ-GFCCVEGCSA-N	1	0	260.385	1.995	50	0		CDAARO
C[NH+]1CCN(c2ncnc3c4ccccc4[nH]c32)CC1	ZINC000004860165	390826928	/nfs/dbraw/zinc/82/69/28/390826928.db2.gz	ISMDMJZAUFJVRY-UHFFFAOYSA-N	1	0	267.336	1.863	50	0		CDAARO
C[NH2+]Cc1nc([C@@H]2CCOC2)nn1-c1nc2ccccc2[nH]1	ZINC000097294939	390916745	/nfs/dbraw/zinc/91/67/45/390916745.db2.gz	LDMRVHQNPKRUPE-SNVBAGLBSA-N	1	0	298.350	1.367	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)NCCCc2ccc(O)cc2)C1	ZINC000417741182	391005528	/nfs/dbraw/zinc/00/55/28/391005528.db2.gz	IUDYTDZRVIRYOW-LBPRGKRZSA-N	1	0	263.341	1.067	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)Cc2cnn(-c3ccccc3)c2)CC1	ZINC000032899978	391535965	/nfs/dbraw/zinc/53/59/65/391535965.db2.gz	SPFRDHPHNUEVBC-UHFFFAOYSA-N	1	0	298.390	1.579	50	0		CDAARO
CC(C)N1CCC[C@H]([NH2+][C@@H]2CCC[C@H]3OCC[C@H]32)C1=O	ZINC000242273594	391681443	/nfs/dbraw/zinc/68/14/43/391681443.db2.gz	YEFUXWQIHPWZMQ-LJISPDSOSA-N	1	0	280.412	1.933	50	0		CDAARO
CCn1nc(CO)c2c1CC[N@H+](C[C@@H]1CCCOC1)C2	ZINC000299768875	391721450	/nfs/dbraw/zinc/72/14/50/391721450.db2.gz	ZPKNYUHZNIKKPZ-LBPRGKRZSA-N	1	0	279.384	1.180	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1cc(-c2ccco2)n[nH]1	ZINC000040497901	391984909	/nfs/dbraw/zinc/98/49/09/391984909.db2.gz	SVXUKEQHXLHQAS-NSHDSACASA-N	1	0	288.351	1.884	50	0		CDAARO
CC[N@H+](CCNC(=O)NC(C1CC1)C1CC1)C1CC1	ZINC000096402825	393178238	/nfs/dbraw/zinc/17/82/38/393178238.db2.gz	AIDNIPJBQMYSIR-UHFFFAOYSA-N	1	0	265.401	1.959	50	0		CDAARO
CCNC(=O)N1CCC[C@@H]([NH2+]Cc2ccccc2)C1	ZINC000084791050	483327097	/nfs/dbraw/zinc/32/70/97/483327097.db2.gz	SHASNFHKMFENKX-CQSZACIVSA-N	1	0	261.369	1.970	50	0		CDAARO
C[NH+](C)CCn1cc(I)cn1	ZINC000070679659	397897973	/nfs/dbraw/zinc/89/79/73/397897973.db2.gz	PAFQTDKYYROHMA-UHFFFAOYSA-N	1	0	265.098	1.049	50	0		CDAARO
CCOC(=O)[C@@H]1CC[C@H](NC(=O)OC(C)(C)C)[C@H]([NH3+])C1	ZINC000095743276	285874259	/nfs/dbraw/zinc/87/42/59/285874259.db2.gz	LJJYOYONMCBZHC-MXWKQRLJSA-N	1	0	286.372	1.570	50	0		CDAARO
Cc1ccc([C@@H](CNC(=O)c2cn(C)cn2)[NH+](C)C)cc1	ZINC000178223155	292201273	/nfs/dbraw/zinc/20/12/73/292201273.db2.gz	NZQMCVMLHJHFMM-OAHLLOKOSA-N	1	0	286.379	1.761	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@H](CO)C2)cc2c1OCO2	ZINC000004948193	170044458	/nfs/dbraw/zinc/04/44/58/170044458.db2.gz	URPGSBSFLHUJNG-NSHDSACASA-N	1	0	279.336	1.628	50	0		CDAARO
CC[C@H](C)[NH2+]Cc1ccc(OCC(N)=O)c(OC)c1	ZINC000005907917	170153686	/nfs/dbraw/zinc/15/36/86/170153686.db2.gz	JMEHNMKTHHMAJV-JTQLQIEISA-N	1	0	266.341	1.447	50	0		CDAARO
COc1ccc(C[n+]2cccc(C(N)=O)c2)cc1F	ZINC000007738804	170299793	/nfs/dbraw/zinc/29/97/93/170299793.db2.gz	IKKWTAKELAEZTQ-UHFFFAOYSA-O	1	0	261.276	1.269	50	0		CDAARO
c1cn([C@@H]2COC[C@@H]2[NH2+]Cc2cccc3[nH]ccc32)nn1	ZINC000284473201	196064403	/nfs/dbraw/zinc/06/44/03/196064403.db2.gz	AMDCNDHXOAMGBB-LSDHHAIUSA-N	1	0	283.335	1.489	50	0		CDAARO
COc1ccc(C)c2cc(CN3CC[NH2+]CC3)c(=O)[nH]c12	ZINC000019684740	170839716	/nfs/dbraw/zinc/83/97/16/170839716.db2.gz	QDCMYJXZGOGTJL-UHFFFAOYSA-N	1	0	287.363	1.250	50	0		CDAARO
CC(C)Oc1ccc(N(C)S(=O)(=O)CC[NH3+])cc1	ZINC000020261650	171118906	/nfs/dbraw/zinc/11/89/06/171118906.db2.gz	XXJIITJXWSMHBX-UHFFFAOYSA-N	1	0	272.370	1.199	50	0		CDAARO
C[C@H](c1nc(Cc2ccccc2)no1)N1CC[NH2+]CC1	ZINC000020282429	171133113	/nfs/dbraw/zinc/13/31/13/171133113.db2.gz	SHCILNFGZJHFNK-GFCCVEGCSA-N	1	0	272.352	1.627	50	0		CDAARO
C[C@@H](CN1CC[NH+](C)CC1)OC(=O)c1ccccc1F	ZINC000020292745	171134339	/nfs/dbraw/zinc/13/43/39/171134339.db2.gz	DNVMQTVCORLUES-LBPRGKRZSA-N	1	0	280.343	1.618	50	0		CDAARO
CC[NH+]1CCN(CCOc2cccc(C(C)=O)c2)CC1	ZINC000020390196	171178863	/nfs/dbraw/zinc/17/88/63/171178863.db2.gz	VRKLMRCPAZLIAG-UHFFFAOYSA-N	1	0	276.380	1.906	50	0		CDAARO
C[C@H](Oc1ccc(F)cc1)C(=O)N1CCC[N@H+](C)CC1	ZINC000020498948	171227123	/nfs/dbraw/zinc/22/71/23/171227123.db2.gz	RMFOXZVWMYXZIY-LBPRGKRZSA-N	1	0	280.343	1.757	50	0		CDAARO
[NH3+]Cc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000022214768	171375542	/nfs/dbraw/zinc/37/55/42/171375542.db2.gz	CHDVLTXVOJUOJL-UHFFFAOYSA-N	1	0	254.355	1.320	50	0		CDAARO
O=S1(=O)CC[C@H]([NH2+]C2CC(c3ccccc3F)C2)C1	ZINC000037506689	173241175	/nfs/dbraw/zinc/24/11/75/173241175.db2.gz	OSPFNVVNRDPBGF-CXQJBGSLSA-N	1	0	283.368	1.848	50	0		CDAARO
COc1cccc(-c2nnc3ccc(OCC[NH3+])nn32)c1	ZINC000038478041	174142075	/nfs/dbraw/zinc/14/20/75/174142075.db2.gz	MBFYXDMWEFUHLB-UHFFFAOYSA-N	1	0	285.307	1.137	50	0		CDAARO
COC(=O)c1ccc(OCC2CC[NH2+]CC2)c(OC)c1	ZINC000063110932	175681653	/nfs/dbraw/zinc/68/16/53/175681653.db2.gz	QRZDOLVJRBXOJP-UHFFFAOYSA-N	1	0	279.336	1.860	50	0		CDAARO
Cc1nccn1-c1ccc(CNC(=O)[C@@H]2CCCC[NH2+]2)cc1	ZINC000071385571	176147206	/nfs/dbraw/zinc/14/72/06/176147206.db2.gz	DUPVDCJKEINGPE-INIZCTEOSA-N	1	0	298.390	1.939	50	0		CDAARO
COc1c(C)cc(S(=O)(=O)N[C@@H]2CC[C@@H]([NH3+])C2)cc1C	ZINC000071498117	176192242	/nfs/dbraw/zinc/19/22/42/176192242.db2.gz	WXIOPEVTIJXKDF-VXGBXAGGSA-N	1	0	298.408	1.470	50	0		CDAARO
OCC(CO)[N@@H+]1CCC[C@@H](CCc2ccc(F)cc2F)C1	ZINC000071748221	176258741	/nfs/dbraw/zinc/25/87/41/176258741.db2.gz	VNGHDMPCVLQFOU-LBPRGKRZSA-N	1	0	299.361	1.963	50	0		CDAARO
Cc1[nH]c(=O)[nH]c(=O)c1C[N@@H+]1C[C@H]2[C@@H](C1)C1CCC2CC1	ZINC000072154061	176327754	/nfs/dbraw/zinc/32/77/54/176327754.db2.gz	IHNYMNYVTYKQAT-QCBYLEPLSA-N	1	0	289.379	1.240	50	0		CDAARO
Cc1cnc(CNC(=O)c2ccccc2[C@@H]2CC[NH2+]C2)cn1	ZINC000072166864	176331646	/nfs/dbraw/zinc/33/16/46/176331646.db2.gz	IYRJKFKOCNCMAQ-CYBMUJFWSA-N	1	0	296.374	1.792	50	0		CDAARO
CSc1cccc(CN(C)C(=O)C[C@@H]2COCC[NH2+]2)c1	ZINC000072168000	176331817	/nfs/dbraw/zinc/33/18/17/176331817.db2.gz	BSPQLVGZTLDGOA-CYBMUJFWSA-N	1	0	294.420	1.745	50	0		CDAARO
CC(C)c1cc(N2CC[C@H]([NH+](C)C)C2)n2nccc2n1	ZINC000072434215	176403174	/nfs/dbraw/zinc/40/31/74/176403174.db2.gz	LLGGZXXQOZEXTL-LBPRGKRZSA-N	1	0	273.384	1.993	50	0		CDAARO
CC(C)c1cc(N2CC[C@@H]([NH+](C)C)C2)n2nccc2n1	ZINC000072434216	176403278	/nfs/dbraw/zinc/40/32/78/176403278.db2.gz	LLGGZXXQOZEXTL-GFCCVEGCSA-N	1	0	273.384	1.993	50	0		CDAARO
Cc1nc(CN2CC[NH+](C[C@H]3CCOC3)CC2)cs1	ZINC000076877305	177125735	/nfs/dbraw/zinc/12/57/35/177125735.db2.gz	ONKVOMAFVZCTKR-CYBMUJFWSA-N	1	0	281.425	1.606	50	0		CDAARO
CSCC(=O)N(C)C[C@@H]1Cc2ccccc2C[N@@H+]1C	ZINC000077298352	177250345	/nfs/dbraw/zinc/25/03/45/177250345.db2.gz	DRYBTSVASIGNLO-AWEZNQCLSA-N	1	0	278.421	1.865	50	0		CDAARO
c1cncc(N2CCN(C[C@H]3CCC[NH2+]C3)CC2)c1	ZINC000077301857	177250649	/nfs/dbraw/zinc/25/06/49/177250649.db2.gz	LEBOALCMFFTLIR-AWEZNQCLSA-N	1	0	260.385	1.203	50	0		CDAARO
Cc1cnc(C)c(N2CC[C@](O)(C[NH+]3CCCCC3)C2)n1	ZINC000077338952	177254208	/nfs/dbraw/zinc/25/42/08/177254208.db2.gz	HZTPGULOEUNWBK-INIZCTEOSA-N	1	0	290.411	1.521	50	0		CDAARO
CC(C)[NH2+][C@H]1CCn2c(=O)[nH]c3cccc(c32)[C@@H]1O	ZINC000000004010	275657343	/nfs/dbraw/zinc/65/73/43/275657343.db2.gz	ZSTCZWJCLIRCOJ-AAEUAGOBSA-N	1	0	261.325	1.133	50	0	in-man	CDAARO
CCC(=O)N1C[C@@H](c2ccc(OC)cc2)[C@H]([NH+](C)C)C1	ZINC000095363476	276203820	/nfs/dbraw/zinc/20/38/20/276203820.db2.gz	RURJWESVAOGJHQ-LSDHHAIUSA-N	1	0	276.380	1.961	50	0		CDAARO
COCC[N@@H+]1CCC[C@]2(CCN(c3ncccn3)C2)C1	ZINC000072142030	277223616	/nfs/dbraw/zinc/22/36/16/277223616.db2.gz	WYRRJGWQQNGEAP-HNNXBMFYSA-N	1	0	276.384	1.415	50	0		CDAARO
COCCN1CCC[C@]2(CC[N@@H+](C3CCOCC3)C2)C1	ZINC000012438745	277223638	/nfs/dbraw/zinc/22/36/38/277223638.db2.gz	JKTUIRWOLPOVGX-INIZCTEOSA-N	1	0	282.428	1.600	50	0		CDAARO
C[C@@H]1C[C@@H]([NH3+])CCN1C(=O)[C@@H]1CCOc2ccccc21	ZINC000129231286	277973266	/nfs/dbraw/zinc/97/32/66/277973266.db2.gz	XSEXYPWORYSNMO-MBNYWOFBSA-N	1	0	274.364	1.891	50	0		CDAARO
Cc1ccc(CN(C)[C@H]2CCN(c3cnn(C)c3)C2=O)o1	ZINC000111193126	279320769	/nfs/dbraw/zinc/32/07/69/279320769.db2.gz	FORILFBSMYKWBX-AWEZNQCLSA-N	1	0	288.351	1.559	50	0		CDAARO
Cc1cc(C(F)(F)F)nc(N2CCC[NH2+]CC2)n1	ZINC000062203433	280377306	/nfs/dbraw/zinc/37/73/06/280377306.db2.gz	RDOIPVPNEMGQKO-UHFFFAOYSA-N	1	0	260.263	1.604	50	0		CDAARO
Cc1ccc(C(F)(F)F)cc1S(=O)(=O)NCC[NH3+]	ZINC000095432002	280794291	/nfs/dbraw/zinc/79/42/91/280794291.db2.gz	FWJNBWPZXXVTCQ-UHFFFAOYSA-N	1	0	282.287	1.251	50	0		CDAARO
CCOc1ccc(/C=C\C(=O)N2CC[NH2+]C[C@@H]2C)cc1	ZINC000255089735	289355933	/nfs/dbraw/zinc/35/59/33/289355933.db2.gz	RRWTYSBNNHQSMV-XURPKSDJSA-N	1	0	274.364	1.919	50	0		CDAARO
COc1ccc(NC(=O)NCC[C@@H]2CCC[NH2+]2)c(OC)c1	ZINC000299796933	295159657	/nfs/dbraw/zinc/15/96/57/295159657.db2.gz	PDEYXXYHFKARDQ-NSHDSACASA-N	1	0	293.367	1.967	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@@H]2CCOc3ccccc32)C1	ZINC000104201382	295257805	/nfs/dbraw/zinc/25/78/05/295257805.db2.gz	IRKBBIUKQDYPGS-WCQYABFASA-N	1	0	260.337	1.360	50	0		CDAARO
CCCc1cc(CN(C)C(=O)[C@H]2CC23CC[NH2+]CC3)[nH]n1	ZINC000534575297	328309935	/nfs/dbraw/zinc/30/99/35/328309935.db2.gz	VTDJYHKRHNVGIY-CQSZACIVSA-N	1	0	290.411	1.710	50	0		CDAARO
O=C(CCC(F)(F)F)N[C@H]1COC[C@@H]1[NH+]1CCCCC1	ZINC000534578186	328310685	/nfs/dbraw/zinc/31/06/85/328310685.db2.gz	OQHHSRDOZFXQKF-QWRGUYRKSA-N	1	0	294.317	1.698	50	0		CDAARO
COCC1(C[NH2+][C@H](C)Cn2nc(C)cc2C)CC1	ZINC000534579030	328311162	/nfs/dbraw/zinc/31/11/62/328311162.db2.gz	XRDPYLPZYJSDLA-GFCCVEGCSA-N	1	0	251.374	1.905	50	0		CDAARO
O=C(C[C@@H]1CC1(F)F)N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000534584179	328311169	/nfs/dbraw/zinc/31/11/69/328311169.db2.gz	OJUVKOIUXSXSFK-NZFPMDFQSA-N	1	0	256.296	1.241	50	0		CDAARO
C[C@H](C(=O)NCCCOC1CCCC1)[NH+]1CCCC1	ZINC000534591722	328318369	/nfs/dbraw/zinc/31/83/69/328318369.db2.gz	CVQGQIWWNYATNU-CYBMUJFWSA-N	1	0	268.401	1.936	50	0		CDAARO
COCC1(CNC(=O)C[C@@H](C)n2ccnc2C)CC1	ZINC000534590172	328317727	/nfs/dbraw/zinc/31/77/27/328317727.db2.gz	LDAUEWQSZQMHGJ-LLVKDONJSA-N	1	0	265.357	1.685	50	0		CDAARO
O=C(NC[C@@H]1CC[N@@H+](C2CCCCC2)C1)c1cn[nH]n1	ZINC000534633017	328332335	/nfs/dbraw/zinc/33/23/35/328332335.db2.gz	YSSMJBPPOSDOQH-NSHDSACASA-N	1	0	277.372	1.189	50	0		CDAARO
CCOc1ccc(C(=O)NC[C@H](C(C)C)[NH+](C)C)o1	ZINC000534635519	328333352	/nfs/dbraw/zinc/33/33/52/328333352.db2.gz	WELGOTYMWBRPOT-LLVKDONJSA-N	1	0	268.357	1.994	50	0		CDAARO
CC(C)[C@H](CNC(=O)Cc1ccc(CO)cc1)[NH+](C)C	ZINC000534637020	328333921	/nfs/dbraw/zinc/33/39/21/328333921.db2.gz	VIDFFRCJOZFWGD-HNNXBMFYSA-N	1	0	278.396	1.424	50	0		CDAARO
C[C@@H](C(=O)NCc1cccnc1N)[N@H+](C)C1CCCCC1	ZINC000534652477	328338036	/nfs/dbraw/zinc/33/80/36/328338036.db2.gz	ULSFBEMLLSLRIP-LBPRGKRZSA-N	1	0	290.411	1.933	50	0		CDAARO
COCC1(CNC(=O)[C@@H]2CCC[N@H+](C)C2)CCCC1	ZINC000534649170	328343733	/nfs/dbraw/zinc/34/37/33/328343733.db2.gz	FNZBIUMNYZSSGH-CYBMUJFWSA-N	1	0	268.401	1.651	50	0		CDAARO
CCCS(=O)(=O)N[C@H](c1nccn1C)C(C)C	ZINC000534656635	328340101	/nfs/dbraw/zinc/34/01/01/328340101.db2.gz	QFLKHRQCWMFGNP-JTQLQIEISA-N	1	0	259.375	1.447	50	0		CDAARO
O=C(Cc1[nH]nc2ccccc21)N1C[C@@H]2CC[C@H]1C[NH2+]C2	ZINC000534666291	328345386	/nfs/dbraw/zinc/34/53/86/328345386.db2.gz	VVKDZBQDQOCSOO-NEPJUHHUSA-N	1	0	284.363	1.316	50	0		CDAARO
CCCCc1nc(C)cc(NCC[NH2+][C@H]2CCCOC2)n1	ZINC000534674658	328349760	/nfs/dbraw/zinc/34/97/60/328349760.db2.gz	AQJGGLFKCUGGBQ-AWEZNQCLSA-N	1	0	292.427	1.730	50	0		CDAARO
CC1(C)[C@H]([NH2+]Cc2nnc3n2CCCC3)[C@@H]2CCCO[C@@H]21	ZINC000183863240	323349358	/nfs/dbraw/zinc/34/93/58/323349358.db2.gz	KTESGAHJDCXLOJ-GLQYFDAESA-N	1	0	290.411	1.908	50	0		CDAARO
CCS(=O)(=O)N1CC(C[NH2+][C@@H]2CC(C)(C)C[C@@H]2C)C1	ZINC000193149864	323527441	/nfs/dbraw/zinc/52/74/41/323527441.db2.gz	IWEPSYGBGODEHS-WCQYABFASA-N	1	0	288.457	1.682	50	0		CDAARO
CCc1cc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3[NH2+]2)on1	ZINC000195542403	323571637	/nfs/dbraw/zinc/57/16/37/323571637.db2.gz	IKWNUZXGTOKNGZ-SWHYSGLUSA-N	1	0	277.368	1.774	50	0		CDAARO
CN1C[C@]2(CC[N@H+](CC3=CCCCC3)C2)OCC1=O	ZINC000670428821	482959779	/nfs/dbraw/zinc/95/97/79/482959779.db2.gz	AYGLBVKZUOIAHR-HNNXBMFYSA-N	1	0	264.369	1.420	50	0		CDAARO
CC(C)(C)[C@H](Cn1ccnc1)NC(=O)CCn1cncn1	ZINC000670434629	482970162	/nfs/dbraw/zinc/97/01/62/482970162.db2.gz	NZJMGIKYMDOPTF-LBPRGKRZSA-N	1	0	290.371	1.096	50	0		CDAARO
CN1CCC2(CC[NH+](CCn3cccn3)CC2)CCC1=O	ZINC000670439044	482982809	/nfs/dbraw/zinc/98/28/09/482982809.db2.gz	NYFNUJZTFLNYNB-UHFFFAOYSA-N	1	0	290.411	1.608	50	0		CDAARO
CNC(=O)C[C@H]1CC[N@H+](Cc2ccc3c(c2)OCCO3)C1	ZINC000670447826	483002212	/nfs/dbraw/zinc/00/22/12/483002212.db2.gz	VSYDAVLOTWOOSG-CYBMUJFWSA-N	1	0	290.363	1.416	50	0		CDAARO
Cc1ccoc1C(=O)NCC[N@@H+]1CCCC[C@H]1CO	ZINC000670459794	483043832	/nfs/dbraw/zinc/04/38/32/483043832.db2.gz	PQVGUGPSGMSWCY-LBPRGKRZSA-N	1	0	266.341	1.165	50	0		CDAARO
C[C@@H](CN(C)CCO)[NH2+]C1(c2cc(F)cc(F)c2)CC1	ZINC000670468612	483062246	/nfs/dbraw/zinc/06/22/46/483062246.db2.gz	CGFRQEFSSFIMOV-NSHDSACASA-N	1	0	284.350	1.856	50	0		CDAARO
Cc1ncc(C[NH2+]CC[S@](C)=O)n1-c1ccccc1	ZINC000084041670	483236109	/nfs/dbraw/zinc/23/61/09/483236109.db2.gz	BNPNZHGDMZIGMS-LJQANCHMSA-N	1	0	277.393	1.649	50	0		CDAARO
CCS[C@@H]1CCC[C@H](NC(=O)[C@H]2CCC[NH2+]2)C1	ZINC000242155959	521725985	/nfs/dbraw/zinc/72/59/85/521725985.db2.gz	WURXYQOTIRSJAY-QJPTWQEYSA-N	1	0	256.415	1.919	50	0		CDAARO
CC[C@@H]1CN(S(C)(=O)=O)CC[C@H]1[NH2+]Cc1cccnc1	ZINC000241719836	523465204	/nfs/dbraw/zinc/46/52/04/523465204.db2.gz	QQAFSBPWIABEJM-ZIAGYGMSSA-N	1	0	297.424	1.231	50	0		CDAARO
C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC(=O)N(C)CCO	ZINC000240886233	525013811	/nfs/dbraw/zinc/01/38/11/525013811.db2.gz	INYQCPPIBGEEFN-UKRRQHHQSA-N	1	0	291.395	1.141	50	0		CDAARO
CC1(C)CN(CC(F)(F)F)CC[N@@H+]1C[C@@H]1CCOC1	ZINC000096492525	529115569	/nfs/dbraw/zinc/11/55/69/529115569.db2.gz	KYCZXFPPKGVTPH-NSHDSACASA-N	1	0	280.334	1.981	50	0		CDAARO
CC[NH+](CC)[C@@H](CNC(=O)c1nccn1C)c1ccco1	ZINC000741263605	576548371	/nfs/dbraw/zinc/54/83/71/576548371.db2.gz	LPKKWBNEMSVIIR-LBPRGKRZSA-N	1	0	290.367	1.826	50	0		CDAARO
CCCCN1CCN(C(=O)[C@@H](CC)[N@H+](C)CC)CC1	ZINC000952969418	614993801	/nfs/dbraw/zinc/99/38/01/614993801.db2.gz	NESNQMMAKWNUND-CQSZACIVSA-N	1	0	269.433	1.661	50	0		CDAARO
CNC(=O)CCC(C)(C)NC(=O)C[NH+]1CCCCCC1	ZINC000952965377	616562275	/nfs/dbraw/zinc/56/22/75/616562275.db2.gz	DCZMFRFQODUXDP-UHFFFAOYSA-N	1	0	283.416	1.283	50	0		CDAARO
CN(C)c1nc(NC[C@@H](c2ccco2)[NH+](C)C)ncc1F	ZINC001772700540	1159436834	/nfs/dbraw/zinc/43/68/34/1159436834.db2.gz	GKNJTZUXXJRKMH-NSHDSACASA-N	1	0	293.346	1.990	50	0		CDAARO
Cc1cc(N2C[C@@H]3[C@H](O)C[C@@H]3C2)nc(N2CCCC2)[nH+]1	ZINC001772709964	1159444158	/nfs/dbraw/zinc/44/41/58/1159444158.db2.gz	NHEQBPIWLFUIFX-FRRDWIJNSA-N	1	0	274.368	1.202	50	0		CDAARO
Cc1nc[nH]c1CN(CC[NH+](C)C)C(=O)c1ccsc1	ZINC001704313289	1177686357	/nfs/dbraw/zinc/68/63/57/1177686357.db2.gz	IFBVBQKLRFXCFF-UHFFFAOYSA-N	1	0	292.408	1.984	50	0		CDAARO
CNc1nc(N[C@@H]2COc3ccccc3C2)cc(C)[nH+]1	ZINC000380819818	739610559	/nfs/dbraw/zinc/61/05/59/739610559.db2.gz	BJDKHBXCYJEBJV-LBPRGKRZSA-N	1	0	270.336	1.086	50	0		CDAARO
C[NH2+]C1(C(=O)NC[C@@H](O)c2ccc(F)cc2)CCC1	ZINC000864092663	739855621	/nfs/dbraw/zinc/85/56/21/739855621.db2.gz	SEPMHTHSCATZBM-GFCCVEGCSA-N	1	0	266.316	1.117	50	0		CDAARO
CC(C)c1cncnc1N1CCOC[C@H](C[NH+](C)C)C1	ZINC000072127077	739864711	/nfs/dbraw/zinc/86/47/11/739864711.db2.gz	ATCGWIYMUPUXFT-CYBMUJFWSA-N	1	0	278.400	1.614	50	0		CDAARO
Cc1nc(/C=C/C(=O)N2CC[N@@H+](C)C[C@H]2C)cs1	ZINC000089709034	740668541	/nfs/dbraw/zinc/66/85/41/740668541.db2.gz	XDNVBXBGADLSAH-ORAHPGNNSA-N	1	0	265.382	1.627	50	0		CDAARO
CN1CC2(CC1=O)CC[NH+](CCCc1cccnc1)CC2	ZINC000072475064	741490294	/nfs/dbraw/zinc/49/02/94/741490294.db2.gz	JJKNMBSBURLRCA-UHFFFAOYSA-N	1	0	287.407	1.959	50	0		CDAARO
O[C@H]1CCCC[C@H]1[NH+]1CCN(c2ccccn2)CC1	ZINC000037490800	741774779	/nfs/dbraw/zinc/77/47/79/741774779.db2.gz	LYOQPSGCAAWIMC-KGLIPLIRSA-N	1	0	261.369	1.507	50	0		CDAARO
Cc1n[nH]cc1C[N@@H+](C)Cc1cccc2nonc21	ZINC000952989055	739548708	/nfs/dbraw/zinc/54/87/08/739548708.db2.gz	SAZNMCUPPKXBDO-UHFFFAOYSA-N	1	0	257.297	1.886	50	0		CDAARO
C[N@H+](CCCc1cccnc1)C[C@H]1COCCO1	ZINC000243957109	740202596	/nfs/dbraw/zinc/20/25/96/740202596.db2.gz	CFXCLHNXSCGLMO-AWEZNQCLSA-N	1	0	250.342	1.361	50	0		CDAARO
CCC1CCN(C(=O)C2CN(C)CC[N@H+](C)C2)CC1	ZINC000863948199	740917600	/nfs/dbraw/zinc/91/76/00/740917600.db2.gz	UVTVYUZWXDTLCB-UHFFFAOYSA-N	1	0	267.417	1.128	50	0		CDAARO
Cc1c[nH]c(CN(C)C(=O)CC[C@@H](C)[NH+]2CCCC2)n1	ZINC000426589871	741078715	/nfs/dbraw/zinc/07/87/15/741078715.db2.gz	ZUWUBXLFIWRRKJ-CYBMUJFWSA-N	1	0	278.400	1.941	50	0		CDAARO
C[C@@H](Cc1ccccc1F)[NH+]1CCC(C(N)=O)CC1	ZINC000000216029	741441408	/nfs/dbraw/zinc/44/14/08/741441408.db2.gz	VKPHURPXJFTRQJ-NSHDSACASA-N	1	0	264.344	1.954	50	0		CDAARO
CCOc1ccc(C[N@H+](C)[C@@H](C)CC(N)=O)cc1CO	ZINC000952872788	910428365	/nfs/dbraw/zinc/42/83/65/910428365.db2.gz	TXQZTMCGVXQFAQ-NSHDSACASA-N	1	0	280.368	1.273	50	0		CDAARO
C[C@@H](CCN(C)Cc1cccnc1N)[NH+]1CCCC1	ZINC000952872905	910428637	/nfs/dbraw/zinc/42/86/37/910428637.db2.gz	RJWZZZMZFGTBRH-ZDUSSCGKSA-N	1	0	262.401	1.970	50	0		CDAARO
Cc1ccc2ncc(C[NH2+][C@]3(CO)CCOC3)cc2c1	ZINC000952877657	910435815	/nfs/dbraw/zinc/43/58/15/910435815.db2.gz	SVYMNWFALYOFIC-INIZCTEOSA-N	1	0	272.348	1.784	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](NC(=O)c2cc(O)ccc2N)C1	ZINC000822922786	925658154	/nfs/dbraw/zinc/65/81/54/925658154.db2.gz	WOKFICBAZRLNMT-LLVKDONJSA-N	1	0	277.368	1.579	50	0		CDAARO
CC[N@@H+]1CC[C@@H](CNS(=O)(=O)CC2CCCC2)C1	ZINC000823104902	925673649	/nfs/dbraw/zinc/67/36/49/925673649.db2.gz	QSZFXRPUKBGOJU-ZDUSSCGKSA-N	1	0	274.430	1.438	50	0		CDAARO
OC[C@@H]1CCC[N@H+](CCCNc2ccncc2F)C1	ZINC000828711232	926169246	/nfs/dbraw/zinc/16/92/46/926169246.db2.gz	TUNMYTQNDYRSMX-GFCCVEGCSA-N	1	0	267.348	1.149	50	0		CDAARO
COC1(C[NH2+]Cc2nncn2-c2ccccc2)CCC1	ZINC000585117634	930985398	/nfs/dbraw/zinc/98/53/98/930985398.db2.gz	OWFLPIZQKMOPHL-UHFFFAOYSA-N	1	0	272.352	1.926	50	0		CDAARO
[NH3+]CCC(=O)N1C[C@@H](c2ccccc2)O[C@@H](C2CC2)C1	ZINC001529179539	969004152	/nfs/dbraw/zinc/00/41/52/969004152.db2.gz	CGQJSTYLIYWFGN-LSDHHAIUSA-N	1	0	274.364	1.714	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)c1ncc(F)cn1	ZINC001529185105	969005888	/nfs/dbraw/zinc/00/58/88/969005888.db2.gz	JUNBFLIVHDYNJH-UHFFFAOYSA-N	1	0	252.337	1.926	50	0		CDAARO
C[NH+](C)CCc1nnc(NC(=O)[C@H]2CC=CCC2)s1	ZINC001506427422	975160767	/nfs/dbraw/zinc/16/07/67/975160767.db2.gz	LGPFNBZXRAUJQA-JTQLQIEISA-N	1	0	280.397	1.937	50	0		CDAARO
O=C(NCCC[N@H+]1CCC[C@@H](O)C1)c1cc(O)ccc1F	ZINC000584902195	341986827	/nfs/dbraw/zinc/98/68/27/341986827.db2.gz	SFAYKJBJKVBHMD-GFCCVEGCSA-N	1	0	296.342	1.108	50	0		CDAARO
Cc1cccc(N2CCC(N[C@H]3CC[NH2+]C3)CC2)c1	ZINC000426422768	230418055	/nfs/dbraw/zinc/41/80/55/230418055.db2.gz	FPQXPLLGUNKIPQ-HNNXBMFYSA-N	1	0	259.397	1.915	50	0		CDAARO
CC(C)c1nccn1CCC(=O)N1CC[NH2+]C[C@H]1C	ZINC000124586404	187144761	/nfs/dbraw/zinc/14/47/61/187144761.db2.gz	SRVWRUMIYODNNO-GFCCVEGCSA-N	1	0	264.373	1.217	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)N[C@@H](C)c1ccccc1)[C@@H]1CCOC1	ZINC000095941384	185036331	/nfs/dbraw/zinc/03/63/31/185036331.db2.gz	LNRFGXWFHTXHJL-VNHYZAJKSA-N	1	0	276.380	1.878	50	0		CDAARO
Cc1ccc2nc(C(=O)NCC[NH+]3CCCCC3)cn2c1	ZINC000097939166	342101465	/nfs/dbraw/zinc/10/14/65/342101465.db2.gz	SJZLRSYKWRHYEQ-UHFFFAOYSA-N	1	0	286.379	1.858	50	0		CDAARO
Cc1ncccc1C[NH2+][C@H]1CCCCC[C@@H]1C(N)=O	ZINC000195562098	342628606	/nfs/dbraw/zinc/62/86/06/342628606.db2.gz	OHKSSBGAJCFZEK-KBPBESRZSA-N	1	0	261.369	1.914	50	0		CDAARO
NC(=O)N1CCC[N@@H+]([C@@H]2CCc3c2cccc3F)CC1	ZINC000095406243	539088075	/nfs/dbraw/zinc/08/80/75/539088075.db2.gz	FJZMIMLFKMBKTO-CQSZACIVSA-N	1	0	277.343	1.899	50	0		CDAARO
CC[C@H]1CCC[N@@H+](C2CCN(S(C)(=O)=O)CC2)CC1	ZINC000095457116	539088080	/nfs/dbraw/zinc/08/80/80/539088080.db2.gz	JCWZYSNLRMYGGS-ZDUSSCGKSA-N	1	0	288.457	1.923	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](CNC(=O)CCc2cn[nH]c2)C1	ZINC000244678938	361857321	/nfs/dbraw/zinc/85/73/21/361857321.db2.gz	IMSQHDNEOTZDDU-CQSZACIVSA-N	1	0	278.400	1.436	50	0		CDAARO
CC(C)C(=O)N1CC[C@H]([NH2+]C2CCSCC2)C1	ZINC000095415604	539088207	/nfs/dbraw/zinc/08/82/07/539088207.db2.gz	RYLNZXBZMHWUQF-LBPRGKRZSA-N	1	0	256.415	1.729	50	0		CDAARO
c1cnn(CC[C@@H]2CCCC[N@@H+]2CCn2cncn2)c1	ZINC000244872855	361866719	/nfs/dbraw/zinc/86/67/19/361866719.db2.gz	WFOGDCRZPWKILQ-AWEZNQCLSA-N	1	0	274.372	1.419	50	0		CDAARO
Cc1csc([C@H]2CN(c3cc(C)[nH+]c(N)n3)CCO2)n1	ZINC000065473924	361907138	/nfs/dbraw/zinc/90/71/38/361907138.db2.gz	XPCWZPUZPYSGHG-SNVBAGLBSA-N	1	0	291.380	1.710	50	0		CDAARO
CC(C)Cn1ncc2cc(C(=O)N3CC[C@@H]([NH3+])C3)cnc21	ZINC000097019392	185152609	/nfs/dbraw/zinc/15/26/09/185152609.db2.gz	IYYHGHYPVPQDFZ-CYBMUJFWSA-N	1	0	287.367	1.261	50	0		CDAARO
NC(=O)[C@@H]1CN(C(=O)c2ccc(C[NH3+])cc2)c2ccccc21	ZINC000097019138	185152853	/nfs/dbraw/zinc/15/28/53/185152853.db2.gz	PKUGSEVOZSWZEG-CQSZACIVSA-N	1	0	295.342	1.375	50	0		CDAARO
Cc1noc(C)c1[C@H](C)C(=O)N1CC[NH2+]C[C@@H]1C	ZINC000125459651	187186344	/nfs/dbraw/zinc/18/63/44/187186344.db2.gz	TXVNCXVXXBTTBC-IUCAKERBSA-N	1	0	251.330	1.215	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)Cc2cccc3cccnc32)CC1	ZINC000097023871	185153937	/nfs/dbraw/zinc/15/39/37/185153937.db2.gz	SUDAHFIHLDWNRC-UHFFFAOYSA-N	1	0	283.375	1.941	50	0		CDAARO
CC(C)Oc1cccc([C@H](C)[NH2+][C@H](C)C(N)=O)c1	ZINC000097033094	185155670	/nfs/dbraw/zinc/15/56/70/185155670.db2.gz	RCTDPMPWLMYCBW-WDEREUQCSA-N	1	0	250.342	1.998	50	0		CDAARO
COc1ccccc1C[C@](C)(CO)[NH2+]CC(=O)NC(C)C	ZINC000585139252	342216552	/nfs/dbraw/zinc/21/65/52/342216552.db2.gz	CKUISBAUFDHYDN-MRXNPFEDSA-N	1	0	294.395	1.103	50	0		CDAARO
CCOc1ccnc(NC[C@@H]2CC[N@H+](CC)C2)n1	ZINC000164484178	539125125	/nfs/dbraw/zinc/12/51/25/539125125.db2.gz	MGIHGOQYAMNKNX-NSHDSACASA-N	1	0	250.346	1.629	50	0		CDAARO
COC[C@]1(C(=O)Nc2cc(C)cc(F)c2)CC[NH2+]C1	ZINC000261591959	536659064	/nfs/dbraw/zinc/65/90/64/536659064.db2.gz	MFFYIQPDCYNODU-AWEZNQCLSA-N	1	0	266.316	1.699	50	0		CDAARO
O=C(NCCc1ccccn1)C12CCC[NH+](CCC1)C2	ZINC000585121141	362040118	/nfs/dbraw/zinc/04/01/18/362040118.db2.gz	HATZKQMDDQTGFI-UHFFFAOYSA-N	1	0	273.380	1.616	50	0		CDAARO
Cc1cnccc1CC[NH2+][C@H](C)C[C@H]1CCCC(=O)N1	ZINC000585117551	362046475	/nfs/dbraw/zinc/04/64/75/362046475.db2.gz	LFRLBLBTBNEXCR-UKRRQHHQSA-N	1	0	275.396	1.969	50	0		CDAARO
c1csc(-c2n[nH]cc2C[NH2+]C[C@@H]2COCCO2)c1	ZINC000037998246	362101680	/nfs/dbraw/zinc/10/16/80/362101680.db2.gz	ZZWZSPXVBLRBHA-LLVKDONJSA-N	1	0	279.365	1.643	50	0		CDAARO
CC(C)N(C)C(=O)[C@H](C)[NH2+][C@H]1CCCC[C@H]1CO	ZINC000252585327	342385670	/nfs/dbraw/zinc/38/56/70/342385670.db2.gz	HTSJNNVPSBIAJK-AVGNSLFASA-N	1	0	256.390	1.382	50	0		CDAARO
CCOC[C@H](O)C[NH+]1CCC(OCC(C)C)CC1	ZINC000084801176	362274614	/nfs/dbraw/zinc/27/46/14/362274614.db2.gz	JYACWBWBDUSZQB-CYBMUJFWSA-N	1	0	259.390	1.521	50	0		CDAARO
CC(=O)N(C)[C@H]1CC[N@H+](CCCc2cccnc2)C1	ZINC000252487807	362387467	/nfs/dbraw/zinc/38/74/67/362387467.db2.gz	IBTQIBYBCXUGPA-HNNXBMFYSA-N	1	0	261.369	1.567	50	0		CDAARO
CNS(=O)(=O)CC[NH2+]C[C@H]1C(C)=CCC[C@H]1C	ZINC000190301520	530017849	/nfs/dbraw/zinc/01/78/49/530017849.db2.gz	RRRROPMCVRZLQF-NEPJUHHUSA-N	1	0	260.403	1.118	50	0		CDAARO
CC(=O)N1CCN([C@@H]2C[N@H+]([C@H]3C=CCCC3)C[C@@H]2C)CC1	ZINC000607974381	345491554	/nfs/dbraw/zinc/49/15/54/345491554.db2.gz	CTFCRIMRPWSGPK-BHYGNILZSA-N	1	0	291.439	1.580	50	0		CDAARO
CC(=O)N1CCN([C@@H]2C[N@H+]([C@@H]3C=CCCC3)C[C@H]2C)CC1	ZINC000607974382	345491556	/nfs/dbraw/zinc/49/15/56/345491556.db2.gz	CTFCRIMRPWSGPK-DJIMGWMZSA-N	1	0	291.439	1.580	50	0		CDAARO
Cc1ccc(Cl)c(O[C@H](C)C(=O)N[C@@H]2CC[NH2+]C2)c1	ZINC000127553870	187314884	/nfs/dbraw/zinc/31/48/84/187314884.db2.gz	DMKJWGPVLUJZNC-GHMZBOCLSA-N	1	0	282.771	1.894	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)Cc2ccc(F)cc2)CC1	ZINC000085467981	179072942	/nfs/dbraw/zinc/07/29/42/179072942.db2.gz	OCUJRNIIQPALID-UHFFFAOYSA-N	1	0	294.370	1.595	50	0		CDAARO
[NH3+][C@H]1CCC[C@@H](C(=O)NCc2cnc3c(c2)CCC3)C1	ZINC000584895965	349357267	/nfs/dbraw/zinc/35/72/67/349357267.db2.gz	PNWMLRPWAKKDRF-KGLIPLIRSA-N	1	0	273.380	1.704	50	0		CDAARO
c1ccn2c(c1)nnc2CCC[NH2+][C@@H]1CCSC1	ZINC000584896454	349358243	/nfs/dbraw/zinc/35/82/43/349358243.db2.gz	MFFUJHYXXWQXIH-LLVKDONJSA-N	1	0	262.382	1.757	50	0		CDAARO
COCC1(C(=O)NC[C@@H]2CCCC[N@@H+]2C)CCC1	ZINC000584886228	349344346	/nfs/dbraw/zinc/34/43/46/349344346.db2.gz	BRDHJNIILIVASE-LBPRGKRZSA-N	1	0	254.374	1.404	50	0		CDAARO
C[NH+](C)Cc1ccccc1CNC(=O)c1c[nH]c(=O)[nH]1	ZINC000584890088	349349043	/nfs/dbraw/zinc/34/90/43/349349043.db2.gz	XDQCZDSAVAGXCH-UHFFFAOYSA-N	1	0	274.324	1.107	50	0		CDAARO
C[C@@H]([NH2+]C1CCOCC1)c1nc(-c2ccncc2)no1	ZINC000584892809	349352562	/nfs/dbraw/zinc/35/25/62/349352562.db2.gz	USGYZOHUXMOFDS-SNVBAGLBSA-N	1	0	274.324	1.961	50	0		CDAARO
Cc1ncnc(N2C[C@H](CO)[C@H](C[NH+]3CCCC3)C2)c1C	ZINC000091351283	180137924	/nfs/dbraw/zinc/13/79/24/180137924.db2.gz	DCHGNEYUYJUJKO-HUUCEWRRSA-N	1	0	290.411	1.234	50	0		CDAARO
CCC[C@]1(CO)CCC[N@H+](Cc2cnc(N)nc2)C1	ZINC000091619925	180208452	/nfs/dbraw/zinc/20/84/52/180208452.db2.gz	PYLISXVBNVIVDH-AWEZNQCLSA-N	1	0	264.373	1.433	50	0		CDAARO
CCCn1ncc(C(=O)N2CC[C@H]3C[NH2+]C[C@H]32)c1C	ZINC000091644589	180214529	/nfs/dbraw/zinc/21/45/29/180214529.db2.gz	BYTIEJXGPSUFCC-WCQYABFASA-N	1	0	262.357	1.035	50	0		CDAARO
COCC[C@]1(O)CC[N@H+](CCC(=O)N2CCCC2)C[C@H]1C	ZINC000091707425	180230869	/nfs/dbraw/zinc/23/08/69/180230869.db2.gz	ULZZTRJUZHRNAX-GDBMZVCRSA-N	1	0	298.427	1.108	50	0		CDAARO
Cc1ccc2[nH]c(C[NH2+][C@H](C)Cn3cncn3)cc(=O)c2c1	ZINC000091713678	180231348	/nfs/dbraw/zinc/23/13/48/180231348.db2.gz	VDNZDMXNMRLIFN-GFCCVEGCSA-N	1	0	297.362	1.606	50	0		CDAARO
C[C@H](CCc1cccc(F)c1)[N@@H+]1C[C@@H](C)O[C@H](C(N)=O)C1	ZINC000108467116	186218441	/nfs/dbraw/zinc/21/84/41/186218441.db2.gz	HXTRVNDAGZZWNV-JMSVASOKSA-N	1	0	294.370	1.721	50	0		CDAARO
COc1cc(C[NH2+]C(C)(C)CO)cc2c1OCO2	ZINC000109844910	186276307	/nfs/dbraw/zinc/27/63/07/186276307.db2.gz	OGRWQNHPRUWKLW-UHFFFAOYSA-N	1	0	253.298	1.284	50	0		CDAARO
CC[NH+](CC)CCn1c(=O)c2ccccc2n(C)c1=O	ZINC000140154529	187908329	/nfs/dbraw/zinc/90/83/29/187908329.db2.gz	WNQRAGMSSWNAIQ-UHFFFAOYSA-N	1	0	275.352	1.042	50	0		CDAARO
COc1ccc(N2C(=O)C[C@H]([NH2+]C3CCCC3)C2=O)cc1	ZINC000000367033	355906971	/nfs/dbraw/zinc/90/69/71/355906971.db2.gz	KPYXNGHCODTBBE-AWEZNQCLSA-N	1	0	288.347	1.859	50	0		CDAARO
O=S(=O)(c1cccc2cnccc21)N1CCC[NH2+]CC1	ZINC000000006486	355879400	/nfs/dbraw/zinc/87/94/00/355879400.db2.gz	NGOGFTYYXHNFQH-UHFFFAOYSA-N	1	0	291.376	1.219	50	0	world	CDAARO
Cc1ccc2cc(C[NH2+]CCCO)c(=O)[nH]c2c1C	ZINC000002584228	355975903	/nfs/dbraw/zinc/97/59/03/355975903.db2.gz	OCJPLOHJEQMZLX-UHFFFAOYSA-N	1	0	260.337	1.617	50	0		CDAARO
COc1cccc(OC)c1OCC[NH2+]C[C@@H](C)O	ZINC000002879717	355986691	/nfs/dbraw/zinc/98/66/91/355986691.db2.gz	LFYLJJJKCKFXFG-SNVBAGLBSA-N	1	0	255.314	1.053	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1CCCNc1ccncn1	ZINC000095355256	356003551	/nfs/dbraw/zinc/00/35/51/356003551.db2.gz	FTJFVXYHODESRK-LBPRGKRZSA-N	1	0	250.346	1.125	50	0		CDAARO
CCOC(=O)CC[NH2+]Cc1ccc(OC)c(OC)c1	ZINC000002285748	355965486	/nfs/dbraw/zinc/96/54/86/355965486.db2.gz	BEYOHIUUBRQWQF-UHFFFAOYSA-N	1	0	267.325	1.747	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]1)N1CCN(c2ccc(F)cc2)CC1	ZINC000005571735	356056868	/nfs/dbraw/zinc/05/68/68/356056868.db2.gz	MWCWRPYPVNASRL-AWEZNQCLSA-N	1	0	277.343	1.226	50	0		CDAARO
CCOC(=O)C[C@@H]1[NH2+]CCC[C@H]1NC(=O)OC(C)(C)C	ZINC000004203237	356022213	/nfs/dbraw/zinc/02/22/13/356022213.db2.gz	JWIFFLUEVLMGJF-MNOVXSKESA-N	1	0	286.372	1.585	50	0		CDAARO
O=S(=O)(Cc1ccccc1)NCCC[NH+]1CCCC1	ZINC000010539151	356260125	/nfs/dbraw/zinc/26/01/25/356260125.db2.gz	NWELZRGCGVOUCL-UHFFFAOYSA-N	1	0	282.409	1.592	50	0		CDAARO
Cc1ccc2c(C[N@H+](C)CCO)cc(=O)oc2c1C	ZINC000004340571	356304390	/nfs/dbraw/zinc/30/43/90/356304390.db2.gz	WWVZIVYGYJDHBA-UHFFFAOYSA-N	1	0	261.321	1.834	50	0	biogenic	CDAARO
CC(C)(CNC(=O)CCc1ccsc1)N1CCOCC1	ZINC000032731371	356353999	/nfs/dbraw/zinc/35/39/99/356353999.db2.gz	CIRJVRXREOCAGY-UHFFFAOYSA-N	1	0	296.436	1.908	50	0		CDAARO
COc1ccc(S(=O)(=O)NC2CC[NH+](C)CC2)cc1	ZINC000014252173	356382171	/nfs/dbraw/zinc/38/21/71/356382171.db2.gz	FLCDYQRZFWGUCI-UHFFFAOYSA-N	1	0	284.381	1.068	50	0		CDAARO
COc1ccc(OC)c(NC(=O)NC2CC[NH+](C)CC2)c1	ZINC000017023236	356451488	/nfs/dbraw/zinc/45/14/88/356451488.db2.gz	LZFGCIDKSYITRV-UHFFFAOYSA-N	1	0	293.367	1.920	50	0		CDAARO
COc1cccc(CN2CC[NH+](C)CC2)c1OC	ZINC000019359537	356483396	/nfs/dbraw/zinc/48/33/96/356483396.db2.gz	IEZJXKHASWPGCG-UHFFFAOYSA-N	1	0	250.342	1.451	50	0		CDAARO
C[C@@H](Oc1ccccc1F)C(=O)N1CC[NH2+]CC1	ZINC000019476685	356486812	/nfs/dbraw/zinc/48/68/12/356486812.db2.gz	LGFYGRLDEYHARN-SNVBAGLBSA-N	1	0	252.289	1.025	50	0		CDAARO
CCOc1c(C[NH2+]CCN(C)C)cccc1OC	ZINC000019871957	356512650	/nfs/dbraw/zinc/51/26/50/356512650.db2.gz	GHPMJQPRYALTKG-UHFFFAOYSA-N	1	0	252.358	1.745	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1ccnc(Cl)c1	ZINC000019813425	356506615	/nfs/dbraw/zinc/50/66/15/356506615.db2.gz	HPWOVMQORBWHSR-UHFFFAOYSA-N	1	0	255.749	1.807	50	0		CDAARO
CCOC(=O)N1CCC(N2CCCC[C@@H]([NH3+])C2)CC1	ZINC000082136933	482763577	/nfs/dbraw/zinc/76/35/77/482763577.db2.gz	QEHOKQVYVNWBJP-GFCCVEGCSA-N	1	0	269.389	1.421	50	0		CDAARO
CC(C)=CCC[C@H](C)C[NH+]1CCN(CCO)CC1	ZINC000023281353	356638282	/nfs/dbraw/zinc/63/82/82/356638282.db2.gz	UBYXKDQTFDGSGI-HNNXBMFYSA-N	1	0	254.418	1.979	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@H](O)C2)c(OC)c1	ZINC000000207303	356812629	/nfs/dbraw/zinc/81/26/29/356812629.db2.gz	UACNZXHUXSAGAV-LBPRGKRZSA-N	1	0	251.326	1.661	50	0		CDAARO
C[NH+](C)Cc1ccc(CNC(=O)C[C@@H]2CCOC2)cc1	ZINC000342916850	356823343	/nfs/dbraw/zinc/82/33/43/356823343.db2.gz	UWMDTCRNILYJHT-HNNXBMFYSA-N	1	0	276.380	1.791	50	0		CDAARO
[NH3+]Cc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000037010203	356895948	/nfs/dbraw/zinc/89/59/48/356895948.db2.gz	CTHWLDCXKRLGRD-UHFFFAOYSA-N	1	0	256.309	1.862	50	0		CDAARO
CCN1CCC[C@H]([N@@H+]2CCC[C@H](CCCO)C2)C1	ZINC000042496515	357070438	/nfs/dbraw/zinc/07/04/38/357070438.db2.gz	IWFICYUSBZVCBY-CABCVRRESA-N	1	0	254.418	1.955	50	0		CDAARO
Cc1cc(C)n(CC(=O)NC[C@@H]2CCC[N@@H+](C(C)C)C2)n1	ZINC000063694596	357516196	/nfs/dbraw/zinc/51/61/96/357516196.db2.gz	OTGSOTUQPHBTMR-HNNXBMFYSA-N	1	0	292.427	1.737	50	0		CDAARO
CC[C@H](O)Cn1cc(C2=CC[N@H+](CCOC)CC2)cn1	ZINC000065406335	357539349	/nfs/dbraw/zinc/53/93/49/357539349.db2.gz	ZMMSZINEALESAN-HNNXBMFYSA-N	1	0	279.384	1.390	50	0		CDAARO
CCC1(CC)CN(C(=O)[C@H]2CC[N@H+](CCOC)C2)CCO1	ZINC000065419853	357540317	/nfs/dbraw/zinc/54/03/17/357540317.db2.gz	GANFBFLVIALRKU-AWEZNQCLSA-N	1	0	298.427	1.372	50	0		CDAARO
OCCOc1ccccc1[C@@H]1NCCc2nc[nH]c21	ZINC000065489361	357544860	/nfs/dbraw/zinc/54/48/60/357544860.db2.gz	UZABPLSKMCGOGZ-ZDUSSCGKSA-N	1	0	259.309	1.016	50	0		CDAARO
C[C@@H](CO)[NH2+]CCC(=O)Nc1ccc(N(C)C)cc1	ZINC000065525838	357547075	/nfs/dbraw/zinc/54/70/75/357547075.db2.gz	RCRBMTIEGXHXIN-NSHDSACASA-N	1	0	265.357	1.052	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@@H](CN(C)C(=O)c2ccc(=O)[nH]c2)C1	ZINC000067714866	357620521	/nfs/dbraw/zinc/62/05/21/357620521.db2.gz	GAPFLQYXWFUEKA-ZDUSSCGKSA-N	1	0	291.395	1.425	50	0		CDAARO
CC/C=C(\C)C[N@@H+]1CC[C@H](CNC(=O)c2ccncn2)C1	ZINC000067821226	357630511	/nfs/dbraw/zinc/63/05/11/357630511.db2.gz	GWYPBPOXRYMXIZ-QJIMOZNHSA-N	1	0	288.395	1.885	50	0		CDAARO
Cc1cc(N2CC[C@@]3(O)CCCC[C@H]3C2)nc(N)[nH+]1	ZINC000091965559	357725524	/nfs/dbraw/zinc/72/55/24/357725524.db2.gz	SKYHBGLORQDNCN-FZMZJTMJSA-N	1	0	262.357	1.499	50	0		CDAARO
Cc1ccc(S(=O)(=O)C[C@@H](C)[NH2+][C@H]2CCCOC2)cc1	ZINC000097113283	357983107	/nfs/dbraw/zinc/98/31/07/357983107.db2.gz	STBBBSOVXPAXJB-KGLIPLIRSA-N	1	0	297.420	1.926	50	0		CDAARO
CO[C@H]1C=CC2=CC[N@@H+]3CC[C@@H]4COC(=O)C=C4[C@]23C1	ZINC000019864716	358007924	/nfs/dbraw/zinc/00/79/24/358007924.db2.gz	IXPDLJKEPLTCOU-FFSVYQOJSA-N	1	0	273.332	1.445	50	0	biogenic,in-vitro	CDAARO
Cc1cc(C(=O)N(C)CC[C@@H]([NH3+])C(C)C)n(C)n1	ZINC000097228991	358043348	/nfs/dbraw/zinc/04/33/48/358043348.db2.gz	AXTWVDIAKVXFEN-LLVKDONJSA-N	1	0	252.362	1.174	50	0		CDAARO
[NH3+][C@H]1CCCCN(C(=O)CCn2cc(Cl)cn2)C1	ZINC000082097346	358146819	/nfs/dbraw/zinc/14/68/19/358146819.db2.gz	UIYPROOSFWBGLO-NSHDSACASA-N	1	0	270.764	1.266	50	0		CDAARO
O=C(CCc1ccc2c(c1)OCO2)NC[C@@H]1C[C@H](F)C[NH2+]1	ZINC000082155897	358149673	/nfs/dbraw/zinc/14/96/73/358149673.db2.gz	AEGCPFMECJVFQC-RYUDHWBXSA-N	1	0	294.326	1.164	50	0		CDAARO
COc1cccc(/C=C\C(=O)N2CC[N@H+](C)C[C@@H]2C)c1	ZINC000098055862	358344456	/nfs/dbraw/zinc/34/44/56/358344456.db2.gz	BERXWLLLFVNROO-WSROAFLRSA-N	1	0	274.364	1.871	50	0		CDAARO
COc1ccc(C[N@H+](C)C[C@@H](O)COC(C)C)c(OC)c1	ZINC000098066150	358354711	/nfs/dbraw/zinc/35/47/11/358354711.db2.gz	BVWYJZFKJQGONO-CQSZACIVSA-N	1	0	297.395	1.922	50	0		CDAARO
CC(C)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000036722810	358425404	/nfs/dbraw/zinc/42/54/04/358425404.db2.gz	KXCWPPQBHIBCNO-OAHLLOKOSA-N	1	0	276.380	1.660	50	0		CDAARO
C[C@@H](CCc1cccc(F)c1)[N@@H+]1CCO[C@@H](CO)C1	ZINC000195558416	358564622	/nfs/dbraw/zinc/56/46/22/358564622.db2.gz	KCTJGCIJPLHBAV-SWLSCSKDSA-N	1	0	267.344	1.840	50	0		CDAARO
COc1ccc(-c2cc(C(=O)N3CC[C@@H]([NH3+])C3)[nH]n2)cc1	ZINC000091793336	358527687	/nfs/dbraw/zinc/52/76/87/358527687.db2.gz	BYRFLIXZKYRISU-LLVKDONJSA-N	1	0	286.335	1.259	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCCN(c2cc(C3CC3)ncn2)C1	ZINC000095384441	358690300	/nfs/dbraw/zinc/69/03/00/358690300.db2.gz	LVDZUBMRTCDGPG-OAHLLOKOSA-N	1	0	276.384	1.247	50	0		CDAARO
Cc1cc(N2CCCN(c3nccc(N)n3)CC2)cc[nH+]1	ZINC000096137569	358709279	/nfs/dbraw/zinc/70/92/79/358709279.db2.gz	ZVMDMCNFDTXLSO-UHFFFAOYSA-N	1	0	284.367	1.479	50	0		CDAARO
C[N@@H+]1C[C@@H]2CC[C@H](C1)N(C(=O)c1cc(C3CC3)n[nH]1)C2	ZINC000097696256	358793794	/nfs/dbraw/zinc/79/37/94/358793794.db2.gz	KIWTVNSZQQWZLO-CMPLNLGQSA-N	1	0	274.368	1.453	50	0		CDAARO
CN(C)c1ccc(CN2C[C@H]3CC[C@@H](C2)[NH2+]C3)cn1	ZINC000097759369	358797983	/nfs/dbraw/zinc/79/79/83/358797983.db2.gz	FBJDTJZYHMWYGU-JSGCOSHPSA-N	1	0	260.385	1.331	50	0		CDAARO
Cc1cc(=O)cc(C(=O)N2CC[C@@H]([NH+]3CCCCC3)C2)o1	ZINC000215748811	358900974	/nfs/dbraw/zinc/90/09/74/358900974.db2.gz	LSLJIUFHMLMMLT-CYBMUJFWSA-N	1	0	290.363	1.649	50	0		CDAARO
CCc1oncc1C(=O)N1CC[C@@H]([NH+](CC)CC)C1	ZINC000216127879	358927183	/nfs/dbraw/zinc/92/71/83/358927183.db2.gz	HNJDVIOZLRWILR-LLVKDONJSA-N	1	0	265.357	1.793	50	0		CDAARO
O=C(C[C@@H]1CC[NH2+]C1)N1CCC(c2ncc[nH]2)CC1	ZINC000216269495	358934243	/nfs/dbraw/zinc/93/42/43/358934243.db2.gz	QXIFOOVJEWRTNK-NSHDSACASA-N	1	0	262.357	1.115	50	0		CDAARO
CO[C@H]1CCCC[C@H]1[NH+]1CCN(C(=O)c2ccco2)CC1	ZINC000000759068	359007556	/nfs/dbraw/zinc/00/75/56/359007556.db2.gz	HRVLJQXAERGABT-KGLIPLIRSA-N	1	0	292.379	1.995	50	0		CDAARO
NC(=[NH2+])c1ccc(N2CCN(c3ccc(F)cc3)CC2)nc1	ZINC000022264259	359048248	/nfs/dbraw/zinc/04/82/48/359048248.db2.gz	LFHAZTWZJTYYPP-UHFFFAOYSA-N	1	0	299.353	1.831	50	0		CDAARO
Cc1nc(N)ncc1C(=O)NCCC12CCC[NH+]1CCC2	ZINC000218878292	359069422	/nfs/dbraw/zinc/06/94/22/359069422.db2.gz	XUMUAOJJRISEKS-UHFFFAOYSA-N	1	0	289.383	1.116	50	0		CDAARO
C[NH2+][C@@H](CC(C)C)C(=O)NCCCc1csc(N)n1	ZINC000222897546	359381599	/nfs/dbraw/zinc/38/15/99/359381599.db2.gz	YAFGMGUDWDVOEX-NSHDSACASA-N	1	0	284.429	1.408	50	0		CDAARO
Cn1cc(CNc2cc(C3CC([NH3+])C3)ncn2)cn1	ZINC000223391478	359422445	/nfs/dbraw/zinc/42/24/45/359422445.db2.gz	QOLXFQMHGASKIF-UHFFFAOYSA-N	1	0	258.329	1.027	50	0		CDAARO
CC(C)[C@@H]([NH2+]CC(=O)NC1CC1)[C@@H](O)c1ccccc1	ZINC000408516359	359899589	/nfs/dbraw/zinc/89/95/89/359899589.db2.gz	NCTBCRZQRYTQCU-CVEARBPZSA-N	1	0	276.380	1.613	50	0		CDAARO
CSc1ccc(C[NH2+]CC2(C(N)=O)CCOCC2)cc1	ZINC000089493865	359941432	/nfs/dbraw/zinc/94/14/32/359941432.db2.gz	MPUJTFHWRZULSN-UHFFFAOYSA-N	1	0	294.420	1.780	50	0		CDAARO
Cc1ccc2c(c1)[C@@H]([NH2+]CCN1CCCS1(=O)=O)CC2	ZINC000089519436	360135971	/nfs/dbraw/zinc/13/59/71/360135971.db2.gz	NWIWYUBLOWXVBJ-HNNXBMFYSA-N	1	0	294.420	1.607	50	0		CDAARO
C[C@@H]1CCCC[C@@H]1OCC(=O)N[C@H]1CC[N@H+](C)C1	ZINC000248020883	360320030	/nfs/dbraw/zinc/32/00/30/360320030.db2.gz	MEUQCTGFRADTET-AGIUHOORSA-N	1	0	254.374	1.402	50	0		CDAARO
Cc1cc(C)nc(N2CC[NH+](C3CCOCC3)CC2)n1	ZINC000267067317	363725559	/nfs/dbraw/zinc/72/55/59/363725559.db2.gz	QETYDQOGGLODTG-UHFFFAOYSA-N	1	0	276.384	1.394	50	0		CDAARO
C[C@H](CC[NH+](C)C)NC(=O)[C@H]1C[C@H]1c1cccnc1	ZINC000248221927	360463347	/nfs/dbraw/zinc/46/33/47/360463347.db2.gz	IBMRYCFZFPEFMZ-XBFCOCLRSA-N	1	0	261.369	1.642	50	0		CDAARO
Cc1cc(C(F)(F)F)nc(CNC(=O)[C@H](C)[NH+](C)C)n1	ZINC000426510930	360679210	/nfs/dbraw/zinc/67/92/10/360679210.db2.gz	ZOMNQPGIBRMQJI-QMMMGPOBSA-N	1	0	290.289	1.370	50	0		CDAARO
O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)[C@@H]1CC[NH2+]C1	ZINC000178471180	189119016	/nfs/dbraw/zinc/11/90/16/189119016.db2.gz	PSAYWRPQHXMARL-QLFBSQMISA-N	1	0	274.364	1.632	50	0		CDAARO
O=C(Cc1cc(F)ccc1F)N[C@H]1CCC[NH2+]C1	ZINC000178393730	189112863	/nfs/dbraw/zinc/11/28/63/189112863.db2.gz	WEQRBBXLBGYNCK-NSHDSACASA-N	1	0	254.280	1.376	50	0		CDAARO
O=C(NCCOCc1ccccc1)[C@H]1CC12CC[NH2+]CC2	ZINC000096162931	360718169	/nfs/dbraw/zinc/71/81/69/360718169.db2.gz	AFMPXQBANRBHBP-OAHLLOKOSA-N	1	0	288.391	1.709	50	0		CDAARO
CCc1ccccc1OCC(=O)N1CC[C@@H](C[NH2+]C)C1	ZINC000178969973	189158653	/nfs/dbraw/zinc/15/86/53/189158653.db2.gz	QINLMEJGIIQFGF-ZDUSSCGKSA-N	1	0	276.380	1.696	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)/C=C/c2cncc(F)c2)C1	ZINC000178992168	189160084	/nfs/dbraw/zinc/16/00/84/189160084.db2.gz	DLTKTBQPEBUIHO-QAVQXKDTSA-N	1	0	263.316	1.302	50	0		CDAARO
Cc1c(C(=O)N(C)[C@@H]2CC[NH2+]C2)cnn1-c1ccccc1C	ZINC000179058594	189165458	/nfs/dbraw/zinc/16/54/58/189165458.db2.gz	WDYFQOJBJZVCCI-CQSZACIVSA-N	1	0	298.390	1.923	50	0		CDAARO
O=C1NCCCC[C@@H]1[NH2+][C@H]1CCc2ccccc2C1	ZINC000004022737	364790663	/nfs/dbraw/zinc/79/06/63/364790663.db2.gz	IIXXQBNVBPXGSJ-GJZGRUSLSA-N	1	0	258.365	1.802	50	0		CDAARO
CCOc1ccccc1CCC(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179081071	364976177	/nfs/dbraw/zinc/97/61/77/364976177.db2.gz	VVDGUGNKUVUDRD-AWEZNQCLSA-N	1	0	276.380	1.838	50	0		CDAARO
C[C@@H](Cc1cccs1)[N@H+](C)CCN1C(=O)CCC1=O	ZINC000089904277	366963714	/nfs/dbraw/zinc/96/37/14/366963714.db2.gz	IZBSYZUSNXMLDB-NSHDSACASA-N	1	0	280.393	1.760	50	0		CDAARO
CC(=O)N(C)C1CC[NH+](C[C@H](C)C(=O)OC(C)(C)C)CC1	ZINC000252482792	367566535	/nfs/dbraw/zinc/56/65/35/367566535.db2.gz	DNXMXTQBDDVLDI-LBPRGKRZSA-N	1	0	298.427	1.907	50	0		CDAARO
Clc1cncc(N2CC[N@@H+]3CCCC[C@H]3C2)n1	ZINC000252517296	367740577	/nfs/dbraw/zinc/74/05/77/367740577.db2.gz	DZFZTFPOGCVSMN-JTQLQIEISA-N	1	0	252.749	1.805	50	0		CDAARO
CCCC(=O)NC[C@@H]1CCC[N@@H+]([C@@H]2CCCC[C@H]2O)C1	ZINC000252513056	367716389	/nfs/dbraw/zinc/71/63/89/367716389.db2.gz	XBULBUGNXGBABS-RRFJBIMHSA-N	1	0	282.428	1.918	50	0		CDAARO
CO[C@H]1CC[N@H+](CC(=O)NCCc2ccc(Cl)cc2)C1	ZINC000361372483	368783270	/nfs/dbraw/zinc/78/32/70/368783270.db2.gz	ODPOCBNBKFRGJR-AWEZNQCLSA-N	1	0	296.798	1.719	50	0		CDAARO
CSc1ccccc1NC(=O)C[NH2+]C[C@H](C)O	ZINC000003338898	369403971	/nfs/dbraw/zinc/40/39/71/369403971.db2.gz	KRUNWPAEWBIMNU-VIFPVBQESA-N	1	0	254.355	1.317	50	0		CDAARO
NC(=O)c1cncc(-c2cccc3c2O[C@H](C[NH3+])C3)c1	ZINC000299761761	372746910	/nfs/dbraw/zinc/74/69/10/372746910.db2.gz	XZXZFJWTWAGSNS-LBPRGKRZSA-N	1	0	269.304	1.110	50	0		CDAARO
CC[N@H+](CC(=O)N1CCCC[C@@H]1c1nc[nH]n1)C1CC1	ZINC000096494452	284387643	/nfs/dbraw/zinc/38/76/43/284387643.db2.gz	ATRVYFOJZRBGPX-GFCCVEGCSA-N	1	0	277.372	1.343	50	0		CDAARO
CN1CC[N@H+](C)Cc2ccc(NC(=O)[C@H]3CCCO3)cc21	ZINC000253390148	373681119	/nfs/dbraw/zinc/68/11/19/373681119.db2.gz	DYNBUWDRUFWCHR-OAHLLOKOSA-N	1	0	289.379	1.686	50	0		CDAARO
COCc1nc2n(n1)C[C@H](Nc1cc[nH+]c(C)c1)CC2	ZINC000253428440	373736202	/nfs/dbraw/zinc/73/62/02/373736202.db2.gz	DELHSRYISRWSKS-GFCCVEGCSA-N	1	0	273.340	1.555	50	0		CDAARO
COC(C[NH+]1CCC(Cc2cccnc2)CC1)OC	ZINC000253431214	373744150	/nfs/dbraw/zinc/74/41/50/373744150.db2.gz	GNDVLVSJCDTGFB-UHFFFAOYSA-N	1	0	264.369	1.955	50	0		CDAARO
C[C@H](COCC(F)(F)F)NC(=O)CC1CC[NH2+]CC1	ZINC000253433420	373747255	/nfs/dbraw/zinc/74/72/55/373747255.db2.gz	WQSVFWMGIZATLJ-SECBINFHSA-N	1	0	282.306	1.460	50	0		CDAARO
Cc1ccccc1NC(=O)NCC[NH+]1CCC(O)CC1	ZINC000206609969	374179014	/nfs/dbraw/zinc/17/90/14/374179014.db2.gz	VITPZAYVLIIOLR-UHFFFAOYSA-N	1	0	277.368	1.573	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)c2ccc(-c3cnccn3)cc2)CC1	ZINC000095433466	374933928	/nfs/dbraw/zinc/93/39/28/374933928.db2.gz	IGTAJGCARBQKBT-UHFFFAOYSA-N	1	0	296.374	1.921	50	0		CDAARO
COC(=O)[C@@]12CCC[C@H]1C[N@H+](Cc1cccn1C)C2	ZINC000108496712	412831054	/nfs/dbraw/zinc/83/10/54/412831054.db2.gz	LRHCXIUSZNDQPC-SWLSCSKDSA-N	1	0	262.353	1.800	50	0		CDAARO
COc1cccc(Cl)c1C[N@@H+]1CC[C@H](C(N)=O)C1	ZINC000095453829	374952153	/nfs/dbraw/zinc/95/21/53/374952153.db2.gz	SJWGHESFUAJSDB-VIFPVBQESA-N	1	0	268.744	1.656	50	0		CDAARO
O=S(=O)(CC[NH2+][C@H]1CCCSC1)NCC1CCC1	ZINC000097084596	375145899	/nfs/dbraw/zinc/14/58/99/375145899.db2.gz	OHHBLRNCMVSMFW-LBPRGKRZSA-N	1	0	292.470	1.191	50	0		CDAARO
COCCC(C)(C)C(=O)N1CCN(c2cc[nH+]cc2)CC1	ZINC000097115426	375150392	/nfs/dbraw/zinc/15/03/92/375150392.db2.gz	JXBSINVHBAWZFX-UHFFFAOYSA-N	1	0	291.395	1.793	50	0		CDAARO
CNC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C[NH3+])cc1	ZINC000493282045	375432935	/nfs/dbraw/zinc/43/29/35/375432935.db2.gz	AZYRNMMFIWPNID-PIZKADEWSA-N	1	0	287.363	1.009	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](CNC(=O)C2(COC)CCC2)C1	ZINC000670440552	542011332	/nfs/dbraw/zinc/01/13/32/542011332.db2.gz	FBQWFSLYKFWUQY-AWEZNQCLSA-N	1	0	298.427	1.278	50	0		CDAARO
FC(F)(F)c1cccnc1NC[C@H]1C[NH2+]CCO1	ZINC000134267212	375825492	/nfs/dbraw/zinc/82/54/92/375825492.db2.gz	OIFSUYTTWVCGAJ-MRVPVSSYSA-N	1	0	261.247	1.501	50	0		CDAARO
COc1ccccc1/C=C\C[NH2+]CCc1cn(C)nn1	ZINC000606444592	375825878	/nfs/dbraw/zinc/82/58/78/375825878.db2.gz	MRTGGYWUCTXCCF-ALCCZGGFSA-N	1	0	272.352	1.669	50	0		CDAARO
CC(C)(C)c1nc(CSc2nc(N)cc(N)[nH+]2)no1	ZINC000031821888	375836906	/nfs/dbraw/zinc/83/69/06/375836906.db2.gz	MBHLOAAWKQRGGA-UHFFFAOYSA-N	1	0	280.357	1.614	50	0		CDAARO
O[C@@H](Cn1cccn1)C[N@@H+]1CC[C@H]2CCCC[C@H]2C1	ZINC000239351862	376015611	/nfs/dbraw/zinc/01/56/11/376015611.db2.gz	AAEAUHRZMQCGTD-QLFBSQMISA-N	1	0	263.385	1.756	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(Cc2ncc(C(C)(C)C)o2)C[C@H]1C	ZINC000241588368	376019971	/nfs/dbraw/zinc/01/99/71/376019971.db2.gz	PCMDBYWDCVKEEB-OLZOCXBDSA-N	1	0	295.427	1.859	50	0		CDAARO
COc1ncccc1-c1cccc(N2CC[NH2+]CC2)n1	ZINC000067973546	377339453	/nfs/dbraw/zinc/33/94/53/377339453.db2.gz	YXJVFMNWYASWGK-UHFFFAOYSA-N	1	0	270.336	1.562	50	0		CDAARO
CCc1nnc(CN2CC[N@H+](C)C[C@H]2c2ccccc2)[nH]1	ZINC000249367329	377424747	/nfs/dbraw/zinc/42/47/47/377424747.db2.gz	VLCGQTNDNJYKNU-AWEZNQCLSA-N	1	0	285.395	1.856	50	0		CDAARO
C[C@H](c1ccncc1)[NH+]1CCC(Nc2cnccn2)CC1	ZINC000571875815	377562815	/nfs/dbraw/zinc/56/28/15/377562815.db2.gz	AXNPIHQFGXVBDN-CYBMUJFWSA-N	1	0	283.379	1.931	50	0		CDAARO
CC[C@H](C(=O)N1CCC[C@@H](C(C)(C)C(=O)OC)C1)[NH+](C)C	ZINC000089367535	377837433	/nfs/dbraw/zinc/83/74/33/377837433.db2.gz	PXXBVYUGBWZVCS-CHWSQXEVSA-N	1	0	298.427	1.764	50	0		CDAARO
COc1ccc(CN2C[C@@]3(C)CCC[N@@H+]3C[C@H]2CO)cc1	ZINC000245224618	377939172	/nfs/dbraw/zinc/93/91/72/377939172.db2.gz	ZUGGYBZWAOHVJU-DOTOQJQBSA-N	1	0	290.407	1.726	50	0		CDAARO
COc1ccc([C@H](C)C[NH2+]C2(CO)CCOCC2)cc1	ZINC000096493577	533157473	/nfs/dbraw/zinc/15/74/73/533157473.db2.gz	MTKFVFRUAPQWOO-CYBMUJFWSA-N	1	0	279.380	1.930	50	0		CDAARO
C[C@H]1NC(=O)N(C2CC[NH+](Cc3ccccc3)CC2)C1=O	ZINC000013548464	256843080	/nfs/dbraw/zinc/84/30/80/256843080.db2.gz	MUELMPXIOWBHPX-GFCCVEGCSA-N	1	0	287.363	1.591	50	0		CDAARO
Cc1ccc(C(=O)N[C@@H]2CC[NH2+]C[C@H]2C)cc1F	ZINC000094345421	184786079	/nfs/dbraw/zinc/78/60/79/184786079.db2.gz	MCUGJJNOCHPIBJ-ZWNOBZJWSA-N	1	0	250.317	1.862	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)NCCc2cnccn2)CC1	ZINC000095366829	184954557	/nfs/dbraw/zinc/95/45/57/184954557.db2.gz	KGFKIYYHYJNLDE-UHFFFAOYSA-N	1	0	276.384	1.256	50	0		CDAARO
Cc1ccc(NC(=O)C2([NH3+])Cc3ccccc3C2)cn1	ZINC000648150565	390432567	/nfs/dbraw/zinc/43/25/67/390432567.db2.gz	MWBQDDKZMFGZMR-UHFFFAOYSA-N	1	0	267.332	1.825	50	0		CDAARO
O=C1N[C@@]2(CC[NH2+]C2)C(=O)N1Cc1ccc(Cl)cc1	ZINC000098212702	390445702	/nfs/dbraw/zinc/44/57/02/390445702.db2.gz	WOBVAXIGPXLMIT-CYBMUJFWSA-N	1	0	279.727	1.124	50	0		CDAARO
C[C@H]1CCCN(C(=O)c2ccc3nccn3c2)[C@@H]1C[NH3+]	ZINC000179223495	390945842	/nfs/dbraw/zinc/94/58/42/390945842.db2.gz	MXNUFPGUPSUPEG-WCQYABFASA-N	1	0	272.352	1.534	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)[C@@H]1SCCc2ccccc21	ZINC000126280817	391492639	/nfs/dbraw/zinc/49/26/39/391492639.db2.gz	INPAUQBVDAUMPN-SMDDNHRTSA-N	1	0	276.405	1.837	50	0		CDAARO
CCOC(=O)CC[NH2+]C[C@H]1COc2ccccc2O1	ZINC000004112094	391936699	/nfs/dbraw/zinc/93/66/99/391936699.db2.gz	HNXGXYPCJMVNQV-NSHDSACASA-N	1	0	265.309	1.369	50	0		CDAARO
OCC[NH2+]C[C@@H](O)c1ccc(Br)cc1	ZINC000071689860	391889213	/nfs/dbraw/zinc/88/92/13/391889213.db2.gz	BYMWMDIOMQFUPJ-SNVBAGLBSA-N	1	0	260.131	1.064	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](C(=O)N2CCO[C@H](c3nccs3)C2)C1	ZINC000262626359	131244257	/nfs/dbraw/zinc/24/42/57/131244257.db2.gz	BTIYFBZHFMGJIJ-MXWKQRLJSA-N	1	0	281.381	1.170	50	0		CDAARO
C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)C[C@H]([NH3+])c1ccccc1	ZINC000037821555	392694429	/nfs/dbraw/zinc/69/44/29/392694429.db2.gz	NNHAUDROYHJQIB-BNOWGMLFSA-N	1	0	289.379	1.189	50	0		CDAARO
[NH3+]CCC(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000269131885	132118182	/nfs/dbraw/zinc/11/81/82/132118182.db2.gz	VOQHVMPHQQEOTA-KBPBESRZSA-N	1	0	262.353	1.450	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)[C@H]2Cc3cc(Cl)ccc3O2)C1	ZINC000269153223	132122204	/nfs/dbraw/zinc/12/22/04/132122204.db2.gz	WNUSLJSORVGAAR-IINYFYTJSA-N	1	0	294.782	1.711	50	0		CDAARO
CCC(=O)N1CCC[N@H+](C[C@H](O)c2ccccc2)CC1	ZINC000095953101	393156089	/nfs/dbraw/zinc/15/60/89/393156089.db2.gz	XVNPEIFQPYANTG-HNNXBMFYSA-N	1	0	276.380	1.664	50	0		CDAARO
C[C@H]1C[C@H](C[NH3+])CN1C(=O)c1cccc2[nH]ncc21	ZINC000261623410	140365117	/nfs/dbraw/zinc/36/51/17/140365117.db2.gz	CELBKIFQXGOIQI-VHSXEESVSA-N	1	0	258.325	1.372	50	0		CDAARO
C[C@H]1CN(C(=O)Cc2cn3ccsc3n2)C[C@H]1[NH+](C)C	ZINC000089937168	146946446	/nfs/dbraw/zinc/94/64/46/146946446.db2.gz	VWPJXNHSOYSCFF-CMPLNLGQSA-N	1	0	292.408	1.347	50	0		CDAARO
CCOCCN(CC)C(=O)[C@@H]1CCCCC[C@H]1[NH3+]	ZINC000094753872	286078665	/nfs/dbraw/zinc/07/86/65/286078665.db2.gz	IFNCCYJLTLHBSL-CHWSQXEVSA-N	1	0	256.390	1.779	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]CCCNS(C)(=O)=O)C[C@@H]1C	ZINC000097379715	296732799	/nfs/dbraw/zinc/73/27/99/296732799.db2.gz	QTTDZFPKQLOFEQ-WOPDTQHZSA-N	1	0	262.419	1.340	50	0		CDAARO
C[NH2+]C1CCN(C(=O)c2cc(Cl)cn2C)CC1	ZINC000179144396	163755935	/nfs/dbraw/zinc/75/59/35/163755935.db2.gz	ZONZUPBNWHLRLC-UHFFFAOYSA-N	1	0	255.749	1.503	50	0		CDAARO
CC(C)(CO)[NH2+]C[C@H](O)Cn1cc(C=O)c2ccccc21	ZINC000002709123	169821492	/nfs/dbraw/zinc/82/14/92/169821492.db2.gz	BFKIQKIMSQSQNH-ZDUSSCGKSA-N	1	0	290.363	1.175	50	0		CDAARO
CC(C)(C)[C@@H](O)C[C@@H](CO)[NH2+]Cc1ccsc1	ZINC000284204359	196002317	/nfs/dbraw/zinc/00/23/17/196002317.db2.gz	ZDKFDPMVXWPBPU-RYUDHWBXSA-N	1	0	257.399	1.996	50	0		CDAARO
CCS(=O)(=O)N1CCC([NH+]2CCC(C)CC2)CC1	ZINC000004744117	170009541	/nfs/dbraw/zinc/00/95/41/170009541.db2.gz	UFAVUCIYCYRCPT-UHFFFAOYSA-N	1	0	274.430	1.532	50	0		CDAARO
COc1ccc(C(=O)NCCC[NH+](C)C)c(OC)c1	ZINC000004839463	170027249	/nfs/dbraw/zinc/02/72/49/170027249.db2.gz	OJJWEYBCMMYLBB-UHFFFAOYSA-N	1	0	266.341	1.385	50	0		CDAARO
COc1cc(C[NH2+]C2CCCC2)ccc1OCC(N)=O	ZINC000005063328	170062691	/nfs/dbraw/zinc/06/26/91/170062691.db2.gz	SKIACZKNCHFNLM-UHFFFAOYSA-N	1	0	278.352	1.592	50	0		CDAARO
CC(=O)c1cc(N)ccc1OC[C@@H](O)C[NH2+]C(C)C	ZINC000005138351	170069958	/nfs/dbraw/zinc/06/99/58/170069958.db2.gz	DBUJVRULIBQHKT-LBPRGKRZSA-N	1	0	266.341	1.209	50	0	in-vitro	CDAARO
CC[NH+](CC)CCCNc1ncnc2c1cnn2C	ZINC000009531968	170380960	/nfs/dbraw/zinc/38/09/60/170380960.db2.gz	AUKNBBWUGXURSN-UHFFFAOYSA-N	1	0	262.361	1.507	50	0		CDAARO
COc1ccc(-c2noc([C@@H]3C[C@@H](O)C[NH2+]3)n2)cc1	ZINC000015674731	170674551	/nfs/dbraw/zinc/67/45/51/170674551.db2.gz	JTHXPLUWNAFDOP-KOLCDFICSA-N	1	0	261.281	1.141	50	0	biogenic,in-vitro	CDAARO
Cc1ccc(S(=O)(=O)N2CCC[C@H]2C[NH3+])cc1C	ZINC000020182653	171046237	/nfs/dbraw/zinc/04/62/37/171046237.db2.gz	ZVSGHBMLPSXTKD-LBPRGKRZSA-N	1	0	268.382	1.415	50	0		CDAARO
[NH3+]Cc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1	ZINC000020473628	171217493	/nfs/dbraw/zinc/21/74/93/171217493.db2.gz	PHQYONDYBKPXJO-UHFFFAOYSA-N	1	0	294.351	1.763	50	0		CDAARO
C[C@H]1CN(CCOc2ccccc2C=O)C[C@H](C)O1	ZINC000020652941	171268739	/nfs/dbraw/zinc/26/87/39/171268739.db2.gz	MEFQSSDZWAILIF-STQMWFEESA-N	1	0	263.337	1.987	50	0		CDAARO
COc1ccc(C(=O)NCCCN2CC[NH+](C)CC2)cc1	ZINC000020726631	171271028	/nfs/dbraw/zinc/27/10/28/171271028.db2.gz	IVDBZAVOEVDAMS-UHFFFAOYSA-N	1	0	291.395	1.063	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc(F)cc2)C[C@@H]1CCO	ZINC000020780638	171272494	/nfs/dbraw/zinc/27/24/94/171272494.db2.gz	XWSLHIHKHPCHTJ-AWEZNQCLSA-N	1	0	252.333	1.324	50	0		CDAARO
Cc1cc(NC(=O)NCCC[NH+]2CCCCC2)no1	ZINC000021835489	171334981	/nfs/dbraw/zinc/33/49/81/171334981.db2.gz	AVVPESNTZMYXQL-UHFFFAOYSA-N	1	0	266.345	1.981	50	0		CDAARO
C[C@@H](CCc1ccccc1)[NH+]1CCN(CCO)CC1	ZINC000022045042	171350768	/nfs/dbraw/zinc/35/07/68/171350768.db2.gz	YRFPLIZPAQGWFA-HNNXBMFYSA-N	1	0	262.397	1.618	50	0		CDAARO
Cc1cc(C)c(C)c(OC[C@H](O)CN2CC[NH+](C)CC2)c1	ZINC000022467423	171388690	/nfs/dbraw/zinc/38/86/90/171388690.db2.gz	KLRGGXJUFGEYOD-MRXNPFEDSA-N	1	0	292.423	1.599	50	0		CDAARO
CC[NH+]1CCN([C@H](C)C(=O)Nc2ccc(OC)cc2)CC1	ZINC000022926836	171403432	/nfs/dbraw/zinc/40/34/32/171403432.db2.gz	SGDRJOJZILGOIN-CYBMUJFWSA-N	1	0	291.395	1.660	50	0		CDAARO
Cc1ccc(C[NH2+]C2CCN(S(C)(=O)=O)CC2)s1	ZINC000030656718	171620394	/nfs/dbraw/zinc/62/03/94/171620394.db2.gz	QCVQCAIHCPUWCI-UHFFFAOYSA-N	1	0	288.438	1.570	50	0		CDAARO
O=C(Nc1nc(C2CC2)cs1)C1CC[NH2+]CC1	ZINC000043830260	175114955	/nfs/dbraw/zinc/11/49/55/175114955.db2.gz	JLLZMVKVFXEUKP-UHFFFAOYSA-N	1	0	251.355	1.959	50	0		CDAARO
CCn1nc(C)c(C[NH2+][C@H](C)Cn2ccnc2)c1C	ZINC000071278620	176108092	/nfs/dbraw/zinc/10/80/92/176108092.db2.gz	RZOIYQAYVSFHQJ-LLVKDONJSA-N	1	0	261.373	1.895	50	0		CDAARO
Cc1nc[nH]c1C(=O)N1CC([N@H+]2CCCC[C@@H]2C)C1	ZINC000071748259	176259116	/nfs/dbraw/zinc/25/91/16/176259116.db2.gz	TUWULIGTICUAJD-JTQLQIEISA-N	1	0	262.357	1.417	50	0		CDAARO
Cc1cnc(CNC(=O)c2cccc([C@@H]3CC[NH2+]C3)c2)cn1	ZINC000072165880	176330979	/nfs/dbraw/zinc/33/09/79/176330979.db2.gz	QHLUXLJRDVEHRL-OAHLLOKOSA-N	1	0	296.374	1.792	50	0		CDAARO
Cc1c2ccc(C)cc2oc1C(=O)NC[C@@]1(O)CC[NH2+]C1	ZINC000072174000	176333672	/nfs/dbraw/zinc/33/36/72/176333672.db2.gz	RGXNKJYWUVPUBC-MRXNPFEDSA-N	1	0	288.347	1.504	50	0		CDAARO
Cc1nc([C@@H]2CCC[N@H+](Cc3cccnc3N)C2)cc(=O)[nH]1	ZINC000072409939	176398579	/nfs/dbraw/zinc/39/85/79/176398579.db2.gz	YZAQZWJFIDOEMO-GFCCVEGCSA-N	1	0	299.378	1.435	50	0		CDAARO
O[C@@H]1COCC[N@H+](Cc2ccc(-c3cc[nH]n3)s2)C1	ZINC000077379689	177260681	/nfs/dbraw/zinc/26/06/81/177260681.db2.gz	HXFUZYZAXKJWSY-JTQLQIEISA-N	1	0	279.365	1.331	50	0		CDAARO
Cc1nccn1CC[N@@H+](C)[C@@H]1CCOC2(CCOCC2)C1	ZINC000077487793	177274573	/nfs/dbraw/zinc/27/45/73/177274573.db2.gz	NXTPLLVAQSMEJI-OAHLLOKOSA-N	1	0	293.411	1.852	50	0		CDAARO
O=S(=O)(Cc1cccc(Cl)c1)NC[C@@H]1CCC[NH2+]1	ZINC000518219157	260359019	/nfs/dbraw/zinc/35/90/19/260359019.db2.gz	ZHKQYSPRZZVEHH-LBPRGKRZSA-N	1	0	288.800	1.511	50	0		CDAARO
C[C@H]1C[C@@H](C(=O)N2CC[N@@H+]3C[C@H](O)C[C@H]3C2)CC(C)(C)C1	ZINC000655296010	424314823	/nfs/dbraw/zinc/31/48/23/424314823.db2.gz	KUDLAXRKMMEGNE-LJISPDSOSA-N	1	0	294.439	1.726	50	0		CDAARO
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H]([NH2+]Cc2ccccc2)C1	ZINC000026897332	275521435	/nfs/dbraw/zinc/52/14/35/275521435.db2.gz	GVYATPKTSSTHKN-ZIAGYGMSSA-N	1	0	292.379	1.756	50	0		CDAARO
CC1(C)Cc2nc(N3CCOCC3)ncc2[C@@H]([NH3+])C1	ZINC000047218878	275873901	/nfs/dbraw/zinc/87/39/01/275873901.db2.gz	GCMJQJPFPCEJSY-NSHDSACASA-N	1	0	262.357	1.285	50	0		CDAARO
CNC(=O)[C@@H](C[NH3+])Cc1ccc(C(F)(F)F)cc1	ZINC000050303853	277240219	/nfs/dbraw/zinc/24/02/19/277240219.db2.gz	ZHZQASDVLDLEKE-SECBINFHSA-N	1	0	260.259	1.569	50	0		CDAARO
CC(C)c1cc(N2CCO[C@@H](CC[NH3+])C2)ncn1	ZINC000095372907	278018972	/nfs/dbraw/zinc/01/89/72/278018972.db2.gz	AXYNZIQLCRDKIH-NSHDSACASA-N	1	0	250.346	1.154	50	0		CDAARO
CC(C)(C)C1CCC2(CC1)[NH2+]C(CO)(CO)CO2	ZINC000020146024	278302588	/nfs/dbraw/zinc/30/25/88/278302588.db2.gz	DISPOMZMACBSJV-UHFFFAOYSA-N	1	0	257.374	1.262	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2ccc(C(N)=O)s2)[C@H]1C[NH3+]	ZINC000299739072	278477514	/nfs/dbraw/zinc/47/75/14/278477514.db2.gz	KGSYODOZTGVROB-BDAKNGLRSA-N	1	0	281.381	1.046	50	0		CDAARO
CCO[C@@H]1C[C@@H](O)C12CC[NH+](C[C@@H](O)C(F)(F)F)CC2	ZINC000248542602	280363788	/nfs/dbraw/zinc/36/37/88/280363788.db2.gz	CCENWSOZKFLRMB-GMTAPVOTSA-N	1	0	297.317	1.162	50	0		CDAARO
CC(C)c1nnc2n1CCN(C[C@@H]1CCC[NH2+]C1)[C@@H]2C	ZINC000261765016	280730028	/nfs/dbraw/zinc/73/00/28/280730028.db2.gz	MQGFMBIJCJJLIO-CHWSQXEVSA-N	1	0	277.416	1.778	50	0		CDAARO
C[C@@]1(C(=O)NCCSC(F)(F)F)CCC[NH2+]C1	ZINC000227419576	289140749	/nfs/dbraw/zinc/14/07/49/289140749.db2.gz	FJWPURBQLGJOAF-SECBINFHSA-N	1	0	270.320	1.745	50	0		CDAARO
COC[C@H](NC1CC[NH+](CC(C)C)CC1)c1ccnn1C	ZINC000067805047	293146555	/nfs/dbraw/zinc/14/65/55/293146555.db2.gz	ZSVZUUXKBRHDOA-HNNXBMFYSA-N	1	0	294.443	1.818	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CCSC2(CCCCC2)C1	ZINC000083897898	293177316	/nfs/dbraw/zinc/17/73/16/293177316.db2.gz	AEYDTRFKLCEWMM-GFCCVEGCSA-N	1	0	259.415	1.745	50	0		CDAARO
C[C@@H](C(=O)NCC1(CO)CCCC1)[NH+]1CCCC1	ZINC000534632935	328331896	/nfs/dbraw/zinc/33/18/96/328331896.db2.gz	SCIBNJLZVFLQKD-LBPRGKRZSA-N	1	0	254.374	1.140	50	0		CDAARO
O=C(C[C@@H]1CCOC1)NC1(C[NH+]2CCCCC2)CC1	ZINC000534639523	328335468	/nfs/dbraw/zinc/33/54/68/328335468.db2.gz	CWLCLNIWGXJZTJ-ZDUSSCGKSA-N	1	0	266.385	1.548	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCNC(=O)c2cnc(N)s2)C1	ZINC000534659552	328342102	/nfs/dbraw/zinc/34/21/02/328342102.db2.gz	QSAFEEKARZSSGR-VIFPVBQESA-N	1	0	268.386	1.017	50	0		CDAARO
CC(C)c1noc(C2CCN(C(=O)[C@H]3C=CC[NH2+]3)CC2)n1	ZINC000534660489	328339488	/nfs/dbraw/zinc/33/94/88/328339488.db2.gz	RINHIQOCJHATTG-GFCCVEGCSA-N	1	0	290.367	1.427	50	0		CDAARO
CC[N@H+](C)C1(CNc2nccnc2OC)CCCC1	ZINC000534660521	328339557	/nfs/dbraw/zinc/33/95/57/328339557.db2.gz	DZYAZZOXBJSLHS-UHFFFAOYSA-N	1	0	264.373	1.584	50	0		CDAARO
CC[NH+](CC)CC1(NC(=O)c2c(C)ncn2C)CC1	ZINC000534670932	328347578	/nfs/dbraw/zinc/34/75/78/328347578.db2.gz	REVOFRDKDKWGBA-UHFFFAOYSA-N	1	0	264.373	1.333	50	0		CDAARO
CCc1nc(CNc2cc[nH+]cc2C(N)=O)cs1	ZINC000189612016	323470572	/nfs/dbraw/zinc/47/05/72/323470572.db2.gz	KAUZBAUUIHFXMD-UHFFFAOYSA-N	1	0	262.338	1.812	50	0		CDAARO
C[NH+](C)Cc1ccc(CNC(=O)c2cn[nH]c2)cc1	ZINC000192751912	323520863	/nfs/dbraw/zinc/52/08/63/323520863.db2.gz	VMQGAZPQUHXQGO-UHFFFAOYSA-N	1	0	258.325	1.401	50	0		CDAARO
C[NH+](C)C(C)(C)CNC(=O)N[C@@H](CO)c1ccccc1	ZINC000303096744	328448131	/nfs/dbraw/zinc/44/81/31/328448131.db2.gz	SXBQWMGJDZRDGJ-ZDUSSCGKSA-N	1	0	279.384	1.359	50	0		CDAARO
COc1nc(NC[C@H](c2ccco2)[NH+](C)C)ncc1F	ZINC001772701427	1159437647	/nfs/dbraw/zinc/43/76/47/1159437647.db2.gz	MFXCIZFXMVFMIL-SNVBAGLBSA-N	1	0	280.303	1.932	50	0		CDAARO
OC[C@@H](O)C1CC[NH+](CCCC(F)(F)F)CC1	ZINC001772702008	1159437740	/nfs/dbraw/zinc/43/77/40/1159437740.db2.gz	BDAAQZOONSMETH-SNVBAGLBSA-N	1	0	255.280	1.394	50	0		CDAARO
CCO[C@H]1C[C@H]([N@H+](C)CCN2CCOC2=O)C1(C)C	ZINC000084800729	482507274	/nfs/dbraw/zinc/50/72/74/482507274.db2.gz	IVJLVIQVWXINQG-RYUDHWBXSA-N	1	0	270.373	1.574	50	0		CDAARO
CN1C(=O)CCC12CC[NH+](Cc1cnc(N)s1)CC2	ZINC000670448445	483003675	/nfs/dbraw/zinc/00/36/75/483003675.db2.gz	MJLKWEWXSPYYBE-UHFFFAOYSA-N	1	0	280.397	1.312	50	0		CDAARO
C[N@@H+]1CCC2(C1)CCN(C(=O)C[C@@H]1CCOC1)CC2	ZINC000670460158	483042091	/nfs/dbraw/zinc/04/20/91/483042091.db2.gz	AYYSFVSVAVCRDX-ZDUSSCGKSA-N	1	0	266.385	1.357	50	0		CDAARO
CCn1cc([C@@H]2OCC[C@H]2C[NH2+]Cc2c[nH]nc2C)cn1	ZINC000083843477	483203980	/nfs/dbraw/zinc/20/39/80/483203980.db2.gz	OSTFOBNLGHQMBE-SWLSCSKDSA-N	1	0	289.383	1.802	50	0		CDAARO
COCCNC(=O)N1CCC[C@H]([NH2+]Cc2ccccc2)C1	ZINC000083911518	483219244	/nfs/dbraw/zinc/21/92/44/483219244.db2.gz	XJOVKYKLFUHYGY-HNNXBMFYSA-N	1	0	291.395	1.597	50	0		CDAARO
Cc1cc(C)cc(OC[C@H](O)C[NH2+]C(C)(C)CO)c1	ZINC000026781274	483228419	/nfs/dbraw/zinc/22/84/19/483228419.db2.gz	DWNDLMZUIKANRP-CYBMUJFWSA-N	1	0	267.369	1.404	50	0		CDAARO
CC[C@H]1CN(S(C)(=O)=O)CC[C@@H]1[NH2+]Cc1cccn1C	ZINC000084736389	483321336	/nfs/dbraw/zinc/32/13/36/483321336.db2.gz	SRJCUJJWDMOGNA-JSGCOSHPSA-N	1	0	299.440	1.175	50	0		CDAARO
CC[C@H]1C[N@H+](CC2(O)CCCCC2)CCN1C[C@@H](C)O	ZINC000084736467	483321509	/nfs/dbraw/zinc/32/15/09/483321509.db2.gz	VAUXIGXURRWGEN-CABCVRRESA-N	1	0	284.444	1.459	50	0		CDAARO
CCOc1ccc(C[NH2+]CCN2CCOCC2)cc1OC	ZINC000019871628	521001738	/nfs/dbraw/zinc/00/17/38/521001738.db2.gz	NLWKIFCYSCFVKD-UHFFFAOYSA-N	1	0	294.395	1.516	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)[C@H]2CC[C@@H](O)CC2)C[C@@H]1c1ccccc1	ZINC000244748621	527418211	/nfs/dbraw/zinc/41/82/11/527418211.db2.gz	OLEVCGCDVPLNMY-QXSJWSMHSA-N	1	0	288.391	1.491	50	0		CDAARO
CCOc1ccc(CSCCNC(N)=[NH2+])cc1	ZINC000001788258	528466724	/nfs/dbraw/zinc/46/67/24/528466724.db2.gz	NPOCLSLWYWHXRZ-UHFFFAOYSA-N	1	0	253.371	1.802	50	0		CDAARO
CC(C)n1ccc(C(=O)N2CCCC[C@@H]2[C@H](C)[NH3+])n1	ZINC000269188270	535082949	/nfs/dbraw/zinc/08/29/49/535082949.db2.gz	NYVYOWMQKYUZQK-WCQYABFASA-N	1	0	264.373	1.806	50	0		CDAARO
C[C@@H]1C[C@H](N)C[NH2+][C@@H]1[C@@H]1CC[C@H](C(F)(F)F)NC1	ZINC000757213058	577036277	/nfs/dbraw/zinc/03/62/77/577036277.db2.gz	NNGYGHVINMQSEQ-NZFPMDFQSA-N	1	0	265.323	1.242	50	0		CDAARO
COCC1(C[NH2+]Cc2nc(C)c(C)n2C)CCC1	ZINC000952977294	616774688	/nfs/dbraw/zinc/77/46/88/616774688.db2.gz	XPSLYQPFZKXBRG-UHFFFAOYSA-N	1	0	251.374	1.943	50	0		CDAARO
Cc1nccnc1N1CC[N@@H+](CC(C)C)[C@@H](CCO)C1	ZINC001772703596	1159438056	/nfs/dbraw/zinc/43/80/56/1159438056.db2.gz	YKAYNNQEVKMNCX-AWEZNQCLSA-N	1	0	278.400	1.314	50	0		CDAARO
Cc1cnc(N2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)nc1N(C)C	ZINC001704305002	1177681633	/nfs/dbraw/zinc/68/16/33/1177681633.db2.gz	ODOLLSKUUTYUJK-MPZDIEGVSA-N	1	0	273.384	1.038	50	0		CDAARO
CC[C@@]1(O)CCC[C@@H]2C[N@H+](Cc3cncnc3)C[C@@H]21	ZINC001704337874	1177692852	/nfs/dbraw/zinc/69/28/52/1177692852.db2.gz	GLGHPMSNRUJFRC-QLFBSQMISA-N	1	0	261.369	1.850	50	0		CDAARO
C[NH2+]CC(=O)N[C@H]1COC[C@H]1Cc1ccnc2ccccc12	ZINC001704350734	1177697451	/nfs/dbraw/zinc/69/74/51/1177697451.db2.gz	DAZHLGWJTGOBKX-CJNGLKHVSA-N	1	0	299.374	1.128	50	0		CDAARO
Cc1ccc(F)c(NC(=O)CN2CC[C@H]([NH+](C)C)C2)c1	ZINC001704353412	1177699089	/nfs/dbraw/zinc/69/90/89/1177699089.db2.gz	WFOVYFGSCJPFNS-LBPRGKRZSA-N	1	0	279.359	1.709	50	0		CDAARO
C[NH+](C)CCn1ccc(-c2nc(C(C)(C)C)no2)n1	ZINC000585133414	1164216712	/nfs/dbraw/zinc/21/67/12/1164216712.db2.gz	HIUYGZQVCIGEFF-UHFFFAOYSA-N	1	0	263.345	1.792	50	0		CDAARO
C[C@@H]1CN(c2cc(Cl)nc(N)n2)[C@@H](C)C[N@@H+]1C	ZINC000095982749	719145375	/nfs/dbraw/zinc/14/53/75/719145375.db2.gz	AUBAJSJDJICIOF-SFYZADRCSA-N	1	0	255.753	1.241	50	0		CDAARO
Cc1cc2c(c(-c3ccc(C(N)=O)o3)c1)O[C@H](C[NH3+])C2	ZINC000067649985	745210374	/nfs/dbraw/zinc/21/03/74/745210374.db2.gz	ZCTCLFGQCUNSRT-JTQLQIEISA-N	1	0	272.304	1.616	50	0		CDAARO
OC[C@@H]1CCC[N@H+](CCNCc2cccc(O)c2Cl)C1	ZINC000952976156	745382201	/nfs/dbraw/zinc/38/22/01/745382201.db2.gz	USTFRNIOSIXXJU-GFCCVEGCSA-N	1	0	298.814	1.840	50	0		CDAARO
CC(C)CCn1cc(-c2nc3c([nH]2)C[NH2+]CC3)cn1	ZINC000095372886	745650519	/nfs/dbraw/zinc/65/05/19/745650519.db2.gz	CKJCBNPMDNQGDB-UHFFFAOYSA-N	1	0	259.357	1.965	50	0		CDAARO
Cn1cccc(C(=O)N2CCC[N@@H+](C3CCC3)CC2)c1=O	ZINC000828184555	745921810	/nfs/dbraw/zinc/92/18/10/745921810.db2.gz	DNAAUUHJUCFXKP-UHFFFAOYSA-N	1	0	289.379	1.086	50	0		CDAARO
C[NH+](C)Cc1ccnc(NC(=O)CC2CCOCC2)c1	ZINC000176945062	746811252	/nfs/dbraw/zinc/81/12/52/746811252.db2.gz	DANPLIIRVCYFGQ-UHFFFAOYSA-N	1	0	277.368	1.898	50	0		CDAARO
Cn1c(C[NH3+])nnc1SCC[C@H](O)c1ccccc1	ZINC000426646958	747315449	/nfs/dbraw/zinc/31/54/49/747315449.db2.gz	BZTVISRBYOFMJA-NSHDSACASA-N	1	0	278.381	1.490	50	0		CDAARO
O[C@@H]1CCN(Cc2nc(Cc3ccccc3Cl)no2)C1	ZINC000012573033	748417952	/nfs/dbraw/zinc/41/79/52/748417952.db2.gz	BBTOMNNEDRBZEZ-LLVKDONJSA-N	1	0	293.754	1.880	50	0		CDAARO
CN(C)c1ncc(CN2c3ccccc3C[C@@H]2CO)n1C	ZINC000585116747	930970290	/nfs/dbraw/zinc/97/02/90/930970290.db2.gz	HFAWAMCTJOVFGP-CYBMUJFWSA-N	1	0	286.379	1.410	50	0		CDAARO
c1nnc(C[NH2+]C[C@H]2CCCCO2)n1-c1ccccc1	ZINC000585117031	930972257	/nfs/dbraw/zinc/97/22/57/930972257.db2.gz	PKMCBALGMFYJIP-CQSZACIVSA-N	1	0	272.352	1.926	50	0		CDAARO
Cc1cc(C(=O)N2C[C@@H]3C[N@H+](C)CC[C@@H]3C2)ns1	ZINC000585130585	931019933	/nfs/dbraw/zinc/01/99/33/931019933.db2.gz	VQAJUMSPOXIFCF-MNOVXSKESA-N	1	0	265.382	1.475	50	0		CDAARO
Cc1cc(N[C@H]2COC[C@H]2Cc2ccncc2)nc(N)[nH+]1	ZINC001529117893	968985974	/nfs/dbraw/zinc/98/59/74/968985974.db2.gz	CRFZOSIZOXHECL-OLZOCXBDSA-N	1	0	285.351	1.432	50	0		CDAARO
Cc1c[nH]c(C[N@@H+](C)[C@@H]2C[C@@H]3C[C@H](O)C[C@@H]3C2)c(C)c1=O	ZINC001529126010	968988633	/nfs/dbraw/zinc/98/86/33/968988633.db2.gz	LBHDHCRUGZZNBB-NMWPEEMBSA-N	1	0	290.407	1.973	50	0		CDAARO
C[NH+](C)[C@H]1CN(c2ncc(Cl)cc2Cl)C[C@@H]1O	ZINC001506400735	975149108	/nfs/dbraw/zinc/14/91/08/975149108.db2.gz	KZVCAXGBMPIVJV-UWVGGRQHSA-N	1	0	276.167	1.500	50	0		CDAARO
Cc1nc(C[NH2+][C@@H]2CCN(c3ccccc3)C2)cc(=O)[nH]1	ZINC001506399672	975149118	/nfs/dbraw/zinc/14/91/18/975149118.db2.gz	PQSYVROOIMHFHK-CYBMUJFWSA-N	1	0	284.363	1.859	50	0		CDAARO
O=C(CC[NH2+][C@H]1CCN(c2ccccc2)C1)N1CCCC1	ZINC001506399418	975149247	/nfs/dbraw/zinc/14/92/47/975149247.db2.gz	NLOUOQHGAXDLJO-HNNXBMFYSA-N	1	0	287.407	1.867	50	0		CDAARO
CC[C@H]1CN(CCc2nccn2C)CC[N@@H+]1C(C)C	ZINC001506403741	975150438	/nfs/dbraw/zinc/15/04/38/975150438.db2.gz	VLZTZPGOORSXOQ-AWEZNQCLSA-N	1	0	264.417	1.767	50	0		CDAARO
O[C@@H]1C[N@H+](CCCCOc2ccccc2)C[C@H]1F	ZINC001506419823	975157473	/nfs/dbraw/zinc/15/74/73/975157473.db2.gz	KGLYOXIXWOVQAJ-ZIAGYGMSSA-N	1	0	253.317	1.860	50	0		CDAARO
Cc1nncn1CC[N@@H+]1CCC[C@@H](Cn2ccnc2)C1	ZINC001506420713	975158360	/nfs/dbraw/zinc/15/83/60/975158360.db2.gz	BTFBVQKXHSMSDI-CQSZACIVSA-N	1	0	274.372	1.195	50	0		CDAARO
[NH3+]CCOCCOCCOCCOCc1ccccc1	ZINC000082046435	177918210	/nfs/dbraw/zinc/91/82/10/177918210.db2.gz	IYODTXXMZZZHEJ-UHFFFAOYSA-N	1	0	283.368	1.212	50	0		CDAARO
C[C@H](Cn1cccn1)NC(=O)C[N@H+](C)C1CCCC1	ZINC000222861906	230398778	/nfs/dbraw/zinc/39/87/78/230398778.db2.gz	VYBPLEKNBKGRDX-GFCCVEGCSA-N	1	0	264.373	1.262	50	0		CDAARO
CCC(=O)N1CCc2cc(C(=O)N3CC[C@H]([NH3+])C3)ccc21	ZINC000095971824	185049288	/nfs/dbraw/zinc/04/92/88/185049288.db2.gz	PTLWDQLIVXBQOF-ZDUSSCGKSA-N	1	0	287.363	1.159	50	0		CDAARO
C[C@@H]1CCC[C@@H]2CCC[N@H+](CCN3CCNC3=O)[C@@H]12	ZINC000242100103	361754553	/nfs/dbraw/zinc/75/45/53/361754553.db2.gz	WEIVKEJJXIIWAS-MCIONIFRSA-N	1	0	265.401	1.912	50	0		CDAARO
CCOP(=O)(C[C@H]([NH3+])[S@](=O)CC)OCC	ZINC000242495704	361758449	/nfs/dbraw/zinc/75/84/49/361758449.db2.gz	GMZBZXWOSQIQKN-ANRSDYALSA-N	1	0	257.292	1.306	50	0		CDAARO
COc1ccccc1C[NH2+][C@H](C(N)=O)C(C)(C)C	ZINC000195573588	342628723	/nfs/dbraw/zinc/62/87/23/342628723.db2.gz	KMGZLENAIDDBJP-GFCCVEGCSA-N	1	0	250.342	1.685	50	0		CDAARO
Cc1c(C(=O)N(C)C2CC[NH2+]CC2)cnn1C(C)(C)C	ZINC000125273478	187177096	/nfs/dbraw/zinc/17/70/96/187177096.db2.gz	ZNZFRHJSUZGAKQ-UHFFFAOYSA-N	1	0	278.400	1.771	50	0		CDAARO
O=c1[nH]ccn1CCN1CC[NH+](C2CCCCC2)CC1	ZINC000244633377	361855010	/nfs/dbraw/zinc/85/50/10/361855010.db2.gz	GBXYXKFLNTUNKE-UHFFFAOYSA-N	1	0	278.400	1.127	50	0		CDAARO
C[N@H+](CCCn1cnnn1)Cc1cccc2cccnc21	ZINC000244647010	361855406	/nfs/dbraw/zinc/85/54/06/361855406.db2.gz	GTIKFTQZGGTNIL-UHFFFAOYSA-N	1	0	282.351	1.743	50	0		CDAARO
CN(C(=O)C[N@H+](C)CCCn1cccn1)c1ccccc1	ZINC000244691630	361856536	/nfs/dbraw/zinc/85/65/36/361856536.db2.gz	JGFVKALJHHXUCI-UHFFFAOYSA-N	1	0	286.379	1.868	50	0		CDAARO
[NH3+][C@H]1C[C@@H](c2cc(N[C@H](CO)Cc3ccccc3)ncn2)C1	ZINC000244787861	361863268	/nfs/dbraw/zinc/86/32/68/361863268.db2.gz	QEZWTPYGXRFNDS-ZNMIVQPWSA-N	1	0	298.390	1.697	50	0		CDAARO
COC[C@@H]1CCC[N@@H+]1Cc1cc(=O)n2cc(C)sc2n1	ZINC000244873504	361868033	/nfs/dbraw/zinc/86/80/33/361868033.db2.gz	WRJBXSVPVNWTNR-LBPRGKRZSA-N	1	0	293.392	1.675	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@@H](COC(=O)c2cncc(F)c2)C1	ZINC000097014681	185151818	/nfs/dbraw/zinc/15/18/18/185151818.db2.gz	YOKYYHFMFICBED-CQSZACIVSA-N	1	0	296.342	1.734	50	0		CDAARO
C[C@H]1C[C@@H](C(=O)Nc2cccc3nonc32)CC[NH2+]1	ZINC000585136816	342216010	/nfs/dbraw/zinc/21/60/10/342216010.db2.gz	UDUMLZCBACDBEL-IUCAKERBSA-N	1	0	260.297	1.549	50	0		CDAARO
Cc1occc1C[NH2+][C@H]1COC[C@H]1Oc1cn[nH]c1	ZINC000685941495	539045907	/nfs/dbraw/zinc/04/59/07/539045907.db2.gz	XWLPWLQQJPNJGA-QWHCGFSZSA-N	1	0	263.297	1.247	50	0		CDAARO
C[C@H](c1ccncc1)[NH+]1CCC(c2ncc(C(N)=O)[nH]2)CC1	ZINC000685941594	539045956	/nfs/dbraw/zinc/04/59/56/539045956.db2.gz	ZNPIJICEHKWBLT-LLVKDONJSA-N	1	0	299.378	1.844	50	0		CDAARO
O=C(NC[C@@H]1C[N@@H+]2CCC[C@H]2CO1)c1cc(F)cc(F)c1	ZINC000247468231	539061312	/nfs/dbraw/zinc/06/13/12/539061312.db2.gz	DJGNYVXWWYTLQX-UONOGXRCSA-N	1	0	296.317	1.558	50	0		CDAARO
O=C(c1ccc(C[N@H+]2CCC[C@H](O)C2)cc1)N1CCCC1	ZINC000024957930	539132560	/nfs/dbraw/zinc/13/25/60/539132560.db2.gz	JIXUDWZSOJJRHH-INIZCTEOSA-N	1	0	288.391	1.879	50	0		CDAARO
O=C(c1n[nH]c2ccccc21)N1CCC[N@@H+](C2CC2)CC1	ZINC000058263966	539160900	/nfs/dbraw/zinc/16/09/00/539160900.db2.gz	OCFCGIIBANTHQS-UHFFFAOYSA-N	1	0	284.363	1.873	50	0		CDAARO
CC(C)c1nccn1CCC(=O)N1CC[NH2+]C[C@@H]1C	ZINC000125724347	187197811	/nfs/dbraw/zinc/19/78/11/187197811.db2.gz	SRVWRUMIYODNNO-LBPRGKRZSA-N	1	0	264.373	1.217	50	0		CDAARO
O=C1C[C@H](C[N@H+]2CCC[C@@H](C(F)(F)F)C2)CN1	ZINC000585094223	362021890	/nfs/dbraw/zinc/02/18/90/362021890.db2.gz	RYKWCKUWFKNANI-DTWKUNHWSA-N	1	0	250.264	1.397	50	0		CDAARO
CC[NH+](CC)CCNC(=O)c1nc(C2CC2)no1	ZINC000585119113	362038177	/nfs/dbraw/zinc/03/81/77/362038177.db2.gz	RLFRFBRNTQTGSF-UHFFFAOYSA-N	1	0	252.318	1.019	50	0		CDAARO
CC[C@H]1COCCN1C(=O)NCc1nccn1CC(C)C	ZINC000084736532	362270064	/nfs/dbraw/zinc/27/00/64/362270064.db2.gz	HFYDRLXTJMHVQW-ZDUSSCGKSA-N	1	0	294.399	1.860	50	0		CDAARO
C[NH+](C)CCNC(=O)NCCc1ccc(F)c(F)c1	ZINC000190324041	362364606	/nfs/dbraw/zinc/36/46/06/362364606.db2.gz	YZCAMINLNLSWPX-UHFFFAOYSA-N	1	0	271.311	1.368	50	0		CDAARO
COc1c(CN[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c(C)nn1C	ZINC000226327225	362527533	/nfs/dbraw/zinc/52/75/33/362527533.db2.gz	AICHSUINHAWPNB-KGLIPLIRSA-N	1	0	278.400	1.454	50	0		CDAARO
COC(=O)[C@H](O)C1CC[NH+](C/C=C/c2ccccc2)CC1	ZINC000095432423	362545557	/nfs/dbraw/zinc/54/55/57/362545557.db2.gz	BLQPTSGEBIMHAQ-CDVVCGDMSA-N	1	0	289.375	1.946	50	0		CDAARO
C[C@@H](O)[C@H]1CCN(C(=O)NCCC[N@@H+]2CCC[C@@H](C)C2)C1	ZINC000097107840	185534442	/nfs/dbraw/zinc/53/44/42/185534442.db2.gz	WGFUVSUSWANNRR-KFWWJZLASA-N	1	0	297.443	1.521	50	0		CDAARO
CC(C)c1cc(N2CCC[C@H]([NH3+])C2)n2nccc2n1	ZINC000072463859	136481950	/nfs/dbraw/zinc/48/19/50/136481950.db2.gz	RLXJFWLTOYMZIU-NSHDSACASA-N	1	0	259.357	1.780	50	0		CDAARO
COCc1cc(C(=O)NCC[NH2+]C2CCCCCC2)no1	ZINC000127486194	187309554	/nfs/dbraw/zinc/30/95/54/187309554.db2.gz	WBWREQPPDRKTFR-UHFFFAOYSA-N	1	0	295.383	1.863	50	0		CDAARO
c1cnc(N2CCC([NH2+]CCC[C@@H]3CCOC3)CC2)nc1	ZINC000096165714	136519033	/nfs/dbraw/zinc/51/90/33/136519033.db2.gz	FHDHPHXMSCGTFQ-CQSZACIVSA-N	1	0	290.411	1.852	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCC[NH2+]C2)cc1Cl	ZINC000193353299	362906995	/nfs/dbraw/zinc/90/69/95/362906995.db2.gz	IXFXCBWGKMDWLV-JTQLQIEISA-N	1	0	288.800	1.679	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)c2sccc2OC)C1	ZINC000128861171	187395441	/nfs/dbraw/zinc/39/54/41/187395441.db2.gz	VCERHUAVSXBMOW-SECBINFHSA-N	1	0	254.355	1.581	50	0		CDAARO
C[C@@H](CN(C)CCO)[NH2+]Cc1ccccc1-n1ccnc1	ZINC000584886785	349345639	/nfs/dbraw/zinc/34/56/39/349345639.db2.gz	RFSGUUZYJSQSPI-AWEZNQCLSA-N	1	0	288.395	1.275	50	0		CDAARO
CN(C[C@@H]1CC[N@H+](C)C1(C)C)C(=O)c1cncnc1	ZINC000584888562	349347398	/nfs/dbraw/zinc/34/73/98/349347398.db2.gz	IMCREIQKAJTTEU-LBPRGKRZSA-N	1	0	262.357	1.279	50	0		CDAARO
O=C(NCCC[N@H+]1CCCC[C@@H]1CO)c1cncc(F)c1	ZINC000584890596	349349823	/nfs/dbraw/zinc/34/98/23/349349823.db2.gz	FFNUUEKJWFLWMQ-CQSZACIVSA-N	1	0	295.358	1.187	50	0		CDAARO
CN(CC[NH+]1CCCC1)C(=O)COC[C@H]1CCCCO1	ZINC000584893113	349352661	/nfs/dbraw/zinc/35/26/61/349352661.db2.gz	WUCOBWOZHQKJSD-CQSZACIVSA-N	1	0	284.400	1.126	50	0		CDAARO
O=C(c1cccc2cc[nH]c21)N1C[C@H](O)[C@@H]([NH+]2CCCC2)C1	ZINC000584900255	349362450	/nfs/dbraw/zinc/36/24/50/349362450.db2.gz	BEWZACRHJWYHBV-GJZGRUSLSA-N	1	0	299.374	1.449	50	0		CDAARO
CCCc1nnc(N2C[C@H](CO)[C@H](C[NH+](C)C)C2)s1	ZINC000091441018	180156495	/nfs/dbraw/zinc/15/64/95/180156495.db2.gz	ZGHRTRGFQAZCIT-GHMZBOCLSA-N	1	0	284.429	1.097	50	0		CDAARO
CC(C)[C@]1(O)CN(C(=O)CCC2CC[NH+](C)CC2)C[C@H]1C	ZINC000091381164	180144101	/nfs/dbraw/zinc/14/41/01/180144101.db2.gz	WYKXRYDWAJYICE-RHSMWYFYSA-N	1	0	296.455	1.974	50	0		CDAARO
CCC[C@H]1CN(C(=O)CCc2ccccn2)C[C@@H]1[NH3+]	ZINC000091616943	180208693	/nfs/dbraw/zinc/20/86/93/180208693.db2.gz	BCVXVKJWZYRSIX-JSGCOSHPSA-N	1	0	261.369	1.600	50	0		CDAARO
Cc1cc(CC(=O)N2CC([N@H+]3CCCC[C@@H]3C)C2)on1	ZINC000091596087	180202706	/nfs/dbraw/zinc/20/27/06/180202706.db2.gz	GTFZOYPWMSCNPT-LBPRGKRZSA-N	1	0	277.368	1.611	50	0		CDAARO
O=C1N(C2CCCC2)CCC[C@@]12CC[N@@H+](CCCO)C2	ZINC000091649688	180216067	/nfs/dbraw/zinc/21/60/67/180216067.db2.gz	POJHEXKAIMKVTR-INIZCTEOSA-N	1	0	280.412	1.626	50	0		CDAARO
COCC[C@]1(CO)CCC[N@H+](Cc2c(C)n[nH]c2C)C1	ZINC000091713478	180231251	/nfs/dbraw/zinc/23/12/51/180231251.db2.gz	MGPXUYFXPWUBJA-OAHLLOKOSA-N	1	0	281.400	1.638	50	0		CDAARO
CN1CCO[C@@H](C[NH2+]Cc2c[nH]nc2-c2ccccc2)C1	ZINC000105471828	186059719	/nfs/dbraw/zinc/05/97/19/186059719.db2.gz	WJTWNAOSNPYJCH-HNNXBMFYSA-N	1	0	286.379	1.497	50	0		CDAARO
C[C@@H]1C[N@H+](CC(=O)N2CCCCC2)C[C@@]1(O)C1CC1	ZINC000092061908	180315310	/nfs/dbraw/zinc/31/53/10/180315310.db2.gz	UOCSYCFFLMBKTJ-DOMZBBRYSA-N	1	0	266.385	1.092	50	0		CDAARO
Cc1nonc1C[N@H+]1CC[C@]2(C1)CCCN(C(C)C)C2=O	ZINC000092077496	180318582	/nfs/dbraw/zinc/31/85/82/180318582.db2.gz	LHUFXAOCEXYZER-HNNXBMFYSA-N	1	0	292.383	1.601	50	0		CDAARO
C[C@H](CCc1cccc(F)c1)[N@@H+]1CC[C@@H](C(N)=O)C1	ZINC000108466956	186218312	/nfs/dbraw/zinc/21/83/12/186218312.db2.gz	QHXUXTKZJPFEHB-DGCLKSJQSA-N	1	0	264.344	1.954	50	0		CDAARO
Cc1noc([C@H]2C[N@@H+](C[C@@]3(C)CCCS3)CCN2C)n1	ZINC000583651490	366013396	/nfs/dbraw/zinc/01/33/96/366013396.db2.gz	NQTHMCMBEXTWSL-TZMCWYRMSA-N	1	0	296.440	1.952	50	0		CDAARO
CCCC[N@@H+]1CCC[C@H](c2n[nH]cc2NC(=O)COC)C1	ZINC000096000124	351469054	/nfs/dbraw/zinc/46/90/54/351469054.db2.gz	PARCIKZHXUAADL-LBPRGKRZSA-N	1	0	294.399	1.974	50	0		CDAARO
COCc1noc(C[NH2+][C@H]2CCCCC[C@@H]2CO)n1	ZINC000126145046	351570210	/nfs/dbraw/zinc/57/02/10/351570210.db2.gz	DMWKTTWWVPWLSO-MNOVXSKESA-N	1	0	269.345	1.247	50	0		CDAARO
CCc1nnc(CN2CC[C@H]([NH+](CC)CC)C2)[nH]1	ZINC000158749116	188392004	/nfs/dbraw/zinc/39/20/04/188392004.db2.gz	AVZMRBKNMLTPSO-NSHDSACASA-N	1	0	251.378	1.283	50	0		CDAARO
COc1cc(NC(=S)N2CCN(C)CC2)cc(OC)c1	ZINC000000307233	355903845	/nfs/dbraw/zinc/90/38/45/355903845.db2.gz	SDMJDPSMIDOOBN-UHFFFAOYSA-N	1	0	295.408	1.648	50	0		CDAARO
Cc1onc(-c2ccccc2)c1C(=O)NCC[NH+](C)C	ZINC000000155132	355891790	/nfs/dbraw/zinc/89/17/90/355891790.db2.gz	WVMBRMPZDDGYEI-UHFFFAOYSA-N	1	0	273.336	1.941	50	0		CDAARO
[NH3+]CCS[C@H]1CC(=O)N(Cc2ccccc2)C1=O	ZINC000002727646	355980541	/nfs/dbraw/zinc/98/05/41/355980541.db2.gz	SSVUWARSVUMHGE-NSHDSACASA-N	1	0	264.350	1.006	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)/C=C\c2ccc(-n3ccnc3)cc2)C1	ZINC000255382824	356074537	/nfs/dbraw/zinc/07/45/37/356074537.db2.gz	LCQXXILFYKGCEZ-KKTNHOPESA-N	1	0	296.374	1.835	50	0		CDAARO
CC(=O)N1CCN(c2nc(N3CCCC3)cc(C)[nH+]2)CC1	ZINC000008803647	356162504	/nfs/dbraw/zinc/16/25/04/356162504.db2.gz	VOXALHHHMDZCHB-UHFFFAOYSA-N	1	0	289.383	1.054	50	0		CDAARO
CCc1ccc(C[N@H+]2CCC(=O)N(CCOC)CC2)cc1	ZINC000011841412	356280906	/nfs/dbraw/zinc/28/09/06/356280906.db2.gz	VTJULCIXIMINAU-UHFFFAOYSA-N	1	0	290.407	1.930	50	0		CDAARO
[NH3+]C1CCN(CC(=O)Nc2ccc(F)cc2)CC1	ZINC000019394776	356483764	/nfs/dbraw/zinc/48/37/64/356483764.db2.gz	PBKMGPZZPSETRY-UHFFFAOYSA-N	1	0	251.305	1.187	50	0		CDAARO
COc1ccc(OCCOCCN2CC[NH+](C)CC2)cc1	ZINC000019792471	356504164	/nfs/dbraw/zinc/50/41/64/356504164.db2.gz	VDMLQDHUNYSOTB-UHFFFAOYSA-N	1	0	294.395	1.338	50	0		CDAARO
C[C@H]1CN(C(=O)C(C)(C)n2cc(Cl)cn2)C[C@@H]1[NH+](C)C	ZINC000078896449	538476868	/nfs/dbraw/zinc/47/68/68/538476868.db2.gz	VNYOOFCPBOGLOF-JQWIXIFHSA-N	1	0	298.818	1.680	50	0		CDAARO
CSc1nc2c(cnn2CC[NH3+])c(NC(C)C)n1	ZINC000026421739	356691992	/nfs/dbraw/zinc/69/19/92/356691992.db2.gz	ACWYMSVTTUHFDI-UHFFFAOYSA-N	1	0	266.374	1.327	50	0		CDAARO
C[C@@H](C(=O)NC[C@H]1COc2ccccc2O1)[NH+]1CCCC1	ZINC000028286251	356719643	/nfs/dbraw/zinc/71/96/43/356719643.db2.gz	UITYIZHPSJIEGD-STQMWFEESA-N	1	0	290.363	1.427	50	0		CDAARO
Cc1cc(=O)n2ccc(C[NH+]3CCCCC3)c(O)c2n1	ZINC000019202010	356814675	/nfs/dbraw/zinc/81/46/75/356814675.db2.gz	OHZWONOBJCSPLP-UHFFFAOYSA-N	1	0	273.336	1.694	50	0		CDAARO
O=c1c2ccccc2ncn1CC[N@H+]1CCCC[C@H]1CO	ZINC000032560989	356782626	/nfs/dbraw/zinc/78/26/26/356782626.db2.gz	OZWADIQAZMHKKL-ZDUSSCGKSA-N	1	0	287.363	1.243	50	0		CDAARO
CCCC[N@@H+]1CCC[C@H](Cn2cc(CCO)nn2)C1	ZINC000048234014	357175355	/nfs/dbraw/zinc/17/53/55/357175355.db2.gz	OKEQZHQQEODURX-ZDUSSCGKSA-N	1	0	266.389	1.325	50	0		CDAARO
CCc1cc(N(C)CCO)nc(N2CCCCC2)[nH+]1	ZINC000065396162	357536930	/nfs/dbraw/zinc/53/69/30/357536930.db2.gz	VDRHQZXJBOXXBO-UHFFFAOYSA-N	1	0	264.373	1.458	50	0		CDAARO
OCc1ccc(C[N@@H+]2CCCC[C@@H]2CN2CCOCC2)o1	ZINC000065435984	357541460	/nfs/dbraw/zinc/54/14/60/357541460.db2.gz	MONIRQAYSWKTSK-CQSZACIVSA-N	1	0	294.395	1.459	50	0		CDAARO
CC[C@H](Nc1cccc(OC)c1)C(=O)NCCC[NH3+]	ZINC000065493738	357544129	/nfs/dbraw/zinc/54/41/29/357544129.db2.gz	BQEWAAUSNKYUFR-ZDUSSCGKSA-N	1	0	265.357	1.351	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)NCc2ccc(-n3cccn3)cc2)C1	ZINC000072417974	357833597	/nfs/dbraw/zinc/83/35/97/357833597.db2.gz	KFNDATYTXGXVQM-UONOGXRCSA-N	1	0	284.363	1.616	50	0		CDAARO
CCn1cc(C[NH+]2CCC(OC[C@@H]3CCOC3)CC2)cn1	ZINC000097108584	357983974	/nfs/dbraw/zinc/98/39/74/357983974.db2.gz	SWEDSXNVYVMJQT-CQSZACIVSA-N	1	0	293.411	1.921	50	0		CDAARO
C[NH+](C)CCn1ccc(NC(=O)c2ccc(O)cc2F)n1	ZINC000097232794	358049430	/nfs/dbraw/zinc/04/94/30/358049430.db2.gz	JPFCCZJMXGFZIL-UHFFFAOYSA-N	1	0	292.314	1.542	50	0		CDAARO
O=S(=O)(NC1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000082164219	358150632	/nfs/dbraw/zinc/15/06/32/358150632.db2.gz	PNSNANVCEHGGFU-CQSZACIVSA-N	1	0	280.393	1.343	50	0		CDAARO
COc1ccc(C(=O)NCC(C)(C)C[NH+](C)C)c(O)c1	ZINC000019838269	358156328	/nfs/dbraw/zinc/15/63/28/358156328.db2.gz	FUMYBWQYFFWTJW-UHFFFAOYSA-N	1	0	280.368	1.718	50	0		CDAARO
CCC([NH3+])(CC)CNS(=O)(=O)N(C)C1CCCCC1	ZINC000130041878	358297411	/nfs/dbraw/zinc/29/74/11/358297411.db2.gz	SJPGBAWWWOHGRM-UHFFFAOYSA-N	1	0	291.461	1.603	50	0		CDAARO
O=C(N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)[C@@H]1CCC[NH2+]1	ZINC000195554544	358556902	/nfs/dbraw/zinc/55/69/02/358556902.db2.gz	WXXNAGDTTILZDA-CBBWQLFWSA-N	1	0	256.349	1.583	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CCC[C@H]2C[NH3+])c(F)c1	ZINC000195544558	358559790	/nfs/dbraw/zinc/55/97/90/358559790.db2.gz	CPTNCKMMCALMKZ-CMPLNLGQSA-N	1	0	286.372	1.540	50	0		CDAARO
CO[C@]12CC[N@H+](Cc3cnn(C)c3C)[C@H]1C[C@@H](O)CC2	ZINC000426406006	358539422	/nfs/dbraw/zinc/53/94/22/358539422.db2.gz	ABDYWTZNIPGQOL-SOUVJXGZSA-N	1	0	279.384	1.233	50	0		CDAARO
CC(C)c1ccnc(NC[C@@H](O)C[NH+]2CCCC2)n1	ZINC000095361600	358685647	/nfs/dbraw/zinc/68/56/47/358685647.db2.gz	OAEOCMIBNYBONA-GFCCVEGCSA-N	1	0	264.373	1.469	50	0		CDAARO
CCCn1cnnc1CN(C)c1cc(C(C)C)[nH+]c(N)n1	ZINC000095367401	358686897	/nfs/dbraw/zinc/68/68/97/358686897.db2.gz	HZEOWOLDZRENRX-UHFFFAOYSA-N	1	0	289.387	1.820	50	0		CDAARO
CC[NH+]1CCC(CC(=O)NCCCn2cc(C)cn2)CC1	ZINC000095373998	358688505	/nfs/dbraw/zinc/68/85/05/358688505.db2.gz	PKPAYVZWGJKRGY-UHFFFAOYSA-N	1	0	292.427	1.820	50	0		CDAARO
CCc1cnc(N(C)C[C@@H]2CCC[N@H+](CCO)C2)nc1	ZINC000095387894	358691484	/nfs/dbraw/zinc/69/14/84/358691484.db2.gz	HERHICNBDHHHNK-AWEZNQCLSA-N	1	0	278.400	1.180	50	0		CDAARO
CCc1cnc(NCC2([NH+](C)C)CCOCC2)nc1	ZINC000095391912	358692310	/nfs/dbraw/zinc/69/23/10/358692310.db2.gz	LIBFZUPBGANNAK-UHFFFAOYSA-N	1	0	264.373	1.562	50	0		CDAARO
Cc1ccc(CC[N@@H+]2CCCN(C(N)=O)CC2)cc1	ZINC000095430652	358694048	/nfs/dbraw/zinc/69/40/48/358694048.db2.gz	PWHJPRTYRMVKDD-UHFFFAOYSA-N	1	0	261.369	1.624	50	0		CDAARO
O=C(NC1(c2ccc(Cl)cc2)CCC1)[C@H]1C[C@@H](O)C[NH2+]1	ZINC000097468054	358779131	/nfs/dbraw/zinc/77/91/31/358779131.db2.gz	MRWIJLZJJDDLGP-CHWSQXEVSA-N	1	0	294.782	1.558	50	0		CDAARO
Cn1c2ccccc2cc(CN2CC[C@H]3CC[C@@H](C2)[NH2+]3)c1=O	ZINC000097515200	358781606	/nfs/dbraw/zinc/78/16/06/358781606.db2.gz	PFSSBHAYTDWCMN-CVEARBPZSA-N	1	0	297.402	1.865	50	0		CDAARO
COc1ccc(C(=O)NCCc2c[nH]cn2)cc1OC	ZINC000013592705	366484192	/nfs/dbraw/zinc/48/41/92/366484192.db2.gz	JUCSKEQEOBBZSX-UHFFFAOYSA-N	1	0	275.308	1.399	50	0		CDAARO
CSc1ccccc1C[N@@H+]1CCC[C@](O)(CO)C1	ZINC000215497641	358892359	/nfs/dbraw/zinc/89/23/59/358892359.db2.gz	GELYLWPBBWRDAL-CQSZACIVSA-N	1	0	267.394	1.728	50	0		CDAARO
COc1ccc(F)c(F)c1C(=O)N1CC[N@@H+]2CCC[C@@H]2C1	ZINC000215722635	358900419	/nfs/dbraw/zinc/90/04/19/358900419.db2.gz	JIZCPBMYZDQZCM-SNVBAGLBSA-N	1	0	296.317	1.894	50	0		CDAARO
COC[C@@H]1CCCC[N@@H+]1Cc1c(C)nn(CCO)c1C	ZINC000216057630	358921166	/nfs/dbraw/zinc/92/11/66/358921166.db2.gz	HPCJCDVLMODZRF-AWEZNQCLSA-N	1	0	281.400	1.493	50	0		CDAARO
Cn1ccnc1CCC[N@H+](C)CC(C)(C)N1CCOCC1	ZINC000216148310	358928537	/nfs/dbraw/zinc/92/85/37/358928537.db2.gz	ZYDVKDIEVDODOV-UHFFFAOYSA-N	1	0	294.443	1.395	50	0		CDAARO
CC(C)c1nc(CNc2cc(C3CC([NH3+])C3)ncn2)no1	ZINC000223571608	359435021	/nfs/dbraw/zinc/43/50/21/359435021.db2.gz	ZHVMXEQLCHQBFC-UHFFFAOYSA-N	1	0	288.355	1.800	50	0		CDAARO
COC[C@@H]1C[N@H+](Cc2cccn2C)C[C@H]1c1nc(C)no1	ZINC000257195505	359613542	/nfs/dbraw/zinc/61/35/42/359613542.db2.gz	WGBOBQOUXTXUDF-GXTWGEPZSA-N	1	0	290.367	1.579	50	0		CDAARO
O=C([C@@H]1CCCC[N@@H+]1C[C@H]1CCCCO1)N1CCOCC1	ZINC000245404684	296010620	/nfs/dbraw/zinc/01/06/20/296010620.db2.gz	QDNQTCYQJLORKQ-CABCVRRESA-N	1	0	296.411	1.269	50	0		CDAARO
CN1C(=O)N(C)[C@]2(CC[N@H+](Cc3ccccc3F)C2)C1=O	ZINC000409420328	360224306	/nfs/dbraw/zinc/22/43/06/360224306.db2.gz	KDBCSKXFZDUVKX-HNNXBMFYSA-N	1	0	291.326	1.294	50	0		CDAARO
CC[N@H+](C1CN(C(=O)c2ccoc2)C1)C1CCN(C)CC1	ZINC000409419961	360226809	/nfs/dbraw/zinc/22/68/09/360226809.db2.gz	DKWAGRZRNJEZTN-UHFFFAOYSA-N	1	0	291.395	1.520	50	0		CDAARO
CCS(=O)(=O)N1CC[C@H](Cn2c(C)c[nH+]c2C)C1	ZINC000409420073	360229247	/nfs/dbraw/zinc/22/92/47/360229247.db2.gz	RRQWTNQGPBEOKD-LBPRGKRZSA-N	1	0	271.386	1.172	50	0		CDAARO
C[N@@H+](Cc1nc(-c2cccnc2)no1)C[C@H]1CCOC1	ZINC000178345467	189109251	/nfs/dbraw/zinc/10/92/51/189109251.db2.gz	GQXOGMWYVXLSBW-LLVKDONJSA-N	1	0	274.324	1.600	50	0		CDAARO
Cc1cc(C)c(CN2CCC[NH2+]CC2)cc1Cn1cncn1	ZINC000426545215	360682397	/nfs/dbraw/zinc/68/23/97/360682397.db2.gz	VATOMLGKVUFXHV-UHFFFAOYSA-N	1	0	299.422	1.739	50	0		CDAARO
Cn1c(CC[NH3+])nnc1SCC[C@@H](O)c1ccccc1	ZINC000426597292	360687429	/nfs/dbraw/zinc/68/74/29/360687429.db2.gz	VQTAGTOPUFLLHS-GFCCVEGCSA-N	1	0	292.408	1.532	50	0		CDAARO
COc1ccc(CCC(=O)N2CC[C@H](C[NH3+])C2)cc1F	ZINC000178526339	189123776	/nfs/dbraw/zinc/12/37/76/189123776.db2.gz	ONDHPENOJOXNOV-GFCCVEGCSA-N	1	0	280.343	1.574	50	0		CDAARO
[NH3+][C@@H]1[C@@H]2CC[C@H]1CN(Cc1cnccc1Cl)C2	ZINC000426423055	360667907	/nfs/dbraw/zinc/66/79/07/360667907.db2.gz	PNOFWCUMKJSERP-DDFAGTSDSA-N	1	0	251.761	1.904	50	0		CDAARO
COc1ccc2c(CC(=O)N3CC[C@H](C[NH3+])C3)coc2c1	ZINC000178556288	189126518	/nfs/dbraw/zinc/12/65/18/189126518.db2.gz	GDMHYSYXAQOADY-LLVKDONJSA-N	1	0	288.347	1.791	50	0		CDAARO
COc1cccc(OC)c1CC(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178564801	189127338	/nfs/dbraw/zinc/12/73/38/189127338.db2.gz	LCQQKOKRVNBGBU-NSHDSACASA-N	1	0	278.352	1.054	50	0		CDAARO
COc1ccc(CCC(=O)N2CC[C@H](C[NH3+])C2)cc1OC	ZINC000178584213	189128538	/nfs/dbraw/zinc/12/85/38/189128538.db2.gz	ZBGWCCPDFOBXMG-CYBMUJFWSA-N	1	0	292.379	1.444	50	0		CDAARO
C[C@H](C(=O)N1CCC(c2ncon2)CC1)[NH+]1CCCCC1	ZINC000426734591	360700965	/nfs/dbraw/zinc/70/09/65/360700965.db2.gz	YVJRPYUVFHTOBQ-GFCCVEGCSA-N	1	0	292.383	1.650	50	0		CDAARO
O=C1C[C@H](C[NH+]2CC(n3cccn3)C2)CN1c1ccccc1	ZINC000299790796	200875028	/nfs/dbraw/zinc/87/50/28/200875028.db2.gz	BXJIYNAOYAEDDM-CQSZACIVSA-N	1	0	296.374	1.793	50	0		CDAARO
CN(C)C(=O)[C@@H]1CCCN1C(=O)C[C@H]([NH3+])c1ccccc1	ZINC000036136325	361076199	/nfs/dbraw/zinc/07/61/99/361076199.db2.gz	GBUTWXZOOVFZJS-KBPBESRZSA-N	1	0	289.379	1.156	50	0		CDAARO
Cc1ccc(C[NH2+][C@H]2CCC(=O)NC23CCC3)c(C)n1	ZINC000367257505	361255866	/nfs/dbraw/zinc/25/58/66/361255866.db2.gz	JCIXTIIOBDGZNT-AWEZNQCLSA-N	1	0	273.380	1.989	50	0		CDAARO
CCn1nccc1C[NH2+][C@H]1CCCN(c2ncccn2)C1	ZINC000125214776	361262604	/nfs/dbraw/zinc/26/26/04/361262604.db2.gz	RXGJSFVHGZYJPB-ZDUSSCGKSA-N	1	0	286.383	1.452	50	0		CDAARO
C[C@H](Oc1ccccc1)C(=O)NCC1(C)CC[NH2+]CC1	ZINC000181281441	189292758	/nfs/dbraw/zinc/29/27/58/189292758.db2.gz	VLDDIUHDQOJHCQ-ZDUSSCGKSA-N	1	0	276.380	1.960	50	0		CDAARO
C[C@@H]([NH2+]CC(C)(C)C(N)=O)c1ccc2c(c1)OCO2	ZINC000183640708	189364578	/nfs/dbraw/zinc/36/45/78/189364578.db2.gz	MCGFTHIDUYTZGN-SECBINFHSA-N	1	0	264.325	1.577	50	0		CDAARO
C[C@H]([NH3+])C(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000019687646	364079969	/nfs/dbraw/zinc/07/99/69/364079969.db2.gz	JDQKEYGBCBRXML-NSHDSACASA-N	1	0	281.787	1.331	50	0		CDAARO
Cc1cnn(C)c1CN1CCC([NH+]2CCCC2)CC1	ZINC000215297560	189693099	/nfs/dbraw/zinc/69/30/99/189693099.db2.gz	DWQICIGRZCEVLC-UHFFFAOYSA-N	1	0	262.401	1.789	50	0		CDAARO
C[C@@H]1CN(C(=O)c2cc(C(F)F)n[nH]2)[C@H](C)CN1C	ZINC000630076990	367312372	/nfs/dbraw/zinc/31/23/72/367312372.db2.gz	MENKYRKQXDRTIL-HTQZYQBOSA-N	1	0	272.299	1.512	50	0		CDAARO
CCOCC[N@@H+]1CCN(Cc2noc(C3CC3)n2)C[C@H]1C	ZINC000252321743	367388924	/nfs/dbraw/zinc/38/89/24/367388924.db2.gz	YZTULRIRVHYEKY-GFCCVEGCSA-N	1	0	294.399	1.490	50	0		CDAARO
C[NH+](C)CC(C)(C)NS(=O)(=O)c1ccc(F)c(F)c1	ZINC000416509199	242028761	/nfs/dbraw/zinc/02/87/61/242028761.db2.gz	QOKQODQADIXTDL-UHFFFAOYSA-N	1	0	292.351	1.583	50	0		CDAARO
CNC(=O)[C@H](CC(C)C)[NH2+][C@@H]1CN(C(C)C)C[C@H]1C	ZINC000252511209	367675338	/nfs/dbraw/zinc/67/53/38/367675338.db2.gz	DZSZXGKBDDXOQF-HZSPNIEDSA-N	1	0	269.433	1.465	50	0		CDAARO
C[C@@H]1CCC[C@H](NC(=O)NC(=O)C[NH+]2CCCC2)[C@@H]1C	ZINC000007813452	369787426	/nfs/dbraw/zinc/78/74/26/369787426.db2.gz	PGPHIJIVTGBTSX-UPJWGTAASA-N	1	0	281.400	1.733	50	0		CDAARO
Cc1cc(=O)[nH]c(CNC(=O)CCC2CC[NH+](C)CC2)n1	ZINC000299788574	372764125	/nfs/dbraw/zinc/76/41/25/372764125.db2.gz	UQPGLCJUEYKVLQ-UHFFFAOYSA-N	1	0	292.383	1.229	50	0		CDAARO
Cc1ccn(CCNc2cc([C@H]3C[C@@H]([NH3+])C3)nc(C)n2)n1	ZINC000244874444	189914158	/nfs/dbraw/zinc/91/41/58/189914158.db2.gz	XBJDSOHBZVURQD-BETUJISGSA-N	1	0	286.383	1.607	50	0		CDAARO
Cn1nccc1C[NH2+]C[C@H]1Cc2ccccc2N(C)C1	ZINC000253433375	373748826	/nfs/dbraw/zinc/74/88/26/373748826.db2.gz	WFDOBDMUFSUYRW-CYBMUJFWSA-N	1	0	270.380	1.818	50	0		CDAARO
Cc1cccc(NC(=O)NCC2CC[NH+](CCO)CC2)n1	ZINC000097142816	541891150	/nfs/dbraw/zinc/89/11/50/541891150.db2.gz	WHDQFBSHFIJWKE-UHFFFAOYSA-N	1	0	292.383	1.216	50	0		CDAARO
CN1CCC([NH2+]C[C@H](O)c2c(F)cccc2F)CC1	ZINC000037887406	374826616	/nfs/dbraw/zinc/82/66/16/374826616.db2.gz	MCGQRHQXJLVOIP-ZDUSSCGKSA-N	1	0	270.323	1.682	50	0		CDAARO
CC(C)[C@@H](CO)[NH2+]CC(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C	ZINC000108466083	412829454	/nfs/dbraw/zinc/82/94/54/412829454.db2.gz	NVUJHFTZFMPWQP-XJFOESAGSA-N	1	0	270.417	1.534	50	0		CDAARO
C[N@H+](CCCO)C1CCN(C(=O)C2CC=CC2)CC1	ZINC000095443689	374944244	/nfs/dbraw/zinc/94/42/44/374944244.db2.gz	RALSYOHHHYICSN-UHFFFAOYSA-N	1	0	266.385	1.258	50	0		CDAARO
CCCCN(C(=O)C[NH2+][C@H](C(N)=O)[C@@H](C)CC)[C@@H](C)CC	ZINC000095463760	374960239	/nfs/dbraw/zinc/96/02/39/374960239.db2.gz	SLDJXPORQCVWFB-YDHLFZDLSA-N	1	0	299.459	1.903	50	0		CDAARO
CC[NH+](CC)CCCNC(=O)c1nnc(C)s1	ZINC000095467293	374961404	/nfs/dbraw/zinc/96/14/04/374961404.db2.gz	PZAZBNDTXFOENZ-UHFFFAOYSA-N	1	0	256.375	1.308	50	0		CDAARO
NC(=O)[C@H]1C[C@@H](O)C[N@@H+]1CCCc1cccc2ccccc21	ZINC000095399125	374904886	/nfs/dbraw/zinc/90/48/86/374904886.db2.gz	GCVWIEJGEDUPJV-NVXWUHKLSA-N	1	0	298.386	1.693	50	0		CDAARO
CCOCC[N@@H+]1CCC[C@@H](CNS(=O)(=O)C(C)C)C1	ZINC000095400870	374905995	/nfs/dbraw/zinc/90/59/95/374905995.db2.gz	SSSQCLZCOLJMQH-ZDUSSCGKSA-N	1	0	292.445	1.063	50	0		CDAARO
Cn1cc(C[NH+]2CCC(OC[C@@H]3CCCO3)CC2)cn1	ZINC000095409294	374910597	/nfs/dbraw/zinc/91/05/97/374910597.db2.gz	LWCNLJMBKDYXHU-HNNXBMFYSA-N	1	0	279.384	1.580	50	0		CDAARO
CC[NH+](CC)CCSc1ncnc2c1cnn2C	ZINC000097058008	375143280	/nfs/dbraw/zinc/14/32/80/375143280.db2.gz	VOWFRZDDTUYYKA-UHFFFAOYSA-N	1	0	265.386	1.797	50	0		CDAARO
Cc1cc(=O)oc2cc(OC[C@@H](O)C[NH2+]C3CC3)ccc12	ZINC000003241715	375599614	/nfs/dbraw/zinc/59/96/14/375599614.db2.gz	XENZZKHMDFKELA-LBPRGKRZSA-N	1	0	289.331	1.593	50	0		CDAARO
COc1cccc([C@H]2C[NH2+]C[C@H]2C(=O)NC(C)C)c1	ZINC000035847947	542014593	/nfs/dbraw/zinc/01/45/93/542014593.db2.gz	CYLJKHHBRBRCRL-ZIAGYGMSSA-N	1	0	262.353	1.523	50	0		CDAARO
CC1CC[NH+](CC(=O)NCC[C@@H]2CCOC2)CC1	ZINC000345720040	375824507	/nfs/dbraw/zinc/82/45/07/375824507.db2.gz	LYGSLURCWJPNEG-CYBMUJFWSA-N	1	0	254.374	1.261	50	0		CDAARO
O=C(NCCc1[nH+]cc2ccccn21)c1ccco1	ZINC000031773075	375828067	/nfs/dbraw/zinc/82/80/67/375828067.db2.gz	PAURPIHDBNAPEP-UHFFFAOYSA-N	1	0	255.277	1.900	50	0		CDAARO
O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)C1CCC1	ZINC000032247962	375922221	/nfs/dbraw/zinc/92/22/21/375922221.db2.gz	GATVOHRMOMNXEC-MRXNPFEDSA-N	1	0	288.391	1.804	50	0		CDAARO
CC[C@@H]1CN(C[C@@H](O)c2ccccc2)CC[N@@H+]1C[C@H](C)O	ZINC000240333513	376017190	/nfs/dbraw/zinc/01/71/90/376017190.db2.gz	FDVMHAJBRCOAMI-USXIJHARSA-N	1	0	292.423	1.497	50	0		CDAARO
CCCS(=O)(=O)CCN(C)[C@@H]1CC[N@H+](CC)C[C@H]1C	ZINC000246477372	376874846	/nfs/dbraw/zinc/87/48/46/376874846.db2.gz	GHMCJYAQJCAXNM-ZIAGYGMSSA-N	1	0	290.473	1.473	50	0		CDAARO
CCS[C@H]1CCCC[C@H]1[NH2+]CCN1C(=O)CCC1=O	ZINC000190022009	377521750	/nfs/dbraw/zinc/52/17/50/377521750.db2.gz	QJOHJAORROEHAC-NEPJUHHUSA-N	1	0	284.425	1.789	50	0		CDAARO
CCc1nnc(NC(=O)N2C[C@H]3CCC[N@@H+]3C[C@@H]2C)s1	ZINC000089296350	377814623	/nfs/dbraw/zinc/81/46/23/377814623.db2.gz	VLOMGYUAMHSGNV-VHSXEESVSA-N	1	0	295.412	1.801	50	0		CDAARO
C[NH+](C)CCn1cnc2oc(-c3ccncc3)nc2c1=O	ZINC000001414929	378146276	/nfs/dbraw/zinc/14/62/76/378146276.db2.gz	QCFVMTGZOIPISJ-UHFFFAOYSA-N	1	0	285.307	1.008	50	0		CDAARO
CC(C)CCO[C@@H]1CC[N@@H+]([C@@H](C)C(=O)N(C)C)C1	ZINC000083689197	483187733	/nfs/dbraw/zinc/18/77/33/483187733.db2.gz	UTRSMERQSHLDPN-QWHCGFSZSA-N	1	0	256.390	1.600	50	0		CDAARO
Cc1ccc(F)c(C(=O)N[C@@H]2CC[NH2+]C[C@@H]2C)c1	ZINC000094345079	184785933	/nfs/dbraw/zinc/78/59/33/184785933.db2.gz	OMDOBBGSSMZZIT-GXFFZTMASA-N	1	0	250.317	1.862	50	0		CDAARO
Cc1cccc(N2C(=O)C[C@H]([NH+]3CCCC3)C2=O)c1	ZINC000003157307	390146699	/nfs/dbraw/zinc/14/66/99/390146699.db2.gz	WJRLKLPCDNJTMY-ZDUSSCGKSA-N	1	0	258.321	1.723	50	0		CDAARO
CC1=C[C@H](C)[C@H]2C(=O)N(c3ccc[n+](C)c3)C(=O)[C@@H]2C1	ZINC000004184556	390150927	/nfs/dbraw/zinc/15/09/27/390150927.db2.gz	UYHYCNHHAGZKQZ-IACUBPJLSA-N	1	0	271.340	1.603	50	0		CDAARO
CCCn1cnnc1CNC(=O)C1CC[NH+](C(C)C)CC1	ZINC000095368529	184955742	/nfs/dbraw/zinc/95/57/42/184955742.db2.gz	VNBWBOSLZYWISY-UHFFFAOYSA-N	1	0	293.415	1.425	50	0		CDAARO
C[C@H](C(=O)NCCNc1ccccn1)[NH+]1CCCCCC1	ZINC000096435987	390519040	/nfs/dbraw/zinc/51/90/40/390519040.db2.gz	YCOLHNGTWLTKAI-CQSZACIVSA-N	1	0	290.411	1.874	50	0		CDAARO
Cc1ccccc1[C@@H]1C[C@H]1C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188443290	390958183	/nfs/dbraw/zinc/95/81/83/390958183.db2.gz	GAPDQLJWCSOKMW-VHDGCEQUSA-N	1	0	258.365	1.919	50	0		CDAARO
C[C@@H](C(=O)NC[C@H](O)C1CCOCC1)[NH+]1CCCCCC1	ZINC000096436966	533275428	/nfs/dbraw/zinc/27/54/28/533275428.db2.gz	ZQNLNZHNAYVBTF-ZFWWWQNUSA-N	1	0	298.427	1.155	50	0		CDAARO
C[NH2+]CC(=O)NCc1cccc(-c2ccccn2)c1	ZINC000193136333	391458864	/nfs/dbraw/zinc/45/88/64/391458864.db2.gz	XTEWGZGKOGVLGR-UHFFFAOYSA-N	1	0	255.321	1.584	50	0		CDAARO
O=C(N[C@H]1CCC[NH2+]C1)c1ccccc1Br	ZINC000070949927	391858341	/nfs/dbraw/zinc/85/83/41/391858341.db2.gz	CYCXIVMAOXYDPU-VIFPVBQESA-N	1	0	283.169	1.931	50	0		CDAARO
C[NH2+]C[C@H](C)C(=O)NC[C@@H](O)c1ccccc1C	ZINC000262674923	131250047	/nfs/dbraw/zinc/25/00/47/131250047.db2.gz	TWGKNRHVDBBDJD-WCQYABFASA-N	1	0	250.342	1.000	50	0		CDAARO
C[C@@H](CCN1CCOCC1)[NH2+]Cc1cccc2c[nH]nc21	ZINC000089895464	392517393	/nfs/dbraw/zinc/51/73/93/392517393.db2.gz	CNRKHLHTBBDUPR-ZDUSSCGKSA-N	1	0	288.395	1.763	50	0		CDAARO
CSCC[C@@H](C)[N@H+](C)C[C@H]1CCCS(=O)(=O)C1	ZINC000253416412	392718467	/nfs/dbraw/zinc/71/84/67/392718467.db2.gz	VAOQNVHZUJWKBJ-VXGBXAGGSA-N	1	0	279.471	1.885	50	0		CDAARO
Cc1cnc(N2CCO[C@H](CC[NH+](C)C)C2)nc1N(C)C	ZINC000012762642	134685024	/nfs/dbraw/zinc/68/50/24/134685024.db2.gz	YRTUMDWUQYTBHY-CYBMUJFWSA-N	1	0	293.415	1.008	50	0		CDAARO
[NH3+]C1(c2noc(-c3cnc4ccccn4c3=O)n2)CCC1	ZINC000261811948	140393277	/nfs/dbraw/zinc/39/32/77/140393277.db2.gz	PWSWJCSNHQZTGP-UHFFFAOYSA-N	1	0	283.291	1.082	50	0		CDAARO
CCC[C@]1(C)NC(=O)N(CC[C@@H]2CCCC[N@@H+]2C)C1=O	ZINC000084740528	483322181	/nfs/dbraw/zinc/32/21/81/483322181.db2.gz	OPOXHXKECXOTKQ-WFASDCNBSA-N	1	0	281.400	1.971	50	0		CDAARO
C[C@@H]1COCCN1C(=O)N[C@@H]1CC[N@@H+](C2CCCC2)C1	ZINC000098012578	398004206	/nfs/dbraw/zinc/00/42/06/398004206.db2.gz	GYLVUZDOUYTMPK-CHWSQXEVSA-N	1	0	281.400	1.434	50	0		CDAARO
CCO[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CCC[NH2+]2)C1(C)C	ZINC000261804675	286243597	/nfs/dbraw/zinc/24/35/97/286243597.db2.gz	WEEHSGKQHDRZLP-IJLUTSLNSA-N	1	0	254.374	1.400	50	0		CDAARO
CS(=O)(=O)N1CC[NH+](C2CCCCCCC2)CC1	ZINC000005023459	170056988	/nfs/dbraw/zinc/05/69/88/170056988.db2.gz	SPSOHMQUQHXHJO-UHFFFAOYSA-N	1	0	274.430	1.677	50	0		CDAARO
C[NH+](C)CCNC(=O)c1csc2c1CCCC2	ZINC000005070053	170064108	/nfs/dbraw/zinc/06/41/08/170064108.db2.gz	PEHBDKFJNKQFMH-UHFFFAOYSA-N	1	0	252.383	1.918	50	0		CDAARO
Cc1cc(NC(=O)C[NH2+]CCCOC(C)C)no1	ZINC000006904015	170254480	/nfs/dbraw/zinc/25/44/80/170254480.db2.gz	NKVNRRMLXHJFTB-UHFFFAOYSA-N	1	0	255.318	1.326	50	0		CDAARO
Cc1cccc(S(=O)(=O)NCCC[NH+](C)C)c1	ZINC000007652945	170295766	/nfs/dbraw/zinc/29/57/66/170295766.db2.gz	IAWWKZYUFCZZMF-UHFFFAOYSA-N	1	0	256.371	1.225	50	0		CDAARO
CC[NH+](CC)CCCNS(=O)(=O)c1c(C)n[nH]c1C	ZINC000007985222	170312168	/nfs/dbraw/zinc/31/21/68/170312168.db2.gz	UJODPRMMXQDBJH-UHFFFAOYSA-N	1	0	288.417	1.037	50	0		CDAARO
Cc1cc(=O)n2nc(C[N@H+]3C[C@H](C)C[C@H](C)C3)sc2n1	ZINC000008307370	170330003	/nfs/dbraw/zinc/33/00/03/170330003.db2.gz	WYKAKGWKDYWRJP-AOOOYVTPSA-N	1	0	292.408	1.937	50	0		CDAARO
Cc1ccc(CS(=O)(=O)NCCC[NH+]2CCCC2)cc1	ZINC000010539156	170409142	/nfs/dbraw/zinc/40/91/42/170409142.db2.gz	XJTNARCKYYKHKD-UHFFFAOYSA-N	1	0	296.436	1.900	50	0		CDAARO
CNC(=O)C1CC[NH+](C[C@H](O)c2ccccc2)CC1	ZINC000012334597	170476468	/nfs/dbraw/zinc/47/64/68/170476468.db2.gz	MQWPZSGQZUJIOX-AWEZNQCLSA-N	1	0	262.353	1.178	50	0		CDAARO
CCc1nc(NCC[C@@H](C)[NH+]2CCN(C)CC2)no1	ZINC000534647866	411829830	/nfs/dbraw/zinc/82/98/30/411829830.db2.gz	HIODIWSBSZIALT-LLVKDONJSA-N	1	0	267.377	1.070	50	0		CDAARO
CCOC(=O)C1CC[NH+](CCc2ccccn2)CC1	ZINC000020135917	171023384	/nfs/dbraw/zinc/02/33/84/171023384.db2.gz	DZPXSORTRMGNJS-UHFFFAOYSA-N	1	0	262.353	1.899	50	0		CDAARO
Cc1ccccc1CC(=O)NCC[NH+]1CCC(O)CC1	ZINC000020453148	171208054	/nfs/dbraw/zinc/20/80/54/171208054.db2.gz	UIJXCVPYJXCCCE-UHFFFAOYSA-N	1	0	276.380	1.110	50	0		CDAARO
OCCc1cn(C2CC[NH+](Cc3cccnc3)CC2)nn1	ZINC000020668477	171269459	/nfs/dbraw/zinc/26/94/59/171269459.db2.gz	ONBNPCHTKQCYCQ-UHFFFAOYSA-N	1	0	287.367	1.045	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(C(=O)N2CC[NH2+]CC2)CC1	ZINC000021984188	171344619	/nfs/dbraw/zinc/34/46/19/171344619.db2.gz	YAFVLOOBEOCICL-UHFFFAOYSA-N	1	0	297.399	1.065	50	0		CDAARO
CCC(=O)NC[C@H](c1ccsc1)N1CC[NH+](C)CC1	ZINC000022459826	171388470	/nfs/dbraw/zinc/38/84/70/171388470.db2.gz	GTXFBXWBYUBPCX-CYBMUJFWSA-N	1	0	281.425	1.563	50	0		CDAARO
CCOc1ccccc1OC/C=C/CN1CC[NH2+]CC1	ZINC000023116700	171413213	/nfs/dbraw/zinc/41/32/13/171413213.db2.gz	BWGIXMJIEBUBKM-AATRIKPKSA-N	1	0	276.380	1.926	50	0		CDAARO
CC[NH2+]Cc1ccccc1NC(=O)c1ccnn1C	ZINC000036903163	172793122	/nfs/dbraw/zinc/79/31/22/172793122.db2.gz	LXSDFGATRQZTDE-UHFFFAOYSA-N	1	0	258.325	1.782	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)NC[C@@H]1CCC[NH2+]C1	ZINC000037376165	173164921	/nfs/dbraw/zinc/16/49/21/173164921.db2.gz	DBDIETHJCNDRKM-LLVKDONJSA-N	1	0	286.372	1.412	50	0		CDAARO
Cc1nc(CN2CC[N@@H+](CC(C)C)[C@H](CCO)C2)c[nH]1	ZINC000039532576	174169210	/nfs/dbraw/zinc/16/92/10/174169210.db2.gz	VRALWMWOZJZRCS-OAHLLOKOSA-N	1	0	280.416	1.243	50	0		CDAARO
CCNc1nc(NCCNC(=O)C(C)(C)C)cc(C)[nH+]1	ZINC000067622504	175780064	/nfs/dbraw/zinc/78/00/64/175780064.db2.gz	UPRMEGVTGOGCOM-UHFFFAOYSA-N	1	0	279.388	1.791	50	0		CDAARO
O=C1CCCN1CC[N@@H+]1CCC[C@@H](c2cc[nH]n2)C1	ZINC000072270688	176354606	/nfs/dbraw/zinc/35/46/06/176354606.db2.gz	PAFYSRJWFBKACT-GFCCVEGCSA-N	1	0	262.357	1.212	50	0		CDAARO
CC(=O)NCC1CC[NH+](Cc2ccc(N(C)C)nc2)CC1	ZINC000077299583	177250353	/nfs/dbraw/zinc/25/03/53/177250353.db2.gz	LMSFLTDGNSBPBG-UHFFFAOYSA-N	1	0	290.411	1.496	50	0		CDAARO
CCCc1ccc(C[N@@H+]2CCOC[C@H](CO)C2)o1	ZINC000077321201	177252744	/nfs/dbraw/zinc/25/27/44/177252744.db2.gz	GPEMVFDNMIYGGF-LBPRGKRZSA-N	1	0	253.342	1.673	50	0		CDAARO
COc1ccccc1/C=C/C(=O)NC1CC[NH+](C)CC1	ZINC000078472926	177344404	/nfs/dbraw/zinc/34/44/04/177344404.db2.gz	ANPKDZYYMLLCMI-BQYQJAHWSA-N	1	0	274.364	1.919	50	0		CDAARO
OCc1ccccc1OCCCC[NH+]1CCOCC1	ZINC000016488787	260099372	/nfs/dbraw/zinc/09/93/72/260099372.db2.gz	ILVOTMDYFGOTBD-UHFFFAOYSA-N	1	0	265.353	1.670	50	0		CDAARO
CCOc1ccccc1NC(=O)N(C)CC[NH2+]C	ZINC000096027379	265326621	/nfs/dbraw/zinc/32/66/21/265326621.db2.gz	XYEGXOPPIJUZIN-UHFFFAOYSA-N	1	0	251.330	1.768	50	0		CDAARO
O=C(Nc1nc2c(cccc2Cl)[nH]1)[C@@H]1CCC[NH2+]1	ZINC000261702939	275001909	/nfs/dbraw/zinc/00/19/09/275001909.db2.gz	LSCRKCHYSJTLAP-VIFPVBQESA-N	1	0	264.716	1.907	50	0		CDAARO
O=C(c1n[nH]c2c1CCCC2)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000067741541	275015923	/nfs/dbraw/zinc/01/59/23/275015923.db2.gz	IYVGVFPWXLVASR-MNOVXSKESA-N	1	0	274.368	1.255	50	0		CDAARO
CC[NH+](CC)CCN1C(=O)[C@@H]2CC=C(Cl)C[C@@H]2C1=O	ZINC000100677008	276098183	/nfs/dbraw/zinc/09/81/83/276098183.db2.gz	ZHKYUMGEZLEDND-NEPJUHHUSA-N	1	0	284.787	1.846	50	0		CDAARO
CCN1C(=O)/C(=C\C=C2/CCC[N@@H+]2C)OC1=S	ZINC000033387567	276145531	/nfs/dbraw/zinc/14/55/31/276145531.db2.gz	YADMFLGOGVPZGG-KZZDLZNXSA-N	1	0	252.339	1.643	50	0		CDAARO
CC(C)(C)OC(=O)N1CC2(C1)OCC[C@@H]2CC[NH3+]	ZINC000306136784	277179781	/nfs/dbraw/zinc/17/97/81/277179781.db2.gz	QDFYBBOCEAHFOU-JTQLQIEISA-N	1	0	256.346	1.361	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2ccncc2Cl)[C@@H]1C[NH3+]	ZINC000091457048	277694306	/nfs/dbraw/zinc/69/43/06/277694306.db2.gz	RCTRLSJUAKDYIJ-BXKDBHETSA-N	1	0	267.760	1.934	50	0		CDAARO
CSCc1ccc(C(=O)N2CC[NH2+]C[C@@H]2C)cc1	ZINC000125941576	278140553	/nfs/dbraw/zinc/14/05/53/278140553.db2.gz	WECARQCEWDGBOL-NSHDSACASA-N	1	0	264.394	1.984	50	0		CDAARO
C[C@H]1CCSCC[N@@H+]1C[C@H](O)COC(C)(C)C	ZINC000241644157	278376530	/nfs/dbraw/zinc/37/65/30/278376530.db2.gz	POSIQBPLJALLAP-RYUDHWBXSA-N	1	0	261.431	1.990	50	0		CDAARO
Cn1cc(C[N@@H+]2CCCC[C@@H]2CN2CCOCC2)cn1	ZINC000111301800	279335357	/nfs/dbraw/zinc/33/53/57/279335357.db2.gz	WXIDHDUXOOOSRF-OAHLLOKOSA-N	1	0	278.400	1.107	50	0		CDAARO
COP(=O)(OC)[C@]1(O)C[C@H](C)[N@H+](C)C[C@H]1C	ZINC000005358774	293376429	/nfs/dbraw/zinc/37/64/29/293376429.db2.gz	ANRNCSUBAGMGGV-KXUCPTDWSA-N	1	0	251.263	1.521	50	0		CDAARO
OC1(C[NH+]2CCOCC2)C2CC3CC(C2)CC1C3	ZINC000049580318	304820844	/nfs/dbraw/zinc/82/08/44/304820844.db2.gz	UGNIRDOXYBDUME-UHFFFAOYSA-N	1	0	251.370	1.506	50	0		CDAARO
O=C(CCn1cnc2ccccc21)NC[C@H]1CCC[NH2+]1	ZINC000178735469	315959537	/nfs/dbraw/zinc/95/95/37/315959537.db2.gz	BMZGPMPYOJJVAJ-GFCCVEGCSA-N	1	0	272.352	1.295	50	0		CDAARO
O=C(CCN1CC[NH2+]CC1)NC1CCCCCCC1	ZINC000534578969	328310956	/nfs/dbraw/zinc/31/09/56/328310956.db2.gz	ZIYKLRYBPNLKMQ-UHFFFAOYSA-N	1	0	267.417	1.511	50	0		CDAARO
Cc1ccccc1[C@H](CNC(=O)c1cn[nH]n1)[NH+](C)C	ZINC000534644185	328330067	/nfs/dbraw/zinc/33/00/67/328330067.db2.gz	ZSWAUNCQPKLAMW-ZDUSSCGKSA-N	1	0	273.340	1.146	50	0		CDAARO
C[C@H](CCc1c[nH]c2ccccc12)[NH2+]CCc1nc(N)n[nH]1	ZINC000534644802	328330351	/nfs/dbraw/zinc/33/03/51/328330351.db2.gz	SFOUAMUZMCGEPO-LLVKDONJSA-N	1	0	298.394	1.852	50	0		CDAARO
C[C@H](NC(=O)CN(C)C1CC[NH2+]CC1)C1=CCCCC1	ZINC000534632083	328331884	/nfs/dbraw/zinc/33/18/84/328331884.db2.gz	VWTQITNYZBEEHH-ZDUSSCGKSA-N	1	0	279.428	1.675	50	0		CDAARO
Cc1cc(C)cc(N2CCC([NH2+][C@@H]3CCNC3=O)CC2)c1	ZINC000534635226	328333536	/nfs/dbraw/zinc/33/35/36/328333536.db2.gz	MEKJLUIHKMPFOX-MRXNPFEDSA-N	1	0	287.407	1.750	50	0		CDAARO
CCCn1ccnc1CNC(=O)[C@@H](C)C[NH+]1CCCC1	ZINC000534660392	328342479	/nfs/dbraw/zinc/34/24/79/328342479.db2.gz	PGGAPSXLXCBBHC-ZDUSSCGKSA-N	1	0	278.400	1.641	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]CC1(COC)CC1	ZINC000534648392	328343224	/nfs/dbraw/zinc/34/32/24/328343224.db2.gz	LLRVMUAEWNTBNK-LBPRGKRZSA-N	1	0	251.374	1.850	50	0		CDAARO
CC1=NO[C@@](C)(C(=O)NCCCOC2CC[NH+](C)CC2)C1	ZINC000534661180	328349289	/nfs/dbraw/zinc/34/92/89/328349289.db2.gz	FFLPJVWLXAIZPL-OAHLLOKOSA-N	1	0	297.399	1.158	50	0		CDAARO
O=C(NCC1(c2ccccc2)CCOCC1)[C@H]1C=CC[NH2+]1	ZINC000534672347	328348105	/nfs/dbraw/zinc/34/81/05/328348105.db2.gz	FONLFGJMEINLJR-OAHLLOKOSA-N	1	0	286.375	1.379	50	0		CDAARO
CC(C)(C)[N@@H+]1CC[C@@H](CNC(=O)C2(C)COC2)C1	ZINC000534661895	328349720	/nfs/dbraw/zinc/34/97/20/328349720.db2.gz	IADSMCIWEAJARE-NSHDSACASA-N	1	0	254.374	1.260	50	0		CDAARO
Cc1ccc(S(=O)(=O)NCCC[NH3+])cc1C(F)(F)F	ZINC000097229259	323207644	/nfs/dbraw/zinc/20/76/44/323207644.db2.gz	QVSDBXONLKDCTG-UHFFFAOYSA-N	1	0	296.314	1.641	50	0		CDAARO
CC[C@H](C(=O)N1CCC(OC[C@H]2CCOC2)CC1)[NH+](C)C	ZINC000097372839	323208005	/nfs/dbraw/zinc/20/80/05/323208005.db2.gz	GRGOTYQUZWQTNR-DZGCQCFKSA-N	1	0	298.427	1.371	50	0		CDAARO
Cc1cc(NC(=O)N2CCC([NH+]3CC=CC3)CC2)nn1C	ZINC000102317070	323208456	/nfs/dbraw/zinc/20/84/56/323208456.db2.gz	OXRYMDWVHGMNNM-UHFFFAOYSA-N	1	0	289.383	1.597	50	0		CDAARO
Cc1ccc(OCC(=O)N(C)[C@H]2CC[NH2+]C2)cc1C	ZINC000179065609	329203770	/nfs/dbraw/zinc/20/37/70/329203770.db2.gz	JOHZPOGLQUTMHP-ZDUSSCGKSA-N	1	0	262.353	1.503	50	0		CDAARO
OC[C@@H](O)C1CC[NH+](CCOc2ccccc2)CC1	ZINC001772708047	1159442508	/nfs/dbraw/zinc/44/25/08/1159442508.db2.gz	CIIMJOXUZRGORY-OAHLLOKOSA-N	1	0	265.353	1.131	50	0		CDAARO
CCCc1cnc(N2CC[NH+](CCSC)CC2)nc1	ZINC000670456686	483035870	/nfs/dbraw/zinc/03/58/70/483035870.db2.gz	GZIDMYCCHOOCJN-UHFFFAOYSA-N	1	0	280.441	1.914	50	0		CDAARO
COc1ncccc1C(=O)NCCNc1cc[nH+]cc1C	ZINC000670467137	483057752	/nfs/dbraw/zinc/05/77/52/483057752.db2.gz	RFGIIMCSSQUOFD-UHFFFAOYSA-N	1	0	286.335	1.057	50	0		CDAARO
Cc1ncc(C[N@@H+]2CCC[C@@H](CN3CCOCC3)C2)n1C	ZINC000668108351	483072959	/nfs/dbraw/zinc/07/29/59/483072959.db2.gz	ZEUNJKFPCGRZGG-HNNXBMFYSA-N	1	0	292.427	1.273	50	0		CDAARO
CCOc1ccc(C[NH2+]CCN2CCOCC2)cc1	ZINC000019871921	521001092	/nfs/dbraw/zinc/00/10/92/521001092.db2.gz	PBQUVZGDLIUXPU-UHFFFAOYSA-N	1	0	264.369	1.507	50	0		CDAARO
CC[C@H]1CN(C(=O)[C@@H]([NH3+])Cc2ccccc2)CCS1	ZINC000096481280	529278425	/nfs/dbraw/zinc/27/84/25/529278425.db2.gz	CKQZODARTLASAD-KBPBESRZSA-N	1	0	278.421	1.910	50	0		CDAARO
Cc1ccccc1Cc1noc(-c2cn(CC[NH3+])nn2)n1	ZINC000089696265	538384916	/nfs/dbraw/zinc/38/49/16/538384916.db2.gz	TULLUBSXUWKYTB-UHFFFAOYSA-N	1	0	284.323	1.186	50	0		CDAARO
Cc1cc(NC(=O)C[NH+]2C[C@H]3CC=CC[C@@H]3C2)on1	ZINC000076040414	538435924	/nfs/dbraw/zinc/43/59/24/538435924.db2.gz	LJSACSNAHDRRCG-VXGBXAGGSA-N	1	0	261.325	1.820	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@H]1c1ccc(NS(C)(=O)=O)cc1	ZINC000757207502	577035891	/nfs/dbraw/zinc/03/58/91/577035891.db2.gz	BJGHMSCCGWMMEG-ZWNOBZJWSA-N	1	0	268.382	1.771	50	0		CDAARO
C[C@@H]1C[C@H]([C@@H]2CC[C@H](C(F)(F)F)NC2)NC[C@H]1[NH3+]	ZINC000757210039	577036340	/nfs/dbraw/zinc/03/63/40/577036340.db2.gz	HQFSEQAUFRVGQX-ISUQUUIWSA-N	1	0	265.323	1.242	50	0		CDAARO
Cn1ccc(C(=O)NC[C@@H]2C[NH2+]Cc3ccccc32)n1	ZINC000888101043	617765299	/nfs/dbraw/zinc/76/52/99/617765299.db2.gz	RIQAHAJLWFWCRF-LBPRGKRZSA-N	1	0	270.336	1.037	50	0		CDAARO
COCc1nccc(N2CC[C@@H]([NH+](C)C)[C@@H]2C)n1	ZINC000928995734	620829929	/nfs/dbraw/zinc/82/99/29/620829929.db2.gz	IYNHGTIAPYEZJA-WDEREUQCSA-N	1	0	250.346	1.152	50	0		CDAARO
CC(=O)c1cnc(NCC[N@@H+]2CCCC[C@H]2CO)nc1C	ZINC001704335990	1177693538	/nfs/dbraw/zinc/69/35/38/1177693538.db2.gz	RXSDPZRJCWHACB-ZDUSSCGKSA-N	1	0	292.383	1.246	50	0		CDAARO
Cc1ncccc1C[N@@H+](C)[C@H]1C[C@H]2CNC(=O)C[C@H]2C1	ZINC001704341989	1177695412	/nfs/dbraw/zinc/69/54/12/1177695412.db2.gz	AXIIZCCDSKDZQZ-QLFBSQMISA-N	1	0	273.380	1.737	50	0		CDAARO
Cc1nccn1Cc1ccccc1NC(=O)[C@@H]1C=CC[NH2+]1	ZINC000952969097	750882666	/nfs/dbraw/zinc/88/26/66/750882666.db2.gz	PQUBDNRLALOWLS-HNNXBMFYSA-N	1	0	282.347	1.706	50	0		CDAARO
CCN(CC[NH+](C)C)Cc1ccc2c(c1)OCCO2	ZINC000022044952	750898047	/nfs/dbraw/zinc/89/80/47/750898047.db2.gz	SDULIGNNNKUYSV-UHFFFAOYSA-N	1	0	264.369	1.841	50	0		CDAARO
O[C@@H]1CN(C2CC[NH+](Cc3ccccc3)CC2)C[C@H]1F	ZINC000952968586	750927207	/nfs/dbraw/zinc/92/72/07/750927207.db2.gz	FFOKGGKOWRQWNC-HZPDHXFCSA-N	1	0	278.371	1.666	50	0		CDAARO
CCn1nc(CNC[C@]2(O)CCC[NH2+]C2)c2ccccc21	ZINC000072481475	752837524	/nfs/dbraw/zinc/83/75/24/752837524.db2.gz	ZIWDFHZIULCPEP-INIZCTEOSA-N	1	0	288.395	1.260	50	0		CDAARO
[NH3+][C@@H](c1ccsc1)C1(O)CCC2(CC1)OCCO2	ZINC000958528795	753105302	/nfs/dbraw/zinc/10/53/02/753105302.db2.gz	VJSAHLCVQPJVOW-NSHDSACASA-N	1	0	269.366	1.796	50	0		CDAARO
CCC[C@@H](C)C[NH+]1CCC(n2cc(CCO)nn2)CC1	ZINC000055370767	753319089	/nfs/dbraw/zinc/31/90/89/753319089.db2.gz	ZQKRCYBJAIWVEL-CYBMUJFWSA-N	1	0	280.416	1.886	50	0		CDAARO
C[N@@H+](Cc1ccnc(N)c1)C[C@@H]1COc2ccccc2O1	ZINC000193302684	753363291	/nfs/dbraw/zinc/36/32/91/753363291.db2.gz	UONCFGJZRNIRSG-CYBMUJFWSA-N	1	0	285.347	1.936	50	0		CDAARO
OC1CCN(CC[NH2+][C@@H]2COc3ccccc3C2)CC1	ZINC000023158406	897177654	/nfs/dbraw/zinc/17/76/54/897177654.db2.gz	ZRUQNSCTIWTTBQ-AWEZNQCLSA-N	1	0	276.380	1.036	50	0		CDAARO
Cc1cc(C[N@@H+]2C[C@H](O)C[C@@]2(C)CO)ccc1F	ZINC000585117367	902278951	/nfs/dbraw/zinc/27/89/51/902278951.db2.gz	ZNIYZQSGGTYLFK-OCCSQVGLSA-N	1	0	253.317	1.452	50	0		CDAARO
Cc1ccnc(C[C@@H]2CC[C@H](C[NH+]3CCSCC3)O2)n1	ZINC000952854493	910409230	/nfs/dbraw/zinc/40/92/30/910409230.db2.gz	GMDLFYWOSHXPIA-UONOGXRCSA-N	1	0	293.436	1.924	50	0		CDAARO
c1sc(-c2cnccn2)nc1C[NH2+]C[C@H]1CCOC1	ZINC000952860015	910411674	/nfs/dbraw/zinc/41/16/74/910411674.db2.gz	SEQCNAAIQFZQFU-SNVBAGLBSA-N	1	0	276.365	1.726	50	0		CDAARO
CC(C)[N@@H+]1CCN(C(=O)Nc2nncs2)C[C@H]1C	ZINC000055342437	911347300	/nfs/dbraw/zinc/34/73/00/911347300.db2.gz	YZHNKHFNXQFZKP-SECBINFHSA-N	1	0	269.374	1.485	50	0		CDAARO
CN(CCC[C@H]1CCCO1)Cc1cc2n(n1)CC[NH2+]C2	ZINC000072153832	936652838	/nfs/dbraw/zinc/65/28/38/936652838.db2.gz	PBYWPJPDINUZQU-HNNXBMFYSA-N	1	0	278.400	1.377	50	0		CDAARO
CC(C)S(=O)(=O)NC[C@H]1CC[N@@H+](C2CCCCC2)C1	ZINC000822034340	925604589	/nfs/dbraw/zinc/60/45/89/925604589.db2.gz	DNWWYFBBJBUQKB-CYBMUJFWSA-N	1	0	288.457	1.969	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCC(=O)NCCc2ncc[nH]2)C1	ZINC000823770642	925728192	/nfs/dbraw/zinc/72/81/92/925728192.db2.gz	STOUEYVCTWWCCD-LBPRGKRZSA-N	1	0	264.373	1.190	50	0		CDAARO
COCC1(CNC(=O)[C@]2(C)CC[N@H+](C)C2)CCC1	ZINC000824346699	925817813	/nfs/dbraw/zinc/81/78/13/925817813.db2.gz	BWQXQUOOWZMYJP-CYBMUJFWSA-N	1	0	254.374	1.261	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](c2nc(-c3ccccc3)n[nH]2)C1	ZINC000824412462	925820740	/nfs/dbraw/zinc/82/07/40/925820740.db2.gz	UUEMQROWMXHERW-CYBMUJFWSA-N	1	0	272.352	1.907	50	0		CDAARO
C[NH+](C)CCn1c(=O)c(CO)cc2ccc(F)cc21	ZINC000828821686	926194541	/nfs/dbraw/zinc/19/45/41/926194541.db2.gz	BGTVYWBJARJXLW-UHFFFAOYSA-N	1	0	264.300	1.195	50	0		CDAARO
C[C@@H](C[NH+](C)C)[C@H]1CCCCN1Cc1cnn(C)c1	ZINC000585117011	930970371	/nfs/dbraw/zinc/97/03/71/930970371.db2.gz	OXKWCWHYPNZXAG-DZGCQCFKSA-N	1	0	264.417	1.972	50	0		CDAARO
Cc1cc(=O)c(C(=O)N[C@@H]2C[C@@H]([NH+](C)C)C23CCC3)c[nH]1	ZINC000585127797	931011442	/nfs/dbraw/zinc/01/14/42/931011442.db2.gz	JNXCZDPKIRMKPX-ZIAGYGMSSA-N	1	0	289.379	1.286	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@@H+](C3Cc4ccccc4C3)C[C@@H]2O)[nH]n1	ZINC001529089593	968978974	/nfs/dbraw/zinc/97/89/74/968978974.db2.gz	MWAGGLLSFBYYFK-QAPCUYQASA-N	1	0	297.402	1.721	50	0		CDAARO
OCC[N@H+]1C[C@@H](Cc2ccc3ccccc3n2)[C@H](O)C1	ZINC001529103923	968980787	/nfs/dbraw/zinc/98/07/87/968980787.db2.gz	IGWGUZOGSVTMHV-CZUORRHYSA-N	1	0	272.348	1.062	50	0		CDAARO
Cc1ccc(NC(C)(C)C(=O)NC[C@@]2(O)CC[NH2+]C2)cc1	ZINC001506399403	975148976	/nfs/dbraw/zinc/14/89/76/975148976.db2.gz	NBKKTLDRVDVFQZ-MRXNPFEDSA-N	1	0	291.395	1.026	50	0		CDAARO
Cn1ccnc1CC[NH+]1CCC(O)(c2cccnc2)CC1	ZINC001506399681	975149101	/nfs/dbraw/zinc/14/91/01/975149101.db2.gz	PLWNYWZYHJVELR-UHFFFAOYSA-N	1	0	286.379	1.341	50	0		CDAARO
COc1nccnc1N(C)CC[C@H](C)[NH+]1CCCC1	ZINC001506408807	975152581	/nfs/dbraw/zinc/15/25/81/975152581.db2.gz	XHPBSKFFFQSKDN-LBPRGKRZSA-N	1	0	264.373	1.796	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)c1cc(C(N)=O)ccn1	ZINC001506414732	975155292	/nfs/dbraw/zinc/15/52/92/975155292.db2.gz	RMCKLQKQOFTLNN-UHFFFAOYSA-N	1	0	276.384	1.491	50	0		CDAARO
Cc1nc(N)nc(N2CCOC[C@@H](C[NH+](C)C)C2)c1Cl	ZINC001506415357	975155617	/nfs/dbraw/zinc/15/56/17/975155617.db2.gz	XOUDWSOMHZNUCY-JTQLQIEISA-N	1	0	299.806	1.035	50	0		CDAARO
Cc1ccnn1CC[N@@H+]1CC[C@@H](O)CC(C)(C)C1	ZINC001506429642	975161745	/nfs/dbraw/zinc/16/17/45/975161745.db2.gz	WCXNUSDZAOPYJS-CYBMUJFWSA-N	1	0	251.374	1.674	50	0		CDAARO
C[C@H](NC(=O)[C@H]1CCCOC1)C(C)(C)C[NH+](C)C	ZINC000096449597	230375549	/nfs/dbraw/zinc/37/55/49/230375549.db2.gz	LXCAXPVEVGKZDE-RYUDHWBXSA-N	1	0	256.390	1.506	50	0		CDAARO
C[C@@H]1CC(C)(C)C[C@](CO)([NH2+]CCn2cncn2)C1	ZINC000096452929	230376253	/nfs/dbraw/zinc/37/62/53/230376253.db2.gz	YRPHQYGUKHQZEE-TZMCWYRMSA-N	1	0	266.389	1.445	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](Nc2cc(C)nc(C)n2)C1	ZINC000096456185	230377369	/nfs/dbraw/zinc/37/73/69/230377369.db2.gz	YSRRIUOVNUDCFA-ZDUSSCGKSA-N	1	0	264.373	1.616	50	0		CDAARO
CCC[C@@H]1CN(C(=O)c2ccc(C)[nH]c2=O)C[C@H]1[NH+](C)C	ZINC000095502956	185000105	/nfs/dbraw/zinc/00/01/05/185000105.db2.gz	AGRSVVXMRDDHEK-TZMCWYRMSA-N	1	0	291.395	1.486	50	0		CDAARO
COCC1(CNC(=O)[C@H]2CC[C@@H]([NH3+])C2)CCCC1	ZINC000584902120	341986831	/nfs/dbraw/zinc/98/68/31/341986831.db2.gz	BGZKPFHFONEFRS-NWDGAFQWSA-N	1	0	254.374	1.437	50	0		CDAARO
CCC[C@@H]1C[N@H+](CCn2cc(Cl)cn2)C[C@H]1NC(C)=O	ZINC000095513380	185002048	/nfs/dbraw/zinc/00/20/48/185002048.db2.gz	BQKNJMKCVFPJCD-TZMCWYRMSA-N	1	0	298.818	1.773	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@@H](C(=O)NCCn2cccc2)C1	ZINC000095529159	185004853	/nfs/dbraw/zinc/00/48/53/185004853.db2.gz	IQMYKLVQWOYBPY-CQSZACIVSA-N	1	0	263.385	1.725	50	0		CDAARO
CS(=O)(=O)Nc1ccc(C(=O)C2CC[NH2+]CC2)cc1	ZINC000095620312	185016385	/nfs/dbraw/zinc/01/63/85/185016385.db2.gz	XUWMUYKCUKZIAR-UHFFFAOYSA-N	1	0	282.365	1.240	50	0		CDAARO
O=C(N[C@@H]1CC[NH2+]C1)c1cccc(-c2noc(C3CC3)n2)c1	ZINC000126922967	342004384	/nfs/dbraw/zinc/00/43/84/342004384.db2.gz	BUVBHDWWZHLWCT-CYBMUJFWSA-N	1	0	298.346	1.706	50	0		CDAARO
CNC(=O)c1ccc(C[N@H+](C)[C@@H]2CCCC[C@@H]2O)o1	ZINC000095976558	185051318	/nfs/dbraw/zinc/05/13/18/185051318.db2.gz	AVYSPKCBHCKFIZ-NEPJUHHUSA-N	1	0	266.341	1.375	50	0		CDAARO
CS(=O)(=O)C[C@H]([NH2+]C[C@@H]1CCCOC1)c1ccccc1	ZINC000095985959	185056216	/nfs/dbraw/zinc/05/62/16/185056216.db2.gz	XJSGQGLYBXNZDK-ZFWWWQNUSA-N	1	0	297.420	1.789	50	0		CDAARO
Cc1cnc(C[NH2+][C@H]2CCC[C@H](S(C)(=O)=O)C2)s1	ZINC000241121712	361750919	/nfs/dbraw/zinc/75/09/19/361750919.db2.gz	JDJDJMXLVRVYAV-QWRGUYRKSA-N	1	0	288.438	1.897	50	0		CDAARO
C[C@@H]1CCSCC[N@@H+]1C[C@H](O)COC(C)(C)C	ZINC000241644155	361753083	/nfs/dbraw/zinc/75/30/83/361753083.db2.gz	POSIQBPLJALLAP-NEPJUHHUSA-N	1	0	261.431	1.990	50	0		CDAARO
CC(=O)Nc1ccn([C@@H]2CC[N@@H+](C[C@@H](O)C(C)C)C2)n1	ZINC000241837493	361753520	/nfs/dbraw/zinc/75/35/20/361753520.db2.gz	SKOGHYBTNUHTDD-CHWSQXEVSA-N	1	0	280.372	1.105	50	0		CDAARO
COC1CC[NH+](C2CN(C(=O)Cc3ccsc3)C2)CC1	ZINC000575610969	370645920	/nfs/dbraw/zinc/64/59/20/370645920.db2.gz	QMTYCDXRRPTYCU-UHFFFAOYSA-N	1	0	294.420	1.612	50	0		CDAARO
O=C(NCc1cccc(OCC(F)F)n1)C1CC[NH2+]CC1	ZINC000195555029	342626150	/nfs/dbraw/zinc/62/61/50/342626150.db2.gz	WIZYXPHTUCXZHM-UHFFFAOYSA-N	1	0	299.321	1.341	50	0		CDAARO
COC(=O)CN1CC[NH+](CCC2CCCC2)CC1	ZINC000195571252	342628728	/nfs/dbraw/zinc/62/87/28/342628728.db2.gz	LUXIPAVKLWIFTH-UHFFFAOYSA-N	1	0	254.374	1.357	50	0		CDAARO
C[C@H](CNc1nccc(N(C)C)n1)C[NH+]1CCCC1	ZINC000195575073	342628777	/nfs/dbraw/zinc/62/87/77/342628777.db2.gz	YRCBKPYMUDLJGA-GFCCVEGCSA-N	1	0	263.389	1.686	50	0		CDAARO
CS[C@@H]1CC[C@H](NC(=O)N2CC[C@@H](C[NH+](C)C)C2)C1	ZINC000195570445	342628858	/nfs/dbraw/zinc/62/88/58/342628858.db2.gz	APPWHWAFFFLMAS-RWMBFGLXSA-N	1	0	285.457	1.864	50	0		CDAARO
CC[N@H+](CCn1ccc(C)n1)C[C@H](O)c1cccc(O)c1	ZINC000244741953	361859819	/nfs/dbraw/zinc/85/98/19/361859819.db2.gz	NZOOSHJZYTVAAM-INIZCTEOSA-N	1	0	289.379	1.953	50	0		CDAARO
C[C@@H](C[N@@H+]1C[C@@H](C)O[C@@H](C(N)=O)C1)c1ccc(F)cc1	ZINC000253370276	361925805	/nfs/dbraw/zinc/92/58/05/361925805.db2.gz	ONYSJKIEDCRUAN-MISXGVKJSA-N	1	0	280.343	1.504	50	0		CDAARO
CC[C@@H](C)[C@@H]([NH3+])C(=O)N1CCC(N2CCCCC2=O)CC1	ZINC000096499725	529397938	/nfs/dbraw/zinc/39/79/38/529397938.db2.gz	ZEABLEHPLRBBNZ-IUODEOHRSA-N	1	0	295.427	1.363	50	0		CDAARO
O=C(OCCN1CCCCC1=O)c1ccn2c[nH+]cc2c1	ZINC000097034306	185157291	/nfs/dbraw/zinc/15/72/91/185157291.db2.gz	WRBKTIYIROXCQP-UHFFFAOYSA-N	1	0	287.319	1.504	50	0		CDAARO
CCn1cc(O[C@@H]2CCC[C@@H]2[NH2+][C@@H]2CCOC2)cn1	ZINC000685941400	539045928	/nfs/dbraw/zinc/04/59/28/539045928.db2.gz	WHXWLVOMPXXZAA-KWCYVHTRSA-N	1	0	265.357	1.581	50	0		CDAARO
CCc1nc(-c2ccc(N3CC[NH2+]CC3)cc2)n(C)n1	ZINC000426599597	539080924	/nfs/dbraw/zinc/08/09/24/539080924.db2.gz	MSLVGGPCPGOTST-UHFFFAOYSA-N	1	0	271.368	1.454	50	0		CDAARO
C[C@@H](C(=O)N1CCO[C@@](C)(c2ccccc2)C1)[NH+](C)C	ZINC000584907919	539102365	/nfs/dbraw/zinc/10/23/65/539102365.db2.gz	COCWGOAPPSRHFE-XJKSGUPXSA-N	1	0	276.380	1.711	50	0		CDAARO
C[N@H+](CC(=O)NC1CC1)Cc1cccc2cnccc21	ZINC000182992223	539143541	/nfs/dbraw/zinc/14/35/41/539143541.db2.gz	PPQBGBJLDDKHMG-UHFFFAOYSA-N	1	0	269.348	1.945	50	0		CDAARO
O=C(Nc1ccncc1)N1CC[NH+](CC2CC2)CC1	ZINC000056500622	349713931	/nfs/dbraw/zinc/71/39/31/349713931.db2.gz	BIJUTLNCRMPDPF-UHFFFAOYSA-N	1	0	260.341	1.641	50	0		CDAARO
CCCC[C@H]([NH3+])C(=O)N1CC[C@H]2OCCC[C@H]2C1	ZINC000253370121	342416277	/nfs/dbraw/zinc/41/62/77/342416277.db2.gz	MJKATVHZWBRJMN-RWMBFGLXSA-N	1	0	254.374	1.531	50	0		CDAARO
OC[C@H]1CC[C@H]2CN(c3noc4ccccc43)CC[N@@H+]2C1	ZINC000034031478	343397197	/nfs/dbraw/zinc/39/71/97/343397197.db2.gz	XVDVTIJHSFDVIE-STQMWFEESA-N	1	0	287.363	1.721	50	0		CDAARO
CC(C)Oc1ccccc1CC(=O)NC[C@@H]1CCC[NH2+]1	ZINC000178731542	362248715	/nfs/dbraw/zinc/24/87/15/362248715.db2.gz	GGKPYTYGDCTYLN-AWEZNQCLSA-N	1	0	276.380	1.885	50	0		CDAARO
COC[C@H](O)C[N@H+](C)[C@@H](C)Cc1ccc(C)cc1	ZINC000127016811	187276339	/nfs/dbraw/zinc/27/63/39/187276339.db2.gz	XMNJLMSLUYLLLZ-DZGCQCFKSA-N	1	0	251.370	1.865	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cc(OC)c(OC)cc2C)C1	ZINC000179010149	362251194	/nfs/dbraw/zinc/25/11/94/362251194.db2.gz	RDOSLYGEZAXDMR-LBPRGKRZSA-N	1	0	292.379	1.694	50	0		CDAARO
C[C@H](CC[NH+](C)C)NC(=O)N1CCSC(C)(C)C1	ZINC000083715342	362253966	/nfs/dbraw/zinc/25/39/66/362253966.db2.gz	RZGGEDUQPBQQCC-LLVKDONJSA-N	1	0	273.446	1.864	50	0		CDAARO
O=C(N[C@@H]1CCCC[C@@H]1CO)[C@H]1CC12CC[NH2+]CC2	ZINC000300729573	344178439	/nfs/dbraw/zinc/17/84/39/344178439.db2.gz	KZFLCDFUBJTKOW-JHJVBQTASA-N	1	0	266.385	1.043	50	0		CDAARO
OC[C@@]1(O)CCC[N@H+](CCOc2ccccc2)CC1	ZINC000252486908	362386614	/nfs/dbraw/zinc/38/66/14/362386614.db2.gz	HQJMIRZDGAHWKT-OAHLLOKOSA-N	1	0	265.353	1.275	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1C(=O)NCCc1ccc2c(c1)OCO2	ZINC000097805499	530052574	/nfs/dbraw/zinc/05/25/74/530052574.db2.gz	DLBKZXGMKOOGDR-ZDUSSCGKSA-N	1	0	290.363	1.558	50	0		CDAARO
C[C@@H](CCc1ccc(O)cc1)NC(=O)c1ccnc(C[NH3+])c1	ZINC000317488414	344958580	/nfs/dbraw/zinc/95/85/80/344958580.db2.gz	ZZVZPJKXELGZER-LBPRGKRZSA-N	1	0	299.374	1.997	50	0		CDAARO
CO[C@]1(C[NH2+]CCc2ccncc2C)CCOC1	ZINC000397547632	345221624	/nfs/dbraw/zinc/22/16/24/345221624.db2.gz	OUHFOMXMNMLLCX-AWEZNQCLSA-N	1	0	250.342	1.328	50	0		CDAARO
C[C@H]1CC(=O)N(CC[N@H+](C)Cc2ccc(F)cc2)C1=O	ZINC000189313476	345604618	/nfs/dbraw/zinc/60/46/18/345604618.db2.gz	DEDSZEREHKYRAL-NSHDSACASA-N	1	0	278.327	1.653	50	0		CDAARO
Cc1ccc(Cl)c(O[C@@H](C)C(=O)N[C@H]2CC[NH2+]C2)c1	ZINC000127554079	187314876	/nfs/dbraw/zinc/31/48/76/187314876.db2.gz	DMKJWGPVLUJZNC-QWRGUYRKSA-N	1	0	282.771	1.894	50	0		CDAARO
CN1CCN(Nc2cc(-c3ccccc3)nc[nH+]2)CC1	ZINC000036708956	362840413	/nfs/dbraw/zinc/84/04/13/362840413.db2.gz	UMRIMSXLPDDGEB-UHFFFAOYSA-N	1	0	269.352	1.718	50	0		CDAARO
Cn1cc([C@H]2OCC[C@H]2C[NH2+]Cc2cccn2C)cn1	ZINC000089756755	347612174	/nfs/dbraw/zinc/61/21/74/347612174.db2.gz	INMQVYMPKMLXQP-WFASDCNBSA-N	1	0	274.368	1.626	50	0		CDAARO
C[C@H]1CC[NH2+]C[C@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC000086996430	179376787	/nfs/dbraw/zinc/37/67/87/179376787.db2.gz	JGJCAMQSEJPZRW-WRWORJQWSA-N	1	0	272.270	1.832	50	0		CDAARO
CC(C)CCNC(=O)N1CCN(c2cc[nH+]cc2)CC1	ZINC000054375216	348747981	/nfs/dbraw/zinc/74/79/81/348747981.db2.gz	PGHGGIJIDWHUDV-UHFFFAOYSA-N	1	0	276.384	1.959	50	0		CDAARO
CCc1noc([C@H](C)[NH2+][C@H]2CCN(C(C)=O)C[C@@H]2CC)n1	ZINC000089290037	179765853	/nfs/dbraw/zinc/76/58/53/179765853.db2.gz	JIZOCQKXXIGVTL-DRZSPHRISA-N	1	0	294.399	1.930	50	0		CDAARO
CN1CC[NH+](C2(CNc3ccncc3F)CCCC2)CC1	ZINC000584889566	349348673	/nfs/dbraw/zinc/34/86/73/349348673.db2.gz	RCTBEDQZAKFCKX-UHFFFAOYSA-N	1	0	292.402	1.615	50	0		CDAARO
Cn1cncc1C(=O)NCC(C)(C)[NH+]1CCCC1	ZINC000584890534	349349340	/nfs/dbraw/zinc/34/93/40/349349340.db2.gz	NTWVFTGFHWPYNQ-UHFFFAOYSA-N	1	0	250.346	1.024	50	0		CDAARO
COCCN(C)CC(=O)N1CC[C@H](C2CCCCC2)C1	ZINC000584898429	349359669	/nfs/dbraw/zinc/35/96/69/349359669.db2.gz	CZMCWGVIFQKVCH-HNNXBMFYSA-N	1	0	282.428	1.993	50	0		CDAARO
C[C@@H](CC(=O)Nc1ccc(F)cc1)[NH2+]C[C@]1(O)CCOC1	ZINC000090849541	180045928	/nfs/dbraw/zinc/04/59/28/180045928.db2.gz	WNKPCQCMIMSDMB-XHDPSFHLSA-N	1	0	296.342	1.284	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2ccc(OC)o2)C[C@@H]1[NH3+]	ZINC000091326970	180135068	/nfs/dbraw/zinc/13/50/68/180135068.db2.gz	XHSGYILUFPDXOS-UWVGGRQHSA-N	1	0	252.314	1.488	50	0		CDAARO
CC(C)Oc1ccccc1C[NH2+]C[C@H]1CN(C)CCO1	ZINC000105472552	186058488	/nfs/dbraw/zinc/05/84/88/186058488.db2.gz	LLDDYCUCGRWZRW-HNNXBMFYSA-N	1	0	278.396	1.894	50	0		CDAARO
CCCn1cc(C(=O)N[C@H]2Cc3ccccc3[C@@H]2[NH3+])c(C)n1	ZINC000091747033	180245425	/nfs/dbraw/zinc/24/54/25/180245425.db2.gz	LKXPTAIUOXZSPW-HOTGVXAUSA-N	1	0	298.390	1.956	50	0		CDAARO
Cc1nc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)cs1	ZINC000092045673	180311093	/nfs/dbraw/zinc/31/10/93/180311093.db2.gz	ASYHJAIGGHCDIY-ZJUUUORDSA-N	1	0	251.355	1.261	50	0		CDAARO
C[C@@H]1C[NH+](C[C@@H](O)COCc2ccccc2F)C[C@@H](C)O1	ZINC000105699654	186068531	/nfs/dbraw/zinc/06/85/31/186068531.db2.gz	RFLIBMKXDGIBSK-UMVBOHGHSA-N	1	0	297.370	1.812	50	0		CDAARO
COc1ccccc1CNC(=O)C[N@@H+]1C[C@@H](C)[C@@](C)(O)C1	ZINC000092080514	180318476	/nfs/dbraw/zinc/31/84/76/180318476.db2.gz	CTXZPTGSQBEEJO-WBMJQRKESA-N	1	0	292.379	1.014	50	0		CDAARO
CC(C)=CCC[N@H+]1CCN(C)[C@@]2(C1)CCNC(=O)CC2	ZINC000107656045	186183643	/nfs/dbraw/zinc/18/36/43/186183643.db2.gz	KNEROSVSOIZNAG-MRXNPFEDSA-N	1	0	279.428	1.629	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[NH2+][C@@H]1CCC[C@H](C)[C@H]1C	ZINC000036773879	362968510	/nfs/dbraw/zinc/96/85/10/362968510.db2.gz	VFHVHFHRDSQHTJ-ZRUFSTJUSA-N	1	0	255.362	1.245	50	0		CDAARO
COC[C@H](O)C[N@H+](C)[C@H](C)Cc1ccc(C)cc1	ZINC000110608859	186304049	/nfs/dbraw/zinc/30/40/49/186304049.db2.gz	XMNJLMSLUYLLLZ-UKRRQHHQSA-N	1	0	251.370	1.865	50	0		CDAARO
C[C@H]1CC[NH2+]C[C@H]1NC(=O)c1ccc(F)c(F)c1F	ZINC000094184053	363238417	/nfs/dbraw/zinc/23/84/17/363238417.db2.gz	XSDVHYUVXJZHAT-OIBJUYFYSA-N	1	0	272.270	1.832	50	0		CDAARO
C[C@H](NC(=O)[C@@H]1C[C@H](O)C[NH2+]1)c1ccc(Cl)s1	ZINC000037020919	363314665	/nfs/dbraw/zinc/31/46/65/363314665.db2.gz	LACVTBWBJBIWDU-FXQIFTODSA-N	1	0	274.773	1.302	50	0		CDAARO
C[C@H](C[NH+](C)C)OC(=O)c1ccc2c(c1)OCO2	ZINC000000206170	355896594	/nfs/dbraw/zinc/89/65/94/355896594.db2.gz	NPAGVLZASGSDFL-SECBINFHSA-N	1	0	251.282	1.522	50	0		CDAARO
COc1ccc(C[NH2+]C[C@H]2CCCO2)c(OC)c1OC	ZINC000000268573	355899941	/nfs/dbraw/zinc/89/99/41/355899941.db2.gz	IOTCZIWATHDQAE-GFCCVEGCSA-N	1	0	281.352	1.981	50	0		CDAARO
FC(F)(F)c1cc(C2CC2)nc(N2CC[NH2+]CC2)n1	ZINC000002554501	355974265	/nfs/dbraw/zinc/97/42/65/355974265.db2.gz	QXIUFZYCZKVMMO-UHFFFAOYSA-N	1	0	272.274	1.782	50	0		CDAARO
C[C@@H]1CCCN(C(=O)/C=C\c2cccnc2)[C@@H]1C[NH3+]	ZINC000255096222	355998742	/nfs/dbraw/zinc/99/87/42/355998742.db2.gz	XOEDMNSBBHARNA-PFBXESSKSA-N	1	0	259.353	1.681	50	0		CDAARO
O=C(NCC[NH+]1CCCCC1)c1ccc2c(c1)OCCO2	ZINC000004523612	356035354	/nfs/dbraw/zinc/03/53/54/356035354.db2.gz	XKAMAOWLRFYEMR-UHFFFAOYSA-N	1	0	290.363	1.674	50	0		CDAARO
CCC[NH+]1CCN(C(=O)c2ccc(OC)cc2)CC1	ZINC000003622847	356007926	/nfs/dbraw/zinc/00/79/26/356007926.db2.gz	QZPCHISLRWVGNR-UHFFFAOYSA-N	1	0	262.353	1.863	50	0		CDAARO
Cc1ccc([C@H](C)[NH2+]CCN2C(=O)NC(C)(C)C2=O)o1	ZINC000097374082	356094658	/nfs/dbraw/zinc/09/46/58/356094658.db2.gz	ZUTMWVDHGCJWED-JTQLQIEISA-N	1	0	279.340	1.569	50	0		CDAARO
C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cn1)[C@@H]1CCCO1	ZINC000097374146	356094725	/nfs/dbraw/zinc/09/47/25/356094725.db2.gz	UCKIOGAVCQKVRI-ONGXEEELSA-N	1	0	283.759	1.831	50	0		CDAARO
CN(C(=O)c1cccc(Nc2cnccn2)c1)[C@@H]1CC[NH2+]C1	ZINC000299738463	356262589	/nfs/dbraw/zinc/26/25/89/356262589.db2.gz	BBDVLNQPJPLFJE-CQSZACIVSA-N	1	0	297.362	1.654	50	0		CDAARO
C[C@H]1CN(C(=O)c2ccnc(C3CC3)n2)C[C@H](C)[NH2+]1	ZINC000299738889	356264525	/nfs/dbraw/zinc/26/45/25/356264525.db2.gz	HXVBONAICSKUNA-UWVGGRQHSA-N	1	0	260.341	1.176	50	0		CDAARO
COc1cc2c(cc1OC)CN(CCC[NH3+])CC2	ZINC000011953190	356284941	/nfs/dbraw/zinc/28/49/41/356284941.db2.gz	NAIOKJKKMHITGC-UHFFFAOYSA-N	1	0	250.342	1.411	50	0	biogenic	CDAARO
O=C1N(CC2CCCCC2)CCC[C@@]1(O)C[NH2+]CC1CC1	ZINC000012030045	356286509	/nfs/dbraw/zinc/28/65/09/356286509.db2.gz	ADEFYTRGCJQQSX-QGZVFWFLSA-N	1	0	294.439	1.920	50	0		CDAARO
Nc1n[nH]c(SCc2cn3cc(Cl)ccc3n2)n1	ZINC000014077762	356373066	/nfs/dbraw/zinc/37/30/66/356373066.db2.gz	FPOHKNDRWDSOCT-UHFFFAOYSA-N	1	0	280.744	1.980	50	0		CDAARO
Cc1cc(NC(=O)NCC(C)(C)C[NH+](C)C)no1	ZINC000032841337	356391398	/nfs/dbraw/zinc/39/13/98/356391398.db2.gz	KBTCRDYJNBLXCC-UHFFFAOYSA-N	1	0	254.334	1.692	50	0		CDAARO
CCNC(=O)NC(=O)[C@@H](C)N(C)Cc1ccc(F)cc1	ZINC000015449671	356416427	/nfs/dbraw/zinc/41/64/27/356416427.db2.gz	KAEOLPSWYLOMDR-SNVBAGLBSA-N	1	0	281.331	1.492	50	0		CDAARO
Cc1cc(C)n(NC(=O)c2cccc(C[NH+](C)C)c2)c(=O)c1	ZINC000019227807	356477977	/nfs/dbraw/zinc/47/79/77/356477977.db2.gz	PQOWDWCSQDOGCI-UHFFFAOYSA-N	1	0	299.374	1.911	50	0		CDAARO
C[C@H]1Cc2ccccc2N1C(=O)CCN1CC[NH+](C)CC1	ZINC000019874074	356512919	/nfs/dbraw/zinc/51/29/19/356512919.db2.gz	CVUVTUDKOZFPMB-AWEZNQCLSA-N	1	0	287.407	1.602	50	0		CDAARO
OCCN1CC[NH+](C2C3CC4CC(C3)CC2C4)CC1	ZINC000019637350	356494369	/nfs/dbraw/zinc/49/43/69/356494369.db2.gz	CVEPXVYVNCXUGY-UHFFFAOYSA-N	1	0	264.413	1.421	50	0		CDAARO
[NH3+]CCCC(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000037822440	356542619	/nfs/dbraw/zinc/54/26/19/356542619.db2.gz	YJNIPSFJTFWNCE-CYBMUJFWSA-N	1	0	282.771	1.979	50	0		CDAARO
CNC(=O)NC(=O)C[NH2+][C@@H](c1cccs1)C(C)C	ZINC000029189819	356732175	/nfs/dbraw/zinc/73/21/75/356732175.db2.gz	JVOBLWKIOBDIPB-LLVKDONJSA-N	1	0	269.370	1.490	50	0		CDAARO
COCCCNC(=O)C[N@H+](C)[C@@H]1CCc2ccccc21	ZINC000029810659	356743370	/nfs/dbraw/zinc/74/33/70/356743370.db2.gz	QETGXWXLGUOWJW-OAHLLOKOSA-N	1	0	276.380	1.758	50	0		CDAARO
COc1ccc(C[C@@H](C)[NH+]2CCN(C=O)CC2)cc1	ZINC000023283127	356816683	/nfs/dbraw/zinc/81/66/83/356816683.db2.gz	WMUFINUBDHLEBE-CYBMUJFWSA-N	1	0	262.353	1.400	50	0		CDAARO
C[N@@H+]1CCCN(c2ccc(Br)cn2)CC1	ZINC000042376758	357065067	/nfs/dbraw/zinc/06/50/67/357065067.db2.gz	CBSOWSJDGZPLHL-UHFFFAOYSA-N	1	0	270.174	1.986	50	0		CDAARO
Cc1cc([C@@H]2CCCN(CCCS(C)(=O)=O)C2)n[nH]1	ZINC000089599040	357502605	/nfs/dbraw/zinc/50/26/05/357502605.db2.gz	SMAJBGIXCKUMJC-GFCCVEGCSA-N	1	0	285.413	1.332	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)c2cc3ccccc3[nH]2)C[C@H]1CO	ZINC000257188177	357448922	/nfs/dbraw/zinc/44/89/22/357448922.db2.gz	DNSAECRNIYRVDU-SWLSCSKDSA-N	1	0	287.363	1.162	50	0		CDAARO
CCCn1cc(CN2CCN3CC[N@H+](C)C[C@@H]3C2)c(C)n1	ZINC000065375645	357533101	/nfs/dbraw/zinc/53/31/01/357533101.db2.gz	CXNUIIAGFYRCHX-MRXNPFEDSA-N	1	0	291.443	1.033	50	0		CDAARO
COc1cccc(C[C@H](C)[NH2+]CC(=O)NC(C)C)c1	ZINC000065409070	357539266	/nfs/dbraw/zinc/53/92/66/357539266.db2.gz	KFFPWCHQULEZOE-LBPRGKRZSA-N	1	0	264.369	1.740	50	0		CDAARO
C[NH2+]CCc1noc(COc2ccc(OC)cc2)n1	ZINC000066323523	357561927	/nfs/dbraw/zinc/56/19/27/357561927.db2.gz	UHAVVQJTDLLUDD-UHFFFAOYSA-N	1	0	263.297	1.419	50	0		CDAARO
CC(C)Cc1cc(C(=O)NC[C@@H]2CCC[N@H+](C)C2)[nH]n1	ZINC000067726644	357621655	/nfs/dbraw/zinc/62/16/55/357621655.db2.gz	VCQWNKRKIUJDTP-LBPRGKRZSA-N	1	0	278.400	1.680	50	0		CDAARO
CNC(=O)c1ccccc1-c1cccc2c1O[C@H](C[NH3+])C2	ZINC000067742164	357623485	/nfs/dbraw/zinc/62/34/85/357623485.db2.gz	SXEBHWPTIBKMOG-LBPRGKRZSA-N	1	0	282.343	1.975	50	0		CDAARO
Cc1nc(C[NH3+])cc(NCCNc2ccccc2)n1	ZINC000067756576	357625343	/nfs/dbraw/zinc/62/53/43/357625343.db2.gz	ZARYTNVKLCQDGO-UHFFFAOYSA-N	1	0	257.341	1.768	50	0		CDAARO
CCc1c(C)nn(CC(=O)N[C@@H]2CC[C@@H]([NH3+])C2)c1C	ZINC000067821269	357629831	/nfs/dbraw/zinc/62/98/31/357629831.db2.gz	QEWZSNDTTOGYFD-VXGBXAGGSA-N	1	0	264.373	1.058	50	0		CDAARO
CNC(=O)[C@@H]1C[C@H]([NH3+])CN1C/C=C(\C)CCC=C(C)C	ZINC000067514017	357611903	/nfs/dbraw/zinc/61/19/03/357611903.db2.gz	CKAHAYSOSPLMHD-DMUBJSPUSA-N	1	0	279.428	1.827	50	0		CDAARO
C/C=C/C[N@H+]1CC=C([C@H](CC)NC(=O)COC)CC1	ZINC000067724298	357621375	/nfs/dbraw/zinc/62/13/75/357621375.db2.gz	DZQZXSOYODXIKT-YVZNUBBCSA-N	1	0	266.385	1.736	50	0		CDAARO
CC(C)Cc1cc(C(=O)N[C@@H]2CC[C@@H]([NH3+])C2)on1	ZINC000071762733	357779625	/nfs/dbraw/zinc/77/96/25/357779625.db2.gz	BEUGPVPHVNKYKI-NXEZZACHSA-N	1	0	251.330	1.483	50	0		CDAARO
Cc1nc[nH]c1CSCCNC(=O)[C@H]1CC[C@@H]([NH3+])C1	ZINC000072430954	357834903	/nfs/dbraw/zinc/83/49/03/357834903.db2.gz	AKVHZOAFAWMFGL-WDEREUQCSA-N	1	0	282.413	1.195	50	0		CDAARO
OC[C@]1(O)CCC[N@H+](Cc2c[nH]nc2-c2ccccc2)C1	ZINC000072430624	357835092	/nfs/dbraw/zinc/83/50/92/357835092.db2.gz	WAQNQLRSSHSXSV-INIZCTEOSA-N	1	0	287.363	1.396	50	0		CDAARO
CCc1nc(C)sc1C[N@@H+]1CC[C@](O)(CC)[C@H](O)C1	ZINC000072481065	357838672	/nfs/dbraw/zinc/83/86/72/357838672.db2.gz	XJFVAUXNTAHCQO-ZIAGYGMSSA-N	1	0	284.425	1.722	50	0		CDAARO
C[C@@H]1CC([NH2+]CC2(O)CCS(=O)(=O)CC2)C[C@@H](C)C1	ZINC000097020465	357914434	/nfs/dbraw/zinc/91/44/34/357914434.db2.gz	GWMNMLHSZUDSKF-RYUDHWBXSA-N	1	0	289.441	1.340	50	0		CDAARO
COC(=O)[C@]12CCC[C@@H]1C[N@H+](Cc1ccncc1)C2	ZINC000097082972	357945617	/nfs/dbraw/zinc/94/56/17/357945617.db2.gz	ZHMOWTRATIEDCY-HIFRSBDPSA-N	1	0	260.337	1.857	50	0		CDAARO
Cc1cc(F)cc(S(=O)(=O)N[C@H](C[NH3+])C2CC2)c1	ZINC000097229420	358043158	/nfs/dbraw/zinc/04/31/58/358043158.db2.gz	MWDAZELLFNVJGR-GFCCVEGCSA-N	1	0	272.345	1.150	50	0		CDAARO
CCCCOCC(=O)N1CCC[C@H](c2nccn2C)C1	ZINC000082139026	358149014	/nfs/dbraw/zinc/14/90/14/358149014.db2.gz	QDCAFLUCBZBFBL-ZDUSSCGKSA-N	1	0	279.384	1.943	50	0		CDAARO
Cc1cc[nH+]c(NC[C@@H]2CCN(CCS(C)(=O)=O)C2)c1	ZINC000097203804	358191259	/nfs/dbraw/zinc/19/12/59/358191259.db2.gz	XSXXEZWGTCKKED-ZDUSSCGKSA-N	1	0	297.424	1.168	50	0		CDAARO
Cc1cc[nH+]c(NC[C@H]2CCN(CCS(C)(=O)=O)C2)c1	ZINC000097203806	358191359	/nfs/dbraw/zinc/19/13/59/358191359.db2.gz	XSXXEZWGTCKKED-CYBMUJFWSA-N	1	0	297.424	1.168	50	0		CDAARO
COCc1cccc(S(=O)(=O)N[C@@H]2CCC[NH2+][C@@H]2C)c1	ZINC000193455636	358295544	/nfs/dbraw/zinc/29/55/44/358295544.db2.gz	SWRZQDYROQAWKE-BXUZGUMPSA-N	1	0	298.408	1.252	50	0		CDAARO
NC(=O)c1c(N)sc2c1CC[N@H+](Cc1ccccc1)C2	ZINC000004524971	283362904	/nfs/dbraw/zinc/36/29/04/283362904.db2.gz	LGGWACZZAOTYKK-UHFFFAOYSA-N	1	0	287.388	1.988	50	0		CDAARO
CC(C)[C@@H]1C[N@H+](Cc2ccccn2)C[C@H]1NC(=O)N(C)C	ZINC000095389551	358692311	/nfs/dbraw/zinc/69/23/11/358692311.db2.gz	PWQMUCXIJSWDFJ-LSDHHAIUSA-N	1	0	290.411	1.809	50	0		CDAARO
Cc1ccsc1C[N@@H+]1CCC[C@@](O)(CO)CC1	ZINC000097307563	358766711	/nfs/dbraw/zinc/76/67/11/358766711.db2.gz	WRQYZVSVMCVZRG-ZDUSSCGKSA-N	1	0	255.383	1.766	50	0		CDAARO
Fc1cnccc1N1CCC(C[NH+]2CCOCC2)CC1	ZINC000096139725	358709241	/nfs/dbraw/zinc/70/92/41/358709241.db2.gz	SLLPEIJVODYUKK-UHFFFAOYSA-N	1	0	279.359	1.769	50	0		CDAARO
OC[C@@]12CN(Cc3c[nH]cn3)C[C@@H]1c1ccccc1OC2	ZINC000096165941	358712442	/nfs/dbraw/zinc/71/24/42/358712442.db2.gz	ITGXBOVEZAJRCD-GDBMZVCRSA-N	1	0	285.347	1.380	50	0		CDAARO
Cc1ccsc1C(=O)N1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1	ZINC000185205294	358775235	/nfs/dbraw/zinc/77/52/35/358775235.db2.gz	BRUODXIXBZCYDY-AXFHLTTASA-N	1	0	250.367	1.866	50	0		CDAARO
Cn1nc(C(=O)N[C@@H]2CCC[NH2+]C2)cc1-c1ccccc1	ZINC000097468516	358779207	/nfs/dbraw/zinc/77/92/07/358779207.db2.gz	JDMCTHBQCYOTPV-CYBMUJFWSA-N	1	0	284.363	1.569	50	0		CDAARO
O=C(NC1CC[NH+](Cc2ccncc2)CC1)c1cn[nH]c1	ZINC000215108141	358875175	/nfs/dbraw/zinc/87/51/75/358875175.db2.gz	RUAZJMIVGAJAIK-UHFFFAOYSA-N	1	0	285.351	1.199	50	0		CDAARO
CCCc1ccc(C[N@@H+]2CC[C@@H](NC(C)=O)C2)o1	ZINC000215751484	358900642	/nfs/dbraw/zinc/90/06/42/358900642.db2.gz	QWTINSPHBIFZAL-GFCCVEGCSA-N	1	0	250.342	1.943	50	0		CDAARO
O[C@H]1CN(Cc2cccc3[nH]ccc32)C[C@@H]1[NH+]1CCCC1	ZINC000216054395	358920754	/nfs/dbraw/zinc/92/07/54/358920754.db2.gz	XRGOULKRVHNKRQ-IRXDYDNUSA-N	1	0	285.391	1.809	50	0		CDAARO
O=C(NCC1([NH+]2CCCC2)CCCC1)c1cn[nH]c1	ZINC000216306330	358936363	/nfs/dbraw/zinc/93/63/63/358936363.db2.gz	JUGUVCKKIZGLDG-UHFFFAOYSA-N	1	0	262.357	1.548	50	0		CDAARO
COCCN(Cc1ccsc1)C(=O)C[C@@H]1CC[NH2+]C1	ZINC000216493829	358947470	/nfs/dbraw/zinc/94/74/70/358947470.db2.gz	XYLBXHSLAFCDKM-LBPRGKRZSA-N	1	0	282.409	1.723	50	0		CDAARO
Cn1c(C[C@H](O)C[NH2+]C(C)(C)C)nc2ccccc21	ZINC000071771742	359104682	/nfs/dbraw/zinc/10/46/82/359104682.db2.gz	AAZHCJWCFHZEQI-NSHDSACASA-N	1	0	261.369	1.865	50	0		CDAARO
CN(CC(=O)NCCCc1ccccn1)Cc1cccnc1	ZINC000221304545	359231086	/nfs/dbraw/zinc/23/10/86/359231086.db2.gz	NWZJDZOPJUNSPB-UHFFFAOYSA-N	1	0	298.390	1.657	50	0		CDAARO
COC[C@H](O)C[N@@H+]1C[C@H](c2ccsc2)C[C@H]1C	ZINC000247881612	359426471	/nfs/dbraw/zinc/42/64/71/359426471.db2.gz	CEZFHQKVRBAQLO-RAIGVLPGSA-N	1	0	255.383	1.933	50	0		CDAARO
CC[C@H](NC(=O)CC[NH+]1CCCC1)c1nc(C)no1	ZINC000223154950	359403825	/nfs/dbraw/zinc/40/38/25/359403825.db2.gz	NCOVITFRTUOIHA-NSHDSACASA-N	1	0	266.345	1.431	50	0		CDAARO
COCCN(C)c1ccc(CN2CCC[C@H](C[NH3+])C2)cn1	ZINC000261921812	359584717	/nfs/dbraw/zinc/58/47/17/359584717.db2.gz	KOKWEGQYZYNNRI-CQSZACIVSA-N	1	0	292.427	1.335	50	0		CDAARO
CCNC(=O)[C@]1(CCO)CC[N@H+](Cc2ccccc2)C1	ZINC000257191257	359588459	/nfs/dbraw/zinc/58/84/59/359588459.db2.gz	PQTVWXUPFRFBLC-INIZCTEOSA-N	1	0	276.380	1.397	50	0		CDAARO
O[C@H](C[NH+]1CCN(c2cccnn2)CC1)C1CCCCC1	ZINC000191329926	359616524	/nfs/dbraw/zinc/61/65/24/359616524.db2.gz	BVRDEBPTNFNUJD-OAHLLOKOSA-N	1	0	290.411	1.540	50	0		CDAARO
CC(C)[C@@H]1OCCC[C@H]1CNC1=[NH+]CCCCN1	ZINC000521396965	359970636	/nfs/dbraw/zinc/97/06/36/359970636.db2.gz	WVUSBDGPCVXKRL-STQMWFEESA-N	1	0	253.390	1.767	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)N[C@@H]1CCCC[C@H]1CO	ZINC000231315712	360054736	/nfs/dbraw/zinc/05/47/36/360054736.db2.gz	QDVBLSFGMSFNRX-QWHCGFSZSA-N	1	0	254.374	1.043	50	0		CDAARO
NC(=O)c1ccc(-c2ccc3c(c2)C[C@H](C[NH3+])O3)cc1	ZINC000299778793	283524665	/nfs/dbraw/zinc/52/46/65/283524665.db2.gz	HHTKFPZQNUZYAU-CQSZACIVSA-N	1	0	268.316	1.715	50	0		CDAARO
CCOCC(=O)N1CCC(n2c(C)c[nH+]c2C)CC1	ZINC000409420026	360228422	/nfs/dbraw/zinc/22/84/22/360228422.db2.gz	GRCWVNQGUMDQGQ-UHFFFAOYSA-N	1	0	265.357	1.700	50	0		CDAARO
Cc1nnc2n1CC[C@H]([N@@H+](C)Cc1cccn1C)CC2	ZINC000409421259	360230859	/nfs/dbraw/zinc/23/08/59/360230859.db2.gz	YCRQQTYQQNGPFJ-CYBMUJFWSA-N	1	0	273.384	1.762	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)c1cccnc1	ZINC000248163473	360427831	/nfs/dbraw/zinc/42/78/31/360427831.db2.gz	YTBXLWJGFMCOJD-ZIAGYGMSSA-N	1	0	259.353	1.780	50	0		CDAARO
Cc1ccc(OCCS(=O)(=O)N2CCC([NH3+])CC2)cc1	ZINC000426535447	360682748	/nfs/dbraw/zinc/68/27/48/360682748.db2.gz	JJQLASFVRIYZTQ-UHFFFAOYSA-N	1	0	298.408	1.127	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)c1ccc(-c2cncnc2)cc1	ZINC000426383108	360661454	/nfs/dbraw/zinc/66/14/54/360661454.db2.gz	IVBHGARZDVPDEA-UHFFFAOYSA-N	1	0	296.374	1.969	50	0		CDAARO
Cc1nc(C(F)(F)F)ncc1CN1CC[C@H]([NH3+])C1	ZINC000426431959	360668965	/nfs/dbraw/zinc/66/89/65/360668965.db2.gz	OEIUZOFDMFMVMZ-VIFPVBQESA-N	1	0	260.263	1.337	50	0		CDAARO
Cc1c[nH+]ccc1NCCNC(=O)c1ccn(C(C)C)n1	ZINC000426497176	360676823	/nfs/dbraw/zinc/67/68/23/360676823.db2.gz	IQOVSVCIAJHJJR-UHFFFAOYSA-N	1	0	287.367	1.431	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)CCOc2ccccc2F)C1	ZINC000178977800	189158870	/nfs/dbraw/zinc/15/88/70/189158870.db2.gz	KNYWCXSVLMERAA-GFCCVEGCSA-N	1	0	280.343	1.663	50	0		CDAARO
[NH3+][C@@H]1CCC[C@H](C(=O)NC[C@H](O)c2c(F)cccc2F)C1	ZINC000299748191	200856549	/nfs/dbraw/zinc/85/65/49/200856549.db2.gz	GJOZHKQPXQWVRR-CWSCBRNRSA-N	1	0	298.333	1.632	50	0		CDAARO
O[C@H](C[NH+]1CCCCC1)c1ccc2c(c1)OCCO2	ZINC000001456004	361186937	/nfs/dbraw/zinc/18/69/37/361186937.db2.gz	IBZCOXOCBPZAIR-CYBMUJFWSA-N	1	0	263.337	1.977	50	0		CDAARO
CN1CCN(C(=O)c2ccc(C[NH+]3CCCC3)cc2)CC1	ZINC000013678646	361414347	/nfs/dbraw/zinc/41/43/47/361414347.db2.gz	IPYKYEXGLJJSNS-UHFFFAOYSA-N	1	0	287.407	1.670	50	0		CDAARO
C[C@@H](CN1CC[NH+](C)CC1)OC(=O)c1ccc(F)cc1	ZINC000019370414	361425808	/nfs/dbraw/zinc/42/58/08/361425808.db2.gz	ZLSVQEWOSQJTNW-LBPRGKRZSA-N	1	0	280.343	1.618	50	0		CDAARO
OC[C@H]1CN(Cc2ccc(F)cc2F)CC[C@H]1O	ZINC000335650924	361712282	/nfs/dbraw/zinc/71/22/82/361712282.db2.gz	WJMXMKWKADFLPF-ZWNOBZJWSA-N	1	0	257.280	1.140	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N(C)[C@H](C)C[NH3+]	ZINC000193280276	189638908	/nfs/dbraw/zinc/63/89/08/189638908.db2.gz	IWSTZMKVZDANLI-SNVBAGLBSA-N	1	0	256.371	1.217	50	0		CDAARO
CC(C)Oc1ccc(S(=O)(=O)N(C)[C@@H](C)C[NH3+])cc1	ZINC000195555273	189679809	/nfs/dbraw/zinc/67/98/09/189679809.db2.gz	PWILFHFWYFCKMB-NSHDSACASA-N	1	0	286.397	1.442	50	0		CDAARO
O=C1CC[C@H]([NH2+][C@H]2CCCOc3ccc(F)cc32)CN1	ZINC000098020492	364978040	/nfs/dbraw/zinc/97/80/40/364978040.db2.gz	SAQAQIVVWOIHAD-AAEUAGOBSA-N	1	0	278.327	1.908	50	0		CDAARO
CCS(=O)(=O)C[C@@H](C)[NH2+][C@@H]1CC(C)(C)OC1(C)C	ZINC000089635935	366891193	/nfs/dbraw/zinc/89/11/93/366891193.db2.gz	LXGZOTHIHGFQDF-GHMZBOCLSA-N	1	0	277.430	1.745	50	0		CDAARO
CCOC(=O)c1c(C)[nH]c(C(=O)N2CC([NH+](C)C)C2)c1C	ZINC000089984773	367003616	/nfs/dbraw/zinc/00/36/16/367003616.db2.gz	QKGNAUIMYDUKIZ-UHFFFAOYSA-N	1	0	293.367	1.194	50	0		CDAARO
Cc1cc(C[NH2+]C2(CO)CCCC2)nc(N(C)C)n1	ZINC000252498757	367646232	/nfs/dbraw/zinc/64/62/32/367646232.db2.gz	RKLXHHHMKLFOPJ-UHFFFAOYSA-N	1	0	264.373	1.246	50	0		CDAARO
O=C(N[C@@H]1CC[N@@H+](C2CCCC2)C1)N1CCSCC1	ZINC000076983727	284053634	/nfs/dbraw/zinc/05/36/34/284053634.db2.gz	KHWSDLPSWZOUAN-GFCCVEGCSA-N	1	0	283.441	1.762	50	0		CDAARO
C[N@@H+]1CCCN(CC(=O)c2ccc3c(c2)CCO3)CC1	ZINC000037661015	369788121	/nfs/dbraw/zinc/78/81/21/369788121.db2.gz	JAYQSXZZNGVPJO-UHFFFAOYSA-N	1	0	274.364	1.442	50	0		CDAARO
C[NH+]1CCC(N(Cc2ccco2)S(C)(=O)=O)CC1	ZINC000089375236	370190833	/nfs/dbraw/zinc/19/08/33/370190833.db2.gz	PEQOXWDMJWWXBS-UHFFFAOYSA-N	1	0	272.370	1.135	50	0		CDAARO
NC(=O)c1cncc(-c2cccc3c2O[C@@H](C[NH3+])C3)c1	ZINC000299761756	372746960	/nfs/dbraw/zinc/74/69/60/372746960.db2.gz	XZXZFJWTWAGSNS-GFCCVEGCSA-N	1	0	269.304	1.110	50	0		CDAARO
Nc1nc(C(=O)NC[C@@H]2CC[N@@H+](C3CCCC3)C2)cs1	ZINC000299767463	372749379	/nfs/dbraw/zinc/74/93/79/372749379.db2.gz	HMQHORFTAIBJAO-JTQLQIEISA-N	1	0	294.424	1.720	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](CN(C)C(=O)c2cncnc2)C1	ZINC000299775525	372752224	/nfs/dbraw/zinc/75/22/24/372752224.db2.gz	KFKTYCGOGMTUIG-LBPRGKRZSA-N	1	0	262.357	1.281	50	0		CDAARO
CC(C)(C)c1cc(CNC(=O)C[C@@H]2CC[NH2+]C2)[nH]n1	ZINC000299777730	372754879	/nfs/dbraw/zinc/75/48/79/372754879.db2.gz	OREXABYAPYSNJD-JTQLQIEISA-N	1	0	264.373	1.323	50	0		CDAARO
Cc1cn2cccc(C(=O)NCC[C@@H]3CCC[N@H+]3C)c2n1	ZINC000299780813	372757587	/nfs/dbraw/zinc/75/75/87/372757587.db2.gz	CTTCISCEPMOBGE-ZDUSSCGKSA-N	1	0	286.379	1.857	50	0		CDAARO
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]([NH3+])CC(C)C	ZINC000001605752	373162651	/nfs/dbraw/zinc/16/26/51/373162651.db2.gz	DJBPSNXKZLENEZ-KBPBESRZSA-N	1	0	292.379	1.260	50	0	biogenic	CDAARO
COc1ccc([C@H](C[NH+](C)C)NCc2cc[nH]n2)cc1	ZINC000253416606	373726542	/nfs/dbraw/zinc/72/65/42/373726542.db2.gz	YWGLBGIOZZQBDS-HNNXBMFYSA-N	1	0	274.368	1.811	50	0		CDAARO
Cc1cc(C)nc(NC(=O)NC2CC[NH+](C)CC2)c1	ZINC000097142998	541891109	/nfs/dbraw/zinc/89/11/09/541891109.db2.gz	JIFRDEJQNNTRFT-UHFFFAOYSA-N	1	0	262.357	1.914	50	0		CDAARO
OC[C@@H](O)C[N@H+](Cc1cccnc1)C1CCCCCC1	ZINC000055054665	373783930	/nfs/dbraw/zinc/78/39/30/373783930.db2.gz	BPQMTKUPRRBRAH-INIZCTEOSA-N	1	0	278.396	1.960	50	0		CDAARO
CS[C@@H]1CCC[C@@H]1[N@H+](C)CC(=O)N(C)C1CC1	ZINC000110642595	374174286	/nfs/dbraw/zinc/17/42/86/374174286.db2.gz	KCPWTQJIEKOVMT-NWDGAFQWSA-N	1	0	256.415	1.823	50	0		CDAARO
Cc1nc2ccccc2nc1NC[C@H]1CN(C)CCO1	ZINC000113648179	374268927	/nfs/dbraw/zinc/26/89/27/374268927.db2.gz	ZBGGFHVMSSXSRP-LBPRGKRZSA-N	1	0	272.352	1.681	50	0		CDAARO
CC(C)OC[C@@H](O)C[NH+]1CCN(c2ccc(F)cc2)CC1	ZINC000019938321	374829900	/nfs/dbraw/zinc/82/99/00/374829900.db2.gz	GNOJFUXZGOGSSY-INIZCTEOSA-N	1	0	296.386	1.734	50	0		CDAARO
COc1ccc(CN(CCO)CCO)c(Cl)c1	ZINC000095430668	374932402	/nfs/dbraw/zinc/93/24/02/374932402.db2.gz	JRPUATSGEVGCBE-UHFFFAOYSA-N	1	0	259.733	1.135	50	0		CDAARO
CC(C)OCC1CC[NH+](CCn2cnnc2)CC1	ZINC000670462276	483047927	/nfs/dbraw/zinc/04/79/27/483047927.db2.gz	BGVMMABDJCHQKE-UHFFFAOYSA-N	1	0	252.362	1.415	50	0		CDAARO
CCCC[C@H](C(N)=O)[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(C)=O	ZINC000299754277	375211517	/nfs/dbraw/zinc/21/15/17/375211517.db2.gz	DZJJBYHRPXAQOC-QLFBSQMISA-N	1	0	295.427	1.506	50	0		CDAARO
C[NH+](C)CCNC(=S)Nc1ccc(F)c(F)c1F	ZINC000003336678	375653988	/nfs/dbraw/zinc/65/39/88/375653988.db2.gz	KZXQXTDOCLCJJN-UHFFFAOYSA-N	1	0	277.315	1.952	50	0		CDAARO
COc1ccc(C(=O)NC(C)(C)C[NH+](C)C)c(F)c1	ZINC000308683544	375822745	/nfs/dbraw/zinc/82/27/45/375822745.db2.gz	TWKKZONDDITWMS-UHFFFAOYSA-N	1	0	268.332	1.904	50	0		CDAARO
Cc1[nH]c2ccccc2c1C(=O)C(=O)NCC[NH+](C)C	ZINC000004163501	375901320	/nfs/dbraw/zinc/90/13/20/375901320.db2.gz	LKLIRFUAGNTUHH-UHFFFAOYSA-N	1	0	273.336	1.337	50	0		CDAARO
O=C(NCCC[NH+]1CCCC1)C(=O)c1c[nH]c2ccccc12	ZINC000004163324	375901716	/nfs/dbraw/zinc/90/17/16/375901716.db2.gz	WXMOZCXWBILBMZ-UHFFFAOYSA-N	1	0	299.374	1.953	50	0		CDAARO
O=c1cc(CN2CC[N@@H+]3CCC[C@H]3C2)nc2sccn21	ZINC000239125217	376015416	/nfs/dbraw/zinc/01/54/16/376015416.db2.gz	KDEZXDSZIDCVQJ-LBPRGKRZSA-N	1	0	290.392	1.036	50	0		CDAARO
COc1ccc(C)cc1/C=C\C(=O)N1CCC[C@@H]1C[NH3+]	ZINC000493012265	253346396	/nfs/dbraw/zinc/34/63/96/253346396.db2.gz	CZTMAHDVRNWQAJ-IQCBXXCUSA-N	1	0	274.364	1.967	50	0		CDAARO
CC[N@@H+]1CC[C@H](CNC(=O)c2ccncc2F)C1	ZINC000096420690	256789161	/nfs/dbraw/zinc/78/91/61/256789161.db2.gz	AGYCZXTXPNQVHB-SNVBAGLBSA-N	1	0	251.305	1.292	50	0		CDAARO
Cc1nn(C)c2nc(NCCC[NH+](C)C)sc12	ZINC000095354984	184951579	/nfs/dbraw/zinc/95/15/79/184951579.db2.gz	NBNDLYWSUAEHGQ-UHFFFAOYSA-N	1	0	253.375	1.702	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1N(C)CCCc1cnn(C)c1	ZINC000095384571	184961403	/nfs/dbraw/zinc/96/14/03/184961403.db2.gz	JVPNASUSMMAKLA-UHFFFAOYSA-N	1	0	288.399	1.732	50	0		CDAARO
O=C(NC1CCC1)NC1CC[NH+](C[C@@H]2CCOC2)CC1	ZINC000096413100	390511260	/nfs/dbraw/zinc/51/12/60/390511260.db2.gz	TZKPNFAASATQSU-LBPRGKRZSA-N	1	0	281.400	1.339	50	0		CDAARO
c1cncc(CN2CCC[N@@H+](C3CCOCC3)CC2)c1	ZINC000096415705	390512126	/nfs/dbraw/zinc/51/21/26/390512126.db2.gz	RZZMOZZDIXVZBH-UHFFFAOYSA-N	1	0	275.396	1.768	50	0		CDAARO
Cc1ccc([C@@H]([NH2+]C(CO)CO)c2cccnc2)cc1C	ZINC000065530873	390551986	/nfs/dbraw/zinc/55/19/86/390551986.db2.gz	BGOOSOYTBDRCFZ-QGZVFWFLSA-N	1	0	286.375	1.731	50	0		CDAARO
CC1CCC(C[N@H+]2C[C@@H]3[C@H](C2)OCCN3C)CC1	ZINC000334828349	390649434	/nfs/dbraw/zinc/64/94/34/390649434.db2.gz	JRBOKPHKHFWPRU-CVSAEHQPSA-N	1	0	252.402	1.828	50	0		CDAARO
CNC(=O)COc1cccc(C[NH2+]Cc2c[nH]nc2C)c1	ZINC000097159453	390800923	/nfs/dbraw/zinc/80/09/23/390800923.db2.gz	AUNAUDLUGZWUGD-UHFFFAOYSA-N	1	0	288.351	1.133	50	0		CDAARO
COC(=O)[C@]12CCC[C@@H]1C[N@H+](CC(=O)NC(C)(C)C)C2	ZINC000097082984	390840312	/nfs/dbraw/zinc/84/03/12/390840312.db2.gz	VTNIGDBHHYLXSJ-ABAIWWIYSA-N	1	0	282.384	1.176	50	0		CDAARO
CC[C@H]1CN(CCc2ccncc2)CC[N@@H+]1C[C@@H](C)O	ZINC000084736473	390947179	/nfs/dbraw/zinc/94/71/79/390947179.db2.gz	ZXJBIFXMLOIXHL-ZBFHGGJFSA-N	1	0	277.412	1.401	50	0		CDAARO
O=S(=O)(c1ccc(Br)cc1)[C@H]1CC[NH2+]C1	ZINC000071646225	296467604	/nfs/dbraw/zinc/46/76/04/296467604.db2.gz	DKBNOAFRMXGKST-JTQLQIEISA-N	1	0	290.182	1.585	50	0	in-vitro	CDAARO
C[C@@H]1COCC[C@H]1[NH2+]Cc1ccc(S(C)(=O)=O)cc1	ZINC000191752811	130296083	/nfs/dbraw/zinc/29/60/83/130296083.db2.gz	MDAWBTPEJDIOLW-BXUZGUMPSA-N	1	0	283.393	1.605	50	0		CDAARO
C[C@H]([NH3+])[C@H](C)C(=O)N1CCO[C@H](c2cccs2)C1	ZINC000192021641	130352438	/nfs/dbraw/zinc/35/24/38/130352438.db2.gz	KNRHXPRXHHUKOF-DCAQKATOSA-N	1	0	268.382	1.631	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(CCc2ccncc2)C[C@H]1C	ZINC000247440394	131103780	/nfs/dbraw/zinc/10/37/80/131103780.db2.gz	ZUOLXEWZYVBZKH-KGLIPLIRSA-N	1	0	263.385	1.011	50	0		CDAARO
Cn1cncc1C[NH2+][C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000263865422	131348974	/nfs/dbraw/zinc/34/89/74/131348974.db2.gz	YHJUAHLEPJCURJ-OAHLLOKOSA-N	1	0	284.363	1.311	50	0		CDAARO
COC[C@@H](O)CN1CC[NH+](C2CCC(C)CC2)CC1	ZINC000096406959	393180019	/nfs/dbraw/zinc/18/00/19/393180019.db2.gz	JNUQWRHAXXIFFT-NRXISQOPSA-N	1	0	270.417	1.190	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NCCOCC1CC1	ZINC000096421704	393184841	/nfs/dbraw/zinc/18/48/41/393184841.db2.gz	VXRCWQDLXZWXSN-CQSZACIVSA-N	1	0	268.401	1.792	50	0		CDAARO
CNC(=O)CC[N@H+](C)[C@@H]1CCCN(c2ccccc2)C1	ZINC000089386066	135059374	/nfs/dbraw/zinc/05/93/74/135059374.db2.gz	WNGBIQZTWSATDF-OAHLLOKOSA-N	1	0	275.396	1.723	50	0		CDAARO
c1cc(CC[NH+]2CCN(c3cc[nH+]cc3)CC2)ccn1	ZINC000089884940	135060819	/nfs/dbraw/zinc/06/08/19/135060819.db2.gz	AWBRWRVSOOMBTM-UHFFFAOYSA-N	1	0	268.364	1.841	50	0		CDAARO
Cn1nccc1C[NH2+][C@@H]1CCCN(c2cccnc2)C1=O	ZINC000097106928	397605209	/nfs/dbraw/zinc/60/52/09/397605209.db2.gz	RRXKOAWTHDMDAV-CQSZACIVSA-N	1	0	285.351	1.100	50	0		CDAARO
CC(C)(C[NH2+]CCc1ccccc1F)NS(C)(=O)=O	ZINC000097162710	397981312	/nfs/dbraw/zinc/98/13/12/397981312.db2.gz	WNHDAHZLYJUERC-UHFFFAOYSA-N	1	0	288.388	1.286	50	0		CDAARO
C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NC(=S)NC1CC1	ZINC000106864219	286851286	/nfs/dbraw/zinc/85/12/86/286851286.db2.gz	UXIQPNVNKTXCBP-UTUOFQBUSA-N	1	0	269.458	1.979	50	0		CDAARO
C[C@@H](O)C[NH+](Cc1ccc(Cl)cc1)C[C@@H](C)O	ZINC000000279195	287084375	/nfs/dbraw/zinc/08/43/75/287084375.db2.gz	DOJAOHHKXIRUFD-GHMZBOCLSA-N	1	0	257.761	1.904	50	0		CDAARO
C[N@@H+]1CCC[C@@H](OC(=O)c2ccc3c(c2)OCCO3)C1	ZINC000004889112	170036128	/nfs/dbraw/zinc/03/61/28/170036128.db2.gz	UTULJXQFQBJKBN-GFCCVEGCSA-N	1	0	277.320	1.709	50	0		CDAARO
C[NH+](C)CCCNC(=O)Cc1ccc(Cl)cc1	ZINC000006176975	170180673	/nfs/dbraw/zinc/18/06/73/170180673.db2.gz	HXZADFQZSORWKX-UHFFFAOYSA-N	1	0	254.761	1.950	50	0		CDAARO
O=S1(=O)CC[C@@H]([NH2+]Cc2ccc(Cl)cc2)C1	ZINC000006645489	170221917	/nfs/dbraw/zinc/22/19/17/170221917.db2.gz	DESXOIJHQSQDQY-LLVKDONJSA-N	1	0	259.758	1.617	50	0		CDAARO
COc1ccc(NC(=O)NCC[NH+]2CCCC2)cc1	ZINC000006819218	170246492	/nfs/dbraw/zinc/24/64/92/170246492.db2.gz	PNOLXCFRYFMNSC-UHFFFAOYSA-N	1	0	263.341	1.913	50	0		CDAARO
C[C@@H](C(=O)N1CCNC1=O)[N@H+](C)Cc1ccc(Cl)cc1	ZINC000007444912	170285492	/nfs/dbraw/zinc/28/54/92/170285492.db2.gz	PMYVQPSFZMSYMM-JTQLQIEISA-N	1	0	295.770	1.712	50	0		CDAARO
[NH3+]C[C@@H](c1ccco1)S(=O)(=O)c1cccs1	ZINC000007951990	170309205	/nfs/dbraw/zinc/30/92/05/170309205.db2.gz	LYCBVRRTCWLGPC-VIFPVBQESA-N	1	0	257.336	1.815	50	0		CDAARO
C[NH+](C)CCNS(=O)(=O)Cc1c(F)cccc1Cl	ZINC000010111706	170397805	/nfs/dbraw/zinc/39/78/05/170397805.db2.gz	DDCZFCUODKEKEB-UHFFFAOYSA-N	1	0	294.779	1.460	50	0		CDAARO
CNC(=O)NC(=O)[C@H](c1ccccc1)[NH+]1CCCC1	ZINC000015376645	170664461	/nfs/dbraw/zinc/66/44/61/170664461.db2.gz	FIDJUGIGCKRJAB-LBPRGKRZSA-N	1	0	261.325	1.279	50	0		CDAARO
COc1ccc(CCN2C[C@H](C[NH3+])CC2=O)cc1OC	ZINC000019669408	170835004	/nfs/dbraw/zinc/83/50/04/170835004.db2.gz	JBSFMBYYPGBGEM-LBPRGKRZSA-N	1	0	278.352	1.054	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc3c(c2)CCO3)C[C@@H]1CCO	ZINC000020256066	171109877	/nfs/dbraw/zinc/10/98/77/171109877.db2.gz	FIIANGNLMSWUIL-HNNXBMFYSA-N	1	0	276.380	1.120	50	0		CDAARO
Cc1ncc2c(c1-c1noc(Cn3cccn3)n1)CC[NH2+]C2	ZINC000020998164	171284308	/nfs/dbraw/zinc/28/43/08/171284308.db2.gz	KMJWLTLIBAJXIW-UHFFFAOYSA-N	1	0	296.334	1.331	50	0		CDAARO
[NH3+]Cc1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000022223586	171379651	/nfs/dbraw/zinc/37/96/51/171379651.db2.gz	KMUSEUUCMJBEQE-UHFFFAOYSA-N	1	0	252.273	1.946	50	0		CDAARO
Cc1nn(C)c(C)c1CC(=O)NCC[NH+](C(C)C)C(C)C	ZINC000022623411	171394911	/nfs/dbraw/zinc/39/49/11/171394911.db2.gz	VVMKKAMCWZBJDT-UHFFFAOYSA-N	1	0	294.443	1.814	50	0		CDAARO
O=C(N[C@H]1CC[NH2+]C1)C1(c2cccc(F)c2)CCOCC1	ZINC000126585727	413710837	/nfs/dbraw/zinc/71/08/37/413710837.db2.gz	LUMSWEDHNZUXRB-AWEZNQCLSA-N	1	0	292.354	1.352	50	0		CDAARO
c1[nH]nc(-c2cccnc2)c1C[NH2+]C[C@H]1CCCO1	ZINC000037215296	173035210	/nfs/dbraw/zinc/03/52/10/173035210.db2.gz	PSZOUUQLOYEMHW-CYBMUJFWSA-N	1	0	258.325	1.740	50	0		CDAARO
[NH3+][C@H](Cc1ccccc1Br)C(=O)N1CCC1	ZINC000038529152	174144388	/nfs/dbraw/zinc/14/43/88/174144388.db2.gz	ZPAWHUOKPDWKNX-LLVKDONJSA-N	1	0	283.169	1.551	50	0		CDAARO
Brc1cccc(OC2CC[NH2+]CC2)n1	ZINC000040434947	174261319	/nfs/dbraw/zinc/26/13/19/174261319.db2.gz	ZSNSZTUPMBVZNP-UHFFFAOYSA-N	1	0	257.131	1.975	50	0		CDAARO
Cc1[nH]c(=O)[nH]c(=O)c1-c1cccc([C@H](C)[NH+](C)C)c1	ZINC000065464782	175740485	/nfs/dbraw/zinc/74/04/85/175740485.db2.gz	KIDMLJFWMNQGPC-JTQLQIEISA-N	1	0	273.336	1.661	50	0		CDAARO
CCOc1cc(CNC(=O)[C@@H]2CCCC[NH2+]2)ccc1OC	ZINC000071715222	176249435	/nfs/dbraw/zinc/24/94/35/176249435.db2.gz	ZTTRZOWYDWEQSN-ZDUSSCGKSA-N	1	0	292.379	1.852	50	0		CDAARO
O=C(c1n[nH]cc1Cl)N1CCC2(CC[NH2+]CC2)CC1	ZINC000071755533	176260889	/nfs/dbraw/zinc/26/08/89/176260889.db2.gz	SQBUJRRXNQCLCU-UHFFFAOYSA-N	1	0	282.775	1.669	50	0		CDAARO
O=C(OCc1ccccc1)N1CCC[C@H]([NH2+]C2COC2)C1	ZINC000071792080	176263649	/nfs/dbraw/zinc/26/36/49/176263649.db2.gz	YPMHVYCSHCRJAT-AWEZNQCLSA-N	1	0	290.363	1.776	50	0		CDAARO
NC(=O)C[N@@H+]1CCC[C@H](CCc2ccc(F)cc2)C1	ZINC000072130879	176321588	/nfs/dbraw/zinc/32/15/88/176321588.db2.gz	NJJKMCDZIZHKCV-CYBMUJFWSA-N	1	0	264.344	1.956	50	0		CDAARO
c1c(CN2CCOC3(CCCC3)C2)nn2c1C[NH2+]CCC2	ZINC000072143209	176323995	/nfs/dbraw/zinc/32/39/95/176323995.db2.gz	CFGQMPVABCRQRS-UHFFFAOYSA-N	1	0	290.411	1.521	50	0		CDAARO
O=C(NC[C@]1(O)CC[NH2+]C1)c1cccc2ccccc21	ZINC000072148404	176325655	/nfs/dbraw/zinc/32/56/55/176325655.db2.gz	LITFYYCNVUACIR-INIZCTEOSA-N	1	0	270.332	1.294	50	0		CDAARO
COc1ccc(NC(=O)NC[C@@H]2C[NH2+]CCOC2)c(C)c1	ZINC000072163440	176330301	/nfs/dbraw/zinc/33/03/01/176330301.db2.gz	UIRZQUCARGTLFI-LBPRGKRZSA-N	1	0	293.367	1.361	50	0		CDAARO
Cc1ccc2[nH]nc(C(=O)N3CCC[C@@H]([NH3+])CC3)c2c1	ZINC000072173995	176333558	/nfs/dbraw/zinc/33/35/58/176333558.db2.gz	QJGWPECDLASXFK-LLVKDONJSA-N	1	0	272.352	1.825	50	0		CDAARO
Cc1c2ccc(C)cc2oc1C(=O)NC[C@]1(O)CC[NH2+]C1	ZINC000072173999	176333639	/nfs/dbraw/zinc/33/36/39/176333639.db2.gz	RGXNKJYWUVPUBC-INIZCTEOSA-N	1	0	288.347	1.504	50	0		CDAARO
CCC(CC)[NH2+]C[C@H]1CCN(c2cnn(C)c(=O)c2)C1	ZINC000077340434	177254202	/nfs/dbraw/zinc/25/42/02/177254202.db2.gz	DYLPHGZOYOZHSH-GFCCVEGCSA-N	1	0	278.400	1.385	50	0		CDAARO
Cc1cc(N2CCN(C(=O)c3cccn3C)CC2)cc(C)[nH+]1	ZINC000077392774	177262962	/nfs/dbraw/zinc/26/29/62/177262962.db2.gz	VOSLMSHEXRYIFW-UHFFFAOYSA-N	1	0	298.390	1.999	50	0		CDAARO
CCOCCC(=O)N(C)C[C@H]1Cc2ccccc2C[N@@H+]1C	ZINC000077452924	177270748	/nfs/dbraw/zinc/27/07/48/177270748.db2.gz	WALOJDACKMPKHI-MRXNPFEDSA-N	1	0	290.407	1.928	50	0		CDAARO
CC[NH+](CC)C[C@@H](C)NC(=O)Nc1cc(C)on1	ZINC000063975418	276330549	/nfs/dbraw/zinc/33/05/49/276330549.db2.gz	MCTCTAIKLRWZSN-SECBINFHSA-N	1	0	254.334	1.835	50	0		CDAARO
CNC(=O)[C@@H]1C[N@H+](CC2CCCCCC2)CCO1	ZINC000182446949	277009880	/nfs/dbraw/zinc/00/98/80/277009880.db2.gz	VINWDIRPYWCAMA-ZDUSSCGKSA-N	1	0	254.374	1.404	50	0		CDAARO
CN1CC[N@H+](C[C@H]2CCOc3ccccc3C2)CCC1=O	ZINC000095498843	277108701	/nfs/dbraw/zinc/10/87/01/277108701.db2.gz	GIPFSWUCSLIBKB-AWEZNQCLSA-N	1	0	288.391	1.792	50	0		CDAARO
CC(C)(C)c1ncsc1C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178544225	277277044	/nfs/dbraw/zinc/27/70/44/277277044.db2.gz	JPIHMOOSGGCUBS-VIFPVBQESA-N	1	0	267.398	1.861	50	0		CDAARO
C[C@H]1CCCN(S(=O)(=O)c2ccccc2)[C@H]1C[NH3+]	ZINC000252114538	278343610	/nfs/dbraw/zinc/34/36/10/278343610.db2.gz	IHMZNNHJCBLYEU-AAEUAGOBSA-N	1	0	268.382	1.435	50	0		CDAARO
Nc1cc(C[N@@H+]2CC3(CCOCC3)CC[C@@H]2CO)ccn1	ZINC000528643963	281264865	/nfs/dbraw/zinc/26/48/65/281264865.db2.gz	IHTQNOKPNKBUCF-CQSZACIVSA-N	1	0	291.395	1.248	50	0		CDAARO
C[C@@H]1C[N@@H+]2CCC[C@H]2CN1S(=O)(=O)C1CCCCC1	ZINC000257365403	288313914	/nfs/dbraw/zinc/31/39/14/288313914.db2.gz	CALABSORWRZEEB-OLZOCXBDSA-N	1	0	286.441	1.817	50	0		CDAARO
Cc1cnc2c(NCC[NH3+])nc3ccc(C)cc3n12	ZINC000001554390	281641639	/nfs/dbraw/zinc/64/16/39/281641639.db2.gz	PSPFQEBFYXJZEV-UHFFFAOYSA-N	1	0	255.325	1.870	50	0	in-vivo	CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1	ZINC000255089908	289355776	/nfs/dbraw/zinc/35/57/76/289355776.db2.gz	XMONNQXKGBKPON-PIZKADEWSA-N	1	0	287.363	1.009	50	0		CDAARO
Cc1cc(CC(=O)NCCc2cn3ccccc3n2)on1	ZINC000557475757	290347254	/nfs/dbraw/zinc/34/72/54/290347254.db2.gz	SLFWIYBQBQDAOA-UHFFFAOYSA-N	1	0	284.319	1.532	50	0		CDAARO
COc1ccccc1S(=O)(=O)N[C@H](C[NH3+])C1CCCC1	ZINC000192029188	295379220	/nfs/dbraw/zinc/37/92/20/295379220.db2.gz	LPNJCIDWOGIXKQ-GFCCVEGCSA-N	1	0	298.408	1.491	50	0		CDAARO
O=C(C[C@@H]1COCC[NH2+]1)N1CCC[C@@H]1c1ccccc1	ZINC000097815491	295538296	/nfs/dbraw/zinc/53/82/96/295538296.db2.gz	QJBVKOUKYUFYLF-HUUCEWRRSA-N	1	0	274.364	1.729	50	0		CDAARO
Cc1cc2c(cc1C)O[C@@H](C(=O)N(C)[C@H]1CC[NH2+]C1)C2	ZINC000179125563	301438215	/nfs/dbraw/zinc/43/82/15/301438215.db2.gz	DAWQPENOCVVXBI-DZGCQCFKSA-N	1	0	274.364	1.427	50	0		CDAARO
O=C(C[C@@H]1CCOC1)NCC1(C[NH+]2CCCC2)CC1	ZINC000534578997	328311090	/nfs/dbraw/zinc/31/10/90/328311090.db2.gz	AVTXXFNERUQLRY-ZDUSSCGKSA-N	1	0	266.385	1.405	50	0		CDAARO
C[C@H](C(=O)NCC1(CO)CCCC1)[NH+]1CCCC1	ZINC000534632934	328332026	/nfs/dbraw/zinc/33/20/26/328332026.db2.gz	SCIBNJLZVFLQKD-GFCCVEGCSA-N	1	0	254.374	1.140	50	0		CDAARO
O=C(NC[C@@H]1CC[NH2+]C[C@H]1O)C1CCCCCC1	ZINC000534637073	328334396	/nfs/dbraw/zinc/33/43/96/328334396.db2.gz	ZWUFOMZXANUAQX-QWHCGFSZSA-N	1	0	254.374	1.043	50	0		CDAARO
Cn1ccnc1C(=O)N[C@@H](CC[NH+](C)C)c1ccccc1	ZINC000534639462	328335545	/nfs/dbraw/zinc/33/55/45/328335545.db2.gz	KEQGGMQKCHGXIG-AWEZNQCLSA-N	1	0	286.379	1.843	50	0		CDAARO
Cc1nc(N)nc(NC[C@H](C(C)C)[NH+](C)C)c1Cl	ZINC000534651140	328337462	/nfs/dbraw/zinc/33/74/62/328337462.db2.gz	PKSZJFHEFNLYKH-SECBINFHSA-N	1	0	271.796	1.271	50	0		CDAARO
Cc1ncc(C(C)C)c(N[C@@H]2CC[NH2+]C[C@H]2O)n1	ZINC000534647842	328343098	/nfs/dbraw/zinc/34/30/98/328343098.db2.gz	DNPLABLVWFZGJR-VXGBXAGGSA-N	1	0	250.346	1.043	50	0		CDAARO
CN(Cc1cc(-c2cccs2)n[nH]1)C(=O)[C@H]1C=CC[NH2+]1	ZINC000534670171	328346907	/nfs/dbraw/zinc/34/69/07/328346907.db2.gz	MSAOOMGUUFUREI-LLVKDONJSA-N	1	0	288.376	1.625	50	0		CDAARO
O=C(NCC1(C[NH+]2CCCC2)CC1)[C@H](O)C1CCCCC1	ZINC000534676121	328356343	/nfs/dbraw/zinc/35/63/43/328356343.db2.gz	GKFSLWVQNOTZRB-OAHLLOKOSA-N	1	0	294.439	1.920	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)NCC1(CO)CCCC1	ZINC000135099535	328449075	/nfs/dbraw/zinc/44/90/75/328449075.db2.gz	JMBCZODGYQEGON-UHFFFAOYSA-N	1	0	254.374	1.045	50	0		CDAARO
COc1ccc(F)cc1C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179119432	329205528	/nfs/dbraw/zinc/20/55/28/329205528.db2.gz	NRQZEUWWNOVVSB-JTQLQIEISA-N	1	0	252.289	1.268	50	0		CDAARO
CCc1cnc(N)nc1N1CCC2(C1)CC[NH+](C)CC2	ZINC001772702535	1159437727	/nfs/dbraw/zinc/43/77/27/1159437727.db2.gz	SZEVKTMJKHFTTD-UHFFFAOYSA-N	1	0	275.400	1.543	50	0		CDAARO
Cc1c(C[NH2+][C@H](C)CC(=O)N2CCCCCC2)cnn1C	ZINC000090887670	482517565	/nfs/dbraw/zinc/51/75/65/482517565.db2.gz	UBANCXQIKUMZHM-CYBMUJFWSA-N	1	0	292.427	1.999	50	0		CDAARO
C[N@@H+](Cc1ccc(OCC(N)=O)cc1)C[C@@H]1CCOC1	ZINC000670437504	482980017	/nfs/dbraw/zinc/98/00/17/482980017.db2.gz	ORRDTFWGELZUCI-ZDUSSCGKSA-N	1	0	278.352	1.019	50	0		CDAARO
CN1CCC(CNC(=O)[C@H]2CC23CCC3)([NH+](C)C)CC1	ZINC000670442321	482989594	/nfs/dbraw/zinc/98/95/94/482989594.db2.gz	LLCCVCIZYPKOHC-CYBMUJFWSA-N	1	0	279.428	1.319	50	0		CDAARO
CCc1nccc(C[N@@H+]2CCC[C@@H](c3nnc(C)[nH]3)C2)n1	ZINC000670447226	482999163	/nfs/dbraw/zinc/99/91/63/482999163.db2.gz	LMISDGQKYDHYPE-GFCCVEGCSA-N	1	0	286.383	1.845	50	0		CDAARO
CCC[C@H](CNC(=O)[C@H]1CC[C@H](O)CC1)[NH+](C)C	ZINC000670455811	483034617	/nfs/dbraw/zinc/03/46/17/483034617.db2.gz	NIIRTVONXVWFAP-JHJVBQTASA-N	1	0	256.390	1.384	50	0		CDAARO
Cc1ncn(CCNC(=O)CCc2cccnc2)c1C	ZINC000670458006	483037569	/nfs/dbraw/zinc/03/75/69/483037569.db2.gz	KKRSFKBGMDCKAI-UHFFFAOYSA-N	1	0	272.352	1.644	50	0		CDAARO
CN(Cc1cc(C[NH+](C)C)cs1)Cc1nncn1C	ZINC000670460949	483046149	/nfs/dbraw/zinc/04/61/49/483046149.db2.gz	LQOOCCXEAMNFTP-UHFFFAOYSA-N	1	0	279.413	1.570	50	0		CDAARO
Cc1cc([C@H]2CCC[N@@H+](CCc3cnn(C)c3)C2)[nH]n1	ZINC000084111238	483248040	/nfs/dbraw/zinc/24/80/40/483248040.db2.gz	ZUZSBHMUKAZTSG-AWEZNQCLSA-N	1	0	273.384	1.874	50	0		CDAARO
C[NH+](C)C[C@@H]1CCCN1S(=O)(=O)c1ccccc1F	ZINC000061644674	521841735	/nfs/dbraw/zinc/84/17/35/521841735.db2.gz	RKKLZJBWZOXWHO-NSHDSACASA-N	1	0	286.372	1.540	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)C[C@H]2OCCc3ccccc32)C1	ZINC000179017699	522089016	/nfs/dbraw/zinc/08/90/16/522089016.db2.gz	QMQSZZOCLQXWSE-CZUORRHYSA-N	1	0	288.391	1.758	50	0		CDAARO
Cn1nnnc1SCCC[NH2+]Cc1ccccc1F	ZINC000004993833	527659922	/nfs/dbraw/zinc/65/99/22/527659922.db2.gz	OJIOKRXVAUZFHO-UHFFFAOYSA-N	1	0	281.360	1.621	50	0		CDAARO
CCC[N@@H+]1CCCN(C(=O)[C@H]2CCC[C@@H]2C(=O)OC)CC1	ZINC000096497085	528215718	/nfs/dbraw/zinc/21/57/18/528215718.db2.gz	SKKNDFREVVBXMM-KBPBESRZSA-N	1	0	296.411	1.520	50	0		CDAARO
O=C(NC[C@H]1OCCc2sccc21)[C@@H]1CCC[NH2+]1	ZINC000072501371	538343111	/nfs/dbraw/zinc/34/31/11/538343111.db2.gz	JDLWHCNSYXUGPE-WDEREUQCSA-N	1	0	266.366	1.230	50	0		CDAARO
CCC(CC)[C@@H]([NH3+])C1(O)C[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000958527716	614576716	/nfs/dbraw/zinc/57/67/16/614576716.db2.gz	FPHVFYSCUAZYLR-DAAZQVBGSA-N	1	0	275.414	1.221	50	0		CDAARO
Cc1cc(C(N)=O)c(N2[C@@H]3CC[C@H]2C[N@H+](C)CC3)nc1C	ZINC001704308359	1177681960	/nfs/dbraw/zinc/68/19/60/1177681960.db2.gz	OMIWQRQHYDVQGK-OLZOCXBDSA-N	1	0	288.395	1.470	50	0		CDAARO
Cc1cc2c(c(-c3cc(C(N)=O)ccn3)c1)O[C@@H](C[NH3+])C2	ZINC000067640976	755030849	/nfs/dbraw/zinc/03/08/49/755030849.db2.gz	JCBDXQRAWQLXGE-GFCCVEGCSA-N	1	0	283.331	1.418	50	0		CDAARO
CS(=O)(=O)c1ccc(-c2nc3c([nH]2)C[NH2+]CC3)cc1	ZINC000095367490	756832805	/nfs/dbraw/zinc/83/28/05/756832805.db2.gz	IQZOIVRHHLBEAY-UHFFFAOYSA-N	1	0	277.349	1.126	50	0		CDAARO
Cc1nccn1[C@@H](C)C(=O)NCCc1ccccn1	ZINC000426628252	757131300	/nfs/dbraw/zinc/13/13/00/757131300.db2.gz	MRRGBNNUCLBIIS-NSHDSACASA-N	1	0	258.325	1.506	50	0		CDAARO
Cc1ccc(C(=O)NC(C)C)cc1NC(=O)[C@H]1CCC[NH2+]1	ZINC000952976013	758726765	/nfs/dbraw/zinc/72/67/65/758726765.db2.gz	UFHWEIANBTWYOB-CYBMUJFWSA-N	1	0	289.379	1.824	50	0		CDAARO
O=C(c1ccncc1)N1CCC([NH2+]CCc2cn[nH]c2)CC1	ZINC000952987033	758759938	/nfs/dbraw/zinc/75/99/38/758759938.db2.gz	NKAIVVZIAWPLJM-UHFFFAOYSA-N	1	0	299.378	1.242	50	0		CDAARO
CN(C)c1cncc(C[C@@H]2CC[C@H](C[NH+]3CCCC3)O2)n1	ZINC000952854089	910409867	/nfs/dbraw/zinc/40/98/67/910409867.db2.gz	IUJHNRMNPYPUDL-LSDHHAIUSA-N	1	0	290.411	1.729	50	0		CDAARO
Cc1nn(C)c(Cl)c1C[NH2+]CCSc1c[nH]nn1	ZINC000952862943	910416010	/nfs/dbraw/zinc/41/60/10/910416010.db2.gz	SFRUDTXKCGPNKX-UHFFFAOYSA-N	1	0	286.792	1.382	50	0		CDAARO
C[C@@H]([NH2+][C@H]1C(=O)NCC1(C)C)C1(Br)CC1	ZINC000952876870	910435896	/nfs/dbraw/zinc/43/58/96/910435896.db2.gz	GXRXZSWZCUYMLJ-SFYZADRCSA-N	1	0	275.190	1.417	50	0		CDAARO
Nc1cc(N2CCC(OCC[NH+]3CCCC3)CC2)ncn1	ZINC000952880666	910442389	/nfs/dbraw/zinc/44/23/89/910442389.db2.gz	CYLOAIWLEMXECK-UHFFFAOYSA-N	1	0	291.399	1.140	50	0		CDAARO
CN(C[C@@H]1CCCO1)C(=O)C[NH+]1CCCCCC1	ZINC000823629728	925715493	/nfs/dbraw/zinc/71/54/93/925715493.db2.gz	OIYUAMJNQKLBSW-ZDUSSCGKSA-N	1	0	254.374	1.500	50	0		CDAARO
CCCCCOCC(=O)NCC[C@H]1CCC[N@@H+]1C	ZINC000585113807	930953008	/nfs/dbraw/zinc/95/30/08/930953008.db2.gz	RISBRHCQLYJXIL-CYBMUJFWSA-N	1	0	256.390	1.794	50	0		CDAARO
COc1ccccc1C[NH2+][C@H](C)[C@H]1CN(C)CCN1C	ZINC000585117532	930984528	/nfs/dbraw/zinc/98/45/28/930984528.db2.gz	JRCYAESXUDYRND-UKRRQHHQSA-N	1	0	277.412	1.419	50	0		CDAARO
Cc1noc([C@@H]2C[N@@H+](C[C@H]3CCCOCC3)CCN2C)n1	ZINC000585117577	930985816	/nfs/dbraw/zinc/98/58/16/930985816.db2.gz	MADCIYZAVFVIPT-KBPBESRZSA-N	1	0	294.399	1.483	50	0		CDAARO
CCC[C@]1(CO)CC[N@H+](CCn2nccc2C)C[C@H]1O	ZINC001529187581	969007358	/nfs/dbraw/zinc/00/73/58/969007358.db2.gz	VGAJUZROFCCMLQ-HUUCEWRRSA-N	1	0	281.400	1.037	50	0		CDAARO
CNc1nc(N2[C@@H]3CC[C@H]2C[N@H+](C)CC3)ncc1F	ZINC001506416107	975155602	/nfs/dbraw/zinc/15/56/02/975155602.db2.gz	UMBGXQXHQWHZPX-ZJUUUORDSA-N	1	0	265.336	1.330	50	0		CDAARO
C[C@H](C(=O)NC[C@@H](O)C1CCOCC1)[NH+]1CCCCCC1	ZINC000096436969	230372066	/nfs/dbraw/zinc/37/20/66/230372066.db2.gz	ZQNLNZHNAYVBTF-UKRRQHHQSA-N	1	0	298.427	1.155	50	0		CDAARO
O=C1C[C@H]2CC[C@@H](CN1Cc1noc(C3CCCC3)n1)[NH2+]2	ZINC000095500055	185000007	/nfs/dbraw/zinc/00/00/07/185000007.db2.gz	YYKDPKKBOOTQNA-NEPJUHHUSA-N	1	0	290.367	1.580	50	0		CDAARO
COC[C@@H](NC(=O)NC[C@H]1CCC[N@H+](C)C1)c1ccco1	ZINC000107357430	398140840	/nfs/dbraw/zinc/14/08/40/398140840.db2.gz	RVKWNRGNOKZRIT-CHWSQXEVSA-N	1	0	295.383	1.608	50	0		CDAARO
CC(=O)OC[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1O	ZINC000095626797	185016346	/nfs/dbraw/zinc/01/63/46/185016346.db2.gz	VSGFDXSAMDSNKW-CABCVRRESA-N	1	0	263.337	1.433	50	0		CDAARO
O=C1C[C@H]([NH2+]CC2CC2)C(=O)N1c1ccc(Cl)cc1	ZINC000095630528	185017085	/nfs/dbraw/zinc/01/70/85/185017085.db2.gz	TVPYRVWWNFLNIB-LBPRGKRZSA-N	1	0	278.739	1.972	50	0		CDAARO
COC(=O)[C@@H](C)C[C@@H](C)[NH2+]Cc1ccnc(OC)c1	ZINC000095940673	185035584	/nfs/dbraw/zinc/03/55/84/185035584.db2.gz	WPIOERJJJLZOLQ-WDEREUQCSA-N	1	0	266.341	1.768	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)/C=C/c1ccc2c(c1)CCO2	ZINC000124658738	187147754	/nfs/dbraw/zinc/14/77/54/187147754.db2.gz	ORMDJUHGLYAKOR-OGOUPESXSA-N	1	0	272.348	1.455	50	0		CDAARO
Cc1nsc(N2CCC[N@H+](C[C@@H]3CCOC3)CC2)n1	ZINC000095962576	185044845	/nfs/dbraw/zinc/04/48/45/185044845.db2.gz	CZKKTBCUVGEEKZ-LBPRGKRZSA-N	1	0	282.413	1.395	50	0		CDAARO
COC[C@@H](Cc1ccccc1)[NH2+][C@H](C)CN1CCOCC1	ZINC000095967313	185046432	/nfs/dbraw/zinc/04/64/32/185046432.db2.gz	QCZNLCHEZHZMMF-NVXWUHKLSA-N	1	0	292.423	1.554	50	0		CDAARO
C[C@@H](CSC(C)(C)C)[NH2+]CCS(C)(=O)=O	ZINC000095967521	185046900	/nfs/dbraw/zinc/04/69/00/185046900.db2.gz	PCXJSJHMPNDZJX-VIFPVBQESA-N	1	0	253.433	1.541	50	0		CDAARO
COC(=O)c1ccc([C@H](C)[N@@H+]2CC[C@@H](C)[C@@H](O)C2)o1	ZINC000095984151	185055570	/nfs/dbraw/zinc/05/55/70/185055570.db2.gz	AMLHDQJIXRPLBT-VWYCJHECSA-N	1	0	267.325	1.830	50	0		CDAARO
O=C(N[C@H]1CC[N@@H+](C2CC2)C1)c1cccn1C1CC1	ZINC000095994950	185060622	/nfs/dbraw/zinc/06/06/22/185060622.db2.gz	BZWBHEUZTFFWRP-NSHDSACASA-N	1	0	259.353	1.790	50	0		CDAARO
CC(C)OC[C@@H](C)[NH2+][C@@H](CO)Cc1ccccc1	ZINC000242273491	361754602	/nfs/dbraw/zinc/75/46/02/361754602.db2.gz	YDBQGQPKXHUKQS-UKRRQHHQSA-N	1	0	251.370	1.993	50	0		CDAARO
COc1ccccc1CCNC(=O)C[C@@H]1CC[NH2+]C1	ZINC000127800766	187334174	/nfs/dbraw/zinc/33/41/74/187334174.db2.gz	QRGGWZCUPAYKCJ-LBPRGKRZSA-N	1	0	262.353	1.354	50	0		CDAARO
Cc1ncc(C[n+]2csc3ccccc32)c(N)n1	ZINC000000313232	342088802	/nfs/dbraw/zinc/08/88/02/342088802.db2.gz	QYMKOMDTMVTGSO-UHFFFAOYSA-N	1	0	257.342	1.918	50	0		CDAARO
CNC(=O)CC1CC[NH+]([C@H]2CCCC[C@H]2O)CC1	ZINC000089907624	539087674	/nfs/dbraw/zinc/08/76/74/539087674.db2.gz	CFGNGTQDDKPSCG-QWHCGFSZSA-N	1	0	254.374	1.138	50	0		CDAARO
CNC(=O)Cn1cc(-c2cccc([C@H](C)[NH+](C)C)c2)cn1	ZINC000096140972	185106403	/nfs/dbraw/zinc/10/64/03/185106403.db2.gz	DAFZWIPJODIEIF-LBPRGKRZSA-N	1	0	286.379	1.919	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)c1cc(F)c(F)cc1Cl	ZINC000195544785	342626632	/nfs/dbraw/zinc/62/66/32/342626632.db2.gz	PCSWXJPMFVDXGM-MNOVXSKESA-N	1	0	290.697	1.335	50	0		CDAARO
NC(=O)N1CCC[N@@H+]([C@H]2CCc3c2cccc3F)CC1	ZINC000095406242	539088051	/nfs/dbraw/zinc/08/80/51/539088051.db2.gz	FJZMIMLFKMBKTO-AWEZNQCLSA-N	1	0	277.343	1.899	50	0		CDAARO
CCn1nc(C)c(NC(=O)CN2CCC[C@H]([NH3+])CC2)c1C	ZINC000244707796	361856629	/nfs/dbraw/zinc/85/66/29/361856629.db2.gz	KHRPQTPIPCWRGY-ZDUSSCGKSA-N	1	0	293.415	1.272	50	0		CDAARO
CCN(CC)C(=O)N1CCCC[C@H]([NH+]2CCN(C)CC2)C1	ZINC000095994946	539088278	/nfs/dbraw/zinc/08/82/78/539088278.db2.gz	OADRHYYCVPZGLC-HNNXBMFYSA-N	1	0	296.459	1.550	50	0		CDAARO
COc1cc(C[NH+]2CCC(O)CC2)cc2c1OCO2	ZINC000000209894	361910620	/nfs/dbraw/zinc/91/06/20/361910620.db2.gz	YJOJLXAUMJHZNV-UHFFFAOYSA-N	1	0	265.309	1.381	50	0		CDAARO
CC(C)N1C(=O)N[C@@]2(CC[N@H+](CC3CCCC3)C2)C1=O	ZINC000084597329	342265209	/nfs/dbraw/zinc/26/52/09/342265209.db2.gz	QDGYIILXKZCMDS-OAHLLOKOSA-N	1	0	279.384	1.581	50	0		CDAARO
NC(=O)[C@H]1C[N@@H+]([C@@H]2CCCCc3ccccc32)CCO1	ZINC000257365170	539096160	/nfs/dbraw/zinc/09/61/60/539096160.db2.gz	WTVCQOLEZGUJIU-HUUCEWRRSA-N	1	0	274.364	1.640	50	0		CDAARO
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1[NH2+]Cc1nccn1C	ZINC000084736435	342268324	/nfs/dbraw/zinc/26/83/24/342268324.db2.gz	ZMDKRWSUUYPQTA-KBPBESRZSA-N	1	0	292.427	1.793	50	0		CDAARO
C[C@H](CCn1cccn1)[NH2+][C@@H]1CCCC[C@H]1C(N)=O	ZINC000253369605	342416168	/nfs/dbraw/zinc/41/61/68/342416168.db2.gz	FODIDOQZNWPCBU-JHJVBQTASA-N	1	0	264.373	1.295	50	0		CDAARO
CC[NH+]1CCN(c2ccc(C(=O)OC)cc2N)CC1	ZINC000004843487	136391705	/nfs/dbraw/zinc/39/17/05/136391705.db2.gz	WPYMGXHYQXEUBR-UHFFFAOYSA-N	1	0	263.341	1.197	50	0		CDAARO
Cc1nnc(CN(C)CC[N@H+]2CCCC[C@@H]2C)o1	ZINC000252483257	362384914	/nfs/dbraw/zinc/38/49/14/362384914.db2.gz	DYBHNXWERIOSOX-NSHDSACASA-N	1	0	252.362	1.684	50	0		CDAARO
C[N@H+](CC(=O)N1CCNC1=O)[C@@H]1CCCc2ccccc21	ZINC000008126393	282345619	/nfs/dbraw/zinc/34/56/19/282345619.db2.gz	DTHDEJRARNBHNX-CQSZACIVSA-N	1	0	287.363	1.548	50	0		CDAARO
Cn1c(=O)[nH]cc(CC[NH+]2CCCCCCC2)c1=O	ZINC000253536495	362434713	/nfs/dbraw/zinc/43/47/13/362434713.db2.gz	GYGBIWULYHUEQA-UHFFFAOYSA-N	1	0	265.357	1.295	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@H](C[NH2+][C@H]2CCOC2)C1	ZINC000097372195	185590766	/nfs/dbraw/zinc/59/07/66/185590766.db2.gz	XAUVDQSSGQNPCX-NEPJUHHUSA-N	1	0	270.373	1.622	50	0		CDAARO
Cc1oncc1C(=O)NCCC12CCC[NH+]1CCC2	ZINC000223678162	346146497	/nfs/dbraw/zinc/14/64/97/346146497.db2.gz	SKMSECDVBZZKOZ-UHFFFAOYSA-N	1	0	263.341	1.731	50	0		CDAARO
O=C(CCC1CCCC1)N1CC[NH+](C[C@H](O)C2CC2)CC1	ZINC000085436591	179063158	/nfs/dbraw/zinc/06/31/58/179063158.db2.gz	MLRMZLTUTFTRFD-INIZCTEOSA-N	1	0	294.439	1.872	50	0		CDAARO
Cc1nc(-n2cccc2)cc(NCCNC(=O)C2CC2)[nH+]1	ZINC000085472158	179077216	/nfs/dbraw/zinc/07/72/16/179077216.db2.gz	PJKJVHRQTAHPRE-UHFFFAOYSA-N	1	0	285.351	1.514	50	0		CDAARO
CC(C)N1CC[C@H]([NH2+][C@@H]2CCC[C@H]3OCC[C@@H]32)C1=O	ZINC000089870012	179874948	/nfs/dbraw/zinc/87/49/48/179874948.db2.gz	MKHNSZDPYAELGA-YIYPIFLZSA-N	1	0	266.385	1.543	50	0		CDAARO
O=C(NCC[C@@H]1CCC[N@@H+]2CCCC[C@H]12)C1(CO)CC1	ZINC000584896155	349357533	/nfs/dbraw/zinc/35/75/33/349357533.db2.gz	NUFSRSCHDQROPW-UONOGXRCSA-N	1	0	280.412	1.530	50	0		CDAARO
C[N@@H+]1CCC2(C1)CCN(C(=O)c1cnc(N)s1)CC2	ZINC000584885069	349343220	/nfs/dbraw/zinc/34/32/20/349343220.db2.gz	PIAPFMKTWHFIIY-UHFFFAOYSA-N	1	0	280.397	1.114	50	0		CDAARO
CO[C@@H]1CCN(C(=O)C[NH+]2CCCCCCC2)C1	ZINC000584892653	349351856	/nfs/dbraw/zinc/35/18/56/349351856.db2.gz	YWULSEOWKMNBDJ-CYBMUJFWSA-N	1	0	254.374	1.500	50	0		CDAARO
CC(=O)Nc1cccc([C@H](C)[NH2+]C[C@]2(O)CCOC2)c1	ZINC000090848884	180045333	/nfs/dbraw/zinc/04/53/33/180045333.db2.gz	QIYOLRHGNGTHNC-XHDPSFHLSA-N	1	0	278.352	1.447	50	0		CDAARO
COCc1ccc(CN2CC[N@H+](C(C)C)[C@H](CCO)C2)o1	ZINC000104451748	186006736	/nfs/dbraw/zinc/00/67/36/186006736.db2.gz	BUPQBTWHRBCIHK-CQSZACIVSA-N	1	0	296.411	1.703	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@H]1NS(=O)(=O)c1ccc(F)cc1F	ZINC000091496836	180172417	/nfs/dbraw/zinc/17/24/17/180172417.db2.gz	MQBPSBGQDSAOIF-LDYMZIIASA-N	1	0	290.335	1.384	50	0		CDAARO
COc1ccc(S(=O)(=O)N[C@H]2CCC[NH2+][C@H]2C)cc1	ZINC000091496955	180172636	/nfs/dbraw/zinc/17/26/36/180172636.db2.gz	ZDCITDQMJRNFNM-GWCFXTLKSA-N	1	0	284.381	1.114	50	0		CDAARO
CN1CC[C@@]2(CN(Cc3ccco3)CC[N@@H+]2C)CCC1=O	ZINC000091518567	180177302	/nfs/dbraw/zinc/17/73/02/180177302.db2.gz	YSFSYAOLWWIUON-MRXNPFEDSA-N	1	0	291.395	1.408	50	0		CDAARO
Cc1c[nH+]ccc1NCCN1C[C@@]2(CCOC2)CCC1=O	ZINC000091625688	180209812	/nfs/dbraw/zinc/20/98/12/180209812.db2.gz	FBBUMLSZQOHHBQ-INIZCTEOSA-N	1	0	289.379	1.831	50	0		CDAARO
c1c[nH]c(CN2C[C@H]3CC[C@@H]2C[N@H+](Cc2cccnc2)C3)n1	ZINC000091651603	180217290	/nfs/dbraw/zinc/21/72/90/180217290.db2.gz	AOHQZPMIDPBOBV-JKSUJKDBSA-N	1	0	297.406	1.901	50	0		CDAARO
CC(C)[C@H]1CN(C(=O)c2nn(C)cc2Cl)C[C@@H]1[NH+](C)C	ZINC000091656930	180217692	/nfs/dbraw/zinc/21/76/92/180217692.db2.gz	XQLNJFPWWMWUJT-PWSUYJOCSA-N	1	0	298.818	1.732	50	0		CDAARO
Fc1ccc(C[NH2+]C[C@H]2CN(C3CC3)CCO2)c(F)c1	ZINC000106380770	186111663	/nfs/dbraw/zinc/11/16/63/186111663.db2.gz	HMPGRELXENHBLV-AWEZNQCLSA-N	1	0	282.334	1.918	50	0		CDAARO
FC(F)(F)CN1CCC[N@H+](C[C@H]2CCOC2)CC1	ZINC000107490765	186175397	/nfs/dbraw/zinc/17/53/97/186175397.db2.gz	FENKRAZBPPZYAX-LLVKDONJSA-N	1	0	266.307	1.593	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCN(S(=O)(=O)c2cccc(F)c2)C1	ZINC000109040352	186241410	/nfs/dbraw/zinc/24/14/10/186241410.db2.gz	HWSSQNNJGYUBKU-MNOVXSKESA-N	1	0	286.372	1.574	50	0		CDAARO
COCc1noc(C[NH2+][C@@H]2CCCCC[C@@H]2CO)n1	ZINC000126144823	351569659	/nfs/dbraw/zinc/56/96/59/351569659.db2.gz	DMWKTTWWVPWLSO-GHMZBOCLSA-N	1	0	269.345	1.247	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CN(C(=O)c2ccc(F)cc2Cl)CCO1	ZINC000122885992	187057522	/nfs/dbraw/zinc/05/75/22/187057522.db2.gz	CCYDMVGBYIUFGG-UFBFGSQYSA-N	1	0	286.734	1.667	50	0		CDAARO
COC[C@H](O)C[N@@H+]1C[C@@H](c2ccsc2)C[C@@H]1C	ZINC000195530808	363456547	/nfs/dbraw/zinc/45/65/47/363456547.db2.gz	CEZFHQKVRBAQLO-WCFLWFBJSA-N	1	0	255.383	1.933	50	0		CDAARO
C[NH+](C)CCc1c[nH]c2ccc(Cn3cncn3)cc12	ZINC000000005895	355879380	/nfs/dbraw/zinc/87/93/80/355879380.db2.gz	ULFRLSNUDGIQQP-UHFFFAOYSA-N	1	0	269.352	1.912	50	0	fda	CDAARO
O=C(C[NH+]1CCCCC1)N1CCN(c2ccccc2)CC1	ZINC000000028977	355879587	/nfs/dbraw/zinc/87/95/87/355879587.db2.gz	WQWCAMVCESGZRP-UHFFFAOYSA-N	1	0	287.407	1.821	50	0		CDAARO
COC(=O)[C@H](CCCC[NH3+])NC(=O)OCc1ccccc1	ZINC000002555065	355974021	/nfs/dbraw/zinc/97/40/21/355974021.db2.gz	CZWJWNQZTSMVAZ-ZDUSSCGKSA-N	1	0	294.351	1.583	50	0		CDAARO
COc1ccc(N2C(=O)C[C@H](SCC[NH3+])C2=O)cc1	ZINC000001821445	355952922	/nfs/dbraw/zinc/95/29/22/355952922.db2.gz	UPPLCWKFQXAGKI-NSHDSACASA-N	1	0	280.349	1.019	50	0		CDAARO
Cn1nnnc1SCC[NH2+]C/C=C/c1ccccc1	ZINC000002181781	355962345	/nfs/dbraw/zinc/96/23/45/355962345.db2.gz	FCBGYDYUJWATKN-VMPITWQZSA-N	1	0	275.381	1.605	50	0		CDAARO
C[C@@H](O)C1CCN(C(=O)[C@@H]2[NH2+]CCc3ccccc32)CC1	ZINC000195543390	363458960	/nfs/dbraw/zinc/45/89/60/363458960.db2.gz	LNVOSNSYMLUQSS-MLGOLLRUSA-N	1	0	288.391	1.493	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccnc(C3CC3)n2)C[C@H](C)[NH2+]1	ZINC000299738887	356264697	/nfs/dbraw/zinc/26/46/97/356264697.db2.gz	HXVBONAICSKUNA-AOOOYVTPSA-N	1	0	260.341	1.176	50	0		CDAARO
Cc1ccc(-c2cc(C(=O)N3CC[NH2+]CC3)[nH]n2)cc1	ZINC000011866611	356281878	/nfs/dbraw/zinc/28/18/78/356281878.db2.gz	DDQMYKDIZAJCBN-UHFFFAOYSA-N	1	0	270.336	1.431	50	0		CDAARO
O=C1C[C@@H]([NH2+]Cc2cnc[nH]2)CN1C1CCCCCC1	ZINC000011818866	356279548	/nfs/dbraw/zinc/27/95/48/356279548.db2.gz	JMRMAEHRRSNDDH-GFCCVEGCSA-N	1	0	276.384	1.823	50	0		CDAARO
COc1cccc(OC[C@H](O)C[NH2+]C2CCCC2)c1	ZINC000004320496	356242963	/nfs/dbraw/zinc/24/29/63/356242963.db2.gz	SHHURLJGQDGSSL-CYBMUJFWSA-N	1	0	265.353	1.967	50	0		CDAARO
COc1ccc(C[NH2+][C@H](C)CN2CCOCC2)cc1O	ZINC000036932751	356283398	/nfs/dbraw/zinc/28/33/98/356283398.db2.gz	OJPALARLYPHRJJ-GFCCVEGCSA-N	1	0	280.368	1.211	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCN(C(=O)COc2ccc(F)cc2F)C1	ZINC000299740004	356285802	/nfs/dbraw/zinc/28/58/02/356285802.db2.gz	UPQBRZUAWOJWCK-MNOVXSKESA-N	1	0	298.333	1.929	50	0		CDAARO
Cc1cc(C)c2oc(=O)cc(C[N@H+](C)CCO)c2c1	ZINC000004353951	356312583	/nfs/dbraw/zinc/31/25/83/356312583.db2.gz	XGBHCQFLWVTCHB-UHFFFAOYSA-N	1	0	261.321	1.834	50	0	biogenic	CDAARO
COc1ccc(C(=O)N2CCOC23CC[NH+](C)CC3)cc1	ZINC000013684137	356353135	/nfs/dbraw/zinc/35/31/35/356353135.db2.gz	IIQVTIXZWRYKHM-UHFFFAOYSA-N	1	0	290.363	1.590	50	0		CDAARO
NC(=O)c1ccccc1NC(=O)C[NH+]1CCCCCC1	ZINC000015952087	356428497	/nfs/dbraw/zinc/42/84/97/356428497.db2.gz	ZXRWAVBRLWYPDS-UHFFFAOYSA-N	1	0	275.352	1.600	50	0		CDAARO
CCOc1ccccc1CNCC[NH2+]C[C@H](C)O	ZINC000019370633	356482874	/nfs/dbraw/zinc/48/28/74/356482874.db2.gz	KILLFNAAZZVBED-LBPRGKRZSA-N	1	0	252.358	1.145	50	0		CDAARO
Cc1ncc2c(c1-c1noc(-c3nccn3C)n1)CC[NH2+]C2	ZINC000019229184	356477919	/nfs/dbraw/zinc/47/79/19/356477919.db2.gz	SGIRSTCFFDSAJF-UHFFFAOYSA-N	1	0	296.334	1.486	50	0		CDAARO
COc1ccc(CCN2CC[NH2+]CC2)cc1OC	ZINC000019801183	356505964	/nfs/dbraw/zinc/50/59/64/356505964.db2.gz	VNQCPVKUMSFXFN-UHFFFAOYSA-N	1	0	250.342	1.152	50	0		CDAARO
COc1ccc(C(=O)NC[C@@H]2CC[N@H+](C)C2)c(O)c1	ZINC000037647357	356516127	/nfs/dbraw/zinc/51/61/27/356516127.db2.gz	VXJMSUBDGCDVKF-JTQLQIEISA-N	1	0	264.325	1.082	50	0		CDAARO
Cn1ncc2c1ncnc2N1CCN(c2cc[nH+]cc2)CC1	ZINC000022018886	356596924	/nfs/dbraw/zinc/59/69/24/356596924.db2.gz	YSBBREPATJDPMI-UHFFFAOYSA-N	1	0	295.350	1.085	50	0		CDAARO
CC[NH+]1CCN([C@H](C)C(=O)Nc2ccccc2)CC1	ZINC000022912666	356624609	/nfs/dbraw/zinc/62/46/09/356624609.db2.gz	BKGFRRVHFOZVHI-CYBMUJFWSA-N	1	0	261.369	1.651	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)c1ccc(=O)[nH]n1)c1ccsc1	ZINC000023132868	356629622	/nfs/dbraw/zinc/62/96/22/356629622.db2.gz	KRIWGQUVTDFCEA-NSHDSACASA-N	1	0	292.364	1.276	50	0		CDAARO
CC(C)(C)OC(=O)N[C@]1(C(F)(F)F)CC[NH2+]C1	ZINC000025336429	356672897	/nfs/dbraw/zinc/67/28/97/356672897.db2.gz	CBRWRWRFOZZKCN-SECBINFHSA-N	1	0	254.252	1.806	50	0		CDAARO
COC(=O)[C@@H]1C[C@H]2CCC[N@@H+]2[C@]12c1ccccc1NC2=O	ZINC000012505487	356700217	/nfs/dbraw/zinc/70/02/17/356700217.db2.gz	GWGXYUQKCIFYGS-RSAASHCRSA-N	1	0	286.331	1.491	50	0		CDAARO
NC(=O)[C@H]([NH2+]C[C@@H]1Cc2ccccc2O1)c1ccccc1	ZINC000027032828	356702895	/nfs/dbraw/zinc/70/28/95/356702895.db2.gz	OGHGNCJYECCLBI-GOEBONIOSA-N	1	0	282.343	1.806	50	0		CDAARO
C[C@H](C(=O)NC[C@H]1COc2ccccc2O1)[NH+]1CCCC1	ZINC000028286249	356719284	/nfs/dbraw/zinc/71/92/84/356719284.db2.gz	UITYIZHPSJIEGD-OLZOCXBDSA-N	1	0	290.363	1.427	50	0		CDAARO
COc1ccccc1C[C@H](C)[NH2+][C@H]1CCCCNC1=O	ZINC000004022935	356735791	/nfs/dbraw/zinc/73/57/91/356735791.db2.gz	PRMOMIGBCGVQBO-JSGCOSHPSA-N	1	0	276.380	1.885	50	0		CDAARO
COCC(=O)NC1CC[NH+](CCc2ccccc2)CC1	ZINC000027938922	356715887	/nfs/dbraw/zinc/71/58/87/356715887.db2.gz	TWOHPXKBCUQRMN-UHFFFAOYSA-N	1	0	276.380	1.456	50	0		CDAARO
CCN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000036132166	356861676	/nfs/dbraw/zinc/86/16/76/356861676.db2.gz	XNPPSQLGKDCRRF-UHFFFAOYSA-N	1	0	268.382	1.321	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1cnc(C(=O)OC)cn1	ZINC000584908605	357142859	/nfs/dbraw/zinc/14/28/59/357142859.db2.gz	IZDFHCPCBCONTQ-LLVKDONJSA-N	1	0	278.356	1.550	50	0		CDAARO
CN1C[C@H]([NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)CCC1=O	ZINC000245339037	283245535	/nfs/dbraw/zinc/24/55/35/283245535.db2.gz	QCSIWJPUYBPFBG-GBOPCIDUSA-N	1	0	278.396	1.545	50	0		CDAARO
CCC1(CC)[C@H]([N@H+](C)CCC(=O)NC)C[C@@H]1OC	ZINC000095424700	357349438	/nfs/dbraw/zinc/34/94/38/357349438.db2.gz	BDCJDKAZBMTGPU-NEPJUHHUSA-N	1	0	256.390	1.648	50	0		CDAARO
COc1ccc(C[C@H](C[NH3+])CO)cc1Br	ZINC000063065248	357502631	/nfs/dbraw/zinc/50/26/31/357502631.db2.gz	KDOUUEQTPBNYQY-SECBINFHSA-N	1	0	274.158	1.567	50	0		CDAARO
O=c1cc(N2CC[NH2+]CC2)c(-c2ccccc2)n[nH]1	ZINC000063110790	357504566	/nfs/dbraw/zinc/50/45/66/357504566.db2.gz	BTLOOVKBRJZVLB-UHFFFAOYSA-N	1	0	256.309	1.259	50	0		CDAARO
CCOc1cccc(OCC[NH2+][C@H](C(N)=O)C(C)C)c1	ZINC000065366141	357531793	/nfs/dbraw/zinc/53/17/93/357531793.db2.gz	NZPBKQDETBFVIE-AWEZNQCLSA-N	1	0	280.368	1.564	50	0		CDAARO
CC(C)[C@H]([NH2+]CC(=O)NC1CCCCCCC1)C(N)=O	ZINC000065380954	357532941	/nfs/dbraw/zinc/53/29/41/357532941.db2.gz	CJKNXAXIZJJVSI-AWEZNQCLSA-N	1	0	283.416	1.315	50	0		CDAARO
CC(C)Oc1ccc([C@@H]2[NH2+]CCc3nc[nH]c32)cc1CO	ZINC000065525811	357547212	/nfs/dbraw/zinc/54/72/12/357547212.db2.gz	ZFWFVDVNGGMPRW-HNNXBMFYSA-N	1	0	287.363	1.924	50	0		CDAARO
[NH3+]C[C@H]1CCN(Cc2cnc(NCc3ccccc3)nc2)C1	ZINC000067758088	357624825	/nfs/dbraw/zinc/62/48/25/357624825.db2.gz	KHRXQLCMLVVHNH-OAHLLOKOSA-N	1	0	297.406	1.869	50	0		CDAARO
Cc1nc(CC[NH3+])cc(N[C@H](CO)c2ccccc2)n1	ZINC000067821639	357630130	/nfs/dbraw/zinc/63/01/30/357630130.db2.gz	GEBVRTDKHASONV-CQSZACIVSA-N	1	0	272.352	1.432	50	0		CDAARO
CN(CCc1cn[nH]c1)C(=O)C[NH+]1CCCCCC1	ZINC000067654730	357616565	/nfs/dbraw/zinc/61/65/65/357616565.db2.gz	VHBPAILXPRJEFW-UHFFFAOYSA-N	1	0	264.373	1.287	50	0		CDAARO
C[NH+](C)CC(=O)N1CCCC[C@@H]1CCc1ccccn1	ZINC000067712600	357619563	/nfs/dbraw/zinc/61/95/63/357619563.db2.gz	GMCVILQVBIZNDK-OAHLLOKOSA-N	1	0	275.396	1.957	50	0		CDAARO
O=C(c1cccc2c1OCC2)N1CC[C@@]2(C1)CCC[NH2+]C2	ZINC000067713613	357620488	/nfs/dbraw/zinc/62/04/88/357620488.db2.gz	YSBAOMWKRFJGSI-KRWDZBQOSA-N	1	0	286.375	1.837	50	0		CDAARO
Cn1nnc2cc(C(=O)Nc3cnc4n3CCCC4)ccc21	ZINC000067727301	357621290	/nfs/dbraw/zinc/62/12/90/357621290.db2.gz	OTQUXVRDANQWRA-UHFFFAOYSA-N	1	0	296.334	1.753	50	0		CDAARO
Cc1ccc(O)c(C(=O)N2CC[C@]3(C2)CCC[NH2+]C3)c1	ZINC000067920297	357637145	/nfs/dbraw/zinc/63/71/45/357637145.db2.gz	NXCAPQZYYFIYAA-MRXNPFEDSA-N	1	0	274.364	1.916	50	0		CDAARO
COC(=O)CCN1CC[N@H+](Cc2cccs2)[C@@H](C)C1	ZINC000097100165	357970710	/nfs/dbraw/zinc/97/07/10/357970710.db2.gz	JBTACGIUUCMXTE-LBPRGKRZSA-N	1	0	282.409	1.817	50	0		CDAARO
COC(=O)C1(C[NH2+]Cc2cnn(C)c2C)CCCCC1	ZINC000097108671	357984416	/nfs/dbraw/zinc/98/44/16/357984416.db2.gz	ANIQORKURDHYGO-UHFFFAOYSA-N	1	0	279.384	1.942	50	0		CDAARO
Nc1ncccc1CN1CCC[C@@](O)(C[NH+]2CCCC2)C1	ZINC000077406085	358018997	/nfs/dbraw/zinc/01/89/97/358018997.db2.gz	IOEMTTWALLKRJD-MRXNPFEDSA-N	1	0	290.411	1.087	50	0		CDAARO
Cc1ccccc1N1CCN(C(=O)Cn2ccnc2)[C@@H](C)C1	ZINC000077440399	358019404	/nfs/dbraw/zinc/01/94/04/358019404.db2.gz	CHKJGWOKNLMJTC-HNNXBMFYSA-N	1	0	298.390	1.929	50	0		CDAARO
C[NH+](C)C[C@H]1CN(C(=O)Nc2ccc(F)cc2)CCO1	ZINC000089314227	358403237	/nfs/dbraw/zinc/40/32/37/358403237.db2.gz	NUZHIPKFKDTOPX-ZDUSSCGKSA-N	1	0	281.331	1.620	50	0		CDAARO
C[C@@H](C[N@H+](C)CC(=O)N1CCOCC1)c1ccc(F)cc1	ZINC000195572799	358567464	/nfs/dbraw/zinc/56/74/64/358567464.db2.gz	IUAMEHXUFSBDNR-ZDUSSCGKSA-N	1	0	294.370	1.720	50	0		CDAARO
O=C(NCC1(O)CC[NH2+]CC1)OCc1ccccc1	ZINC000095218136	358679938	/nfs/dbraw/zinc/67/99/38/358679938.db2.gz	SUTLAODQXUHTTO-UHFFFAOYSA-N	1	0	264.325	1.027	50	0		CDAARO
c1nc2c([nH]1)CN(C1CC[NH+](Cc3ccccn3)CC1)CC2	ZINC000097243754	358760719	/nfs/dbraw/zinc/76/07/19/358760719.db2.gz	GHFRQMDHZPYYKP-UHFFFAOYSA-N	1	0	297.406	1.827	50	0		CDAARO
Cc1ccsc1C[N@@H+]1CCC[C@](O)(CO)CC1	ZINC000097307560	358766735	/nfs/dbraw/zinc/76/67/35/358766735.db2.gz	WRQYZVSVMCVZRG-CYBMUJFWSA-N	1	0	255.383	1.766	50	0		CDAARO
NC(=O)c1cccnc1-c1cccc(N2CC[NH2+]CC2)c1	ZINC000096151847	358709399	/nfs/dbraw/zinc/70/93/99/358709399.db2.gz	CRMWUGCZMYWXCU-UHFFFAOYSA-N	1	0	282.347	1.257	50	0		CDAARO
O=C(N[C@@H]1CCC[NH2+]C1)c1cnc(-c2ccncc2)nc1	ZINC000097475466	358779216	/nfs/dbraw/zinc/77/92/16/358779216.db2.gz	SDVCPGNCTHTYAD-CYBMUJFWSA-N	1	0	283.335	1.020	50	0		CDAARO
O=C(C[NH2+]C1CC1)N[C@H](c1ccccn1)C(F)(F)F	ZINC000215753800	358901998	/nfs/dbraw/zinc/90/19/98/358901998.db2.gz	YMWZWTLEGWJSIA-LLVKDONJSA-N	1	0	273.258	1.553	50	0		CDAARO
Cc1cc(=O)cc(C(=O)NCC2([NH+](C)C)CCCCC2)o1	ZINC000216469337	358946538	/nfs/dbraw/zinc/94/65/38/358946538.db2.gz	OIAHCDVOZYLNOZ-UHFFFAOYSA-N	1	0	292.379	1.943	50	0		CDAARO
OCC[NH+]1CCN(CCCOc2ccccc2)CC1	ZINC000022891157	359141002	/nfs/dbraw/zinc/14/10/02/359141002.db2.gz	FEOKPQAJWTUTKA-UHFFFAOYSA-N	1	0	264.369	1.065	50	0		CDAARO
O=c1cc(C2CC[NH2+]CC2)nc(-c2cccs2)[nH]1	ZINC000023506627	359153705	/nfs/dbraw/zinc/15/37/05/359153705.db2.gz	FQCJPNGPVKLZHL-UHFFFAOYSA-N	1	0	261.350	1.965	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](NS(=O)(=O)c2ccc(N)cc2)C1	ZINC000048505744	359207825	/nfs/dbraw/zinc/20/78/25/359207825.db2.gz	DGLWZXSBTXMOOG-GFCCVEGCSA-N	1	0	283.397	1.031	50	0		CDAARO
COc1cc(C[NH2+]CC(C)(C)N(C)C)cc2c1OCCO2	ZINC000025362767	359360435	/nfs/dbraw/zinc/36/04/35/359360435.db2.gz	UFTUOBJOPBTEPZ-UHFFFAOYSA-N	1	0	294.395	1.896	50	0		CDAARO
C[NH+](C)[C@@H](Cc1ccccc1)C(=O)NCC1(C)COC1	ZINC000112728435	359351233	/nfs/dbraw/zinc/35/12/33/359351233.db2.gz	ANCNZZBZHQEZTI-AWEZNQCLSA-N	1	0	276.380	1.312	50	0		CDAARO
CN1C(=O)[C@H]2C[N@H+](Cc3c[nH]c4ccccc34)C[C@H]2C1=O	ZINC000257186219	359522388	/nfs/dbraw/zinc/52/23/88/359522388.db2.gz	YQMMUDOCCKLANT-BETUJISGSA-N	1	0	283.331	1.215	50	0		CDAARO
C[C@@H](Oc1ccccc1)C(=O)NC1CC[NH+](C)CC1	ZINC000012380622	359543211	/nfs/dbraw/zinc/54/32/11/359543211.db2.gz	FAVDGRBVFPVLKR-GFCCVEGCSA-N	1	0	262.353	1.664	50	0		CDAARO
CCn1cc(C[NH+]2CCC3(CC2)C[C@@H](O)CCO3)c(C)n1	ZINC000257191250	359588164	/nfs/dbraw/zinc/58/81/64/359588164.db2.gz	PPSULUXDRPXSPX-HNNXBMFYSA-N	1	0	293.411	1.717	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)Nc1ccc(F)cn1	ZINC000296811522	200005521	/nfs/dbraw/zinc/00/55/21/200005521.db2.gz	MBMSWYUHKJSCAH-LLVKDONJSA-N	1	0	266.320	1.827	50	0		CDAARO
CCC[N@H+](C)C[C@@H]1CCN(C(=O)CCc2ccncn2)C1	ZINC000191268005	359610686	/nfs/dbraw/zinc/61/06/86/359610686.db2.gz	QMKHZNDPTAHMHH-AWEZNQCLSA-N	1	0	290.411	1.600	50	0		CDAARO
CC(C)n1ccc(C(=O)N[C@@H]2CCC[C@H]2[NH+](C)C)n1	ZINC000408516178	359899094	/nfs/dbraw/zinc/89/90/94/359899094.db2.gz	VPECJFQGSHXFRS-DGCLKSJQSA-N	1	0	264.373	1.677	50	0		CDAARO
O=C(CC[N@@H+]1CC[C@@H](c2nnc[nH]2)C1)Nc1ccccc1	ZINC000408524900	359934529	/nfs/dbraw/zinc/93/45/29/359934529.db2.gz	PDJOPKWAXMMEMR-GFCCVEGCSA-N	1	0	285.351	1.623	50	0		CDAARO
C[C@@H]1C[C@@H]([NH3+])CCN1S(=O)(=O)CC1CCCC1	ZINC000566412019	360112632	/nfs/dbraw/zinc/11/26/32/360112632.db2.gz	PVXSTWNKVDCPEA-PWSUYJOCSA-N	1	0	260.403	1.318	50	0		CDAARO
C[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)CCCn1cccn1	ZINC000248108566	360362207	/nfs/dbraw/zinc/36/22/07/360362207.db2.gz	GNRQTBWMOVYMMJ-LSDHHAIUSA-N	1	0	290.411	1.749	50	0		CDAARO
CC(=O)Nc1ccc(C(=O)O[C@H](C)C[NH+](C)C)cc1	ZINC000143841646	360536905	/nfs/dbraw/zinc/53/69/05/360536905.db2.gz	QLYIOURIXWBCJF-SNVBAGLBSA-N	1	0	264.325	1.752	50	0		CDAARO
Cc1cc(C)n2ncc(CN3C[C@H]4CC[C@@H](C3)[C@H]4[NH3+])c2n1	ZINC000426661174	360693368	/nfs/dbraw/zinc/69/33/68/360693368.db2.gz	DFABBUODCBUCBA-NHAGDIPZSA-N	1	0	285.395	1.515	50	0		CDAARO
Cc1nn(C)c(C(=O)NCCn2ccnc2)c1Cl	ZINC000426370934	360660084	/nfs/dbraw/zinc/66/00/84/360660084.db2.gz	JVWJGDRMZATBKE-UHFFFAOYSA-N	1	0	267.720	1.008	50	0		CDAARO
Cc1c[nH+]ccc1NCCNc1cc([C@@H]2CCOC2)ncn1	ZINC000426712555	360698531	/nfs/dbraw/zinc/69/85/31/360698531.db2.gz	BVCAFQWVNMYQLF-CYBMUJFWSA-N	1	0	299.378	1.052	50	0		CDAARO
CNC(=O)c1nc(-c2cccc([C@@H](C)[NH+]3CCCC3)c2)n[nH]1	ZINC000426707472	360698667	/nfs/dbraw/zinc/69/86/67/360698667.db2.gz	SEVCTDKVAPGJPS-LLVKDONJSA-N	1	0	299.378	1.988	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2c[nH]nc2-c2ccccc2)C1	ZINC000178971414	189158618	/nfs/dbraw/zinc/15/86/18/189158618.db2.gz	XGEGXRBRMHSJRU-LBPRGKRZSA-N	1	0	284.363	1.758	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)COc2ccccc2Cl)C1	ZINC000178994519	189160352	/nfs/dbraw/zinc/16/03/52/189160352.db2.gz	BBPFUAIJFCBKMW-NSHDSACASA-N	1	0	282.771	1.787	50	0		CDAARO
CN(C(=O)CCc1cc(F)ccc1F)[C@@H]1CC[NH2+]C1	ZINC000179102217	189169698	/nfs/dbraw/zinc/16/96/98/189169698.db2.gz	MYRHQOUICGPSHU-GFCCVEGCSA-N	1	0	268.307	1.718	50	0		CDAARO
O=C(NC[C@@H]1CCC[NH2+]C1)c1cccc(Cl)n1	ZINC000129992904	360902146	/nfs/dbraw/zinc/90/21/46/360902146.db2.gz	HESQXBGHCGWSSB-SECBINFHSA-N	1	0	253.733	1.464	50	0		CDAARO
C[N@H+](Cc1ccncc1)C1CCN(CCn2cccn2)CC1	ZINC000130393297	360948794	/nfs/dbraw/zinc/94/87/94/360948794.db2.gz	UGNKMDCHOOGNFX-UHFFFAOYSA-N	1	0	299.422	1.875	50	0		CDAARO
C[C@@H]1CCCN(C(=O)CC[C@@H]2CCCOC2)[C@H]1C[NH3+]	ZINC000299738734	200850466	/nfs/dbraw/zinc/85/04/66/200850466.db2.gz	FSJVGQNNRVVCND-RDBSUJKOSA-N	1	0	268.401	1.779	50	0		CDAARO
Cc1ccc(OCC[NH3+])c(C(=O)N(C)CC2(C)COC2)c1	ZINC000299801376	200879319	/nfs/dbraw/zinc/87/93/19/200879319.db2.gz	WXGSDBJHYHVQCU-UHFFFAOYSA-N	1	0	292.379	1.441	50	0		CDAARO
CC1(C)NC(=[NH2+])NC(=N)N1c1ccc(Cl)cc1	ZINC000000001233	361266360	/nfs/dbraw/zinc/26/63/60/361266360.db2.gz	QMNFFXRFOJIOKZ-UHFFFAOYSA-N	1	0	251.721	1.526	50	0	world	CDAARO
[NH3+][C@H]1CCN(C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000335591180	361602487	/nfs/dbraw/zinc/60/24/87/361602487.db2.gz	NZKWLKMHZRSLSC-NSHDSACASA-N	1	0	287.285	1.948	50	0		CDAARO
C[N@H+](CCn1cccn1)[C@@H]1CCc2ccccc2NC1=O	ZINC000192019484	361587221	/nfs/dbraw/zinc/58/72/21/361587221.db2.gz	HMPUBSHATCMXNG-OAHLLOKOSA-N	1	0	284.363	1.768	50	0		CDAARO
CC1=CC[N@H+](C[C@@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000339659368	361685796	/nfs/dbraw/zinc/68/57/96/361685796.db2.gz	PKBTZZJUSSKQFA-CYBMUJFWSA-N	1	0	291.347	1.807	50	0		CDAARO
CNC(=O)c1cccnc1NC[C@H](c1ccco1)[NH+](C)C	ZINC000301381617	364242495	/nfs/dbraw/zinc/24/24/95/364242495.db2.gz	ZJYLZKSDFCKPCI-GFCCVEGCSA-N	1	0	288.351	1.749	50	0		CDAARO
C[C@H](CCC(=O)NCCn1cccn1)[NH+]1CCCC1	ZINC000221214566	189725125	/nfs/dbraw/zinc/72/51/25/189725125.db2.gz	YUPJLZPHSHHVQT-CYBMUJFWSA-N	1	0	264.373	1.264	50	0		CDAARO
COC[C@H](O)CN1CCC([NH2+]Cc2ccccc2)CC1	ZINC000089800793	366936208	/nfs/dbraw/zinc/93/62/08/366936208.db2.gz	UIVJVLFGLSPPQT-MRXNPFEDSA-N	1	0	278.396	1.248	50	0		CDAARO
COC(=O)CC[N@H+](C)[C@H](C)C(=O)NCc1ccccc1C	ZINC000252508514	367656322	/nfs/dbraw/zinc/65/63/22/367656322.db2.gz	XOLINZKHCRZHBW-CYBMUJFWSA-N	1	0	292.379	1.495	50	0		CDAARO
O=C([C@H]1CCC[N@@H+]1C1CCOCC1)N1CC(C2CCC2)C1	ZINC000367666636	296109217	/nfs/dbraw/zinc/10/92/17/296109217.db2.gz	VPHFKNZCIIUHKW-MRXNPFEDSA-N	1	0	292.423	1.888	50	0		CDAARO
CC(C)[C@@H](O)C[N@@H+]1CCC[C@@H](c2ccnc(N)n2)C1	ZINC000367928101	369291492	/nfs/dbraw/zinc/29/14/92/369291492.db2.gz	HVVVGZZCRFCNFU-YPMHNXCESA-N	1	0	264.373	1.085	50	0		CDAARO
CC(C)(C)OC(=O)N1CCn2cnc(C[NH3+])c2C1	ZINC000089195524	370451677	/nfs/dbraw/zinc/45/16/77/370451677.db2.gz	PMRJWAFBVXFGAP-UHFFFAOYSA-N	1	0	252.318	1.093	50	0		CDAARO
O=C(NCC1CC[NH+]([C@H]2CCOC2)CC1)c1ccco1	ZINC000575608558	370623188	/nfs/dbraw/zinc/62/31/88/370623188.db2.gz	TYUMSQYIYSARIA-ZDUSSCGKSA-N	1	0	278.352	1.510	50	0		CDAARO
[NH3+][C@H]1CCN(Cc2ccc(Br)cc2)C1	ZINC000042317173	372343935	/nfs/dbraw/zinc/34/39/35/372343935.db2.gz	ZHJQXMFKXUEQEM-NSHDSACASA-N	1	0	255.159	1.982	50	0		CDAARO
COc1cc2[nH]cc(CC[NH3+])c2c(OC)c1OC	ZINC000002037281	372352059	/nfs/dbraw/zinc/35/20/59/372352059.db2.gz	MEHYOLHJCSYBTI-UHFFFAOYSA-N	1	0	250.298	1.695	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@H]([NH3+])CN1Cc1cccc2ccccc21	ZINC000299788940	372764825	/nfs/dbraw/zinc/76/48/25/372764825.db2.gz	VOTRCZXVFICJPM-RDJZCZTQSA-N	1	0	297.402	1.878	50	0		CDAARO
CCn1nccc1CC[N@@H+]1CC[C@@H](CN2CCOCC2)C1	ZINC000253420292	373730213	/nfs/dbraw/zinc/73/02/13/373730213.db2.gz	HEEXWLJIQCGHSN-OAHLLOKOSA-N	1	0	292.427	1.100	50	0		CDAARO
Cc1ccc(CN2C(=[NH2+])S[C@@H]3CS(=O)(=O)C[C@@H]32)cc1	ZINC000102775804	373737579	/nfs/dbraw/zinc/73/75/79/373737579.db2.gz	JYVNZVYQTGDGNP-NWDGAFQWSA-N	1	0	296.417	1.644	50	0		CDAARO
OC1(C[NH2+]Cc2cc(F)ccc2F)CCOCC1	ZINC000112717300	374227750	/nfs/dbraw/zinc/22/77/50/374227750.db2.gz	BJMWDVQOPKIOJI-UHFFFAOYSA-N	1	0	257.280	1.596	50	0		CDAARO
CC(C)[NH+](CCNC(=O)c1ccc(=O)oc1)C(C)C	ZINC000002431282	374475073	/nfs/dbraw/zinc/47/50/73/374475073.db2.gz	QXDRKQCQWBMPHX-UHFFFAOYSA-N	1	0	266.341	1.488	50	0		CDAARO
COc1ccc(CN2CCC[N@H+](C)CC2)cc1OC	ZINC000019537627	374749176	/nfs/dbraw/zinc/74/91/76/374749176.db2.gz	KYPHCVQAVGTDOD-UHFFFAOYSA-N	1	0	264.369	1.841	50	0		CDAARO
CCn1cnnc1C1CCN(C(=O)[C@@H]([NH3+])CC(C)C)CC1	ZINC000095466776	374961885	/nfs/dbraw/zinc/96/18/85/374961885.db2.gz	YMVDTXAOOGKRRL-ZDUSSCGKSA-N	1	0	293.415	1.377	50	0		CDAARO
Oc1ccccc1N1CC[NH+](CCn2ccnc2)CC1	ZINC000095409715	374913210	/nfs/dbraw/zinc/91/32/10/374913210.db2.gz	USMXMLMVTBDVBO-UHFFFAOYSA-N	1	0	272.352	1.411	50	0		CDAARO
O=C(Nc1c[nH+]ccc1N1CCCCC1)[C@H]1COCCO1	ZINC000095958976	375041236	/nfs/dbraw/zinc/04/12/36/375041236.db2.gz	LHKPYBZJLJMFSC-CQSZACIVSA-N	1	0	291.351	1.426	50	0		CDAARO
CCn1cc(CN2CC[N@H+](C)C[C@@H]2C(C)C)cn1	ZINC000097059021	375142818	/nfs/dbraw/zinc/14/28/18/375142818.db2.gz	QKIJORZJRJEAPJ-CQSZACIVSA-N	1	0	250.390	1.675	50	0		CDAARO
COC[C@@H]1CCC[N@H+](CC(=O)NCc2ccc(C)cc2)C1	ZINC000056908368	375385557	/nfs/dbraw/zinc/38/55/57/375385557.db2.gz	BNPJFUXRFMRZDB-MRXNPFEDSA-N	1	0	290.407	1.970	50	0		CDAARO
CC[NH+](CC)CCOC(=O)c1ccc(S(C)(=O)=O)cc1	ZINC000003265784	375613160	/nfs/dbraw/zinc/61/31/60/375613160.db2.gz	BJGRXSHUFJCQAK-UHFFFAOYSA-N	1	0	299.392	1.589	50	0		CDAARO
Nc1cc(N)[nH+]c(SCC(=O)c2cc(F)ccc2F)n1	ZINC000003349815	375657004	/nfs/dbraw/zinc/65/70/04/375657004.db2.gz	QPBJYVUYCGKNIB-UHFFFAOYSA-N	1	0	296.302	1.894	50	0		CDAARO
CNC(=O)c1ccc(C[N@H+](C)[C@H]2CCCC[C@H]2O)o1	ZINC000239539254	376016725	/nfs/dbraw/zinc/01/67/25/376016725.db2.gz	AVYSPKCBHCKFIZ-NWDGAFQWSA-N	1	0	266.341	1.375	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cccc(-c3n[nH]c(C)n3)c2)C1	ZINC000429449363	247481233	/nfs/dbraw/zinc/48/12/33/247481233.db2.gz	RZVPSNGSGDJSSR-GFCCVEGCSA-N	1	0	299.378	1.462	50	0		CDAARO
Cc1nn(C)c(C(=O)NC2CC[NH+](C(C)C)CC2)c1Cl	ZINC000002781207	378054433	/nfs/dbraw/zinc/05/44/33/378054433.db2.gz	ZFFMNIDHBPZXRE-UHFFFAOYSA-N	1	0	298.818	1.985	50	0		CDAARO
O=C1CC[C@@H]2C[N@H+](C[C@@H]3CCOC3)CC[C@@H]2N1C1CC1	ZINC000343555440	378907444	/nfs/dbraw/zinc/90/74/44/378907444.db2.gz	XLWKOTKFGILDGQ-GUTXKFCHSA-N	1	0	278.396	1.498	50	0		CDAARO
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C[NH3+])cc1	ZINC000022161896	296320472	/nfs/dbraw/zinc/32/04/72/296320472.db2.gz	LLJIOVQMEOKVCQ-LLVKDONJSA-N	1	0	268.382	1.708	50	0		CDAARO
CCC[C@@H]([NH2+]CCNC(=O)c1ccn[nH]1)C1CCC1	ZINC000453193054	252281028	/nfs/dbraw/zinc/28/10/28/252281028.db2.gz	DCYFYXLFUZFYHD-GFCCVEGCSA-N	1	0	264.373	1.698	50	0		CDAARO
CCOc1ccccc1/C=C\C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000493192017	253394931	/nfs/dbraw/zinc/39/49/31/253394931.db2.gz	QKYXPHQRTZHGHE-QIAWRQBBSA-N	1	0	274.364	1.919	50	0		CDAARO
COc1ccc(C)cc1/C=C\C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000493482508	253473153	/nfs/dbraw/zinc/47/31/53/253473153.db2.gz	JEMGXIUGYSJOBG-BRLPQQTGSA-N	1	0	274.364	1.837	50	0		CDAARO
C[NH+]1CCN(CCCCOc2ccccc2C=O)CC1	ZINC000020327325	390232049	/nfs/dbraw/zinc/23/20/49/390232049.db2.gz	FDGXABIAEZTJCM-UHFFFAOYSA-N	1	0	276.380	1.906	50	0		CDAARO
CC(C)CC[NH+]1CCN(CCOC[C@H]2CCCO2)CC1	ZINC000096421132	390514339	/nfs/dbraw/zinc/51/43/39/390514339.db2.gz	GMQXLXWACSTJSL-MRXNPFEDSA-N	1	0	284.444	1.846	50	0		CDAARO
COc1ccc(Br)c(C(=O)NCCC[NH3+])c1	ZINC000019427447	533256565	/nfs/dbraw/zinc/25/65/65/533256565.db2.gz	NVKQHQIIHOJJHM-UHFFFAOYSA-N	1	0	287.157	1.536	50	0		CDAARO
CN(C)C(=O)CC1CC[NH+](C[C@@H]2CCCOC2)CC1	ZINC000358076037	391538416	/nfs/dbraw/zinc/53/84/16/391538416.db2.gz	RIKROCRGCCMJCM-AWEZNQCLSA-N	1	0	268.401	1.603	50	0		CDAARO
CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)Nc1ccc(F)cn1	ZINC000192683624	391761891	/nfs/dbraw/zinc/76/18/91/391761891.db2.gz	SCYRKBZFJJXNIQ-AWEZNQCLSA-N	1	0	295.358	1.952	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@@H](CNc2ncncc2Cl)C1	ZINC000189583944	391773540	/nfs/dbraw/zinc/77/35/40/391773540.db2.gz	DAKDZWKRNIJCPO-NSHDSACASA-N	1	0	284.791	1.899	50	0		CDAARO
C[C@H]([NH2+][C@H](CO)[C@@H]1CCCOC1)[C@@H]1C[C@H]1C1CC1	ZINC000527722889	392125525	/nfs/dbraw/zinc/12/55/25/392125525.db2.gz	ZHUPBHJAEIEGIH-WCDYYPSBSA-N	1	0	253.386	1.798	50	0		CDAARO
Cn1cc([C@H]([NH2+]C2Cc3ccccc3C2)[C@H]2C[C@@H](O)C2)cn1	ZINC000243885667	131083669	/nfs/dbraw/zinc/08/36/69/131083669.db2.gz	ABGRBHCGGYNHDF-FHLIZLRMSA-N	1	0	297.402	1.989	50	0		CDAARO
CC1=CCC[C@H](C)[C@H]1C[N@H+]1C[C@@H](C)O[C@@H](C(N)=O)C1	ZINC000249100772	392451373	/nfs/dbraw/zinc/45/13/73/392451373.db2.gz	PMKCMSBMXOZEQH-RFQIPJPRSA-N	1	0	266.385	1.553	50	0		CDAARO
CN(C)C(=O)C[N@H+](C[C@H]1CCCO1)[C@@H]1CCSC1	ZINC000089952493	392531148	/nfs/dbraw/zinc/53/11/48/392531148.db2.gz	FAHFQLNBRUAZLC-VXGBXAGGSA-N	1	0	272.414	1.061	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@H]1C(=O)NC[C@H](O)C1CCCC1	ZINC000096421741	393185035	/nfs/dbraw/zinc/18/50/35/393185035.db2.gz	JINBCWRTWVCLPR-GJZGRUSLSA-N	1	0	282.428	1.917	50	0		CDAARO
CCOC(=O)c1cccnc1SCC[NH+](C)C	ZINC000096430238	397864685	/nfs/dbraw/zinc/86/46/85/397864685.db2.gz	MRHTYEGIQMNVPN-UHFFFAOYSA-N	1	0	254.355	1.912	50	0		CDAARO
Cc1c[nH+]ccc1NCCNS(=O)(=O)c1cccnc1	ZINC000192705566	148587791	/nfs/dbraw/zinc/58/77/91/148587791.db2.gz	ZWKCASGAPQECDK-UHFFFAOYSA-N	1	0	292.364	1.175	50	0		CDAARO
CC[NH+](CC)CCNC(=O)COc1ccc(OC)cc1	ZINC000002024936	169768609	/nfs/dbraw/zinc/76/86/09/169768609.db2.gz	HUNIPYLVUPMFCZ-UHFFFAOYSA-N	1	0	280.368	1.532	50	0	in-man	CDAARO
C[NH+](C)CCC(=O)NC[C@@H]1OCCc2ccccc21	ZINC000002294050	169784529	/nfs/dbraw/zinc/78/45/29/169784529.db2.gz	MXWHFMIKSYRLDW-AWEZNQCLSA-N	1	0	262.353	1.368	50	0		CDAARO
Cc1cc(C)cc(OCCOCC[NH2+]CCO)c1	ZINC000002981020	169847069	/nfs/dbraw/zinc/84/70/69/169847069.db2.gz	UFKUVMFFCRUOCR-UHFFFAOYSA-N	1	0	253.342	1.281	50	0		CDAARO
COc1ccc(COC[C@@H](O)C[NH2+]C(C)C)cc1	ZINC000003122986	169858359	/nfs/dbraw/zinc/85/83/59/169858359.db2.gz	GOAPGSMNVDOHLI-ZDUSSCGKSA-N	1	0	253.342	1.571	50	0		CDAARO
O=C1CCCN1CCC[NH2+]C[C@@H](O)COc1ccccc1	ZINC000003324740	169879364	/nfs/dbraw/zinc/87/93/64/169879364.db2.gz	JLLCQLYAQVGORT-CQSZACIVSA-N	1	0	292.379	1.028	50	0		CDAARO
CC(C)(C)[C@H](O)C[C@@H](CO)[NH2+]Cc1ccsc1	ZINC000284204354	196002193	/nfs/dbraw/zinc/00/21/93/196002193.db2.gz	ZDKFDPMVXWPBPU-NWDGAFQWSA-N	1	0	257.399	1.996	50	0		CDAARO
COc1cc(C(C)=O)ccc1OC[C@H](O)C[NH+]1CCCC1	ZINC000004487271	169971128	/nfs/dbraw/zinc/97/11/28/169971128.db2.gz	DMBFUPPDJYCILS-CQSZACIVSA-N	1	0	293.363	1.733	50	0		CDAARO
CC(C)[NH2+]C[C@H](O)COc1cc(=O)oc2ccccc12	ZINC000005284725	170082997	/nfs/dbraw/zinc/08/29/97/170082997.db2.gz	MQSKIFZJQYDFJI-NSHDSACASA-N	1	0	277.320	1.531	50	0		CDAARO
CCCc1ccc(S(=O)(=O)NCCC[NH+](C)C)cc1	ZINC000005597715	170117828	/nfs/dbraw/zinc/11/78/28/170117828.db2.gz	IDCLTDDGORDJCI-UHFFFAOYSA-N	1	0	284.425	1.869	50	0		CDAARO
CC[C@H](CO)[NH2+]Cc1cc(OC)c(OC)cc1OC	ZINC000008327047	170331249	/nfs/dbraw/zinc/33/12/49/170331249.db2.gz	HGCNCRLZWOETBZ-LLVKDONJSA-N	1	0	269.341	1.573	50	0		CDAARO
CC(C)NC(=O)c1ccccc1OC1CC[NH2+]CC1	ZINC000012359706	170479561	/nfs/dbraw/zinc/47/95/61/170479561.db2.gz	LGXIYGMRPDJNQR-UHFFFAOYSA-N	1	0	262.353	1.956	50	0		CDAARO
CC(C)(C)CN1CCC[C@@](O)(C[NH2+]C2CCCC2)C1=O	ZINC000012596671	170499898	/nfs/dbraw/zinc/49/98/98/170499898.db2.gz	MFYKETKMSCUGIG-MRXNPFEDSA-N	1	0	282.428	1.918	50	0		CDAARO
CCN1C(=O)N(C)C(=O)C12CC[NH+]([C@@H]1CCSC1)CC2	ZINC000014742895	170644595	/nfs/dbraw/zinc/64/45/95/170644595.db2.gz	YXHBEIPQFADFCA-LLVKDONJSA-N	1	0	297.424	1.240	50	0		CDAARO
CCOC(=O)[C@@H](c1ccc(Cl)cc1)N1CC[NH2+]CC1	ZINC000020268586	171124619	/nfs/dbraw/zinc/12/46/19/171124619.db2.gz	BYMTYIQWJHLTDK-CYBMUJFWSA-N	1	0	282.771	1.849	50	0		CDAARO
CC[NH+]1CCN(CCOCCOc2ccccc2)CC1	ZINC000020323099	171150407	/nfs/dbraw/zinc/15/04/07/171150407.db2.gz	GVAUJIPHMRERHQ-UHFFFAOYSA-N	1	0	278.396	1.720	50	0		CDAARO
CC(C)[NH+](CCNC(=O)c1ccc(=O)[nH]c1)C(C)C	ZINC000020363134	171162433	/nfs/dbraw/zinc/16/24/33/171162433.db2.gz	PTLIYMOJUNSPLK-UHFFFAOYSA-N	1	0	265.357	1.224	50	0		CDAARO
COc1cc(C)ccc1OCCC[NH2+]CCN(C)C	ZINC000020418833	171183807	/nfs/dbraw/zinc/18/38/07/171183807.db2.gz	WRJFNCIWTLZTAY-UHFFFAOYSA-N	1	0	266.385	1.924	50	0		CDAARO
Cc1ccc(S(=O)(=O)NC[C@H]2CCC[NH2+]C2)c(C)c1	ZINC000020432088	171196843	/nfs/dbraw/zinc/19/68/43/171196843.db2.gz	QNHVNWLTZVYQFA-ZDUSSCGKSA-N	1	0	282.409	1.581	50	0		CDAARO
CCC[NH+]1CCC(NC(=O)c2cc(C)on2)CC1	ZINC000020595091	171264133	/nfs/dbraw/zinc/26/41/33/171264133.db2.gz	HGMSKKITMMUVJW-UHFFFAOYSA-N	1	0	251.330	1.587	50	0		CDAARO
C[C@@H]1C[NH+](C[C@H](O)COC2CCCCC2)C[C@@H](C)O1	ZINC000020682903	171270121	/nfs/dbraw/zinc/27/01/21/171270121.db2.gz	WRNHQEHAJUBKFK-MCIONIFRSA-N	1	0	271.401	1.806	50	0		CDAARO
COc1ccc(CN(C)CC[NH+](C)C)c(OC)c1	ZINC000022588986	171393240	/nfs/dbraw/zinc/39/32/40/171393240.db2.gz	GDVDLRQSUOCRDJ-UHFFFAOYSA-N	1	0	252.358	1.697	50	0		CDAARO
c1cn(CCC[NH2+]Cc2ccc3c(c2)OCCO3)cn1	ZINC000035268968	172091773	/nfs/dbraw/zinc/09/17/73/172091773.db2.gz	MJUFSZPPLGLJQG-UHFFFAOYSA-N	1	0	273.336	1.834	50	0		CDAARO
CNC(=O)CN1CCC([NH2+]Cc2ccc(C)c(C)c2)CC1	ZINC000035273412	172093557	/nfs/dbraw/zinc/09/35/57/172093557.db2.gz	RCZBKWJJNUORLE-UHFFFAOYSA-N	1	0	289.423	1.603	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]Cc1ccc2c(c1)OCCO2	ZINC000035273938	172094093	/nfs/dbraw/zinc/09/40/93/172094093.db2.gz	XIDSIWFRNJSXPZ-UHFFFAOYSA-N	1	0	259.309	1.779	50	0		CDAARO
NC(=O)N1CCC([NH2+][C@H]2CCC[C@@H]2n2ccnc2)CC1	ZINC000037314056	173115677	/nfs/dbraw/zinc/11/56/77/173115677.db2.gz	XCYRZWGSEXYOKU-STQMWFEESA-N	1	0	277.372	1.109	50	0		CDAARO
CC(C)OC(=O)N1CCC(n2cc(C[NH3+])cn2)CC1	ZINC000040449709	174266004	/nfs/dbraw/zinc/26/60/04/174266004.db2.gz	ODWLMVRVNRAFIK-UHFFFAOYSA-N	1	0	266.345	1.524	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@H](CCNC(=O)c2cncs2)C1	ZINC000071314973	176121763	/nfs/dbraw/zinc/12/17/63/176121763.db2.gz	WKTBZLWZLIROBM-GFCCVEGCSA-N	1	0	297.424	1.620	50	0		CDAARO
O=C(CCc1[nH]nc2c1CCCC2)N1CC[C@H]2C[NH2+]C[C@H]21	ZINC000077303784	177250451	/nfs/dbraw/zinc/25/04/51/177250451.db2.gz	RIQCUSKXBZZTBP-XHDPSFHLSA-N	1	0	288.395	1.041	50	0		CDAARO
Oc1cccc(CN2CC[C@](O)(C[NH+]3CCCCC3)C2)c1	ZINC000077392939	177262957	/nfs/dbraw/zinc/26/29/57/177262957.db2.gz	XBDRDYYWYPCPLL-KRWDZBQOSA-N	1	0	290.407	1.815	50	0		CDAARO
O[C@@]1(C[NH+]2CCCC2)CCCN(Cc2ccncc2)C1	ZINC000077503378	177275949	/nfs/dbraw/zinc/27/59/49/177275949.db2.gz	FFFMWUUHAIPIQT-MRXNPFEDSA-N	1	0	275.396	1.504	50	0		CDAARO
COc1cccc(OCc2nc3c(c(=O)[nH]2)CC[NH2+]C3)c1	ZINC000077522063	177277627	/nfs/dbraw/zinc/27/76/27/177277627.db2.gz	OSKAMOMTLDHEDQ-UHFFFAOYSA-N	1	0	287.319	1.003	50	0		CDAARO
Cc1ocnc1C(=O)NCC[N@@H+](C)C1CCCC1	ZINC000104574768	270236090	/nfs/dbraw/zinc/23/60/90/270236090.db2.gz	FXKWOARVZOXUOZ-UHFFFAOYSA-N	1	0	251.330	1.587	50	0		CDAARO
CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CCN2C(=O)NC(=O)[C@@H]2C1	ZINC000097164476	276179730	/nfs/dbraw/zinc/17/97/30/276179730.db2.gz	CMEJHLVQROTNKY-XQQFMLRXSA-N	1	0	277.368	1.215	50	0		CDAARO
C[NH+]1CCC(Cc2nc3c([nH]2)C(=O)NCC(C)(C)C3)CC1	ZINC000095368181	277026963	/nfs/dbraw/zinc/02/69/63/277026963.db2.gz	AZTLFXDLYYWRJF-UHFFFAOYSA-N	1	0	290.411	1.606	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)[C@H]2COc3ccccc3C2)CC1	ZINC000012976922	277049420	/nfs/dbraw/zinc/04/94/20/277049420.db2.gz	CRASULWZBCLTAS-CQSZACIVSA-N	1	0	274.364	1.402	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)[C@H]2CSc3ccccc3O2)C1	ZINC000299739003	277279631	/nfs/dbraw/zinc/27/96/31/277279631.db2.gz	JJVOGNINPXWDHL-WCQYABFASA-N	1	0	292.404	1.608	50	0		CDAARO
CC(C)(O)CNC(=O)[C@H]1CCC[N@@H+]1C1CCCC1	ZINC000084326010	277317319	/nfs/dbraw/zinc/31/73/19/277317319.db2.gz	WAOIKLBQAPICMK-GFCCVEGCSA-N	1	0	254.374	1.281	50	0		CDAARO
COC(=O)[C@@H]1CC(=O)N(OCCC(C)C)C12CC[NH2+]CC2	ZINC000299802753	277343564	/nfs/dbraw/zinc/34/35/64/277343564.db2.gz	OQMWUQKKJOVCOR-LBPRGKRZSA-N	1	0	298.383	1.108	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+]1C[C@@H]1CCc2ccccc2C1	ZINC000195578101	277370261	/nfs/dbraw/zinc/37/02/61/277370261.db2.gz	CJYXIPGPCYXWNO-KCXAZCMYSA-N	1	0	289.375	1.400	50	0		CDAARO
COc1cccc2c1CC[C@@H]2[NH2+][C@H]1CCCNC1=O	ZINC000095421369	278033895	/nfs/dbraw/zinc/03/38/95/278033895.db2.gz	XPUSFAWKQLEPJN-STQMWFEESA-N	1	0	260.337	1.551	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)c2ccc(-n3cncn3)cc2)C1	ZINC000299738632	278313277	/nfs/dbraw/zinc/31/32/77/278313277.db2.gz	DHVFRQAMIFCFJN-TZMCWYRMSA-N	1	0	299.378	1.467	50	0		CDAARO
CC(C)[C@H](CNC(=O)N(C)[C@@H](C)CO)[NH+]1CCCCCC1	ZINC000252491496	280241796	/nfs/dbraw/zinc/24/17/96/280241796.db2.gz	LNLUBYBJPAUGBM-GJZGRUSLSA-N	1	0	299.459	1.909	50	0		CDAARO
[NH3+][C@H](CC(F)F)C(=O)Nc1cnn(-c2ccccn2)c1	ZINC000520819499	281057747	/nfs/dbraw/zinc/05/77/47/281057747.db2.gz	CEDHXEGXKSSXQO-SECBINFHSA-N	1	0	281.266	1.188	50	0		CDAARO
Cc1ncc(/C=C\C(=O)N2CC[NH2+]C[C@@H]2C)s1	ZINC000255030793	289351597	/nfs/dbraw/zinc/35/15/97/289351597.db2.gz	KMMVKFCGOHLEEC-TYRPZCRBSA-N	1	0	251.355	1.285	50	0		CDAARO
C[C@H]1CCCCN1c1ccc(N2CC[NH2+]CC2)nn1	ZINC000206578982	290397236	/nfs/dbraw/zinc/39/72/36/290397236.db2.gz	VLKSPZOYXAWCRH-LBPRGKRZSA-N	1	0	261.373	1.265	50	0		CDAARO
C[C@H]1CCN(C(=O)CCNC(=O)C(C)(C)C)[C@@H](C)[C@H]1[NH3+]	ZINC000408520167	299923371	/nfs/dbraw/zinc/92/33/71/299923371.db2.gz	OSCFBFCNNJMDMW-GVXVVHGQSA-N	1	0	283.416	1.123	50	0		CDAARO
O=C(CCc1cccc(Cl)c1)NC[C@@H]1CC[NH2+]C[C@H]1O	ZINC000534585892	328315203	/nfs/dbraw/zinc/31/52/03/328315203.db2.gz	JWJMTFVPXYDMIQ-GXTWGEPZSA-N	1	0	296.798	1.359	50	0		CDAARO
C[C@@H](CN1CCCCCC1)[NH2+]CCc1ncc[nH]1	ZINC000534588326	328316617	/nfs/dbraw/zinc/31/66/17/328316617.db2.gz	SFQOKZROCFMZAY-ZDUSSCGKSA-N	1	0	250.390	1.806	50	0		CDAARO
Cc1n[nH]c(C)c1CCCNC(=O)[C@@H]1CCC[NH2+]CC1	ZINC000534590663	328317896	/nfs/dbraw/zinc/31/78/96/328317896.db2.gz	JVUOXIRPYJHCDF-CYBMUJFWSA-N	1	0	278.400	1.465	50	0		CDAARO
Cc1noc([C@H](C)NC(=O)Cc2ccc3[nH]c(C)nc3c2)n1	ZINC000534648692	328343588	/nfs/dbraw/zinc/34/35/88/328343588.db2.gz	LAEKYRFHUFDWCF-QMMMGPOBSA-N	1	0	299.334	1.983	50	0		CDAARO
COCC1(NC(=O)CC2CC[NH2+]CC2)CCCC1	ZINC000534654388	328338813	/nfs/dbraw/zinc/33/88/13/328338813.db2.gz	IJAXGCNCMMGPQN-UHFFFAOYSA-N	1	0	254.374	1.452	50	0		CDAARO
CCN(CCOC)C(=O)N[C@H](c1nccn1C)C(C)C	ZINC000534656677	328340238	/nfs/dbraw/zinc/34/02/38/328340238.db2.gz	YUOSZVYFOWDRHM-LBPRGKRZSA-N	1	0	282.388	1.795	50	0		CDAARO
C[NH+]1CCC(OCCCNC(=O)C2CC=CC2)CC1	ZINC000534662563	328350390	/nfs/dbraw/zinc/35/03/90/328350390.db2.gz	OPFOMJOKTWJZJV-UHFFFAOYSA-N	1	0	266.385	1.570	50	0		CDAARO
CCc1noc(C)c1NC(=O)C[C@@H]1CSCC[NH2+]1	ZINC000125475103	323209643	/nfs/dbraw/zinc/20/96/43/323209643.db2.gz	OLTSASGWVJVCFI-SECBINFHSA-N	1	0	269.370	1.579	50	0		CDAARO
CN(C)c1ccc(CCNc2nnc(C(C)(C)[NH3+])o2)cc1	ZINC001772701259	1159436687	/nfs/dbraw/zinc/43/66/87/1159436687.db2.gz	DBMKEEGJEBSHOZ-UHFFFAOYSA-N	1	0	289.383	1.984	50	0		CDAARO
COc1ccnc(CN2CCCC[C@@H]([NH3+])C2)c1OC	ZINC000082107135	482762621	/nfs/dbraw/zinc/76/26/21/482762621.db2.gz	MYGGCWUQLLEWPL-LLVKDONJSA-N	1	0	265.357	1.412	50	0		CDAARO
CCOc1ccc(C[N@@H+]2CC[C@H](CO)C2)cc1C[NH+](C)C	ZINC000670437449	482977213	/nfs/dbraw/zinc/97/72/13/482977213.db2.gz	IVRZFIRBVJWIJK-HNNXBMFYSA-N	1	0	292.423	1.961	50	0		CDAARO
CC(C)[NH+]1CCC(CNc2ccc(C(N)=O)cn2)CC1	ZINC000670442517	482989571	/nfs/dbraw/zinc/98/95/71/482989571.db2.gz	ROKZIBTZUKSVHY-UHFFFAOYSA-N	1	0	276.384	1.713	50	0		CDAARO
COc1nc(NCCC[N@@H+]2CCCC[C@@H]2CO)ncc1F	ZINC000670446169	482995885	/nfs/dbraw/zinc/99/58/85/482995885.db2.gz	GBRVASMVZMIXNL-LLVKDONJSA-N	1	0	298.362	1.273	50	0		CDAARO
C[C@@H](c1ncnn1CCc1ccccc1)N1CC[NH+](C)CC1	ZINC000670448757	483004087	/nfs/dbraw/zinc/00/40/87/483004087.db2.gz	OXIFYWJKDMLJHS-HNNXBMFYSA-N	1	0	299.422	1.829	50	0		CDAARO
O=C(N1CCCC1)N1CCC([NH2+][C@H]2CCOC2)CC1	ZINC000670448469	483004339	/nfs/dbraw/zinc/00/43/39/483004339.db2.gz	JZUBLRQFLJVQNV-ZDUSSCGKSA-N	1	0	267.373	1.045	50	0		CDAARO
CNC(=O)C[C@@H]1CC[N@H+](Cc2cc(CC(C)C)n[nH]2)C1	ZINC000670449786	483010129	/nfs/dbraw/zinc/01/01/29/483010129.db2.gz	KMFFRWYSGHOZIW-LBPRGKRZSA-N	1	0	278.400	1.566	50	0		CDAARO
Cc1cc(C(=O)N2CCN(c3cc[nH+]cc3)CC2)nc(C)n1	ZINC000680395897	483608646	/nfs/dbraw/zinc/60/86/46/483608646.db2.gz	POMBNTRGHGNKMW-UHFFFAOYSA-N	1	0	297.362	1.451	50	0		CDAARO
C[C@@H]1CCC[C@H](OCC(=O)N2CC[C@@H]([NH3+])C[C@H]2C)C1	ZINC000408519195	533881244	/nfs/dbraw/zinc/88/12/44/533881244.db2.gz	QAECIQOSFMQBCA-SYQHCUMBSA-N	1	0	268.401	1.920	50	0		CDAARO
C[C@@H]1C[C@H]([NH3+])CCN1C(=O)Cc1noc2ccccc21	ZINC000129265922	533897813	/nfs/dbraw/zinc/89/78/13/533897813.db2.gz	JZUDIZMCCZSVLD-GHMZBOCLSA-N	1	0	273.336	1.709	50	0		CDAARO
NC(=O)C1CC[NH+](C[C@@H](O)CC2CCCC2)CC1	ZINC000188636425	526857488	/nfs/dbraw/zinc/85/74/88/526857488.db2.gz	PFOWLVFVYLCNOA-ZDUSSCGKSA-N	1	0	254.374	1.125	50	0		CDAARO
C[C@H]1C[C@@H](c2ccc(NS(C)(=O)=O)cc2)CC[NH2+]1	ZINC000757211104	577036311	/nfs/dbraw/zinc/03/63/11/577036311.db2.gz	JFOKFYSYWJAASD-JQWIXIFHSA-N	1	0	268.382	1.914	50	0		CDAARO
c1cc2cc(-c3cnc(N4CC[NH2+]CC4)cn3)cnc2[nH]1	ZINC000935619092	617468254	/nfs/dbraw/zinc/46/82/54/617468254.db2.gz	UARIRVWEJWRZNF-UHFFFAOYSA-N	1	0	280.335	1.381	50	0		CDAARO
CCCN(C(=O)C1CC[NH+](C(C)C)CC1)[C@@H](C)CO	ZINC000952977950	614499007	/nfs/dbraw/zinc/49/90/07/614499007.db2.gz	RNFPQBGRUUFBQE-ZDUSSCGKSA-N	1	0	270.417	1.726	50	0		CDAARO
[NH3+]C[C@H](NC(=O)CCc1ccon1)C1CCCC1	ZINC000888096355	617758313	/nfs/dbraw/zinc/75/83/13/617758313.db2.gz	CLJHMDUSWSNEDF-LBPRGKRZSA-N	1	0	251.330	1.241	50	0		CDAARO
COCCC[N@@H+]1CCC[C@@H](CNC(=O)c2ccoc2)C1	ZINC000952988465	616884638	/nfs/dbraw/zinc/88/46/38/616884638.db2.gz	QJVQDZNHBVXHPZ-ZDUSSCGKSA-N	1	0	280.368	1.758	50	0		CDAARO
Cc1cc(N2CCN(Cc3cccs3)CC2)nc(N)[nH+]1	ZINC000032517972	631780590	/nfs/dbraw/zinc/78/05/90/631780590.db2.gz	BDNKNVVCRYVEDA-UHFFFAOYSA-N	1	0	289.408	1.751	50	0		CDAARO
O=C(N[C@@H]1CCCOC12CC[NH2+]CC2)c1cccc(O)c1	ZINC001772705961	1159440642	/nfs/dbraw/zinc/44/06/42/1159440642.db2.gz	UIAVWQPMBMFYFI-CQSZACIVSA-N	1	0	290.363	1.423	50	0		CDAARO
CO[C@@H]1CCC[C@@]12CCC[N@H+](CCN1CCCC1=O)C2	ZINC001704302435	1177680765	/nfs/dbraw/zinc/68/07/65/1177680765.db2.gz	KUVKIDYBBDCAON-ZBFHGGJFSA-N	1	0	280.412	1.890	50	0		CDAARO
Cc1noc(-c2ccccc2C(=O)NC[C@H]2CCC[NH2+]2)n1	ZINC000178761058	769061969	/nfs/dbraw/zinc/06/19/69/769061969.db2.gz	JQWDSLHIDMHHAJ-LLVKDONJSA-N	1	0	286.335	1.527	50	0		CDAARO
Cc1nc(N)sc1C(=O)N1C[C@@H](C(C)C)[C@H]([NH+](C)C)C1	ZINC000095501545	770934614	/nfs/dbraw/zinc/93/46/14/770934614.db2.gz	XNIJBEPGQHDGAV-WDEREUQCSA-N	1	0	296.440	1.692	50	0		CDAARO
CC[NH2+]CCNC(=O)/C(C)=C\c1ccc(F)cc1	ZINC000821759866	771868796	/nfs/dbraw/zinc/86/87/96/771868796.db2.gz	XHNSYQKNPGVNQT-KHPPLWFESA-N	1	0	250.317	1.955	50	0		CDAARO
CCC[N@H+]1CCc2nnc([C@H](C)NC(=O)C3CC3)n2CC1	ZINC000011788303	772421609	/nfs/dbraw/zinc/42/16/09/772421609.db2.gz	XSLNYZRVSSHBIT-NSHDSACASA-N	1	0	291.399	1.133	50	0		CDAARO
C[C@H](C(=O)OC(C)(C)C)N1[C@@H]2CC[C@H]1C[N@H+](C)CC2	ZINC000717402983	772693873	/nfs/dbraw/zinc/69/38/73/772693873.db2.gz	ACYQPSHXFNUULM-UPJWGTAASA-N	1	0	268.401	1.885	50	0		CDAARO
CC(C)C[N@@H+]1CCCN(C(=O)c2cnc(N)s2)CC1	ZINC001506421595	909179832	/nfs/dbraw/zinc/17/98/32/909179832.db2.gz	KDSVPVQUTLJIET-UHFFFAOYSA-N	1	0	282.413	1.529	50	0		CDAARO
COCC[N@H+](C)C[C@H]1CC[C@@H](Cc2nccc(OC)n2)O1	ZINC000952854442	910406980	/nfs/dbraw/zinc/40/69/80/910406980.db2.gz	PFXVUFDXHFWEOC-QWHCGFSZSA-N	1	0	295.383	1.154	50	0		CDAARO
C[C@H](CCN(C)Cc1cccnc1N)[NH+]1CCCC1	ZINC000952872902	910429206	/nfs/dbraw/zinc/42/92/06/910429206.db2.gz	RJWZZZMZFGTBRH-CYBMUJFWSA-N	1	0	262.401	1.970	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]CCn1cnc(C)c1C	ZINC000823557589	925711149	/nfs/dbraw/zinc/71/11/49/925711149.db2.gz	WGEQHGIJXQFXDB-LBPRGKRZSA-N	1	0	275.400	1.937	50	0		CDAARO
COC[C@@H]1CCCN1C(=O)C[NH+]1CCCCCC1	ZINC000824469451	925822519	/nfs/dbraw/zinc/82/25/19/925822519.db2.gz	QVEOQVVECQBZFM-ZDUSSCGKSA-N	1	0	254.374	1.500	50	0		CDAARO
COc1nc(NC[C@@H](C(C)C)[NH+](C)C)ncc1F	ZINC000824845747	925840698	/nfs/dbraw/zinc/84/06/98/925840698.db2.gz	FENBFGPILVJVIY-JTQLQIEISA-N	1	0	256.325	1.622	50	0		CDAARO
Cc1nccn1C[C@H](C)[NH2+]CCc1nc(C)cc(=O)[nH]1	ZINC000825264402	925858843	/nfs/dbraw/zinc/85/88/43/925858843.db2.gz	BNFCTSRFFWQELD-NSHDSACASA-N	1	0	275.356	1.216	50	0		CDAARO
CN(C)[C@@H](C(=O)N[C@H]1CC[C@@H]([NH3+])CC1)c1ccccc1F	ZINC000827523352	925944743	/nfs/dbraw/zinc/94/47/43/925944743.db2.gz	SXVPOQYFEBJGGN-TYNCELHUSA-N	1	0	293.386	1.815	50	0		CDAARO
Cc1ncc(C[NH2+]CCc2cn(C)nn2)n1-c1ccccc1	ZINC000585089139	930912074	/nfs/dbraw/zinc/91/20/74/930912074.db2.gz	DLSVWEHKRFELES-UHFFFAOYSA-N	1	0	296.378	1.642	50	0		CDAARO
Cc1ncoc1CN1CC[N@@H+](CC(C)(C)O)C[C@@H]1C	ZINC000585120871	930993306	/nfs/dbraw/zinc/99/33/06/930993306.db2.gz	RRWOJKKNUSCNLO-NSHDSACASA-N	1	0	267.373	1.260	50	0		CDAARO
C[C@@H]1CN(C(=O)Cc2ncc(Cl)s2)[C@@H](C)C[N@@H+]1C	ZINC000585139482	931033446	/nfs/dbraw/zinc/03/34/46/931033446.db2.gz	AFFGZJUKSCWQMF-BDAKNGLRSA-N	1	0	287.816	1.890	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3cccc(C)n3)C[C@@H]2O)on1	ZINC001529119035	968986408	/nfs/dbraw/zinc/98/64/08/968986408.db2.gz	AUZDMZYAZNAFLR-CJNGLKHVSA-N	1	0	287.363	1.722	50	0		CDAARO
Cc1cc(N[C@@H]2COC[C@H]2Cc2ccncc2)nc(N)[nH+]1	ZINC001529180204	969007404	/nfs/dbraw/zinc/00/74/04/969007404.db2.gz	CRFZOSIZOXHECL-CHWSQXEVSA-N	1	0	285.351	1.432	50	0		CDAARO
O=c1cc([C@@H]2CCC[N@H+](CCCn3ccnc3)C2)nc[nH]1	ZINC001506403607	975150720	/nfs/dbraw/zinc/15/07/20/975150720.db2.gz	UPGDYSMAXFUFMS-CYBMUJFWSA-N	1	0	287.367	1.648	50	0		CDAARO
Cc1ncsc1C[N@H+]1CCC(=O)N(CC2CC2)CC1	ZINC001506414083	975154760	/nfs/dbraw/zinc/15/47/60/975154760.db2.gz	NOHOUMVPQOUFRV-UHFFFAOYSA-N	1	0	279.409	1.896	50	0		CDAARO
Cc1cnc(C)c(NCC(C)(C)N2CC[NH+](C)CC2)n1	ZINC001506417380	975155369	/nfs/dbraw/zinc/15/53/69/975155369.db2.gz	IZIPQJUNWMOISF-UHFFFAOYSA-N	1	0	277.416	1.531	50	0		CDAARO
Cc1nncn1CC[NH+]1CCC([C@H](O)CC(C)C)CC1	ZINC001506421420	975158520	/nfs/dbraw/zinc/15/85/20/975158520.db2.gz	JHQSDPCJZOZGBC-OAHLLOKOSA-N	1	0	280.416	1.706	50	0		CDAARO
CC(C)[C@@H](CNc1cc(C(N)=O)ccn1)[NH+]1CCCC1	ZINC001506426341	975160974	/nfs/dbraw/zinc/16/09/74/975160974.db2.gz	GPOMYGRWIDRIDP-CYBMUJFWSA-N	1	0	276.384	1.713	50	0		CDAARO
CO[C@@H]1CCCC[C@@H]1NC(=O)N[C@@H]1CC[N@H+](CC2CC2)C1	ZINC000096440558	230372586	/nfs/dbraw/zinc/37/25/86/230372586.db2.gz	DPRHZPSESSLVPU-QLFBSQMISA-N	1	0	295.427	1.728	50	0		CDAARO
C[C@@H](CCc1ccccc1)NC(=O)CNCCC[NH+](C)C	ZINC000002632783	230367326	/nfs/dbraw/zinc/36/73/26/230367326.db2.gz	DLOHZKDIBOAONQ-HNNXBMFYSA-N	1	0	291.439	1.665	50	0		CDAARO
Cc1cccc(OC[C@@H](O)C[NH2+]CCCn2ccnc2)c1	ZINC000002630966	230367449	/nfs/dbraw/zinc/36/74/49/230367449.db2.gz	JLUXMUOTISGGDF-HNNXBMFYSA-N	1	0	289.379	1.611	50	0		CDAARO
CC(=O)N1CCc2cc(C(=O)NC3CC[NH2+]CC3)ccc21	ZINC000095956827	185042273	/nfs/dbraw/zinc/04/22/73/185042273.db2.gz	BLAJZGMQIDQYKT-UHFFFAOYSA-N	1	0	287.363	1.077	50	0		CDAARO
CC[N@H+](CC(C)(C)O)[C@@H](C(N)=O)c1ccccc1	ZINC000095978705	185053001	/nfs/dbraw/zinc/05/30/01/185053001.db2.gz	PRWBNFPARUFYCS-GFCCVEGCSA-N	1	0	250.342	1.306	50	0		CDAARO
COC1(CNC(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)CCC1	ZINC000096002183	185062240	/nfs/dbraw/zinc/06/22/40/185062240.db2.gz	GOPVHVPKCZGVQT-LBPRGKRZSA-N	1	0	281.400	1.339	50	0		CDAARO
CCOC(=O)[C@@H]1C[N@H+](Cc2ccccc2)CC12COC2	ZINC000238850639	361739906	/nfs/dbraw/zinc/73/99/06/361739906.db2.gz	CGBYSXYQRGWJGI-AWEZNQCLSA-N	1	0	275.348	1.698	50	0		CDAARO
CO[C@]1(C)C[C@H](N(C)C(=O)[C@H]2CC[C@H]([NH3+])C2)C1(C)C	ZINC000262628370	361742949	/nfs/dbraw/zinc/74/29/49/361742949.db2.gz	JPXDPODOXGTKQA-JUFZMCDQSA-N	1	0	268.401	1.776	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)CCC(=O)c1ccc(C)s1	ZINC000241383496	361752471	/nfs/dbraw/zinc/75/24/71/361752471.db2.gz	MVTZZNTZGIGHKQ-JQWIXIFHSA-N	1	0	296.392	1.122	50	0		CDAARO
C[C@H]1CN(CC[N@@H+]2CCC[C@@H](OCC3CC3)C2)CCO1	ZINC000241588055	361753657	/nfs/dbraw/zinc/75/36/57/361753657.db2.gz	OZFZLHWJQWUCMG-GOEBONIOSA-N	1	0	282.428	1.598	50	0		CDAARO
[NH3+]CCCCS(=O)(=O)c1cccc(Br)c1	ZINC000082790994	178296243	/nfs/dbraw/zinc/29/62/43/178296243.db2.gz	ZDAMPKQNZCKDIF-UHFFFAOYSA-N	1	0	292.198	1.962	50	0		CDAARO
[NH3+][C@H](C(=O)N1CCOC2(CCC2)C1)c1ccccc1	ZINC000195554951	342626175	/nfs/dbraw/zinc/62/61/75/342626175.db2.gz	SVTVHLPLQPYMJC-ZDUSSCGKSA-N	1	0	260.337	1.468	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2cccc(Cl)n2)[C@H]1C[NH3+]	ZINC000195542972	342626612	/nfs/dbraw/zinc/62/66/12/342626612.db2.gz	AHUBNEOOOWNICW-KOLCDFICSA-N	1	0	267.760	1.934	50	0		CDAARO
CCc1nccn1CC[N@@H+]1CCCC[C@@H]1CCO	ZINC000244605546	361853870	/nfs/dbraw/zinc/85/38/70/361853870.db2.gz	FAQLDSOAXIYNHY-CYBMUJFWSA-N	1	0	251.374	1.682	50	0		CDAARO
C[N@H+](C[C@@H]1COc2ccccc2O1)C1CCOCC1	ZINC000244633252	361855027	/nfs/dbraw/zinc/85/50/27/361855027.db2.gz	FZTXJUWNFKCTIQ-CYBMUJFWSA-N	1	0	263.337	1.937	50	0		CDAARO
O=C(N[C@H]([C@H]1C[C@H](O)C1)C1CC[NH2+]CC1)C1CC=CC1	ZINC000244840282	361866569	/nfs/dbraw/zinc/86/65/69/361866569.db2.gz	UKJZTIVVNBKJFG-KKUMJFAQSA-N	1	0	278.396	1.208	50	0		CDAARO
CN(C)Cc1nnc([C@H]2C[C@H]([NH2+]C3CCCC3)C2)n1C	ZINC000244718746	361859021	/nfs/dbraw/zinc/85/90/21/361859021.db2.gz	LQDZYGYOWBWCDN-AULYBMBSSA-N	1	0	277.416	1.655	50	0		CDAARO
CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1[NH2+]Cc1ccncc1	ZINC000084736398	342268397	/nfs/dbraw/zinc/26/83/97/342268397.db2.gz	YOHJKTFFEVJTDV-KGLIPLIRSA-N	1	0	297.424	1.231	50	0		CDAARO
COCCC(=O)N1CCC(C[NH3+])(C(F)(F)F)CC1	ZINC000725264802	539162021	/nfs/dbraw/zinc/16/20/21/539162021.db2.gz	ZYMJIEBNSXCLDK-UHFFFAOYSA-N	1	0	268.279	1.153	50	0		CDAARO
COCCOc1cccc(C(=O)N2CC[NH2+]C[C@@H]2C)c1	ZINC000126310191	187231752	/nfs/dbraw/zinc/23/17/52/187231752.db2.gz	CABVAUITXVAWTI-LBPRGKRZSA-N	1	0	278.352	1.146	50	0		CDAARO
O=C(NCCC[N@@H+]1CCc2ccccc2C1)[C@H]1CCCO1	ZINC000036391876	362050223	/nfs/dbraw/zinc/05/02/23/362050223.db2.gz	WQILFRPYFVTIIN-MRXNPFEDSA-N	1	0	288.391	1.730	50	0		CDAARO
OCc1ccnc(N2CCC[C@H](C[NH+]3CCOCC3)C2)c1	ZINC000585133006	362057413	/nfs/dbraw/zinc/05/74/13/362057413.db2.gz	MIOKWMXHZUQMGI-OAHLLOKOSA-N	1	0	291.395	1.123	50	0		CDAARO
CCOC(=O)c1cccc(NC(=O)[C@]2(F)CC[NH2+]C2)c1	ZINC000252496581	342382556	/nfs/dbraw/zinc/38/25/56/342382556.db2.gz	PMCGQNUWMUHTOV-AWEZNQCLSA-N	1	0	280.299	1.503	50	0		CDAARO
C[C@H](CCn1cccn1)[NH2+][C@H]1CCCC[C@H]1C(N)=O	ZINC000253369606	342416106	/nfs/dbraw/zinc/41/61/06/342416106.db2.gz	FODIDOQZNWPCBU-UPJWGTAASA-N	1	0	264.373	1.295	50	0		CDAARO
C[NH+]1CCC(OCCCNC(=O)c2cncs2)CC1	ZINC000252486884	362386409	/nfs/dbraw/zinc/38/64/09/362386409.db2.gz	HPYFTVZBTRRRHR-UHFFFAOYSA-N	1	0	283.397	1.374	50	0		CDAARO
Cc1nnc(CN(C)CC[N@@H+]2C[C@H]3CC[C@@H]2C3)o1	ZINC000252486655	362386968	/nfs/dbraw/zinc/38/69/68/362386968.db2.gz	HNZSHBLWKCLKJZ-NWDGAFQWSA-N	1	0	250.346	1.294	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)c2cc(C(C)C)nn2C)C1	ZINC000096482480	529988396	/nfs/dbraw/zinc/98/83/96/529988396.db2.gz	JEERVJLIPMFYAC-LBPRGKRZSA-N	1	0	278.400	1.615	50	0		CDAARO
C[NH+]1CCC(NC(=S)Nc2ccc3c(c2)OCO3)CC1	ZINC000013775582	530050485	/nfs/dbraw/zinc/05/04/85/530050485.db2.gz	DWSJHOPXMFJOLT-UHFFFAOYSA-N	1	0	293.392	1.796	50	0		CDAARO
CCC1(CC)[C@H]([NH2+][C@@H]2CCN(C)C2=O)C[C@H]1OC	ZINC000095419472	282456898	/nfs/dbraw/zinc/45/68/98/282456898.db2.gz	JUUQWCUWCHJGIM-IJLUTSLNSA-N	1	0	254.374	1.400	50	0		CDAARO
COCC[NH+]1CCC(NC(=O)Cc2cccc(C)c2)CC1	ZINC000085467985	179073229	/nfs/dbraw/zinc/07/32/29/179073229.db2.gz	ODUVCVJHVLQLID-UHFFFAOYSA-N	1	0	290.407	1.765	50	0		CDAARO
O=C1N=NC(CC2CC[NH2+]CC2)N1c1ccccc1F	ZINC000407947155	349979062	/nfs/dbraw/zinc/97/90/62/349979062.db2.gz	YGOHGUXTNKXTMV-UHFFFAOYSA-N	1	0	276.315	1.654	50	0		CDAARO
CC[C@H](C[NH+](C)C)NC(=O)N1CC(c2ccccn2)C1	ZINC000584886355	349344030	/nfs/dbraw/zinc/34/40/30/349344030.db2.gz	ZTAXLXAVKAJWPU-CYBMUJFWSA-N	1	0	276.384	1.531	50	0		CDAARO
Cc1cc(C(=O)NCC(C)(C)[NH+]2CCCC2)c(O)cn1	ZINC000584886646	349345137	/nfs/dbraw/zinc/34/51/37/349345137.db2.gz	CYBVYDOICSZOLL-UHFFFAOYSA-N	1	0	277.368	1.700	50	0		CDAARO
C[C@H](CN(C)CCO)[NH2+]Cc1ccccc1-n1ccnc1	ZINC000584886786	349345815	/nfs/dbraw/zinc/34/58/15/349345815.db2.gz	RFSGUUZYJSQSPI-CQSZACIVSA-N	1	0	288.395	1.275	50	0		CDAARO
CN(CCn1ccnc1)C(=O)C[N@H+](C)C1CCCC1	ZINC000584890776	349349762	/nfs/dbraw/zinc/34/97/62/349349762.db2.gz	NWSMYBKZJBNLRO-UHFFFAOYSA-N	1	0	264.373	1.216	50	0		CDAARO
CCc1csc(CC[NH2+][C@H](C)CS(C)(=O)=O)n1	ZINC000584891697	349351311	/nfs/dbraw/zinc/35/13/11/349351311.db2.gz	RLKUTCJTRNETHB-SECBINFHSA-N	1	0	276.427	1.271	50	0		CDAARO
c1ncn(-c2ncccc2C[NH2+][C@H]2CCSC2)n1	ZINC000584894068	349354343	/nfs/dbraw/zinc/35/43/43/349354343.db2.gz	GDNKJZUPUDRGFO-NSHDSACASA-N	1	0	261.354	1.257	50	0		CDAARO
O=C(C[N@H+](C[C@H]1CCCO1)C1CCCC1)NCC1CC1	ZINC000089818118	179870315	/nfs/dbraw/zinc/87/03/15/179870315.db2.gz	ZZKJPGUAIOFMGT-OAHLLOKOSA-N	1	0	280.412	1.936	50	0		CDAARO
O=C(c1cncc(O)c1)N1CCC[C@H](C[NH+]2CCCC2)C1	ZINC000584900850	349363365	/nfs/dbraw/zinc/36/33/65/349363365.db2.gz	VSKGQNBVKMQLCZ-CYBMUJFWSA-N	1	0	289.379	1.735	50	0		CDAARO
CC(=O)Nc1cccc([C@@H](C)[NH2+]C[C@@]2(O)CCOC2)c1	ZINC000090848887	180045602	/nfs/dbraw/zinc/04/56/02/180045602.db2.gz	QIYOLRHGNGTHNC-ABAIWWIYSA-N	1	0	278.352	1.447	50	0		CDAARO
CCC[C@H]1CN(C(=O)c2oc(C)nc2C)C[C@@H]1[NH3+]	ZINC000091736275	180243126	/nfs/dbraw/zinc/24/31/26/180243126.db2.gz	MGTNVBFFRRDFAP-QWRGUYRKSA-N	1	0	251.330	1.491	50	0		CDAARO
c1c[nH]c(CN2C[C@H]3CC[C@@H]2C[N@H+](Cc2ccncc2)C3)n1	ZINC000091819234	180262827	/nfs/dbraw/zinc/26/28/27/180262827.db2.gz	KXZMBQRVFPBHFY-JKSUJKDBSA-N	1	0	297.406	1.901	50	0		CDAARO
CCCOCC(=O)N1C[C@H]([NH+](C)C)[C@@H](c2ccc(C)o2)C1	ZINC000091817500	180263400	/nfs/dbraw/zinc/26/34/00/180263400.db2.gz	DSZFYOIIIRYMIC-KBPBESRZSA-N	1	0	294.395	1.871	50	0		CDAARO
CCn1nnc(C)c1C[N@@H+]1CC(C)(C)CC[C@H]1CO	ZINC000621381073	350578815	/nfs/dbraw/zinc/57/88/15/350578815.db2.gz	KMODVJAFLHNYEH-LBPRGKRZSA-N	1	0	266.389	1.589	50	0		CDAARO
O[C@H]([C@H]1CCC[N@@H+]1CCOC[C@@H]1CCCO1)C(F)(F)F	ZINC000110617864	186305312	/nfs/dbraw/zinc/30/53/12/186305312.db2.gz	AEMRESOZUGYQLY-QJPTWQEYSA-N	1	0	297.317	1.570	50	0		CDAARO
COc1cc[nH+]c(N2CCN(c3cnccn3)CC2)c1	ZINC000264149041	362979642	/nfs/dbraw/zinc/97/96/42/362979642.db2.gz	RVFLCQDNQWOESU-UHFFFAOYSA-N	1	0	271.324	1.207	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CN(C(=O)c2cccc(F)c2F)CCO1	ZINC000122897183	187058032	/nfs/dbraw/zinc/05/80/32/187058032.db2.gz	UXLQKZGYKUDKCA-LDYMZIIASA-N	1	0	270.279	1.153	50	0		CDAARO
CC(C)n1ccc(C(=O)NC[C@@H](C)C[NH+](C)C)n1	ZINC000292332829	198247837	/nfs/dbraw/zinc/24/78/37/198247837.db2.gz	JWXMREFFLVQFFT-LLVKDONJSA-N	1	0	252.362	1.392	50	0		CDAARO
C[C@H](CN1CCOCC1)[NH2+]Cc1ccc(F)cc1	ZINC000036932703	363295397	/nfs/dbraw/zinc/29/53/97/363295397.db2.gz	AXEUCEAMXZKXNA-GFCCVEGCSA-N	1	0	252.333	1.636	50	0		CDAARO
C[C@@H]([NH2+]Cc1cnn(C)c1)c1ccc2c(c1)OCO2	ZINC000036981975	363311192	/nfs/dbraw/zinc/31/11/92/363311192.db2.gz	VXBLFWRFIASUEG-SNVBAGLBSA-N	1	0	259.309	2.000	50	0		CDAARO
COc1cc(C[NH+]2CCC(O)CC2)cc(OC)c1	ZINC000000042942	355881121	/nfs/dbraw/zinc/88/11/21/355881121.db2.gz	XUMBSSRIVJOXCR-UHFFFAOYSA-N	1	0	251.326	1.661	50	0		CDAARO
O=C(C[NH+]1CCCCC1)NC[C@@H]1COc2ccccc2O1	ZINC000000108662	355887015	/nfs/dbraw/zinc/88/70/15/355887015.db2.gz	YNTXUFONQWCEHR-CYBMUJFWSA-N	1	0	290.363	1.429	50	0		CDAARO
OCC[NH2+]C[C@H](O)Cn1c2ccccc2c2ccccc21	ZINC000001806036	355951999	/nfs/dbraw/zinc/95/19/99/355951999.db2.gz	QZUDLONPOLSENE-ZDUSSCGKSA-N	1	0	284.359	1.737	50	0		CDAARO
C[C@@H](Cn1cccn1)[NH2+]CCCc1nnc2ccccn21	ZINC000584901542	355956718	/nfs/dbraw/zinc/95/67/18/355956718.db2.gz	SVUOUBXSTNOKMR-ZDUSSCGKSA-N	1	0	284.367	1.537	50	0		CDAARO
CCOc1ccc(/C=C\C(=O)N2CC[C@H](C[NH3+])C2)cc1	ZINC000255301517	356035644	/nfs/dbraw/zinc/03/56/44/356035644.db2.gz	YKOHHEYTEIWHCJ-BMWLXYDHSA-N	1	0	274.364	1.906	50	0		CDAARO
CC(C)C[NH2+]C[C@]1(O)CCCN(CC(C)(C)C)C1=O	ZINC000011948069	356284734	/nfs/dbraw/zinc/28/47/34/356284734.db2.gz	PZOLWHWQNLWUJR-OAHLLOKOSA-N	1	0	270.417	1.632	50	0		CDAARO
Cc1c(O)ccc2c(C[N@H+](C)CCO)cc(=O)oc12	ZINC000004353956	356313046	/nfs/dbraw/zinc/31/30/46/356313046.db2.gz	ZJQLECZUFUUPJG-UHFFFAOYSA-N	1	0	263.293	1.231	50	0	biogenic	CDAARO
Brc1cnc(O[C@@H]2CCC[NH2+]C2)nc1	ZINC000016678707	356444688	/nfs/dbraw/zinc/44/46/88/356444688.db2.gz	HBAYDUMSWQKSEP-MRVPVSSYSA-N	1	0	258.119	1.370	50	0		CDAARO
Brc1ccc(CN2CC[NH2+]CC2)cc1	ZINC000019399947	356484132	/nfs/dbraw/zinc/48/41/32/356484132.db2.gz	MAHWBNAOEVAPJF-UHFFFAOYSA-N	1	0	255.159	1.854	50	0		CDAARO
CC[NH+]1CCN(CCC(=O)Nc2cccc(C)c2)CC1	ZINC000019528185	356490490	/nfs/dbraw/zinc/49/04/90/356490490.db2.gz	USTRMKFHDWCACC-UHFFFAOYSA-N	1	0	275.396	1.961	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](C[NH+]2CCC(OCCOC)CC2)C1	ZINC000019114387	356475820	/nfs/dbraw/zinc/47/58/20/356475820.db2.gz	WTKPPPMODPIDBS-OAHLLOKOSA-N	1	0	284.444	1.846	50	0		CDAARO
Cc1cccc(C)c1OCCOCCNCC[NH3+]	ZINC000019772396	356501182	/nfs/dbraw/zinc/50/11/82/356501182.db2.gz	LQNWONRPSPKMJA-UHFFFAOYSA-N	1	0	252.358	1.247	50	0		CDAARO
c1ccc(N2CCN(C[C@@H]3CCC[NH2+]C3)CC2)nc1	ZINC000020072928	356525369	/nfs/dbraw/zinc/52/53/69/356525369.db2.gz	YBHAJIYLLVWXBK-CQSZACIVSA-N	1	0	260.385	1.203	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000121583671	366300214	/nfs/dbraw/zinc/30/02/14/366300214.db2.gz	NNPHBEYLGVZKEG-KKUMJFAQSA-N	1	0	276.380	1.838	50	0		CDAARO
Cc1nnnn1CCC[N@@H+]1CCC[C@H]1c1ccccn1	ZINC000072150568	356629482	/nfs/dbraw/zinc/62/94/82/356629482.db2.gz	FQJFPGLTASPSQT-AWEZNQCLSA-N	1	0	272.356	1.604	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)c1nccnc1N)c1ccsc1	ZINC000023133335	356629843	/nfs/dbraw/zinc/62/98/43/356629843.db2.gz	XRWLPINNXOYJDQ-JTQLQIEISA-N	1	0	291.380	1.153	50	0		CDAARO
CC[C@H]([NH2+]CC(=O)NC(=O)NC)c1ccc(Cl)cc1	ZINC000024253515	356655060	/nfs/dbraw/zinc/65/50/60/356655060.db2.gz	SWZKCYDCPHNGSI-NSHDSACASA-N	1	0	283.759	1.836	50	0		CDAARO
Cn1ccccc1=[N+]1CCN(Cc2ccccc2)CC1	ZINC000025285188	356671020	/nfs/dbraw/zinc/67/10/20/356671020.db2.gz	RNYYNFCHLCYFIJ-UHFFFAOYSA-N	1	0	268.384	1.833	50	0		CDAARO
C[N@@H+]1CCC[C@H]1C(=O)N1CCCC2(CCOCC2)C1	ZINC000335870235	356763541	/nfs/dbraw/zinc/76/35/41/356763541.db2.gz	KMEVVWQCJSGRPX-ZDUSSCGKSA-N	1	0	266.385	1.500	50	0		CDAARO
CC(C)=CCC[C@@H](C)[NH2+]C[C@H]1CCN(S(C)(=O)=O)C1	ZINC000090797114	356831572	/nfs/dbraw/zinc/83/15/72/356831572.db2.gz	WFOCDXJNMLLWDI-ZIAGYGMSSA-N	1	0	288.457	1.992	50	0		CDAARO
Cn1c2ccc(C[NH2+]Cc3ccccn3)cc2n(C)c1=O	ZINC000032616881	356784035	/nfs/dbraw/zinc/78/40/35/356784035.db2.gz	UXHHIIFZUXGVMG-UHFFFAOYSA-N	1	0	282.347	1.562	50	0		CDAARO
COC(=O)[C@H](CC[NH2+]Cc1ccccc1)[C@@H](C)O	ZINC000043214666	363572047	/nfs/dbraw/zinc/57/20/47/363572047.db2.gz	JGNJXWYXCHOBBP-DGCLKSJQSA-N	1	0	251.326	1.336	50	0		CDAARO
O=C(N[C@@H](CCO)C1CC1)NC1CC[NH+](C2CC2)CC1	ZINC000095401078	357193379	/nfs/dbraw/zinc/19/33/79/357193379.db2.gz	ZZYVEMFBCLQBCM-AWEZNQCLSA-N	1	0	281.400	1.073	50	0		CDAARO
COC[C@@H](Cc1ccccc1)[NH2+]C[C@@H]1CCS(=O)(=O)C1	ZINC000095419615	357334343	/nfs/dbraw/zinc/33/43/43/357334343.db2.gz	HBUPBNBOXGQNEM-LSDHHAIUSA-N	1	0	297.420	1.268	50	0		CDAARO
CNc1ccnc(N(C)CC[N@@H+]2CCCC[C@@H]2C)n1	ZINC000065405015	357538016	/nfs/dbraw/zinc/53/80/16/357538016.db2.gz	CQZPUYVQCBICBE-LBPRGKRZSA-N	1	0	263.389	1.829	50	0		CDAARO
Cc1cccc([C@H](C(=O)N2CCC([NH3+])CC2)N(C)C)c1	ZINC000065404435	357538269	/nfs/dbraw/zinc/53/82/69/357538269.db2.gz	JRTRFGFAOQWPJA-OAHLLOKOSA-N	1	0	275.396	1.547	50	0		CDAARO
C[C@@H](CCn1cccn1)[NH2+]Cc1ccc2nonc2c1	ZINC000065461948	357543040	/nfs/dbraw/zinc/54/30/40/357543040.db2.gz	AVOQAWZRUUBTRM-NSHDSACASA-N	1	0	271.324	1.988	50	0		CDAARO
COc1cccc(OCC(=O)NC[C@@H]2CCC[N@H+](C)C2)c1	ZINC000067604976	357614569	/nfs/dbraw/zinc/61/45/69/357614569.db2.gz	SXNXFKZHDJABQB-ZDUSSCGKSA-N	1	0	292.379	1.532	50	0		CDAARO
Cc1cc(C(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)[nH]n1	ZINC000067956410	357640872	/nfs/dbraw/zinc/64/08/72/357640872.db2.gz	MBGQAGWSRDTSCZ-LBPRGKRZSA-N	1	0	264.373	1.426	50	0		CDAARO
CN1CCCN(Cc2c[nH]cn2)CC12CC[NH+](C)CC2	ZINC000067973914	357641431	/nfs/dbraw/zinc/64/14/31/357641431.db2.gz	YNBNGUXLBIZIIS-UHFFFAOYSA-N	1	0	277.416	1.012	50	0		CDAARO
CSCc1ccc(C(=O)N2CC[C@@H](C[NH3+])C2)cc1	ZINC000299738895	357700927	/nfs/dbraw/zinc/70/09/27/357700927.db2.gz	IDANNENLZHXLMB-LBPRGKRZSA-N	1	0	264.394	1.970	50	0		CDAARO
Cc1cccc(CNC(=O)C[NH2+][C@@H](C)[C@@H]2CCCO2)c1	ZINC000097111604	357986913	/nfs/dbraw/zinc/98/69/13/357986913.db2.gz	KNJMKIZRXGPGRE-ZFWWWQNUSA-N	1	0	276.380	1.768	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](C(=O)N2CC[C@]3(CCOC3)C2)C1	ZINC000097228019	358043223	/nfs/dbraw/zinc/04/32/23/358043223.db2.gz	JPOVIFSQRCDPCZ-HOCLYGCPSA-N	1	0	280.412	1.603	50	0		CDAARO
[NH3+][C@@H]1CCN(CCCC(=O)c2ccc(F)cc2)C[C@H]1O	ZINC000082115844	358147750	/nfs/dbraw/zinc/14/77/50/358147750.db2.gz	GYANWKQJZXFHQD-UKRRQHHQSA-N	1	0	280.343	1.183	50	0		CDAARO
C[NH2+]CC(=O)N1CCC(Oc2ccccc2C)CC1	ZINC000082114657	358147777	/nfs/dbraw/zinc/14/77/77/358147777.db2.gz	CCCKXKHJOTXCTP-UHFFFAOYSA-N	1	0	262.353	1.584	50	0		CDAARO
Cc1cc(N2CCC(c3cnn(C)c3)CC2)nc(N)[nH+]1	ZINC000097202145	358188610	/nfs/dbraw/zinc/18/86/10/358188610.db2.gz	JABBCRNLURNGTG-UHFFFAOYSA-N	1	0	272.356	1.485	50	0		CDAARO
O[C@@H]1C[C@H](O)C12CC[NH+](CCCC(F)(F)F)CC2	ZINC000091586897	358518942	/nfs/dbraw/zinc/51/89/42/358518942.db2.gz	RIKPYOSHPPDCJB-AOOOYVTPSA-N	1	0	267.291	1.537	50	0		CDAARO
Cc1cc(S(=O)(=O)N2CCC[C@@H]2C[NH3+])sc1C	ZINC000195555301	358557503	/nfs/dbraw/zinc/55/75/03/358557503.db2.gz	AANMAUZSCIWZQN-SNVBAGLBSA-N	1	0	274.411	1.477	50	0		CDAARO
CCCS(=O)(=O)N[C@@H](C)C[N@@H+]1CCC[C@@H](C)C1	ZINC000195574183	358567411	/nfs/dbraw/zinc/56/74/11/358567411.db2.gz	RARGNOWWILPFCH-NEPJUHHUSA-N	1	0	262.419	1.436	50	0		CDAARO
CN(Cc1cc[nH]n1)CC(C)(C)C[NH+]1CCOCC1	ZINC000093769748	358631974	/nfs/dbraw/zinc/63/19/74/358631974.db2.gz	BCFMAXGKZMNGHG-UHFFFAOYSA-N	1	0	266.389	1.200	50	0		CDAARO
CC[C@@H]([NH2+][C@@H]1CCc2nc(COC)nn2C1)C1CCC1	ZINC000567336061	358662232	/nfs/dbraw/zinc/66/22/32/358662232.db2.gz	MELDKJCZXWNORX-CHWSQXEVSA-N	1	0	278.400	1.908	50	0		CDAARO
C[N@@H+](Cc1cccc(-c2nn[nH]n2)c1)C[C@H]1CCOC1	ZINC000095193335	358680081	/nfs/dbraw/zinc/68/00/81/358680081.db2.gz	XVGCSAUJPCEPDH-GFCCVEGCSA-N	1	0	273.340	1.335	50	0		CDAARO
CCc1nc(N)nc(NCC[NH+]2CCC(CO)CC2)c1C	ZINC000095353648	358683462	/nfs/dbraw/zinc/68/34/62/358683462.db2.gz	VQFIWPMLXZGIHC-UHFFFAOYSA-N	1	0	293.415	1.046	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCC(=O)NCCn2ccnc2)C1	ZINC000095372975	358688821	/nfs/dbraw/zinc/68/88/21/358688821.db2.gz	NUSUDRGRICSZIL-ZDUSSCGKSA-N	1	0	264.373	1.121	50	0		CDAARO
C[N@@H+]1C[C@@]2(C)CN(C(=O)c3ccccc3)C[C@@](C)(C1)[C@@H]2O	ZINC000100795074	358835079	/nfs/dbraw/zinc/83/50/79/358835079.db2.gz	USEYMIDJPFFVEL-BJWYYQGGSA-N	1	0	288.391	1.461	50	0		CDAARO
COCCC1(C[N@@H+]2CCC[C@H](C(N)=O)C2)CCC1	ZINC000095468535	358930578	/nfs/dbraw/zinc/93/05/78/358930578.db2.gz	BTRHVKSSIXXPBY-LBPRGKRZSA-N	1	0	254.374	1.391	50	0		CDAARO
CO[C@@H]1CC[N@H+](Cc2cnc(-c3ccccn3)nc2)C1	ZINC000216274871	358934435	/nfs/dbraw/zinc/93/44/35/358934435.db2.gz	QOZCLHBMTWIPRL-CYBMUJFWSA-N	1	0	270.336	1.759	50	0		CDAARO
COCCn1ccnc1C[N@H+](C)C1CCSCC1	ZINC000216340570	358938583	/nfs/dbraw/zinc/93/85/83/358938583.db2.gz	NHTRURQVYSFRHU-UHFFFAOYSA-N	1	0	269.414	1.857	50	0		CDAARO
COc1ccc(F)c(F)c1C(=O)N1CC[C@H](C[NH3+])C1	ZINC000222606995	359359158	/nfs/dbraw/zinc/35/91/58/359359158.db2.gz	BXGINUXHCBGQLZ-MRVPVSSYSA-N	1	0	270.279	1.394	50	0		CDAARO
CN(Cc1cccc(O)c1)c1cc(C2CC([NH3+])C2)nc(N)n1	ZINC000223208222	359407200	/nfs/dbraw/zinc/40/72/00/359407200.db2.gz	ADFNQAZTIOWGBD-UHFFFAOYSA-N	1	0	299.378	1.606	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)Cc2ccccc2Cl)C[C@H]1CO	ZINC000257185577	359516712	/nfs/dbraw/zinc/51/67/12/359516712.db2.gz	JQFXUYBPVTWMJU-GXTWGEPZSA-N	1	0	296.798	1.263	50	0		CDAARO
CC(C)n1ccc(C(=O)NC[C@@H]2CCC[N@@H+]2CCCO)n1	ZINC000408519819	359913219	/nfs/dbraw/zinc/91/32/19/359913219.db2.gz	DEPMVAFRBITNJH-ZDUSSCGKSA-N	1	0	294.399	1.041	50	0		CDAARO
CS(=O)(=O)c1ccc(CN2CC[C@H]3CC[C@@H](C2)[NH2+]3)cc1	ZINC000065380445	360094071	/nfs/dbraw/zinc/09/40/71/360094071.db2.gz	RYTYZJHBVIOCMQ-KGLIPLIRSA-N	1	0	294.420	1.416	50	0		CDAARO
Cc1cc(C(=O)N2CC[C@H](n3c(C)c[nH+]c3C)C2)n(C)n1	ZINC000409420726	360224632	/nfs/dbraw/zinc/22/46/32/360224632.db2.gz	NPPJAOWLMDIFHW-ZDUSSCGKSA-N	1	0	287.367	1.629	50	0		CDAARO
CC[N@H+](C[C@@H](O)COc1ccc(F)cc1)C[C@H]1CCOC1	ZINC000248269957	360479992	/nfs/dbraw/zinc/47/99/92/360479992.db2.gz	VIEKORHLTDSWIJ-UKRRQHHQSA-N	1	0	297.370	1.924	50	0		CDAARO
CSc1cccc(NC(=O)NC[C@@]2(O)CCC[NH2+]C2)c1	ZINC000426434605	360530766	/nfs/dbraw/zinc/53/07/66/360530766.db2.gz	XONVJJCCMMICRK-CQSZACIVSA-N	1	0	295.408	1.645	50	0		CDAARO
Cc1nn(C[C@@H](C)N2CCC[NH2+]CC2)c(C)c1Cl	ZINC000426500108	360677649	/nfs/dbraw/zinc/67/76/49/360677649.db2.gz	MUKGNDAPVDARKQ-SNVBAGLBSA-N	1	0	270.808	1.837	50	0		CDAARO
CN(Cc1ccoc1)C(=O)NCC[N@@H+]1CCC[C@H](CO)C1	ZINC000426498477	360677729	/nfs/dbraw/zinc/67/77/29/360677729.db2.gz	IYBRFDKGZWLALW-ZDUSSCGKSA-N	1	0	295.383	1.125	50	0		CDAARO
C[NH2+]Cc1nnc(SC[C@H]2CC(F)(F)C2(F)F)n1C	ZINC000426530795	360681568	/nfs/dbraw/zinc/68/15/68/360681568.db2.gz	KBGJQVTZNUNNOC-ZCFIWIBFSA-N	1	0	298.309	1.917	50	0		CDAARO
CC(=O)c1cc(CN2CCC3(CC2)C[NH2+]CCO3)cs1	ZINC000426622872	360690999	/nfs/dbraw/zinc/69/09/99/360690999.db2.gz	BLZWTGFFPRUJNV-UHFFFAOYSA-N	1	0	294.420	1.905	50	0		CDAARO
CO[C@H]1CCN(C(=O)c2ccc(C)cc2OCCC[NH3+])C1	ZINC000426668416	360694259	/nfs/dbraw/zinc/69/42/59/360694259.db2.gz	QNUYPMDNUAVQGP-ZDUSSCGKSA-N	1	0	292.379	1.584	50	0		CDAARO
[NH3+]CCOc1cccc(C(=O)NCC[C@H]2CCOC2)c1	ZINC000426485669	360675170	/nfs/dbraw/zinc/67/51/70/360675170.db2.gz	HVLRAANBGWAFAU-LBPRGKRZSA-N	1	0	278.352	1.181	50	0		CDAARO
Cc1c[nH]cc1C(=O)N1CCC([N@H+]2CCOC[C@@H]2C)CC1	ZINC000584345353	360794952	/nfs/dbraw/zinc/79/49/52/360794952.db2.gz	QGIWVLCLBBMLKP-ZDUSSCGKSA-N	1	0	291.395	1.648	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2ccc(-n3cccn3)cc2)C1	ZINC000178980455	189158735	/nfs/dbraw/zinc/15/87/35/189158735.db2.gz	FLBRRZCOFKONDJ-ZDUSSCGKSA-N	1	0	284.363	1.554	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2nc(C(C)C)ncc2Cl)C1	ZINC000178966536	189157744	/nfs/dbraw/zinc/15/77/44/189157744.db2.gz	ZSTSWCFNXGVJMI-JTQLQIEISA-N	1	0	296.802	1.935	50	0		CDAARO
O=C(NC[C@H]1CCC[NH2+]C1)c1cccc(Cl)n1	ZINC000129993107	360903611	/nfs/dbraw/zinc/90/36/11/360903611.db2.gz	HESQXBGHCGWSSB-VIFPVBQESA-N	1	0	253.733	1.464	50	0		CDAARO
C(=C/c1ccccc1)\CN1CCN([C@@H]2CC[NH2+]C2)CC1	ZINC000097425406	360959645	/nfs/dbraw/zinc/95/96/45/360959645.db2.gz	ZQSVRSZNVMQQQU-BBOMDTFKSA-N	1	0	271.408	1.679	50	0		CDAARO
CC(C)NC(=O)[C@@H]1C[C@H]([NH3+])CN1Cc1ccccc1Cl	ZINC000299762167	200862298	/nfs/dbraw/zinc/86/22/98/200862298.db2.gz	RSBUAJNZHHOAQN-JSGCOSHPSA-N	1	0	295.814	1.766	50	0		CDAARO
CC(C)N(C(C)C)S(=O)(=O)c1cccc(C[NH3+])c1	ZINC000526055980	363771591	/nfs/dbraw/zinc/77/15/91/363771591.db2.gz	ZAEXUGKSKGQACO-UHFFFAOYSA-N	1	0	270.398	1.953	50	0		CDAARO
COCc1nc(CN2CC[NH+](C3CCCCC3)CC2)no1	ZINC000182565360	189327925	/nfs/dbraw/zinc/32/79/25/189327925.db2.gz	PZXNHMCSCHYWBQ-UHFFFAOYSA-N	1	0	294.399	1.666	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N2CCC[C@H]([NH3+])C2)c1	ZINC000036297065	361462326	/nfs/dbraw/zinc/46/23/26/361462326.db2.gz	PJXBOYZPPKAYDS-JTQLQIEISA-N	1	0	272.345	1.246	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc(Cl)cc2)C[C@H]1CCO	ZINC000104335974	361587281	/nfs/dbraw/zinc/58/72/81/361587281.db2.gz	OLZBNJCHCJDTMH-CQSZACIVSA-N	1	0	268.788	1.838	50	0		CDAARO
O[C@H](COc1ccc2c(c1)OCO2)C[NH+]1CCCCC1	ZINC000002686876	364636540	/nfs/dbraw/zinc/63/65/40/364636540.db2.gz	ANFLPTDQGKPBFJ-LBPRGKRZSA-N	1	0	279.336	1.641	50	0		CDAARO
C[C@H](NC(=O)[C@@H]1CCC[NH2+]1)c1cccc(F)c1F	ZINC000195554981	189679743	/nfs/dbraw/zinc/67/97/43/189679743.db2.gz	PKJNRXYXNUDCSW-KWQFWETISA-N	1	0	254.280	1.894	50	0		CDAARO
COCCOc1cccc(C(=O)NC(C)(C)C[NH+](C)C)c1	ZINC000457200072	365286468	/nfs/dbraw/zinc/28/64/68/365286468.db2.gz	DFYTUCBZYQRCFE-UHFFFAOYSA-N	1	0	294.395	1.782	50	0		CDAARO
COc1ccccc1NC(=O)NC[C@](C)(O)C[NH+](C)C	ZINC000089901170	366962247	/nfs/dbraw/zinc/96/22/47/366962247.db2.gz	PJLMSJIKCXADSB-AWEZNQCLSA-N	1	0	281.356	1.129	50	0		CDAARO
C[C@H]1C[N@H+](C)CCN1CCCn1c2ccccc2oc1=O	ZINC000089939234	366974747	/nfs/dbraw/zinc/97/47/47/366974747.db2.gz	VIRBMMLGZHWUME-ZDUSSCGKSA-N	1	0	289.379	1.621	50	0		CDAARO
CCNC(=O)CC[N@@H+]1CCC[C@@H](Cc2nccn2C)C1	ZINC000090003605	367006189	/nfs/dbraw/zinc/00/61/89/367006189.db2.gz	ARTWZSGOQRNEIU-ZDUSSCGKSA-N	1	0	278.400	1.201	50	0		CDAARO
COc1csc(C(=O)N2CC[C@H]([NH3+])C[C@H]2C)c1	ZINC000124749776	367266639	/nfs/dbraw/zinc/26/66/39/367266639.db2.gz	DMHRNJCIUZIWTM-BDAKNGLRSA-N	1	0	254.355	1.709	50	0		CDAARO
CCOCCO[C@H]1CC[N@@H+]([C@H]2CCCC[C@H]2O)C1	ZINC000252511468	367676274	/nfs/dbraw/zinc/67/62/74/367676274.db2.gz	HCWXHEICORCUPU-MELADBBJSA-N	1	0	257.374	1.417	50	0		CDAARO
CCOCCN1CC[N@@H+]([C@H]2CCCOC2)C[C@@H]1CC	ZINC000252517690	367741602	/nfs/dbraw/zinc/74/16/02/367741602.db2.gz	OPPOSKYGJCEKHR-GJZGRUSLSA-N	1	0	270.417	1.598	50	0		CDAARO
CCOC(=O)[C@@H](C)N1CCC[C@H]1CC(=O)c1cnn(C)c1	ZINC000252517477	367741922	/nfs/dbraw/zinc/74/19/22/367741922.db2.gz	JOEJEAVXPYKDIJ-YPMHNXCESA-N	1	0	293.367	1.409	50	0		CDAARO
CCN(CC)c1ccc2cc(C(N)=O)c(=[NH+]C)oc2c1	ZINC000252605180	368379174	/nfs/dbraw/zinc/37/91/74/368379174.db2.gz	GHDOMAWUFISJOK-UHFFFAOYSA-N	1	0	273.336	1.908	50	0		CDAARO
CC(C)(C[N@@H+]1CC[C@@]2(O)CCCC[C@H]2C1)N1CCOCC1	ZINC000638106200	368402009	/nfs/dbraw/zinc/40/20/09/368402009.db2.gz	NCSSOYADHDPGPZ-RDJZCZTQSA-N	1	0	296.455	1.724	50	0		CDAARO
Cc1cc(C(=O)NCC[NH+]2CCCCC2)nc(C)n1	ZINC000330844583	203304194	/nfs/dbraw/zinc/30/41/94/203304194.db2.gz	JSXRUCMWUXDRCW-UHFFFAOYSA-N	1	0	262.357	1.309	50	0		CDAARO
Cc1n[nH]c(C)c1CCC[N@@H+](C)CCn1cnnc1	ZINC000670441826	482986892	/nfs/dbraw/zinc/98/68/92/482986892.db2.gz	ROZKSJIWWYREJU-UHFFFAOYSA-N	1	0	262.361	1.183	50	0		CDAARO
CCOCC[NH2+][C@H]1COc2ccc(OC)cc2C1	ZINC000295977031	371546636	/nfs/dbraw/zinc/54/66/36/371546636.db2.gz	MZUBXOPZZRRODV-GFCCVEGCSA-N	1	0	251.326	1.625	50	0		CDAARO
Cc1n[nH]nc1C(=O)N1CCC([C@@H](C)[NH+]2CCCC2)CC1	ZINC000299770313	372750856	/nfs/dbraw/zinc/75/08/56/372750856.db2.gz	RUOAAJGYEXJXPJ-GFCCVEGCSA-N	1	0	291.399	1.450	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N1CCC(c2ccncn2)CC1	ZINC000299793026	372767346	/nfs/dbraw/zinc/76/73/46/372767346.db2.gz	IRMPCEXFSPOUBL-LBPRGKRZSA-N	1	0	294.424	1.263	50	0		CDAARO
O[C@]12CC[NH2+]C[C@H]1CN(Cc1cc(C3CC3)on1)CC2	ZINC000244673980	189909442	/nfs/dbraw/zinc/90/94/42/189909442.db2.gz	HZFQYHKHYLKLFT-WFASDCNBSA-N	1	0	277.368	1.098	50	0		CDAARO
CC[NH+](CC)[C@@H]1CCN(CCC(=O)Nc2cccnc2)C1	ZINC000244882462	189914622	/nfs/dbraw/zinc/91/46/22/189914622.db2.gz	XSELNYVTNQYGLL-OAHLLOKOSA-N	1	0	290.411	1.826	50	0		CDAARO
C[C@@H](C[NH+](C)C)NC(=O)c1ccc(-n2ccnc2)cc1	ZINC000253420358	373730335	/nfs/dbraw/zinc/73/03/35/373730335.db2.gz	RMBJNWLOVJPAEF-LBPRGKRZSA-N	1	0	272.352	1.552	50	0		CDAARO
CCC[C@H]1C[C@H](C(=O)NCC[N@H+]2CC=CCC2)CCO1	ZINC000253431732	373745436	/nfs/dbraw/zinc/74/54/36/373745436.db2.gz	SZEJOWWYBCMIGM-CABCVRRESA-N	1	0	280.412	1.960	50	0		CDAARO
[NH3+]CCCOC1CCN(C(=O)CC2CCCC2)CC1	ZINC000094070866	374813116	/nfs/dbraw/zinc/81/31/16/374813116.db2.gz	AULDPJQFRRWFCO-UHFFFAOYSA-N	1	0	268.401	1.923	50	0		CDAARO
Cc1nccc(N2CC[C@H]([NH+](C)C)[C@H](CCCO)C2)n1	ZINC000095376225	374893289	/nfs/dbraw/zinc/89/32/89/374893289.db2.gz	ZSNLPCCIBRKNNT-KGLIPLIRSA-N	1	0	278.400	1.314	50	0		CDAARO
O=C1CCCN1CC[N@@H+](CCO)C1CCCCC1	ZINC000095395103	374902475	/nfs/dbraw/zinc/90/24/75/374902475.db2.gz	DLDBLWOHRJQUKH-UHFFFAOYSA-N	1	0	254.374	1.236	50	0		CDAARO
CC[NH+](CC)CCNCC(=O)Nc1ccc2c(c1)OCO2	ZINC000020027063	374838103	/nfs/dbraw/zinc/83/81/03/374838103.db2.gz	FSPXOGJXVVTHKS-UHFFFAOYSA-N	1	0	293.367	1.285	50	0		CDAARO
COCCOc1ccc(C[NH2+][C@H]2C[C@H](C)N(C)C2)cn1	ZINC000095420408	374922967	/nfs/dbraw/zinc/92/29/67/374922967.db2.gz	MEFLVUJUMLGTMG-JSGCOSHPSA-N	1	0	279.384	1.289	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1n[nH]c2c1CCC2	ZINC000095472584	374965978	/nfs/dbraw/zinc/96/59/78/374965978.db2.gz	PQMVPYQZRGYUOI-JTQLQIEISA-N	1	0	262.357	1.113	50	0		CDAARO
COc1ccc([C@@H](O)C[NH2+]C2CCOCC2)cc1	ZINC000037893119	374990314	/nfs/dbraw/zinc/99/03/14/374990314.db2.gz	CPTHSBQFSSENCA-AWEZNQCLSA-N	1	0	251.326	1.497	50	0		CDAARO
NC(=O)[C@H]([NH2+][C@@H]1CCCSC1)c1ccccc1	ZINC000097084457	375144787	/nfs/dbraw/zinc/14/47/87/375144787.db2.gz	LVMRZUFBZDGSGW-VXGBXAGGSA-N	1	0	250.367	1.698	50	0		CDAARO
CC[N@H+](CC(=O)N1CCC[C@H](C2(C)OCCO2)C1)C1CC1	ZINC000097108134	375148968	/nfs/dbraw/zinc/14/89/68/375148968.db2.gz	XVSDCMBYINKCEQ-ZDUSSCGKSA-N	1	0	296.411	1.472	50	0		CDAARO
CC(C)[NH+]1CCC(NC(=O)c2c(Cl)cnn2C)CC1	ZINC000002782425	375326799	/nfs/dbraw/zinc/32/67/99/375326799.db2.gz	OTFHBBCVOHOAFJ-UHFFFAOYSA-N	1	0	284.791	1.676	50	0		CDAARO
COC1CC[NH+](CC(=O)N2C[C@H](C)C[C@H](C)C2)CC1	ZINC000053906861	375727603	/nfs/dbraw/zinc/72/76/03/375727603.db2.gz	IAWWWIKHPZCYJN-BETUJISGSA-N	1	0	268.401	1.602	50	0		CDAARO
CCC[C@@H]([NH2+]CCCn1cc(CO)nn1)[C@@H]1CC1(C)C	ZINC000417324563	375780939	/nfs/dbraw/zinc/78/09/39/375780939.db2.gz	ALXARJJPRNBFAO-UONOGXRCSA-N	1	0	280.416	1.965	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)/C=C\c1csc(C)n1	ZINC000606441561	375823027	/nfs/dbraw/zinc/82/30/27/375823027.db2.gz	OACRYKJZMDOYIE-FOQNGQEVSA-N	1	0	265.382	1.675	50	0		CDAARO
Cc1nc(/C=C\C(=O)N2CC[NH2+][C@@H](C)C2)cs1	ZINC000606441382	375823469	/nfs/dbraw/zinc/82/34/69/375823469.db2.gz	WNNYDJSCTKSSMJ-TYRPZCRBSA-N	1	0	251.355	1.285	50	0		CDAARO
Cc1nc(-c2cccnc2)sc1C(=O)NCC[NH+](C)C	ZINC000031868022	375847965	/nfs/dbraw/zinc/84/79/65/375847965.db2.gz	VAQNGUQEVUIPBI-UHFFFAOYSA-N	1	0	290.392	1.805	50	0		CDAARO
NC(=[NH2+])N[C@H]1CC[C@@H](C(=O)OCc2ccccc2)CC1	ZINC000263623489	190070122	/nfs/dbraw/zinc/07/01/22/190070122.db2.gz	HWVACYSUMHWFLP-BETUJISGSA-N	1	0	275.352	1.772	50	0		CDAARO
Cc1c[nH+]ccc1N1CCC(C(=O)N2CCOCC2)CC1	ZINC000072793275	376808599	/nfs/dbraw/zinc/80/85/99/376808599.db2.gz	DVDXCYPSKWJMBO-UHFFFAOYSA-N	1	0	289.379	1.465	50	0		CDAARO
CC(C)N1C[C@@H](C)[C@H]([NH2+][C@H](C)CCS(C)(=O)=O)C1	ZINC000245338655	378070857	/nfs/dbraw/zinc/07/08/57/378070857.db2.gz	NOZLPZMXLCFMPC-JHJVBQTASA-N	1	0	276.446	1.128	50	0		CDAARO
Cn1nnnc1-c1cc(O)cc(CC[C@@H]2CCCC[NH2+]2)c1	ZINC000071767518	379633901	/nfs/dbraw/zinc/63/39/01/379633901.db2.gz	HMAJALFUPRBBDI-ZDUSSCGKSA-N	1	0	287.367	1.657	50	0		CDAARO
Cc1n(CCO)c2cc(Cl)c(Cl)cc2[n+]1CCO	ZINC000000370117	169620845	/nfs/dbraw/zinc/62/08/45/169620845.db2.gz	MSXUIASJIXWZMF-UHFFFAOYSA-N	1	0	290.170	1.529	50	0		CDAARO
CCOC(=O)[C@@](C)(NC(=O)C[N@H+](C)C(C)C)C(C)C	ZINC000096412769	256790220	/nfs/dbraw/zinc/79/02/20/256790220.db2.gz	SPYFRDVTNDGJDF-AWEZNQCLSA-N	1	0	272.389	1.421	50	0		CDAARO
CCCC[N@H+](C)[C@@H](C)C(=O)Nc1ccc(C(N)=O)cc1	ZINC000032799795	390210803	/nfs/dbraw/zinc/21/08/03/390210803.db2.gz	NSPKLYHOCFKYQK-NSHDSACASA-N	1	0	277.368	1.844	50	0		CDAARO
CC(C)NC(=O)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCN(C3CC3)C2)C1	ZINC000241644684	391680722	/nfs/dbraw/zinc/68/07/22/391680722.db2.gz	PSRNQYBYGGQHTJ-KFWWJZLASA-N	1	0	293.455	1.896	50	0		CDAARO
Cc1cc(Cl)ccc1S(=O)(=O)N1CCC[NH2+]CC1	ZINC000036983620	392038275	/nfs/dbraw/zinc/03/82/75/392038275.db2.gz	VTMCDAJFJBSMCL-UHFFFAOYSA-N	1	0	288.800	1.632	50	0		CDAARO
CC1(C)CC([NH2+]Cc2ccc(S(=O)(=O)CCO)cc2)C1	ZINC000433069806	392333079	/nfs/dbraw/zinc/33/30/79/392333079.db2.gz	WDKNFWSDSDTYNJ-UHFFFAOYSA-N	1	0	297.420	1.731	50	0		CDAARO
Cc1ccc([C@H]2CC[N@H+](CCCS(N)(=O)=O)C2)c(C)c1	ZINC000280467401	393152207	/nfs/dbraw/zinc/15/22/07/393152207.db2.gz	OSUDFLZXBIOYTM-AWEZNQCLSA-N	1	0	296.436	1.771	50	0		CDAARO
Cc1ccc(NC(=O)c2cc[nH]n2)c(OCC[NH+](C)C)c1	ZINC000096414006	393183215	/nfs/dbraw/zinc/18/32/15/393183215.db2.gz	CJEWTUSPWSQJIQ-UHFFFAOYSA-N	1	0	288.351	1.911	50	0		CDAARO
OCC[C@@H]1CCC[N@H+](CCOC[C@@H]2CCCO2)C1	ZINC000096421780	393185522	/nfs/dbraw/zinc/18/55/22/393185522.db2.gz	WPTLQIJXXNFCME-KBPBESRZSA-N	1	0	257.374	1.276	50	0		CDAARO
CC[C@H](C)[C@@H]([NH3+])C(=O)N1CCC[C@H](Cc2nccn2C)C1	ZINC000299753348	393199769	/nfs/dbraw/zinc/19/97/69/393199769.db2.gz	XXMLJLGVMBYGFU-GZBFAFLISA-N	1	0	292.427	1.575	50	0		CDAARO
CC1=CCC[C@H](C)[C@@H]1C[N@H+](C)CC(=O)N1CCC(O)CC1	ZINC000195575802	393304561	/nfs/dbraw/zinc/30/45/61/393304561.db2.gz	AEZPCKCAXRYNGG-GOEBONIOSA-N	1	0	294.439	1.894	50	0		CDAARO
O=C([C@H]1CCC[NH2+]1)N1CCN(c2ccccc2F)CC1	ZINC000005394991	134657024	/nfs/dbraw/zinc/65/70/24/134657024.db2.gz	FJCXOAFDEBQQDP-CYBMUJFWSA-N	1	0	277.343	1.226	50	0		CDAARO
O=C(NC[C@H]1[NH2+]CCc2ccccc21)c1cc[nH]c(=O)c1	ZINC000261625582	140365465	/nfs/dbraw/zinc/36/54/65/140365465.db2.gz	HBHANKMHIDDPIQ-CQSZACIVSA-N	1	0	283.331	1.404	50	0		CDAARO
[NH3+][C@H](C(=O)Nc1cnc2ccccc2c1)C1CCOCC1	ZINC000261726737	140380749	/nfs/dbraw/zinc/38/07/49/140380749.db2.gz	JRDVZMXVZJOIFU-HNNXBMFYSA-N	1	0	285.347	1.927	50	0		CDAARO
C[C@]1(C[NH3+])CCN(C(=O)c2cccc3c2OCCO3)C1	ZINC000261836857	140396956	/nfs/dbraw/zinc/39/69/56/140396956.db2.gz	VFUKHUMHSOLQIB-OAHLLOKOSA-N	1	0	276.336	1.269	50	0		CDAARO
CC[C@@H]1CN(c2ncnc3c2CCC3)CC[N@@H+]1C[C@H](C)O	ZINC000106906108	398123347	/nfs/dbraw/zinc/12/33/47/398123347.db2.gz	IJOGUOUJZAOXKI-QWHCGFSZSA-N	1	0	290.411	1.247	50	0		CDAARO
CC[C@H]([NH2+]Cc1cc(=O)n2ccsc2n1)[C@@H]1CCCO1	ZINC000182367821	148258370	/nfs/dbraw/zinc/25/83/70/148258370.db2.gz	BTFRYZFNYNMUND-RYUDHWBXSA-N	1	0	293.392	1.803	50	0		CDAARO
CO[C@]1(C)C[C@H](NC(=O)[C@@H]2CCCC[NH2+]2)C1(C)C	ZINC000121681547	286170084	/nfs/dbraw/zinc/17/00/84/286170084.db2.gz	ZXOAFLJOGGXRMQ-COPLHBTASA-N	1	0	254.374	1.448	50	0		CDAARO
C[NH+](C)[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1ccccc1	ZINC000000858967	289289669	/nfs/dbraw/zinc/28/96/69/289289669.db2.gz	VLEJSVXWQQVRQO-UONOGXRCSA-N	1	0	282.409	1.838	50	0		CDAARO
COC(=O)[C@H](CCCC[NH3+])NC(=O)OC(C)(C)C	ZINC000002555029	169807734	/nfs/dbraw/zinc/80/77/34/169807734.db2.gz	UEBNVLLIWJWEKV-VIFPVBQESA-N	1	0	260.334	1.182	50	0		CDAARO
COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCCCNC2=O)cc1	ZINC000004989280	170050041	/nfs/dbraw/zinc/05/00/41/170050041.db2.gz	WWPLVGJTGXDBAY-IUODEOHRSA-N	1	0	276.380	1.885	50	0		CDAARO
O=C(Cc1cccs1)NCC[NH+]1CCCCC1	ZINC000006528236	170210878	/nfs/dbraw/zinc/21/08/78/170210878.db2.gz	XKXSTTBRSYREIW-UHFFFAOYSA-N	1	0	252.383	1.893	50	0		CDAARO
C[C@H]1CCC[N@H+](CC(=O)NC(=O)NCC(F)(F)F)C1	ZINC000007340739	170277794	/nfs/dbraw/zinc/27/77/94/170277794.db2.gz	FBNQJOPFSLTQAR-QMMMGPOBSA-N	1	0	281.278	1.106	50	0		CDAARO
COCCC[NH2+]CC(=O)Nc1ccc2c(c1)CCC2	ZINC000008343473	170332035	/nfs/dbraw/zinc/33/20/35/170332035.db2.gz	YOVWCFWJYFDERI-UHFFFAOYSA-N	1	0	262.353	1.740	50	0		CDAARO
C[C@H](CCc1ccccc1)[NH2+]CCN1CCOCC1	ZINC000019954131	170940575	/nfs/dbraw/zinc/94/05/75/170940575.db2.gz	FVXIKYAOFZNMHI-OAHLLOKOSA-N	1	0	262.397	1.930	50	0		CDAARO
COc1ccc(C[NH2+]CCNC(=O)C(C)C)c(OC)c1	ZINC000020125111	171007552	/nfs/dbraw/zinc/00/75/52/171007552.db2.gz	MEDGDBHTELWMMD-UHFFFAOYSA-N	1	0	280.368	1.566	50	0		CDAARO
COc1cc(C[NH2+]CCCN2CCOCC2)cc(OC)c1	ZINC000020141972	171028536	/nfs/dbraw/zinc/02/85/36/171028536.db2.gz	NJOHECXYYOUJBI-UHFFFAOYSA-N	1	0	294.395	1.516	50	0		CDAARO
Cc1ccc(-c2noc(CN3CC[NH2+]CC3)n2)cc1	ZINC000020280642	171132955	/nfs/dbraw/zinc/13/29/55/171132955.db2.gz	VLTQMKPBOCRLEA-UHFFFAOYSA-N	1	0	258.325	1.450	50	0		CDAARO
O[C@@H](CN1CC[NH+](Cc2ccccc2)CC1)C(F)(F)F	ZINC000020388109	171177264	/nfs/dbraw/zinc/17/72/64/171177264.db2.gz	PKEONBQBQCKUHP-ZDUSSCGKSA-N	1	0	288.313	1.727	50	0		CDAARO
C[NH+]1CCN(Cc2cc(=O)oc3ccc(O)cc23)CC1	ZINC000020590837	171261027	/nfs/dbraw/zinc/26/10/27/171261027.db2.gz	IQMLSUNQOOIGEF-UHFFFAOYSA-N	1	0	274.320	1.246	50	0		CDAARO
CS[C@H](C)CC[NH+]1CCC(Cn2cc(CO)nn2)CC1	ZINC000020864202	171276699	/nfs/dbraw/zinc/27/66/99/171276699.db2.gz	ZOQWKNFUNCRNPN-GFCCVEGCSA-N	1	0	298.456	1.624	50	0		CDAARO
CC[NH+](CC)CCCNC(=O)c1cnc(N(C)C)nc1C	ZINC000021034997	171292327	/nfs/dbraw/zinc/29/23/27/171292327.db2.gz	GXNLCZNXENUPGX-UHFFFAOYSA-N	1	0	293.415	1.313	50	0		CDAARO
CC1(C)CC(NC(=O)c2nccnc2N)CC(C)(C)[NH2+]1	ZINC000021472959	171304150	/nfs/dbraw/zinc/30/41/50/171304150.db2.gz	AGNUEXDFZSGMFV-UHFFFAOYSA-N	1	0	277.372	1.098	50	0		CDAARO
CCOc1cc(CN2CC[NH+](CCO)CC2)ccc1OC	ZINC000022585271	171392349	/nfs/dbraw/zinc/39/23/49/171392349.db2.gz	JPNDPNUZZUWPFK-UHFFFAOYSA-N	1	0	294.395	1.204	50	0		CDAARO
CC(C)C(=O)NC[C@@H](c1ccsc1)N1CC[NH+](C)CC1	ZINC000022575953	171392673	/nfs/dbraw/zinc/39/26/73/171392673.db2.gz	KYSIMVUAPOYARS-AWEZNQCLSA-N	1	0	295.452	1.809	50	0		CDAARO
CC(C)NC(=O)Nc1ccc(CN2CC[NH+](C)CC2)cc1	ZINC000035598056	172287367	/nfs/dbraw/zinc/28/73/67/172287367.db2.gz	LNCXKUSZBYUFCE-UHFFFAOYSA-N	1	0	290.411	1.964	50	0		CDAARO
CCOc1cc2c(cc1C[NH2+][C@@H](C)CO)O[C@H](C)C2	ZINC000035603839	172292294	/nfs/dbraw/zinc/29/22/94/172292294.db2.gz	YPNWKUOFHVPGPO-WDEREUQCSA-N	1	0	265.353	1.879	50	0		CDAARO
O=C(NCc1cccc(C(F)(F)F)c1)[C@@H]1C[NH2+]CCO1	ZINC000043707523	175100040	/nfs/dbraw/zinc/10/00/40/175100040.db2.gz	KWHVORXERIMBAH-NSHDSACASA-N	1	0	288.269	1.310	50	0		CDAARO
Cc1ccc(-c2cc(C(=O)N3CCC([NH3+])CC3)[nH]n2)cc1	ZINC000045948692	175388348	/nfs/dbraw/zinc/38/83/48/175388348.db2.gz	PVFQRXGSEXMCER-UHFFFAOYSA-N	1	0	284.363	1.948	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](NC(=O)c2cccc(-n3cccn3)c2)C1	ZINC000071749986	176259421	/nfs/dbraw/zinc/25/94/21/176259421.db2.gz	ZTMVENKSKVUFGS-CHWSQXEVSA-N	1	0	270.336	1.482	50	0		CDAARO
CS(=O)(=O)c1cnc(CC2CC2)nc1[C@@H]1CCC[NH2+]C1	ZINC000071748760	176259701	/nfs/dbraw/zinc/25/97/01/176259701.db2.gz	BINVJJKPBXOXTA-LLVKDONJSA-N	1	0	295.408	1.300	50	0		CDAARO
CN(CCc1cn[nH]c1)C(=O)c1cccc([C@H]2CC[NH2+]C2)c1	ZINC000072154479	176327808	/nfs/dbraw/zinc/32/78/08/176327808.db2.gz	LJZKABXDZPWCIC-INIZCTEOSA-N	1	0	298.390	1.801	50	0		CDAARO
CCn1nc(C(C)C)cc1C(=O)N1CCC[C@@H]([NH3+])CC1	ZINC000072156631	176328510	/nfs/dbraw/zinc/32/85/10/176328510.db2.gz	QOCVLXDEQLXEPM-GFCCVEGCSA-N	1	0	278.400	1.980	50	0		CDAARO
Cc1ccc(Cl)cc1C(=O)NC[C@@H]1CC[NH2+]C[C@H]1O	ZINC000072158374	176329520	/nfs/dbraw/zinc/32/95/20/176329520.db2.gz	DGSUWFMJKCDZPP-GXFFZTMASA-N	1	0	282.771	1.349	50	0		CDAARO
[NH3+][C@@H]1CCN(c2ccc(C(=O)Nc3ccccc3)cn2)C1	ZINC000072332508	176370435	/nfs/dbraw/zinc/37/04/35/176370435.db2.gz	CDGVOCAZKUHHES-CYBMUJFWSA-N	1	0	282.347	1.871	50	0		CDAARO
CN(Cc1ccc(-n2cccn2)cc1)C(=O)[C@@H]1CC[NH2+]1	ZINC000072409187	176398258	/nfs/dbraw/zinc/39/82/58/176398258.db2.gz	DUWWUNPFYSXSOV-AWEZNQCLSA-N	1	0	270.336	1.193	50	0		CDAARO
Cc1ncsc1CCN(C)C[C@]1(O)CCC[NH2+]C1	ZINC000077297932	177250166	/nfs/dbraw/zinc/25/01/66/177250166.db2.gz	VWZRMYLOBOVRBD-ZDUSSCGKSA-N	1	0	269.414	1.040	50	0		CDAARO
Cn1cccc1[C@H]1NC(=[NH2+])Nc2nc3ccccc3n21	ZINC000001408245	274896665	/nfs/dbraw/zinc/89/66/65/274896665.db2.gz	CVAOVQAFJATNEY-LBPRGKRZSA-N	1	0	266.308	1.471	50	0		CDAARO
O=C(c1nc2c(s1)CCCC2)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065386559	275016198	/nfs/dbraw/zinc/01/61/98/275016198.db2.gz	MBAVMNFOBLRSOS-MNOVXSKESA-N	1	0	291.420	1.988	50	0		CDAARO
CC(=O)NC1CCC([NH2+][C@H]2Cc3ccccc3[C@H]2O)CC1	ZINC000187214671	275478273	/nfs/dbraw/zinc/47/82/73/275478273.db2.gz	DWBNMOFOBQCEQQ-YQEWQEHLSA-N	1	0	288.391	1.682	50	0		CDAARO
CC[C@H](C(=O)N[C@H]1CCCCC[C@@H]1CO)[NH+](C)C	ZINC000095443473	276610542	/nfs/dbraw/zinc/61/05/42/276610542.db2.gz	OFDYGMKALQZFSO-FRRDWIJNSA-N	1	0	256.390	1.384	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)NCCc1ccncc1	ZINC000091656263	277042763	/nfs/dbraw/zinc/04/27/63/277042763.db2.gz	IXQHOVDDDAXCKP-AWEZNQCLSA-N	1	0	261.369	1.615	50	0		CDAARO
CC(C)=CC(=O)N1CC[NH+]([C@@H]2CCSC2)CC1	ZINC000087488117	277322249	/nfs/dbraw/zinc/32/22/49/277322249.db2.gz	VQZNWNFTNKDFGY-GFCCVEGCSA-N	1	0	254.399	1.602	50	0		CDAARO
C[C@@H]1[C@@H]2CCC[N@@H+]2CCN1C(=O)c1ccc2c(c1)nnn2C	ZINC000020540858	278086698	/nfs/dbraw/zinc/08/66/98/278086698.db2.gz	HNLONUROJMOWNB-RISCZKNCSA-N	1	0	299.378	1.277	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(CC[C@H](C[NH3+])O2)CC1	ZINC000091303588	278384388	/nfs/dbraw/zinc/38/43/88/278384388.db2.gz	LXUKJCKJBCDGOJ-LLVKDONJSA-N	1	0	270.373	1.894	50	0		CDAARO
CC(C)N1CC[C@@H]([N@@H+]2CCC[C@H]([C@H](C)O)C2)C1=O	ZINC000245338718	280203704	/nfs/dbraw/zinc/20/37/04/280203704.db2.gz	OAGOMHUBNQAPDY-RWMBFGLXSA-N	1	0	254.374	1.089	50	0		CDAARO
Cc1ccccc1[C@@]1(O)CC[N@H+](CCc2cn[nH]c2)C1	ZINC000244787847	281378892	/nfs/dbraw/zinc/37/88/92/281378892.db2.gz	QESALAZKQZERLX-MRXNPFEDSA-N	1	0	271.364	1.854	50	0		CDAARO
O=C(/C=C\c1c(F)cccc1F)N1CC[NH2+]CC1	ZINC000255362126	289368296	/nfs/dbraw/zinc/36/82/96/289368296.db2.gz	GXWQNFBZDWVFFH-PLNGDYQASA-N	1	0	252.264	1.410	50	0		CDAARO
C[C@H](Oc1cccnc1)C(=O)N1CCC[C@@H](C)[C@H]1C[NH3+]	ZINC000247314664	290187391	/nfs/dbraw/zinc/18/73/91/290187391.db2.gz	RPDRENXZEZLVCM-MBNYWOFBSA-N	1	0	277.368	1.435	50	0		CDAARO
[NH3+]C1CCC(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000055143888	295212982	/nfs/dbraw/zinc/21/29/82/295212982.db2.gz	RXZCBLUXDOQUEN-UHFFFAOYSA-N	1	0	257.330	1.869	50	0		CDAARO
[NH3+][C@H]1CCS(=O)(=O)c2ccc(Br)cc21	ZINC000089222708	295340694	/nfs/dbraw/zinc/34/06/94/295340694.db2.gz	KJUYFPJSIRWYOW-QMMMGPOBSA-N	1	0	276.155	1.626	50	0		CDAARO
C[C@H]([NH3+])CCNC(=O)c1csc(-c2ccoc2)n1	ZINC000178702172	315958991	/nfs/dbraw/zinc/95/89/91/315958991.db2.gz	YHMYKJAXMOXHQC-QMMMGPOBSA-N	1	0	265.338	1.870	50	0		CDAARO
CS(=O)(=O)N1CCC[N@H+](CCCc2ccco2)CC1	ZINC000252510268	328106008	/nfs/dbraw/zinc/10/60/08/328106008.db2.gz	ZFVDXLDWXDLJKH-UHFFFAOYSA-N	1	0	286.397	1.180	50	0		CDAARO
Cc1nn(C(C)C)c(C)c1CN(C)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000534588250	328316492	/nfs/dbraw/zinc/31/64/92/328316492.db2.gz	AFMMDNSQISDSFF-AWEZNQCLSA-N	1	0	276.384	1.567	50	0		CDAARO
C[C@@H](C[NH+]1CCCCC1)C(=O)NCc1cccnc1N	ZINC000534645986	328332363	/nfs/dbraw/zinc/33/23/63/328332363.db2.gz	UFEIMASJUWXZHS-LBPRGKRZSA-N	1	0	276.384	1.402	50	0		CDAARO
Nc1ncc(C(=O)NC[C@@H]2CC[N@@H+](C3CCCC3)C2)s1	ZINC000534636986	328334046	/nfs/dbraw/zinc/33/40/46/328334046.db2.gz	IRMJCYAOOUAFPA-JTQLQIEISA-N	1	0	294.424	1.550	50	0		CDAARO
O=C(N[C@H]1COC[C@@H]1[NH+]1CCCC1)c1cccn1C1CC1	ZINC000534640160	328335608	/nfs/dbraw/zinc/33/56/08/328335608.db2.gz	GKBBJEHGYFUCNC-ZFWWWQNUSA-N	1	0	289.379	1.416	50	0		CDAARO
C[NH+](C)C(C)(C)CNC(=O)N1Cc2ccccc2[C@H](O)C1	ZINC000534640203	328335920	/nfs/dbraw/zinc/33/59/20/328335920.db2.gz	RSRCYYRAOBRFTI-CQSZACIVSA-N	1	0	291.395	1.585	50	0		CDAARO
Cc1csc(S(=O)(=O)NC[C@@H](C(C)C)[NH+](C)C)c1	ZINC000534665547	328344973	/nfs/dbraw/zinc/34/49/73/328344973.db2.gz	DKNPGJFBNUGRNM-NSHDSACASA-N	1	0	290.454	1.921	50	0		CDAARO
CNc1nc(NCCc2nc3ccccc3s2)cc(C)[nH+]1	ZINC000534674493	328349045	/nfs/dbraw/zinc/34/90/45/328349045.db2.gz	FQQRTDPLPZBHNE-UHFFFAOYSA-N	1	0	299.403	1.935	50	0		CDAARO
CCn1ccnc1C[NH2+]C[C@H]1CCCn2ccnc21	ZINC000083843634	323207291	/nfs/dbraw/zinc/20/72/91/323207291.db2.gz	LGOCWKVHEQELPQ-GFCCVEGCSA-N	1	0	259.357	1.767	50	0		CDAARO
COC(=O)CCCC(=O)N1CCCC[C@@H]([NH+]2CCCC2)C1	ZINC000097378094	323208110	/nfs/dbraw/zinc/20/81/10/323208110.db2.gz	ZDHRRNHVJVXGHH-CQSZACIVSA-N	1	0	296.411	1.807	50	0		CDAARO
[NH3+][C@H]1CC[C@@H](C(=O)N2CCOc3ccccc3C2)C1	ZINC000091543756	482570970	/nfs/dbraw/zinc/57/09/70/482570970.db2.gz	VNARBPZONBSUDR-YPMHNXCESA-N	1	0	260.337	1.535	50	0		CDAARO
C[C@H](c1ncnn1CCO)[N@H+](C)C1CCCCC1	ZINC000091965388	482594445	/nfs/dbraw/zinc/59/44/45/482594445.db2.gz	QSPLLURONKITMM-LLVKDONJSA-N	1	0	252.362	1.596	50	0		CDAARO
C[NH+](C)[C@H]1CC[C@H](NC(=O)Cc2noc3ccccc23)C1	ZINC000092473140	482623329	/nfs/dbraw/zinc/62/33/29/482623329.db2.gz	RMSXXYQVXKDJNY-RYUDHWBXSA-N	1	0	287.363	1.969	50	0		CDAARO
C[N@H+](Cc1cc(=O)c2ccccc2[nH]1)CC1(C)COC1	ZINC000670455474	483032761	/nfs/dbraw/zinc/03/27/61/483032761.db2.gz	UYUPALGRODKICH-UHFFFAOYSA-N	1	0	272.348	1.996	50	0		CDAARO
O=C(C1CCC1)N1CCC([N@@H+]2CCC[C@H](O)CC2)CC1	ZINC000670466907	483057459	/nfs/dbraw/zinc/05/74/59/483057459.db2.gz	NKWCNYRGJCQYMZ-HNNXBMFYSA-N	1	0	280.412	1.624	50	0		CDAARO
O=c1c2c(Cl)cccc2ncn1C[C@]1(O)CCC[NH2+]C1	ZINC000670471432	483074319	/nfs/dbraw/zinc/07/43/19/483074319.db2.gz	LUTUTCGEPLHZOP-AWEZNQCLSA-N	1	0	293.754	1.164	50	0		CDAARO
Cc1cc(C)cc(OC[C@@H](O)C[NH2+]C(C)(C)CO)c1	ZINC000026781272	483228275	/nfs/dbraw/zinc/22/82/75/483228275.db2.gz	DWNDLMZUIKANRP-ZDUSSCGKSA-N	1	0	267.369	1.404	50	0		CDAARO
O=C(COC1CCCCC1)NC[C@H]1C[N@@H+]2CCC[C@@H]2CO1	ZINC000084543985	483286502	/nfs/dbraw/zinc/28/65/02/483286502.db2.gz	VAJGPFWVKOSYDU-HIFRSBDPSA-N	1	0	296.411	1.315	50	0		CDAARO
O=C(NC1CC1)[C@H]1CCC[N@H+](C[C@H]2CCCCO2)C1	ZINC000084544098	483286661	/nfs/dbraw/zinc/28/66/61/483286661.db2.gz	WYMVRWQDRNDPBI-GXTWGEPZSA-N	1	0	266.385	1.546	50	0		CDAARO
C[C@H](NC(=O)c1ccncc1F)C(C)(C)C[NH+](C)C	ZINC000096449599	533769072	/nfs/dbraw/zinc/76/90/72/533769072.db2.gz	NCCPGHUQGGJCRF-JTQLQIEISA-N	1	0	267.348	1.927	50	0		CDAARO
Cc1nn(C)c(=O)n1C1CC[NH+](CC(C)C)CC1	ZINC000581814039	1161981685	/nfs/dbraw/zinc/98/16/85/1161981685.db2.gz	MDYCDMMSJHAMAJ-UHFFFAOYSA-N	1	0	252.362	1.183	50	0		CDAARO
COc1ccccc1C[C@@H](C)[NH2+]C[C@H](C)N1CCOCC1	ZINC000097016491	534104505	/nfs/dbraw/zinc/10/45/05/534104505.db2.gz	GYVMXFPDPHNRQI-CABCVRRESA-N	1	0	292.423	1.937	50	0		CDAARO
O=C(NCC[NH+]1CCC(O)CC1)c1cccc2cnccc21	ZINC000220008614	534324354	/nfs/dbraw/zinc/32/43/54/534324354.db2.gz	HURLYXFLZBQZLP-UHFFFAOYSA-N	1	0	299.374	1.421	50	0		CDAARO
Cc1nc2ncnn2c2c1CCN2CC[NH+]1CCCCC1	ZINC000004072898	534714311	/nfs/dbraw/zinc/71/43/11/534714311.db2.gz	CSYHUNBSXVWNQW-UHFFFAOYSA-N	1	0	286.383	1.281	50	0		CDAARO
[NH3+][C@H]1CCN(Cc2cn3cc(Cl)ccc3n2)C1	ZINC000050243252	527411357	/nfs/dbraw/zinc/41/13/57/527411357.db2.gz	GQECXAZGOCZJAF-JTQLQIEISA-N	1	0	250.733	1.521	50	0		CDAARO
CC(C)n1cc([C@H](C)[NH2+]CC(C)(C)S(C)(=O)=O)cn1	ZINC000096479041	528577490	/nfs/dbraw/zinc/57/74/90/528577490.db2.gz	DBYYDLVHZGAGHG-NSHDSACASA-N	1	0	287.429	1.938	50	0		CDAARO
C[NH+](C)C1(CNc2cc(=O)[nH]cn2)CCCCC1	ZINC000891476459	617430559	/nfs/dbraw/zinc/43/05/59/617430559.db2.gz	QSMZGABDJLZGFK-UHFFFAOYSA-N	1	0	250.346	1.859	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](CNc2ncc(F)cn2)C1	ZINC000952967226	616349186	/nfs/dbraw/zinc/34/91/86/616349186.db2.gz	KFLQLTKJEDTESB-LLVKDONJSA-N	1	0	268.336	1.386	50	0		CDAARO
C[N@@H+]1CCN(c2ncc(F)cn2)C[C@@H]1C(C)(C)C	ZINC000874435557	632388419	/nfs/dbraw/zinc/38/84/19/632388419.db2.gz	XMJCTXWQSFXWPU-LLVKDONJSA-N	1	0	252.337	1.782	50	0		CDAARO
Cc1nc(CN(CC[NH+](C)C)C(=O)C[C@H]2C=CCC2)c[nH]1	ZINC001772702414	1159437323	/nfs/dbraw/zinc/43/73/23/1159437323.db2.gz	RVOKXNPEWGRMBP-AWEZNQCLSA-N	1	0	290.411	1.965	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1nnc(CN(C)C)o1	ZINC001772701564	1159437634	/nfs/dbraw/zinc/43/76/34/1159437634.db2.gz	NZEGGCHULKIWFH-NSHDSACASA-N	1	0	267.377	1.418	50	0		CDAARO
CC1=NO[C@](C)(C(=O)Nc2nnc(CC[NH+](C)C)s2)C1	ZINC001506413803	1160711378	/nfs/dbraw/zinc/71/13/78/1160711378.db2.gz	VXGUHHUPFAGJMX-LBPRGKRZSA-N	1	0	297.384	1.136	50	0		CDAARO
O=C(NCCCCC[NH+]1CCOCC1)c1cncc(O)c1	ZINC000828930807	1161949298	/nfs/dbraw/zinc/94/92/98/1161949298.db2.gz	HIYHQTWIFOGFPA-UHFFFAOYSA-N	1	0	293.367	1.020	50	0		CDAARO
CN(C)c1nccnc1N1CCC[C@H]([NH+](C)C)CC1	ZINC001704344725	1177695034	/nfs/dbraw/zinc/69/50/34/1177695034.db2.gz	XJTLTIPBZRNLRO-LBPRGKRZSA-N	1	0	263.389	1.463	50	0		CDAARO
CCCCCOCC(=O)N[C@@]1(C)C[NH+]2CCC1CC2	ZINC000585126611	1164214469	/nfs/dbraw/zinc/21/44/69/1164214469.db2.gz	DBWICJSWXNXYNA-HNNXBMFYSA-N	1	0	268.401	1.794	50	0		CDAARO
O[C@@H]1CN(C2CCC2)CC[C@H]1[NH+]1CCCCCC1	ZINC000014950424	774880380	/nfs/dbraw/zinc/88/03/80/774880380.db2.gz	BODYLRAOMHXMSY-HUUCEWRRSA-N	1	0	252.402	1.850	50	0		CDAARO
COCCN1CCC[C@]2(CC[N@H+](Cc3ccco3)C2)C1=O	ZINC000015079661	776164149	/nfs/dbraw/zinc/16/41/49/776164149.db2.gz	BNFODSXXJXEYGE-MRXNPFEDSA-N	1	0	292.379	1.741	50	0		CDAARO
Cc1nnc(CN2CCC[C@@H](c3cc(=O)[nH]cn3)C2)s1	ZINC000299787736	776209716	/nfs/dbraw/zinc/20/97/16/776209716.db2.gz	XMTPUTAJCKCLHT-SNVBAGLBSA-N	1	0	291.380	1.722	50	0		CDAARO
Cc1cccc2[nH]c(CCC(=O)NC[C@H]3CCC[NH2+]3)nc21	ZINC000178752735	776540494	/nfs/dbraw/zinc/54/04/94/776540494.db2.gz	BTJJJBGTZJKBCB-GFCCVEGCSA-N	1	0	286.379	1.672	50	0		CDAARO
CC[N@H+](C)C[C@]1(O)CCCN(Cc2ccc(F)cc2)C1=O	ZINC000012711218	777211011	/nfs/dbraw/zinc/21/10/11/777211011.db2.gz	YCENJGRHKRBQRT-MRXNPFEDSA-N	1	0	294.370	1.631	50	0		CDAARO
CC(C)(C)n1cc(C(=O)N2CC[C@@H]([NH3+])C(C)(C)C2)cn1	ZINC000261965439	778154517	/nfs/dbraw/zinc/15/45/17/778154517.db2.gz	LHOJEPCKBBCRAA-GFCCVEGCSA-N	1	0	278.400	1.838	50	0		CDAARO
Cc1nc(C)c(C(=O)N2CCC[N@@H+](CC(C)C)CC2)[nH]1	ZINC000952972761	778587782	/nfs/dbraw/zinc/58/77/82/778587782.db2.gz	LXLTWFGKHHVQMS-UHFFFAOYSA-N	1	0	278.400	1.830	50	0		CDAARO
C=CC(=O)NCC1([NH+]2CCSCC2)CCCC1	ZINC000791324964	778776465	/nfs/dbraw/zinc/77/64/65/778776465.db2.gz	WZBYUGHMLZJBCG-UHFFFAOYSA-N	1	0	254.399	1.650	50	0		CDAARO
[NH3+]CC(C[NH3+])NCc1c(Cl)oc2ccccc21	ZINC000864096798	779100459	/nfs/dbraw/zinc/10/04/59/779100459.db2.gz	HYHAVFDOSXFKQN-UHFFFAOYSA-N	1	0	253.733	1.462	50	0		CDAARO
C[C@@H]1CCC[N@H+](CCc2nc(-c3cn(C)cn3)no2)C1	ZINC000020450087	779982307	/nfs/dbraw/zinc/98/23/07/779982307.db2.gz	FZFHZMJBKRYTIN-LLVKDONJSA-N	1	0	275.356	1.745	50	0		CDAARO
Cn1cccc1C(=O)N[C@@H]1C[C@@H]([NH+](C)C)C12CCC2	ZINC000585131558	896142948	/nfs/dbraw/zinc/14/29/48/896142948.db2.gz	ZJAMOXIKXNHAAF-CHWSQXEVSA-N	1	0	261.369	1.628	50	0		CDAARO
CCc1cc(OC)ccc1C[N@@H+]1CC[C@H](CC(N)=O)C1	ZINC000952846234	910403970	/nfs/dbraw/zinc/40/39/70/910403970.db2.gz	RFAOVWPIKQXSQX-GFCCVEGCSA-N	1	0	276.380	1.955	50	0		CDAARO
Cc1nnc(CN[C@@H](C)C[NH+]2CCCCCC2)[nH]1	ZINC000952869137	910418991	/nfs/dbraw/zinc/41/89/91/910418991.db2.gz	XOWGHKPDGWPHSQ-NSHDSACASA-N	1	0	251.378	1.467	50	0		CDAARO
CNc1ccccc1C[N@@H+]1CCO[C@]2(CCOC2)C1	ZINC000952876926	910435839	/nfs/dbraw/zinc/43/58/39/910435839.db2.gz	IMYMWJCBFPEWIM-OAHLLOKOSA-N	1	0	262.353	1.720	50	0		CDAARO
C/C=C/CC(=O)N1CCC[C@](CO)(C[NH+](C)C)C1	ZINC000820394974	925522330	/nfs/dbraw/zinc/52/23/30/925522330.db2.gz	MVBMVROBMGDQMX-NNTXTVRGSA-N	1	0	254.374	1.115	50	0		CDAARO
Cc1nonc1CN[C@@H](C)C[NH+]1CCCCCC1	ZINC000821260048	925574998	/nfs/dbraw/zinc/57/49/98/925574998.db2.gz	JGUJVUMCIHRNFQ-NSHDSACASA-N	1	0	252.362	1.732	50	0		CDAARO
CCc1nc(CN2CCC[C@@H](C)C2)n(CC(C)(C)O)n1	ZINC000823560469	925711114	/nfs/dbraw/zinc/71/11/14/925711114.db2.gz	FPAGEBJAOZUVNA-GFCCVEGCSA-N	1	0	280.416	1.843	50	0		CDAARO
C[NH+]1CCC(NCc2nc(C(F)(F)F)n[nH]2)CC1	ZINC000823765147	925728116	/nfs/dbraw/zinc/72/81/16/925728116.db2.gz	YSRITKBUNMYURX-UHFFFAOYSA-N	1	0	263.267	1.007	50	0		CDAARO
Cc1cc(C(N)=O)c(N(C)CC[NH+]2CCCCC2)nc1C	ZINC000823737619	925729974	/nfs/dbraw/zinc/72/99/74/925729974.db2.gz	WFRVCPSMKNRXHB-UHFFFAOYSA-N	1	0	290.411	1.719	50	0		CDAARO
C[NH+]1CCN(C(C)(C)CNc2ncc(Cl)cn2)CC1	ZINC000823789262	925733435	/nfs/dbraw/zinc/73/34/35/925733435.db2.gz	ARUILXUSKZGCLH-UHFFFAOYSA-N	1	0	283.807	1.568	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CN(C)Cc2cnc(C)nc2)C1	ZINC000824412472	925821595	/nfs/dbraw/zinc/82/15/95/925821595.db2.gz	WIURQBOQQVXGCL-AWEZNQCLSA-N	1	0	278.400	1.185	50	0		CDAARO
COc1ncc(CN2CCC[C@H]([NH+](C)C)C2)cn1	ZINC000824851773	925839794	/nfs/dbraw/zinc/83/97/94/925839794.db2.gz	FGCOFQYBLBWENO-LBPRGKRZSA-N	1	0	250.346	1.011	50	0		CDAARO
Cc1nc([C@@H]2C[C@@H](O)C[NH2+]2)n(CCc2ccccc2)n1	ZINC000828901675	926202187	/nfs/dbraw/zinc/20/21/87/926202187.db2.gz	JEITUHZQCMZWTI-KGLIPLIRSA-N	1	0	272.352	1.225	50	0		CDAARO
COc1ccccc1N1CCN([C@@H]2CCC[N@H+](C)C2)CC1	ZINC000200536370	929257021	/nfs/dbraw/zinc/25/70/21/929257021.db2.gz	LDEJZYGLXWHIPX-OAHLLOKOSA-N	1	0	289.423	1.911	50	0		CDAARO
CCN(Cc1cccc2c1OCO2)[C@@H]1CC[N@H+](C)C1	ZINC000584908346	930677199	/nfs/dbraw/zinc/67/71/99/930677199.db2.gz	XPLIALLOOSKVDD-CYBMUJFWSA-N	1	0	262.353	1.941	50	0		CDAARO
CCn1cc(C[N@@H+]2C[C@H](O)[C@H](Cc3ccncc3)C2)cn1	ZINC001529158415	968998305	/nfs/dbraw/zinc/99/83/05/968998305.db2.gz	CACSIGZBCRLFLJ-CVEARBPZSA-N	1	0	286.379	1.333	50	0		CDAARO
Cc1cccc(N2CCC([NH2+]CCOCCO)CC2)c1C	ZINC001506409431	975153373	/nfs/dbraw/zinc/15/33/73/975153373.db2.gz	XFQUVXDXUYRZSR-UHFFFAOYSA-N	1	0	292.423	1.871	50	0		CDAARO
Cn1ccnc1CC[N@H+](C)C[C@@H](O)c1ccccc1	ZINC001506408956	975153420	/nfs/dbraw/zinc/15/34/20/975153420.db2.gz	NZBDOGHNYIBHGL-CQSZACIVSA-N	1	0	259.353	1.628	50	0		CDAARO
CC[NH+](CC)[C@H]1CCN(CCc2nccn2C)C1	ZINC001506416641	975155706	/nfs/dbraw/zinc/15/57/06/975155706.db2.gz	HTTGNZTXHQOSSQ-ZDUSSCGKSA-N	1	0	250.390	1.379	50	0		CDAARO
C[NH+](C)Cc1ccc(C(=O)NCCn2cccc2)cc1	ZINC000096449873	230375488	/nfs/dbraw/zinc/37/54/88/230375488.db2.gz	HNRATWICKNEBJL-UHFFFAOYSA-N	1	0	271.364	1.980	50	0		CDAARO
C[C@@H](NC(=O)C[C@@H]1CCOC1)C(C)(C)C[NH+](C)C	ZINC000096449602	230375566	/nfs/dbraw/zinc/37/55/66/230375566.db2.gz	GZIIVSSPQRDQCC-NEPJUHHUSA-N	1	0	256.390	1.506	50	0		CDAARO
Cc1nn(C)c(C)c1C[NH2+]C[C@@H]1COC2(CCOCC2)O1	ZINC000096494768	230383796	/nfs/dbraw/zinc/38/37/96/230383796.db2.gz	HSTJKKJDEZRVDQ-CYBMUJFWSA-N	1	0	295.383	1.049	50	0		CDAARO
CC(C)[NH2+]C[C@@H](O)COc1cccc2c1CCCC2=O	ZINC000096027981	341986137	/nfs/dbraw/zinc/98/61/37/341986137.db2.gz	BWBDSUYCEFZILK-GFCCVEGCSA-N	1	0	277.364	1.943	50	0		CDAARO
CC(C)[NH2+]C[C@H](O)COc1cccc2c1CCCC2=O	ZINC000096027980	341986173	/nfs/dbraw/zinc/98/61/73/341986173.db2.gz	BWBDSUYCEFZILK-LBPRGKRZSA-N	1	0	277.364	1.943	50	0		CDAARO
CN(C[C@H]1CCCC[N@@H+]1C)C(=O)[C@H]1CC[C@@H](O)CC1	ZINC000584903014	341986524	/nfs/dbraw/zinc/98/65/24/341986524.db2.gz	JWWGODPYEVNWTM-MCIONIFRSA-N	1	0	268.401	1.480	50	0		CDAARO
CC(C)[NH+]1CCC(CC(=O)N[C@H](C)c2ncnn2C)CC1	ZINC000095516412	185001218	/nfs/dbraw/zinc/00/12/18/185001218.db2.gz	BAXRFTCWANHGGP-GFCCVEGCSA-N	1	0	293.415	1.503	50	0		CDAARO
C[C@@H](CCC(=O)NCCc1cnn(C)c1)[NH+]1CCCC1	ZINC000426373626	230416215	/nfs/dbraw/zinc/41/62/15/230416215.db2.gz	NWYKNTXYVGKGMF-ZDUSSCGKSA-N	1	0	278.400	1.343	50	0		CDAARO
Cc1n[nH]c(C)c1CCNC(=O)N(C)CCC[NH+](C)C	ZINC000426485986	230419913	/nfs/dbraw/zinc/41/99/13/230419913.db2.gz	DKRRAKDLNIUUFQ-UHFFFAOYSA-N	1	0	281.404	1.162	50	0		CDAARO
C[C@@H](NC(=O)CCC[NH+]1CCCCCC1)c1nncn1C	ZINC000584903982	341994155	/nfs/dbraw/zinc/99/41/55/341994155.db2.gz	SKCMVTBGLWBFNX-CYBMUJFWSA-N	1	0	293.415	1.649	50	0		CDAARO
COc1ccc([C@@H]2CCCN2CC[NH3+])c(OC)c1	ZINC000084101836	539086117	/nfs/dbraw/zinc/08/61/17/539086117.db2.gz	KNEVEPQXCAPAKZ-ZDUSSCGKSA-N	1	0	250.342	1.799	50	0		CDAARO
Cc1noc(C)c1S(=O)(=O)N(C)C1CC[NH+](C)CC1	ZINC000095950191	185039228	/nfs/dbraw/zinc/03/92/28/185039228.db2.gz	WRIFBPHPGYQPEF-UHFFFAOYSA-N	1	0	287.385	1.006	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H](C[NH3+])C2CC2)c(F)c1	ZINC000095972648	185049338	/nfs/dbraw/zinc/04/93/38/185049338.db2.gz	RMQDIQLFFVMVII-LLVKDONJSA-N	1	0	272.345	1.150	50	0		CDAARO
CC(C)[C@@H](C(=O)NCc1nccc(N)n1)[NH+]1CCCCC1	ZINC000095993386	185059330	/nfs/dbraw/zinc/05/93/30/185059330.db2.gz	PMDLOCHQBRUEPJ-AWEZNQCLSA-N	1	0	291.399	1.186	50	0		CDAARO
COCCOc1ccc(C[NH2+][C@@H](C)[C@@H](C)COC)cn1	ZINC000095995516	185059977	/nfs/dbraw/zinc/05/99/77/185059977.db2.gz	GISCFEXRJDXMER-STQMWFEESA-N	1	0	282.384	1.867	50	0		CDAARO
Cc1cnc(C[NH2+][C@@H]2CCC[C@@H](S(C)(=O)=O)C2)s1	ZINC000241121710	361750931	/nfs/dbraw/zinc/75/09/31/361750931.db2.gz	JDJDJMXLVRVYAV-GHMZBOCLSA-N	1	0	288.438	1.897	50	0		CDAARO
C[C@@H]1[C@@H](Cc2ccccc2)CC[N@@H+]1CCC(=O)NC(N)=O	ZINC000242288036	361755925	/nfs/dbraw/zinc/75/59/25/361755925.db2.gz	YKNNNHLOOXBZQG-TZMCWYRMSA-N	1	0	289.379	1.525	50	0		CDAARO
CCn1nccc1C[NH2+][C@H]1CCCN(c2cccnc2)C1=O	ZINC000195559926	342628512	/nfs/dbraw/zinc/62/85/12/342628512.db2.gz	YZZJYFQCAGZUDA-HNNXBMFYSA-N	1	0	299.378	1.583	50	0		CDAARO
O=C1C[C@@H]([NH2+]C2CCOCC2)CN1c1ccccc1	ZINC000095421059	539087994	/nfs/dbraw/zinc/08/79/94/539087994.db2.gz	OILBZHAAFSYPDS-CYBMUJFWSA-N	1	0	260.337	1.561	50	0		CDAARO
OCc1nnc([C@H]2C[C@H]([NH2+]C3CCOCC3)C2)n1C1CC1	ZINC000244796146	361865086	/nfs/dbraw/zinc/86/50/86/361865086.db2.gz	RTYPGXZKSYRPGY-UMSPYCQHSA-N	1	0	292.383	1.120	50	0		CDAARO
Cc1ccccc1[C@@H]1C[C@H]1C(=O)N1CC[NH2+]C[C@@H]1C	ZINC000125439398	187184543	/nfs/dbraw/zinc/18/45/43/187184543.db2.gz	GDUAESQXMLIFOG-AEGPPILISA-N	1	0	258.365	1.919	50	0		CDAARO
Cn1ccnc1[C@H]([NH2+]CCNc1ccccn1)C1CC1	ZINC000097033763	185155543	/nfs/dbraw/zinc/15/55/43/185155543.db2.gz	UPVZYEGPSNKIHK-CQSZACIVSA-N	1	0	271.368	1.968	50	0		CDAARO
C[N@@H+]1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3c3ccco3)[C@H]2C1	ZINC000685939753	539045608	/nfs/dbraw/zinc/04/56/08/539045608.db2.gz	HXZSYWQLVLBTLQ-RQJABVFESA-N	1	0	274.364	1.936	50	0		CDAARO
C[C@H]1CCC[N@H+](CC(=O)NC(=O)NC2CCCC2)C1	ZINC000007787444	539090783	/nfs/dbraw/zinc/09/07/83/539090783.db2.gz	GJENIICYXCBNSF-NSHDSACASA-N	1	0	267.373	1.487	50	0		CDAARO
CSCCC[N@@H+]1CC[C@]2(C1)NC(=O)N(C(C)C)C2=O	ZINC000084597343	342265301	/nfs/dbraw/zinc/26/53/01/342265301.db2.gz	CWEPUBBDBKIVCR-CYBMUJFWSA-N	1	0	285.413	1.144	50	0		CDAARO
COCCc1nc(-c2ccccc2)c2n1CC[NH2+]C2	ZINC000072233507	342273268	/nfs/dbraw/zinc/27/32/68/342273268.db2.gz	IZLTVQVNEORSPV-UHFFFAOYSA-N	1	0	257.337	1.842	50	0		CDAARO
Cc1nsc(N2CCC[N@H+](C[C@H]3CCCCO3)CC2)n1	ZINC000247223498	362093018	/nfs/dbraw/zinc/09/30/18/362093018.db2.gz	CWANDAMJQXDIJT-CYBMUJFWSA-N	1	0	296.440	1.928	50	0		CDAARO
C[N@H+](C[C@H](O)CC1CCCC1)[C@H]1CCCCNC1=O	ZINC000252570358	342385163	/nfs/dbraw/zinc/38/51/63/342385163.db2.gz	WMZNYJLIVXECMH-KGLIPLIRSA-N	1	0	268.401	1.528	50	0		CDAARO
Cc1n[nH]cc1C[NH2+][C@H]1CCCN(c2cccnn2)C1	ZINC000105904976	136378853	/nfs/dbraw/zinc/37/88/53/136378853.db2.gz	NFSQAAJDCWIDPG-ZDUSSCGKSA-N	1	0	272.356	1.267	50	0		CDAARO
[NH3+]C[C@@H]1CCN(Cc2cc(=O)c3cc(F)ccc3[nH]2)C1	ZINC000253537314	362436878	/nfs/dbraw/zinc/43/68/78/362436878.db2.gz	LXVFUDHAUXOMKH-JTQLQIEISA-N	1	0	275.327	1.860	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(S(=O)(=O)c3ccccc3)C[C@@H]12	ZINC000248617623	362682947	/nfs/dbraw/zinc/68/29/47/362682947.db2.gz	MGNHTLZJKIBVTL-RAIGVLPGSA-N	1	0	266.366	1.044	50	0		CDAARO
OC[C@@H]1C[C@H](O)C[N@@H+]1CCSCc1ccccc1	ZINC000192788601	362687474	/nfs/dbraw/zinc/68/74/74/362687474.db2.gz	VSOJZVOZSMEJNI-KBPBESRZSA-N	1	0	267.394	1.347	50	0		CDAARO
c1c(CC[NH2+][C@@H]2CN3CCC2CC3)nc2ccccn12	ZINC000584895978	349357550	/nfs/dbraw/zinc/35/75/50/349357550.db2.gz	HXRADYOAMWPOHC-OAHLLOKOSA-N	1	0	270.380	1.561	50	0		CDAARO
COCCCC[NH+]1CCN(C(=O)c2ccn(C)c2C)CC1	ZINC000584884080	349341566	/nfs/dbraw/zinc/34/15/66/349341566.db2.gz	WRXQJWDBKRMCIA-UHFFFAOYSA-N	1	0	293.411	1.518	50	0		CDAARO
CCC[N@@H+]1CCCN(C(=O)CCc2cn[nH]c2)CC1	ZINC000584887292	349345761	/nfs/dbraw/zinc/34/57/61/349345761.db2.gz	UGXSOPFZLFCGJY-UHFFFAOYSA-N	1	0	264.373	1.287	50	0		CDAARO
O=C(CC1CCC1)N1CCN([C@H]2C[NH+]3CCC2CC3)CC1	ZINC000584888164	349346300	/nfs/dbraw/zinc/34/63/00/349346300.db2.gz	LMZSGNRWTOVHCL-INIZCTEOSA-N	1	0	291.439	1.415	50	0		CDAARO
C[N@@H+]1CCOC[C@H](CNC(=O)c2cccc3cc[nH]c32)C1	ZINC000584889663	349348987	/nfs/dbraw/zinc/34/89/87/349348987.db2.gz	UOTIDXFBTDRJNH-GFCCVEGCSA-N	1	0	287.363	1.476	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(Cc2ccc(Cl)o2)C[C@H]1O	ZINC000584900555	349362148	/nfs/dbraw/zinc/36/21/48/349362148.db2.gz	CPYRSHYVCOGQJG-CMPLNLGQSA-N	1	0	272.776	1.677	50	0		CDAARO
CS[C@@H](C)Cc1cn(CC[NH+]2CCCC2)nn1	ZINC000091256078	180114542	/nfs/dbraw/zinc/11/45/42/180114542.db2.gz	XOSFZUKIEDNQCT-NSHDSACASA-N	1	0	254.403	1.668	50	0		CDAARO
Cc1cc(C)n(CCN(C)C(=O)[C@@H]2CCCCC[N@@H+]2C)n1	ZINC000091321864	180134453	/nfs/dbraw/zinc/13/44/53/180134453.db2.gz	JTEDHPRSERBATI-HNNXBMFYSA-N	1	0	292.427	1.833	50	0		CDAARO
Cc1cnc(CNc2nc(N)[nH+]c3c2CCCC3)cn1	ZINC000091441042	180156516	/nfs/dbraw/zinc/15/65/16/180156516.db2.gz	KPTXKJNTRGNGBK-UHFFFAOYSA-N	1	0	270.340	1.648	50	0		CDAARO
Cc1ccc2[nH]c(CN3CC[C@H]([NH+](C)C)C3)cc(=O)c2c1	ZINC000091441090	180156670	/nfs/dbraw/zinc/15/66/70/180156670.db2.gz	KYCBGTXRPFDFOC-AWEZNQCLSA-N	1	0	285.391	1.972	50	0		CDAARO
Cc1cc(C(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)ccc1O	ZINC000091474976	180165217	/nfs/dbraw/zinc/16/52/17/180165217.db2.gz	MRAHSOGMLQPMJW-OLZOCXBDSA-N	1	0	260.337	1.510	50	0		CDAARO
Cc1nccn1CCC[N@H+]1C[C@@H](C)[C@](O)(C2CC2)C1	ZINC000091563038	180192866	/nfs/dbraw/zinc/19/28/66/180192866.db2.gz	ATIQJOLCUBEZNA-DOMZBBRYSA-N	1	0	263.385	1.674	50	0		CDAARO
O=C(c1cc[nH]n1)N1C[C@H]2CC[C@H](C[N@H+]2CC2CCC2)C1	ZINC000091563136	180193022	/nfs/dbraw/zinc/19/30/22/180193022.db2.gz	GDQMJZORAGXUBL-ZIAGYGMSSA-N	1	0	288.395	1.746	50	0		CDAARO
COc1ccc(OCCN(C)C(=O)[C@@H]2CC[C@@H]([NH3+])C2)cc1	ZINC000091545883	180186361	/nfs/dbraw/zinc/18/63/61/180186361.db2.gz	IIEFUGGXFSGTAZ-CHWSQXEVSA-N	1	0	292.379	1.660	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1CCC[C@@H](c2nncn2C2CC2)C1	ZINC000091629566	180210177	/nfs/dbraw/zinc/21/01/77/180210177.db2.gz	JWIPMRAUTBYEJN-DGCLKSJQSA-N	1	0	264.373	1.563	50	0		CDAARO
COc1ccnc(C[N@@H+]2CC(C)(C)[C@@](C)(O)C2)c1	ZINC000091636372	180211039	/nfs/dbraw/zinc/21/10/39/180211039.db2.gz	KQVLJQVAJDDCJG-AWEZNQCLSA-N	1	0	250.342	1.683	50	0		CDAARO
CCCCc1c(C)[nH+]c(N)nc1N1CC[C@H](OC)C1	ZINC000091707005	180230273	/nfs/dbraw/zinc/23/02/73/180230273.db2.gz	PTJIJMDEGJNMHY-NSHDSACASA-N	1	0	264.373	1.935	50	0		CDAARO
CC[C@H]1CN(C(=O)CCn2cc(C)cn2)CC[N@@H+]1C(C)C	ZINC000091738179	180244023	/nfs/dbraw/zinc/24/40/23/180244023.db2.gz	ZIHOREXGDSRESY-HNNXBMFYSA-N	1	0	292.427	1.913	50	0		CDAARO
COC(=O)c1ccc([C@@H](C)[N@@H+]2CC[C@@H](CO)C2)o1	ZINC000108329035	186212422	/nfs/dbraw/zinc/21/24/22/186212422.db2.gz	FVHYPWRDZVATQR-NXEZZACHSA-N	1	0	253.298	1.441	50	0		CDAARO
Cc1ccc(C[N@@H+]2CC[C@@H](C(N)=O)C2)cc1Cl	ZINC000193588923	362977582	/nfs/dbraw/zinc/97/75/82/362977582.db2.gz	NEXICDXNLZNOSV-LLVKDONJSA-N	1	0	252.745	1.956	50	0		CDAARO
CC[N@H+]1[C@H](C)CN(Cc2nnnn2C(C)(C)C)C[C@@H]1C	ZINC000583651311	366009940	/nfs/dbraw/zinc/00/99/40/366009940.db2.gz	KPIPWYTUYGTVKW-TXEJJXNPSA-N	1	0	280.420	1.343	50	0		CDAARO
Cn1cc([C@H]2OCC[C@@H]2C[NH2+]Cc2ccccn2)cn1	ZINC000095402035	351397292	/nfs/dbraw/zinc/39/72/92/351397292.db2.gz	BCNWMBAGSMZTMO-DOMZBBRYSA-N	1	0	272.352	1.683	50	0		CDAARO
Cc1cc(CN(C)C(=O)CC[C@H]2CCCC[N@@H+]2C)[nH]n1	ZINC000065434315	363270439	/nfs/dbraw/zinc/27/04/39/363270439.db2.gz	LGVYLRIWASXJSP-CQSZACIVSA-N	1	0	278.400	1.941	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@@H]1CCC[NH2+]C1	ZINC000036961613	363301989	/nfs/dbraw/zinc/30/19/89/363301989.db2.gz	DGLVGXOPNHDVGL-LLVKDONJSA-N	1	0	272.345	1.164	50	0		CDAARO
COc1ccc(CC(=O)NCC[NH+]2CCCC2)cc1	ZINC000000383091	355907616	/nfs/dbraw/zinc/90/76/16/355907616.db2.gz	YIHXROFFEIPGJX-UHFFFAOYSA-N	1	0	262.353	1.450	50	0		CDAARO
COc1ccc(C(=O)NC[C@H](C)C[NH+](C)C)cc1OC	ZINC000002828071	355983285	/nfs/dbraw/zinc/98/32/85/355983285.db2.gz	YBTQAPGSPRIBGT-NSHDSACASA-N	1	0	280.368	1.631	50	0		CDAARO
[NH3+]CCN1C(=O)S/C(=C/c2ccc(F)cc2)C1=O	ZINC000003194380	355996300	/nfs/dbraw/zinc/99/63/00/355996300.db2.gz	SWPLPGAZGUFJJB-JXMROGBWSA-N	1	0	266.297	1.821	50	0		CDAARO
C[N@@H+]1CCOC[C@H](CNC(=O)c2ccncc2Cl)C1	ZINC000584901822	355956356	/nfs/dbraw/zinc/95/63/56/355956356.db2.gz	SRKQYDXIXRSLMN-SNVBAGLBSA-N	1	0	283.759	1.043	50	0		CDAARO
Cn1nnnc1SCC[NH2+]Cc1ccccc1F	ZINC000002223514	355964390	/nfs/dbraw/zinc/96/43/90/355964390.db2.gz	DMUFQNBXNRRSKO-UHFFFAOYSA-N	1	0	267.333	1.231	50	0		CDAARO
O=C(C1CC[NH2+]CC1)N1CCC[C@@H]1c1ccncc1	ZINC000036136550	356222551	/nfs/dbraw/zinc/22/25/51/356222551.db2.gz	DSXJVFWLAYNCNM-CQSZACIVSA-N	1	0	259.353	1.745	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)[C@H]2CSc3ccccc3O2)C1	ZINC000299739036	356267269	/nfs/dbraw/zinc/26/72/69/356267269.db2.gz	JRVGTEPZXFIWPB-ZYHUDNBSSA-N	1	0	278.377	1.347	50	0		CDAARO
CC(C)[C@H]([NH3+])C(=O)N1CCN(Cc2ccccc2)CC1	ZINC000011958494	356285841	/nfs/dbraw/zinc/28/58/41/356285841.db2.gz	FTNMATHIBXHACZ-HNNXBMFYSA-N	1	0	275.396	1.314	50	0		CDAARO
CN(C)c1ncccc1CNC(=O)c1ccc2c(c1)OCO2	ZINC000032687070	356334504	/nfs/dbraw/zinc/33/45/04/356334504.db2.gz	UOMKPRDRZMBQBX-UHFFFAOYSA-N	1	0	299.330	1.806	50	0		CDAARO
c1ccc2c(c1)N(CCN1CCOCC1)C1=[NH+]CCN21	ZINC000013590490	356349660	/nfs/dbraw/zinc/34/96/60/356349660.db2.gz	LHGPXSYLXXNAQV-UHFFFAOYSA-N	1	0	272.352	1.015	50	0		CDAARO
CC[C@@H](Oc1ccc(OC)cc1)C(=O)NCC[NH+](C)C	ZINC000013670675	356352957	/nfs/dbraw/zinc/35/29/57/356352957.db2.gz	SZRAEUNZTJAZGV-CQSZACIVSA-N	1	0	280.368	1.530	50	0		CDAARO
CCCc1noc(CN2CCCC[C@@H]2CCO)n1	ZINC000015075058	356404898	/nfs/dbraw/zinc/40/48/98/356404898.db2.gz	VEECALCOEVGJLW-LLVKDONJSA-N	1	0	253.346	1.759	50	0		CDAARO
CC[NH+](CC)CCNC(=O)C(=O)Nc1ccc(Cl)cc1	ZINC000004583571	356432550	/nfs/dbraw/zinc/43/25/50/356432550.db2.gz	GPHVGDYIAPNPNS-UHFFFAOYSA-N	1	0	297.786	1.737	50	0		CDAARO
C[C@@H](CN1CC[NH+](C)CC1)OC(=O)c1ccccc1	ZINC000019456175	356485280	/nfs/dbraw/zinc/48/52/80/356485280.db2.gz	RDIGRIHLBCLZPD-ZDUSSCGKSA-N	1	0	262.353	1.479	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1C(=O)NCc1cccnc1N(C)C	ZINC000019147966	356476433	/nfs/dbraw/zinc/47/64/33/356476433.db2.gz	OSJDPBSAWVMZTQ-AWEZNQCLSA-N	1	0	290.411	1.638	50	0		CDAARO
Cc1cc(C)c(OCCOCCN2CC[NH2+]CC2)c(C)c1	ZINC000019944983	356518914	/nfs/dbraw/zinc/51/89/14/356518914.db2.gz	FNVUJNHSGKCKGE-UHFFFAOYSA-N	1	0	292.423	1.912	50	0		CDAARO
COc1ccccc1OC/C=C/CN1CC[NH+](C)CC1	ZINC000023116724	356628630	/nfs/dbraw/zinc/62/86/30/356628630.db2.gz	MNZPIQWITXJZLE-AATRIKPKSA-N	1	0	276.380	1.878	50	0		CDAARO
CNC(=O)c1cccc(CNc2ncnc3c2cnn3C)c1	ZINC000026729499	356698439	/nfs/dbraw/zinc/69/84/39/356698439.db2.gz	CEDANTNCPLISKI-UHFFFAOYSA-N	1	0	296.334	1.335	50	0		CDAARO
CN(CC(F)(F)F)C(=O)[C@H]1CC12CC[NH2+]CC2	ZINC000070253666	356742281	/nfs/dbraw/zinc/74/22/81/356742281.db2.gz	AMQGTBVXEXJLJQ-MRVPVSSYSA-N	1	0	250.264	1.397	50	0		CDAARO
C[C@H](C(N)=O)N1CCN([C@@H](C)c2ccccc2Cl)CC1	ZINC000029686019	356741466	/nfs/dbraw/zinc/74/14/66/356741466.db2.gz	WYMYQGIADAEYED-NWDGAFQWSA-N	1	0	295.814	1.892	50	0		CDAARO
[NH3+]CCc1nn2c(COc3ccccc3)nnc2s1	ZINC000032121727	356774805	/nfs/dbraw/zinc/77/48/05/356774805.db2.gz	SHQRYIQQQFTUBT-UHFFFAOYSA-N	1	0	275.337	1.266	50	0		CDAARO
CCC(=O)c1ccc(OCCN2CC[NH2+][C@@H](C)C2)cc1	ZINC000033359729	356801364	/nfs/dbraw/zinc/80/13/64/356801364.db2.gz	DGTWDTJYFDFSEZ-ZDUSSCGKSA-N	1	0	276.380	1.952	50	0		CDAARO
O=C(C1CC[NH+](Cc2cccnc2)CC1)N1CCCC1	ZINC000004600419	357110492	/nfs/dbraw/zinc/11/04/92/357110492.db2.gz	APYNODRTHOTYKW-UHFFFAOYSA-N	1	0	273.380	1.916	50	0		CDAARO
CNc1cc(N2CCC([C@@H](C)[NH+](C)C)CC2)nc(N)n1	ZINC000096152862	357175146	/nfs/dbraw/zinc/17/51/46/357175146.db2.gz	OSBBKYSNYKZRDF-SNVBAGLBSA-N	1	0	278.404	1.267	50	0		CDAARO
CCCN(Cc1ccc(SC)cc1)C(=O)[C@@H]([NH3+])[C@@H](C)O	ZINC000055415120	357332911	/nfs/dbraw/zinc/33/29/11/357332911.db2.gz	RUTNCBLUVNLTFL-RISCZKNCSA-N	1	0	296.436	1.855	50	0		CDAARO
CCNC(=O)C(C)(C)CNC(=O)[C@H](C)[N@H+]1[C@H](C)CC[C@@H]1C	ZINC000095431069	357446626	/nfs/dbraw/zinc/44/66/26/357446626.db2.gz	ZILVRDFXAZGRLD-XQQFMLRXSA-N	1	0	297.443	1.526	50	0		CDAARO
Cc1ccc([C@H]([NH2+]C(CO)CO)c2ccncc2)cc1	ZINC000065383606	357534756	/nfs/dbraw/zinc/53/47/56/357534756.db2.gz	RJUQXWVYOYYWBT-INIZCTEOSA-N	1	0	272.348	1.422	50	0		CDAARO
Cc1cc(N2CC[C@H]([NH+](C)C)C2)nc(-c2cccnc2)n1	ZINC000065507620	357546577	/nfs/dbraw/zinc/54/65/77/357546577.db2.gz	BLWOWQQBTNBGTF-AWEZNQCLSA-N	1	0	283.379	1.987	50	0		CDAARO
CN(CCO)c1nc(-c2ccccc2)nc2c1CC[NH2+]C2	ZINC000067774636	357626668	/nfs/dbraw/zinc/62/66/68/357626668.db2.gz	CCYFIEXDPHHRKM-UHFFFAOYSA-N	1	0	284.363	1.218	50	0		CDAARO
C[NH+]1CCC(CNC(=O)C(=O)Nc2ccc(F)cc2)CC1	ZINC000022999036	357582124	/nfs/dbraw/zinc/58/21/24/357582124.db2.gz	PJCYWTBBYGDCIZ-UHFFFAOYSA-N	1	0	293.342	1.222	50	0		CDAARO
CCCCc1nc(Cl)c(CN2CCO[C@@H](C[NH3+])C2)[nH]1	ZINC000067675622	357617646	/nfs/dbraw/zinc/61/76/46/357617646.db2.gz	LYXSTHQJABHYQD-JTQLQIEISA-N	1	0	286.807	1.565	50	0		CDAARO
O=C(CCC(F)(F)F)N1CCC[C@]2(CC[NH2+]C2)C1	ZINC000067673866	357618058	/nfs/dbraw/zinc/61/80/58/357618058.db2.gz	YAKZIUQWVVAQCF-LLVKDONJSA-N	1	0	264.291	1.931	50	0		CDAARO
Cc1cc(-n2cnnc2[C@H]2CCC[N@H+](C)C2)n(C)n1	ZINC000067965998	357641327	/nfs/dbraw/zinc/64/13/27/357641327.db2.gz	CPSLZPBQSYZRKK-NSHDSACASA-N	1	0	260.345	1.118	50	0		CDAARO
Cc1c(C[NH+]2CCC3(CC(=O)N(C)C3)CC2)cnn1C	ZINC000072475934	357837853	/nfs/dbraw/zinc/83/78/53/357837853.db2.gz	ONXPMIYPMSDEBV-UHFFFAOYSA-N	1	0	276.384	1.173	50	0		CDAARO
COC(=O)CCN1CC[N@H+](Cc2cccs2)[C@H](C)C1	ZINC000097100162	357970745	/nfs/dbraw/zinc/97/07/45/357970745.db2.gz	JBTACGIUUCMXTE-GFCCVEGCSA-N	1	0	282.409	1.817	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1C1CN(C(=O)Cc2cccnc2)C1	ZINC000082166360	358150613	/nfs/dbraw/zinc/15/06/13/358150613.db2.gz	OFNBLDDLZDSUFF-ZDUSSCGKSA-N	1	0	273.380	1.709	50	0		CDAARO
CC(C)[C@H](O)CC[NH2+][C@H]1CCN(CC(F)(F)F)C1	ZINC000088734833	366429663	/nfs/dbraw/zinc/42/96/63/366429663.db2.gz	NIZGLMBHXWHSKZ-WDEREUQCSA-N	1	0	268.323	1.620	50	0		CDAARO
C[C@@]1(C(=O)NCCOCc2ccccc2)CCCC[NH2+]1	ZINC000195556990	358559737	/nfs/dbraw/zinc/55/97/37/358559737.db2.gz	VPACKNOHURWHIS-INIZCTEOSA-N	1	0	276.380	1.852	50	0		CDAARO
CC(=O)c1cc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)ccc1C	ZINC000194603524	358526814	/nfs/dbraw/zinc/52/68/14/358526814.db2.gz	PJKYCHZCTZGOQG-GASCZTMLSA-N	1	0	286.375	1.831	50	0		CDAARO
O=c1cc(C[NH2+]C[C@@H]2COCCO2)[nH]c2ccc(F)cc12	ZINC000095358043	358684831	/nfs/dbraw/zinc/68/48/31/358684831.db2.gz	AVWOISGBGUHERG-GFCCVEGCSA-N	1	0	292.310	1.172	50	0		CDAARO
CCc1nccn1CCNC(=O)CC[C@H]1CCCC[N@@H+]1C	ZINC000095359308	358684837	/nfs/dbraw/zinc/68/48/37/358684837.db2.gz	QZJXSBNOSDWUAF-CQSZACIVSA-N	1	0	292.427	1.826	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1NC[C@H](CC)N1CCOCC1	ZINC000095379372	358689544	/nfs/dbraw/zinc/68/95/44/358689544.db2.gz	QBAQMNDGLZBFRU-LBPRGKRZSA-N	1	0	293.415	1.452	50	0		CDAARO
NC(=O)[C@H](c1ccccc1)N1CCCC[C@H]1Cn1cncn1	ZINC000247716969	358745757	/nfs/dbraw/zinc/74/57/57/358745757.db2.gz	OAGOCZXXCOBZNR-GJZGRUSLSA-N	1	0	299.378	1.359	50	0		CDAARO
Cc1ccsc1C[N@@H+]1CCCN([C@H]2COC[C@@H]2O)CC1	ZINC000097099202	358751090	/nfs/dbraw/zinc/75/10/90/358751090.db2.gz	KQOSLPRZXIWEEI-KBPBESRZSA-N	1	0	296.436	1.324	50	0		CDAARO
Cc1[nH]c(=O)c(C(=O)N2CC[NH2+][C@H](C)C2)c(C)c1Cl	ZINC000097495465	358780688	/nfs/dbraw/zinc/78/06/88/358780688.db2.gz	RCFYKICJVLDVGD-SSDOTTSWSA-N	1	0	283.759	1.079	50	0		CDAARO
Cc1ccc(C)c(CN2C[C@H](O)[C@@H]([NH+]3CCCC3)C2)c1	ZINC000097532561	358782392	/nfs/dbraw/zinc/78/23/92/358782392.db2.gz	LRVHMYWFVVYTMC-IRXDYDNUSA-N	1	0	274.408	1.944	50	0		CDAARO
C[NH+]1CCC(CCC(=O)N[C@@H](CO)c2ccccc2)CC1	ZINC000097553155	358785277	/nfs/dbraw/zinc/78/52/77/358785277.db2.gz	ZUMXUXUARSSYGH-INIZCTEOSA-N	1	0	290.407	1.958	50	0		CDAARO
Cc1[nH]c(=O)c(C(=O)NCCc2c[nH]cn2)c(C)c1Cl	ZINC000097654049	358790116	/nfs/dbraw/zinc/79/01/16/358790116.db2.gz	OCPHNQFGSJYBPA-UHFFFAOYSA-N	1	0	294.742	1.341	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CN(C)Cc2nc(C)c[nH]2)C1	ZINC000097785190	358799084	/nfs/dbraw/zinc/79/90/84/358799084.db2.gz	GBBVMBLLFKBNST-CYBMUJFWSA-N	1	0	266.389	1.118	50	0		CDAARO
CO[C@H]1CC[N@H+](Cc2cnc(N3CCCC3)s2)C1	ZINC000215789525	358903499	/nfs/dbraw/zinc/90/34/99/358903499.db2.gz	RVTBQNCUEDNLHA-NSHDSACASA-N	1	0	267.398	1.964	50	0		CDAARO
CSc1ncc(CN2CC[N@@H+]3CCCC[C@@H]3C2)cn1	ZINC000215866916	358906684	/nfs/dbraw/zinc/90/66/84/358906684.db2.gz	MSZPINVQSXYXPR-CYBMUJFWSA-N	1	0	278.425	1.869	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1ccccc1OC	ZINC000033834816	359363371	/nfs/dbraw/zinc/36/33/71/359363371.db2.gz	UHCGCOWDMZJDOC-GFCCVEGCSA-N	1	0	262.353	1.909	50	0		CDAARO
COc1ccc(Cl)cc1C(=O)N1C[C@H](O)[C@@H]([NH+](C)C)C1	ZINC000222448556	359344461	/nfs/dbraw/zinc/34/44/61/359344461.db2.gz	DASSDARQYRGLIQ-RYUDHWBXSA-N	1	0	298.770	1.096	50	0		CDAARO
CCOc1ccccc1C[N@@H+]1C[C@@H]2C(=O)N(C)C(=O)[C@@H]2C1	ZINC000257184649	359500689	/nfs/dbraw/zinc/50/06/89/359500689.db2.gz	VAZNIQXONYPQBA-BETUJISGSA-N	1	0	288.347	1.132	50	0		CDAARO
C[N@H+]1C[C@@H](c2ccncc2)[C@H](C(=O)N2CCCCC2)C1	ZINC000257183779	359492965	/nfs/dbraw/zinc/49/29/65/359492965.db2.gz	HYBLFBRKMVREIQ-LSDHHAIUSA-N	1	0	273.380	1.739	50	0		CDAARO
O[C@H]1CCOC2(CC[NH+](Cc3ccco3)CC2)C1	ZINC000257191533	359586122	/nfs/dbraw/zinc/58/61/22/359586122.db2.gz	QOXVOIQQNMFHCC-LBPRGKRZSA-N	1	0	251.326	1.786	50	0		CDAARO
COc1cccc(C[N@@H+]2CCCOCCNC(=O)CC2)c1	ZINC000257195021	359610061	/nfs/dbraw/zinc/61/00/61/359610061.db2.gz	VFGQYWDLRJQPPP-UHFFFAOYSA-N	1	0	292.379	1.424	50	0		CDAARO
CCC(=O)NCCN(CC[NH+]1CCCCCC1)C(=O)CC	ZINC000408516799	359900498	/nfs/dbraw/zinc/90/04/98/359900498.db2.gz	ZNIIHMFHIQXLIE-UHFFFAOYSA-N	1	0	297.443	1.627	50	0		CDAARO
CC[NH+]1CCN(CC(C)(C)NC(=O)c2c[nH]cc2C)CC1	ZINC000408520815	359917260	/nfs/dbraw/zinc/91/72/60/359917260.db2.gz	YFFGCDRNNOBQDV-UHFFFAOYSA-N	1	0	292.427	1.469	50	0		CDAARO
C[NH+](C)Cc1ccc(C(=O)NCc2cc(=O)[nH]cn2)cc1	ZINC000426531554	360680649	/nfs/dbraw/zinc/68/06/49/360680649.db2.gz	HUTASBIFGUARPQ-UHFFFAOYSA-N	1	0	286.335	1.174	50	0		CDAARO
Cc1ccc(C(=O)N2CC([NH+]3CCCCC3)C2)c(=O)n1C	ZINC000426566789	360684522	/nfs/dbraw/zinc/68/45/22/360684522.db2.gz	BMVBZXXEZBHLIC-UHFFFAOYSA-N	1	0	289.379	1.004	50	0		CDAARO
Nc1cc(N2CC[C@@]3(C2)CCC[N@H+](CC2CC2)C3)ncn1	ZINC000426372114	360659496	/nfs/dbraw/zinc/65/94/96/360659496.db2.gz	POVFHYTVHIMIFO-INIZCTEOSA-N	1	0	287.411	1.761	50	0		CDAARO
C[C@@H](O)CSc1nnc(CC[NH3+])n1-c1ccc(F)cc1	ZINC000426368306	360659956	/nfs/dbraw/zinc/65/99/56/360659956.db2.gz	MJMCKLMHFIXHPI-SECBINFHSA-N	1	0	296.371	1.381	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)NCc2c(F)cccc2F)C1	ZINC000426407491	360666249	/nfs/dbraw/zinc/66/62/49/360666249.db2.gz	FYVKGGQKSCCUIK-VIFPVBQESA-N	1	0	269.295	1.455	50	0		CDAARO
CC[NH+](CC)CCNC(=O)N(C)CCn1ccnc1C	ZINC000426496691	360676553	/nfs/dbraw/zinc/67/65/53/360676553.db2.gz	NHOYIHANENKMRH-UHFFFAOYSA-N	1	0	281.404	1.175	50	0		CDAARO
Cc1ccc(C)c(OCC(=O)N2CC[C@@H](C[NH3+])C2)c1	ZINC000178565735	189127613	/nfs/dbraw/zinc/12/76/13/189127613.db2.gz	CVWAQRLRGJPJND-ZDUSSCGKSA-N	1	0	262.353	1.489	50	0		CDAARO
C[C@H](Cc1ccccc1F)C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178582144	189128528	/nfs/dbraw/zinc/12/85/28/189128528.db2.gz	DTCIBEQBEKYTLQ-NEPJUHHUSA-N	1	0	264.344	1.812	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)Cc2c(OC)cccc2OC)C1	ZINC000179002583	189161087	/nfs/dbraw/zinc/16/10/87/189161087.db2.gz	GWSIEJNJVSQELF-LBPRGKRZSA-N	1	0	292.379	1.314	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cc3c(c(Cl)c2)OCO3)C1	ZINC000179021862	189162715	/nfs/dbraw/zinc/16/27/15/189162715.db2.gz	ITQUZZFIHJALRV-SECBINFHSA-N	1	0	296.754	1.750	50	0		CDAARO
C[NH2+]Cc1nnc(SCc2noc(C3CC3)n2)n1C	ZINC000426535960	361005380	/nfs/dbraw/zinc/00/53/80/361005380.db2.gz	VOZGTWFHMGFHFH-UHFFFAOYSA-N	1	0	280.357	1.087	50	0		CDAARO
c1cnn(CCCN2CC[NH+](C3CCSCC3)CC2)c1	ZINC000244852820	361051355	/nfs/dbraw/zinc/05/13/55/361051355.db2.gz	UZQORCPZQNCNBN-UHFFFAOYSA-N	1	0	294.468	1.786	50	0		CDAARO
CC(=O)c1ccc(NC(=O)N2CC[C@H]3C[NH2+]C[C@H]32)cc1	ZINC000299780827	200870468	/nfs/dbraw/zinc/87/04/68/200870468.db2.gz	CUUYLWJMQKNDNL-GXTWGEPZSA-N	1	0	273.336	1.715	50	0		CDAARO
C[C@@H]([NH3+])c1ccc(Br)cc1OCCO	ZINC000132039328	361181124	/nfs/dbraw/zinc/18/11/24/361181124.db2.gz	NVWXKUUAGIRMSO-SSDOTTSWSA-N	1	0	260.131	1.840	50	0		CDAARO
C[C@H](Nc1c(=O)c(=O)c1NCC[NH+](C)C)c1ccccc1	ZINC000101700268	364039775	/nfs/dbraw/zinc/03/97/75/364039775.db2.gz	AJAODSKHQVPHMZ-NSHDSACASA-N	1	0	287.363	1.429	50	0		CDAARO
CO[C@H]1CN(c2ncnc3sccc32)CC[C@H]1[NH3+]	ZINC000071730567	364619557	/nfs/dbraw/zinc/61/95/57/364619557.db2.gz	YBLYLKDGBXUBBO-ZJUUUORDSA-N	1	0	264.354	1.244	50	0		CDAARO
C(CSc1nnnn1C1CC1)C[NH+]1CCCCC1	ZINC000187675525	364799578	/nfs/dbraw/zinc/79/95/78/364799578.db2.gz	ZKJLOFWGHNOGNS-UHFFFAOYSA-N	1	0	267.402	1.976	50	0		CDAARO
CN1c2ccccc2Oc2nnc(N3CC[NH2+]CC3)cc21	ZINC000031575543	364955537	/nfs/dbraw/zinc/95/55/37/364955537.db2.gz	KMKHHMJOWLXRHH-UHFFFAOYSA-N	1	0	283.335	1.760	50	0		CDAARO
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1[NH2+]Cc1ncc[nH]1	ZINC000089948774	366975376	/nfs/dbraw/zinc/97/53/76/366975376.db2.gz	PTEMDDUWTYWSGN-QWHCGFSZSA-N	1	0	278.400	1.782	50	0		CDAARO
CCC(CC)[C@H](CNC(=O)c1ccc(=O)[nH]n1)[NH+](C)C	ZINC000089943129	366976299	/nfs/dbraw/zinc/97/62/99/366976299.db2.gz	ZKBPWAGQELTZRE-LBPRGKRZSA-N	1	0	280.372	1.278	50	0		CDAARO
CCN1CCN(C(=O)N[C@@H](C)C(C)(C)C[NH+](C)C)CC1	ZINC000089977280	366993770	/nfs/dbraw/zinc/99/37/70/366993770.db2.gz	LGALXWZQMBIJPU-ZDUSSCGKSA-N	1	0	284.448	1.310	50	0		CDAARO
CCN(CC)C(=O)N1CCC[C@@H]1C[N@@H+]1CCC[C@H]1CO	ZINC000252477217	367545859	/nfs/dbraw/zinc/54/58/59/367545859.db2.gz	KGMNIUHAYFHWJW-KGLIPLIRSA-N	1	0	283.416	1.369	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCCN(C(=O)Nc2cccc(F)c2)C1	ZINC000630093248	367732686	/nfs/dbraw/zinc/73/26/86/367732686.db2.gz	JLGJURUORSEDJA-OAHLLOKOSA-N	1	0	295.358	1.746	50	0		CDAARO
COCCC(=O)N1CCC(Cn2c(C)c[nH+]c2C)CC1	ZINC000575548885	369109571	/nfs/dbraw/zinc/10/95/71/369109571.db2.gz	FDPVVYPFSUFGNL-UHFFFAOYSA-N	1	0	279.384	1.775	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C[C@H]1CCN(CC(F)(F)F)C1	ZINC000037648508	369521254	/nfs/dbraw/zinc/52/12/54/369521254.db2.gz	CKVYZNZASQVWKQ-SNVBAGLBSA-N	1	0	276.306	1.692	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+][C@H]2CCN(C)C2=O)C1(CC)CC	ZINC000245338987	370049008	/nfs/dbraw/zinc/04/90/08/370049008.db2.gz	PUUCDHAYXHDYSL-RWMBFGLXSA-N	1	0	268.401	1.791	50	0		CDAARO
c1ccc2c(c1)CCN(Cc1nnc3n1CCC3)C2	ZINC000575606533	370616539	/nfs/dbraw/zinc/61/65/39/370616539.db2.gz	LETDDDLJJYQLQG-UHFFFAOYSA-N	1	0	254.337	1.783	50	0		CDAARO
C[C@@H]1CCC[C@@H](NC(=O)CCC(=O)NCC[NH+](C)C)[C@@H]1C	ZINC000006266038	371523975	/nfs/dbraw/zinc/52/39/75/371523975.db2.gz	BVMNLTCKDVFEQL-MGPQQGTHSA-N	1	0	297.443	1.385	50	0		CDAARO
O=C(C1CCC1)N1CC[NH+](C[C@@H]2CCCOC2)CC1	ZINC000670445305	482995765	/nfs/dbraw/zinc/99/57/65/482995765.db2.gz	YQBONWFSKRTTSW-ZDUSSCGKSA-N	1	0	266.385	1.357	50	0		CDAARO
O=C(NCC[NH+]1CCC(CO)CC1)c1ccncc1Cl	ZINC000299792121	372764775	/nfs/dbraw/zinc/76/47/75/372764775.db2.gz	FMIBWGSOSKBDCW-UHFFFAOYSA-N	1	0	297.786	1.169	50	0		CDAARO
O=C(N[C@H]1COC[C@@H]1[NH+]1CCCCC1)c1ccsc1	ZINC000299764930	372749414	/nfs/dbraw/zinc/74/94/14/372749414.db2.gz	XBAAIVZBVSDMAI-STQMWFEESA-N	1	0	280.393	1.731	50	0		CDAARO
CC(C)c1nccn1CCCNC(=O)c1csc(N)n1	ZINC000299777623	372755206	/nfs/dbraw/zinc/75/52/06/372755206.db2.gz	QRQDKQMBQMZUCM-UHFFFAOYSA-N	1	0	293.396	1.865	50	0		CDAARO
Cc1cc(C)n(CC[N@H+]2CCC[C@@H](c3nnc(C)[nH]3)C2)n1	ZINC000299798822	372768901	/nfs/dbraw/zinc/76/89/01/372768901.db2.gz	SNYKUIPPNAVHIJ-CQSZACIVSA-N	1	0	288.399	1.806	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+](Cc2cncn2C)C1	ZINC000177271087	372838782	/nfs/dbraw/zinc/83/87/82/372838782.db2.gz	WSPGUDKBQVTECW-UONOGXRCSA-N	1	0	292.427	1.937	50	0		CDAARO
CCN(Cc1ccccc1Cl)C(=O)[C@H]1C[C@H](O)C[NH2+]1	ZINC000037808798	373375371	/nfs/dbraw/zinc/37/53/71/373375371.db2.gz	AHFSARJUDKKQTB-WCQYABFASA-N	1	0	282.771	1.411	50	0		CDAARO
O=C(O[C@@H]1C[NH+]2CCC1CC2)c1cccc2[nH]cnc21	ZINC000000385645	373640840	/nfs/dbraw/zinc/64/08/40/373640840.db2.gz	GWWYTCNQOVHBHJ-CYBMUJFWSA-N	1	0	271.320	1.814	50	0		CDAARO
CO[C@@H](C)CC(=O)OCCC[N@@H+]1CCOC[C@@H]1C	ZINC000108174148	412815770	/nfs/dbraw/zinc/81/57/70/412815770.db2.gz	VEIFANOOLNSDJY-RYUDHWBXSA-N	1	0	259.346	1.065	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	ZINC000088834107	374064602	/nfs/dbraw/zinc/06/46/02/374064602.db2.gz	IBRFSTQMDUUHIB-RKDXNWHRSA-N	1	0	252.280	1.915	50	0		CDAARO
CCC[C@@H]([NH3+])C(=O)N1CCN(CC(F)(F)F)[C@H](C)C1	ZINC000299747618	375207013	/nfs/dbraw/zinc/20/70/13/375207013.db2.gz	DKKGVDYGIDFWLZ-NXEZZACHSA-N	1	0	281.322	1.209	50	0		CDAARO
CCc1c(C)nc(NC[C@H]2CCC[NH2+]C2)[nH]c1=O	ZINC000057329944	375817114	/nfs/dbraw/zinc/81/71/14/375817114.db2.gz	ZGFVDNKDOBPABT-JTQLQIEISA-N	1	0	250.346	1.052	50	0		CDAARO
C[C@@H]1CN(C(=O)CN2CCC[C@H]2c2ccc[nH]2)C[C@H](C)O1	ZINC000257365155	190038241	/nfs/dbraw/zinc/03/82/41/190038241.db2.gz	JYPSGYZOLPBPHL-GUTXKFCHSA-N	1	0	291.395	1.787	50	0		CDAARO
CCN(Cc1ccncc1)CN1C(=O)[C@@H]2CC=CC[C@H]2C1=O	ZINC000241231046	376019990	/nfs/dbraw/zinc/01/99/90/376019990.db2.gz	KRMLTOSSGJMHOZ-HUUCEWRRSA-N	1	0	299.374	1.812	50	0		CDAARO
CO[C@H]1CN(C(=O)C(C)(C)c2ccccc2)CC[C@H]1[NH3+]	ZINC000071774962	184576676	/nfs/dbraw/zinc/57/66/76/184576676.db2.gz	JYLAWHAWGSXLDY-KGLIPLIRSA-N	1	0	276.380	1.539	50	0		CDAARO
O=c1c2ccc[nH]c-2cn1[C@H]1COC[C@@H]1[NH+]1CCCCC1	ZINC000065371306	285026877	/nfs/dbraw/zinc/02/68/77/285026877.db2.gz	XWIWMQOEZMGSFQ-GJZGRUSLSA-N	1	0	287.363	1.291	50	0		CDAARO
COc1ccc(Cl)cc1/C=C\C(=O)N1CC[C@H]([NH3+])C1	ZINC000493119020	253375027	/nfs/dbraw/zinc/37/50/27/253375027.db2.gz	NKBCRLFLJHWSBE-PZBKNZOISA-N	1	0	280.755	1.921	50	0		CDAARO
CCOc1ccccc1/C=C\C(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000493192016	253395113	/nfs/dbraw/zinc/39/51/13/253395113.db2.gz	QKYXPHQRTZHGHE-CKXPSTMWSA-N	1	0	274.364	1.919	50	0		CDAARO
[NH3+]C[C@@H]1CCCCN1C(=O)Cc1ccc(F)cc1F	ZINC000095067592	184930007	/nfs/dbraw/zinc/93/00/07/184930007.db2.gz	DBIUNGUHQGAXAA-LBPRGKRZSA-N	1	0	268.307	1.847	50	0		CDAARO
Cc1cnc(N2CCC[C@@](O)(C[NH+](C)C)CC2)nc1	ZINC000095363828	184954041	/nfs/dbraw/zinc/95/40/41/184954041.db2.gz	NOJYNRJAWBPXPQ-AWEZNQCLSA-N	1	0	264.373	1.068	50	0		CDAARO
CC(C)(C)CC(=O)N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000096426629	390517496	/nfs/dbraw/zinc/51/74/96/390517496.db2.gz	ZKTIEAFKJRKILS-CYBMUJFWSA-N	1	0	268.401	1.603	50	0		CDAARO
NS(=O)(=O)NC[C@@H]1CCC[N@H+](CCC2CCCC2)C1	ZINC000096424179	390516340	/nfs/dbraw/zinc/51/63/40/390516340.db2.gz	COXDRBNNHXHYMY-ZDUSSCGKSA-N	1	0	289.445	1.072	50	0		CDAARO
NC(=O)N1CCC[N@@H+]([C@H]2CCc3ccc(F)cc32)CC1	ZINC000095407504	390956446	/nfs/dbraw/zinc/95/64/46/390956446.db2.gz	KBRZTVUQSQNBCP-AWEZNQCLSA-N	1	0	277.343	1.899	50	0		CDAARO
C[N@@H+]1CCC[C@H]1CN1CCN(c2ccc(O)cc2)CC1	ZINC000244716099	391343644	/nfs/dbraw/zinc/34/36/44/391343644.db2.gz	LIKVMRKHROAGKU-HNNXBMFYSA-N	1	0	275.396	1.608	50	0		CDAARO
COc1c2c(cc3c1[C@@H](C[C@@H](C)O)[N@H+](C)CC3)OCO2	ZINC000004029120	391935874	/nfs/dbraw/zinc/93/58/74/391935874.db2.gz	QLEBYGRJDONRLS-MWLCHTKSSA-N	1	0	279.336	1.724	50	0	biogenic	CDAARO
CC(C)N1CC[C@H]([N@H+](C)C[C@H]2CCCOC2)C1=O	ZINC000245339170	391979600	/nfs/dbraw/zinc/97/96/00/391979600.db2.gz	QZQVVSPQQYPQHH-OLZOCXBDSA-N	1	0	254.374	1.354	50	0		CDAARO
COC(=O)CCC[N@@H+]1C[C@@H](O)C[C@H]1c1cccc(F)c1	ZINC000281894677	393161527	/nfs/dbraw/zinc/16/15/27/393161527.db2.gz	QFRCSYHMLNCSRO-KBPBESRZSA-N	1	0	281.327	1.887	50	0		CDAARO
CC(C)[C@@H](NC(=O)C[N@H+](C)C1CC1)c1ccccn1	ZINC000096437060	393186442	/nfs/dbraw/zinc/18/64/42/393186442.db2.gz	SKWQCCKTHUIYBU-OAHLLOKOSA-N	1	0	261.369	1.989	50	0		CDAARO
Cc1cn2nc(N3CC[N@@H+]4CCC[C@H]4C3)sc2n1	ZINC000252467603	393260760	/nfs/dbraw/zinc/26/07/60/393260760.db2.gz	VGCIETIARFYVGK-JTQLQIEISA-N	1	0	263.370	1.384	50	0		CDAARO
Cc1cc(C2CCC2)nc(N2CCO[C@@H](CC[NH3+])C2)n1	ZINC000071738693	134975885	/nfs/dbraw/zinc/97/58/85/134975885.db2.gz	ADLZXMMLWAGOQT-ZDUSSCGKSA-N	1	0	276.384	1.607	50	0		CDAARO
Cn1cncc1C(=O)Nc1ccc2c(c1)C[NH2+]CCO2	ZINC000261689227	140375098	/nfs/dbraw/zinc/37/50/98/140375098.db2.gz	HNDACRYYGLNEOD-UHFFFAOYSA-N	1	0	272.308	1.154	50	0		CDAARO
C[N@H+](CCNC(=O)[C@@]1(C)CC1(Cl)Cl)C1CC1	ZINC000084673279	483311166	/nfs/dbraw/zinc/31/11/66/483311166.db2.gz	NPFJHBSKWFJQRG-SNVBAGLBSA-N	1	0	265.184	1.781	50	0		CDAARO
CCOC1(OCC)CCN(C(=O)OC(C)(C)C)C[C@@H]1[NH3+]	ZINC000072267272	286009109	/nfs/dbraw/zinc/00/91/09/286009109.db2.gz	DXICWTCECGHECU-NSHDSACASA-N	1	0	288.388	1.724	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)NCCc2ccccc2F)C1	ZINC000334892322	150043542	/nfs/dbraw/zinc/04/35/42/150043542.db2.gz	UHPARNCFMLZBCR-LLVKDONJSA-N	1	0	251.305	1.111	50	0		CDAARO
C[NH+](C)Cc1cccc(C(=O)N[C@H]2CCc3c[nH]nc3C2)c1	ZINC000371959919	160064298	/nfs/dbraw/zinc/06/42/98/160064298.db2.gz	OUSKEVBATRHJQS-HNNXBMFYSA-N	1	0	298.390	1.759	50	0		CDAARO
CC[C@H](CO)[NH2+]C[C@H](O)COCc1ccc(Cl)cc1	ZINC000003893463	169921372	/nfs/dbraw/zinc/92/13/72/169921372.db2.gz	RKQDUSVCVGWAKJ-KGLIPLIRSA-N	1	0	287.787	1.578	50	0		CDAARO
C[NH+](C)CCNC(=O)C[C@@H]1Sc2ccccc2NC1=O	ZINC000006177129	170180698	/nfs/dbraw/zinc/18/06/98/170180698.db2.gz	ZQEIPLMOPVLOSA-LBPRGKRZSA-N	1	0	293.392	1.167	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)c2ccc(Br)o2)CC1	ZINC000006731235	170235498	/nfs/dbraw/zinc/23/54/98/170235498.db2.gz	VEBYFNMOGUNLLY-UHFFFAOYSA-N	1	0	287.157	1.820	50	0		CDAARO
Cc1ccc(C(C)C)c(OC[C@H](O)C[NH2+]CCO)c1	ZINC000009970644	170392378	/nfs/dbraw/zinc/39/23/78/170392378.db2.gz	DBHXHWYFZNYLNE-CYBMUJFWSA-N	1	0	267.369	1.440	50	0		CDAARO
COc1cccc(CN2CC[N@H+](C)[C@@H](CCO)C2)c1	ZINC000020363223	171162371	/nfs/dbraw/zinc/16/23/71/171162371.db2.gz	PRELKPJCCVHDGS-AWEZNQCLSA-N	1	0	264.369	1.194	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)Nc2cccc(F)c2)CC1	ZINC000020514825	171232092	/nfs/dbraw/zinc/23/20/92/171232092.db2.gz	KPJLAEBVUUSWID-UHFFFAOYSA-N	1	0	251.305	1.995	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)c1ccc(=O)[nH]n1)c1ccccc1	ZINC000022622849	171394921	/nfs/dbraw/zinc/39/49/21/171394921.db2.gz	XLSBBMBYGBECJT-CYBMUJFWSA-N	1	0	286.335	1.215	50	0		CDAARO
COc1cccc([C@H]2C[NH2+]C[C@@H]2C(=O)NC(C)C)c1	ZINC000035847949	172424276	/nfs/dbraw/zinc/42/42/76/172424276.db2.gz	CYLJKHHBRBRCRL-KGLIPLIRSA-N	1	0	262.353	1.523	50	0		CDAARO
CCCN(C(=O)c1c(C)nn(C)c1C)[C@@H]1CC[NH2+]C1	ZINC000037540011	173261300	/nfs/dbraw/zinc/26/13/00/173261300.db2.gz	MGVKEQBXZQWHON-GFCCVEGCSA-N	1	0	264.373	1.251	50	0		CDAARO
Cc1nc(CC[NH3+])cc(NCCc2ccccn2)n1	ZINC000067712577	175785151	/nfs/dbraw/zinc/78/51/51/175785151.db2.gz	PGKLBYJVGBZRPU-UHFFFAOYSA-N	1	0	257.341	1.336	50	0		CDAARO
CC/C=C(\C)C[N@@H+]1CC[C@@H](CNC(=O)c2ccncn2)C1	ZINC000067821228	175795025	/nfs/dbraw/zinc/79/50/25/175795025.db2.gz	GWYPBPOXRYMXIZ-HIICFIELSA-N	1	0	288.395	1.885	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)c2cnn(Cc3ccccc3)c2)CC1	ZINC000072129420	176321040	/nfs/dbraw/zinc/32/10/40/176321040.db2.gz	YLNPGSDUXFBZIK-MRXNPFEDSA-N	1	0	298.390	1.885	50	0		CDAARO
Cc1nc(C(C)C)sc1C(=O)NC[C@@]1(O)CC[NH2+]C1	ZINC000072135569	176322059	/nfs/dbraw/zinc/32/20/59/176322059.db2.gz	CGXZASHNMOFIMM-CYBMUJFWSA-N	1	0	283.397	1.029	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)c2ccc(Cn3ccnc3)o2)CC1	ZINC000072146668	176324797	/nfs/dbraw/zinc/32/47/97/176324797.db2.gz	BRGSNGNGCDVSEO-LBPRGKRZSA-N	1	0	288.351	1.478	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(C(=O)c2ccnc(N)c2)CC1	ZINC000072160951	176330011	/nfs/dbraw/zinc/33/00/11/176330011.db2.gz	FRJSEKVBRFLDNO-GFCCVEGCSA-N	1	0	262.357	1.220	50	0		CDAARO
C[N@@H+]1CC[C@H]2CN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C[C@H]21	ZINC000077354720	177256208	/nfs/dbraw/zinc/25/62/08/177256208.db2.gz	JXZGEGHMXGAFLG-GOEBONIOSA-N	1	0	296.374	1.853	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2csc(CC[NH3+])n2)[C@H]1C	ZINC000090953603	287342076	/nfs/dbraw/zinc/34/20/76/287342076.db2.gz	JLHLPFLQXGVFJT-ZJUUUORDSA-N	1	0	267.398	1.905	50	0		CDAARO
C[NH+]1CCC(CNC(=O)c2ccc(F)cc2)CC1	ZINC000023013554	260125137	/nfs/dbraw/zinc/12/51/37/260125137.db2.gz	QBCLCRKZPHKYGD-UHFFFAOYSA-N	1	0	250.317	1.897	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC([C@@H]2OCC[C@H]2[NH3+])CC1	ZINC000238853053	275823107	/nfs/dbraw/zinc/82/31/07/275823107.db2.gz	IDWVGGMOYJZQRB-NEPJUHHUSA-N	1	0	270.373	1.750	50	0		CDAARO
CC(C)c1ccc([C@H]([NH3+])CNS(=O)(=O)N(C)C)cc1	ZINC000123761355	276058224	/nfs/dbraw/zinc/05/82/24/276058224.db2.gz	NTIYFEMIGNUJBA-CYBMUJFWSA-N	1	0	285.413	1.206	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+]C[C@]2(O)CCSC2)C12CCC2	ZINC000097034615	276352823	/nfs/dbraw/zinc/35/28/23/276352823.db2.gz	XGWKVQPNGBKMKH-YNEHKIRRSA-N	1	0	271.426	1.792	50	0		CDAARO
CCn1nc(C(=O)NC)c2c1CC[C@H]([NH2+]C1CCCC1)C2	ZINC000014540030	276721276	/nfs/dbraw/zinc/72/12/76/276721276.db2.gz	BNEFRDUSZPPLFQ-LBPRGKRZSA-N	1	0	290.411	1.652	50	0		CDAARO
COC(=O)[C@@H](CC(C)C)NC(=O)[C@H]([NH3+])Cc1ccccc1	ZINC000057466869	277077615	/nfs/dbraw/zinc/07/76/15/277077615.db2.gz	HGVNLOSOAISYIT-ZIAGYGMSSA-N	1	0	292.379	1.260	50	0		CDAARO
COc1cc2c(cc1OC)[C@@H]([C@@H](C)CO)[NH2+]CC2	ZINC000032099022	277394472	/nfs/dbraw/zinc/39/44/72/277394472.db2.gz	NOKHNYXMHMHPQS-LKFCYVNXSA-N	1	0	251.326	1.519	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(CC1)C[NH2+]CC[C@H]2O	ZINC000096945371	278383407	/nfs/dbraw/zinc/38/34/07/278383407.db2.gz	DZUSGBFCNIPQMO-LLVKDONJSA-N	1	0	270.373	1.358	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OCCc1cncn1C	ZINC000408525730	279134092	/nfs/dbraw/zinc/13/40/92/279134092.db2.gz	XVUYXDPUQGSLIN-LBPRGKRZSA-N	1	0	267.373	1.517	50	0		CDAARO
CC[C@H](O)C[N@@H+]1CC[C@@H](N(C)C(=O)OC(C)(C)C)C1	ZINC000195535103	288112681	/nfs/dbraw/zinc/11/26/81/288112681.db2.gz	NINIPMHHPVAVGG-NEPJUHHUSA-N	1	0	272.389	1.699	50	0		CDAARO
Cn1cnc(C(=O)N[C@H]2CCC[N@@H+](C3CCCC3)C2)c1	ZINC000299800265	279382640	/nfs/dbraw/zinc/38/26/40/279382640.db2.gz	XLGIBIKTFXABFP-LBPRGKRZSA-N	1	0	276.384	1.557	50	0		CDAARO
C[C@H]1CCCC[C@H]1C[NH2+]C1CCN(CC(N)=O)CC1	ZINC000096502304	279657993	/nfs/dbraw/zinc/65/79/93/279657993.db2.gz	DABRLKDINQQCDA-STQMWFEESA-N	1	0	267.417	1.352	50	0		CDAARO
C[NH+]1CCC(CNC(=O)COc2ccc(F)cc2F)CC1	ZINC000194939564	280063199	/nfs/dbraw/zinc/06/31/99/280063199.db2.gz	ONYQADDZIWEQIZ-UHFFFAOYSA-N	1	0	298.333	1.802	50	0		CDAARO
COc1ccc2nc(C(=O)N3C[C@H]4C[NH2+]C[C@H]4C3)ccc2c1	ZINC000195253459	280076448	/nfs/dbraw/zinc/07/64/48/280076448.db2.gz	GHPLEUCWZKMAJZ-BETUJISGSA-N	1	0	297.358	1.535	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C	ZINC000036773878	290499557	/nfs/dbraw/zinc/49/95/57/290499557.db2.gz	VFHVHFHRDSQHTJ-CHWFTXMASA-N	1	0	255.362	1.245	50	0		CDAARO
CO[C@@H]1C[NH2+][C@@H](C(=O)NC/C=C\c2ccccc2)C1	ZINC000568831191	294106764	/nfs/dbraw/zinc/10/67/64/294106764.db2.gz	ZDPJYFUCYOPUAH-UIKBEFBESA-N	1	0	260.337	1.193	50	0		CDAARO
COc1ccccc1S(=O)(=O)N[C@H]1CCCC[C@H]1C[NH3+]	ZINC000089108047	295379311	/nfs/dbraw/zinc/37/93/11/295379311.db2.gz	OOHOAQVFRBISSO-RYUDHWBXSA-N	1	0	298.408	1.491	50	0		CDAARO
C[C@H]1C[N@H+](C)CC[C@H]1N(C)C(=O)CCOCC(F)(F)F	ZINC000245316872	300218125	/nfs/dbraw/zinc/21/81/25/300218125.db2.gz	KZVWNVRTBQICIR-WDEREUQCSA-N	1	0	296.333	1.754	50	0		CDAARO
Cc1ccccc1C1(C(=O)N2CC[NH2+][C@@H](C)C2)CC1	ZINC000299739857	302086543	/nfs/dbraw/zinc/08/65/43/302086543.db2.gz	SIJGVLPYRHRARG-ZDUSSCGKSA-N	1	0	258.365	1.847	50	0		CDAARO
Cc1noc(C)c1[C@H](C)C(=O)N1CC[C@@H]([NH3+])C[C@H]1C	ZINC000408519168	302845541	/nfs/dbraw/zinc/84/55/41/302845541.db2.gz	LHKGICDVGRIUMC-VDDIYKPWSA-N	1	0	265.357	1.733	50	0		CDAARO
CCC(=O)N1CCC([NH2+][C@H](C)Cn2ccnc2CC)CC1	ZINC000534578272	328311026	/nfs/dbraw/zinc/31/10/26/328311026.db2.gz	ZZIUKRFUFHFKGK-CYBMUJFWSA-N	1	0	292.427	1.825	50	0		CDAARO
c1c(CN2CC[C@H]3C[NH2+]C[C@H]32)onc1-c1ccccn1	ZINC000534584910	328314693	/nfs/dbraw/zinc/31/46/93/328314693.db2.gz	DRLYDDZYGSNMLW-XHDPSFHLSA-N	1	0	270.336	1.530	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccc(-c3ccc(O)cn3)cc2)CC[NH2+]1	ZINC000534588318	328316571	/nfs/dbraw/zinc/31/65/71/328316571.db2.gz	MPQOZLVXAISSJT-GFCCVEGCSA-N	1	0	297.358	1.888	50	0		CDAARO
CC[N@H+](C)C1(CNc2nc(OC)cc(OC)n2)CCCC1	ZINC000534637790	328334705	/nfs/dbraw/zinc/33/47/05/328334705.db2.gz	ITELLPQSBSOVBD-UHFFFAOYSA-N	1	0	294.399	1.592	50	0		CDAARO
CCCOc1ccccc1CCNC(=O)[C@@H]1C=CC[NH2+]1	ZINC000534653602	328338588	/nfs/dbraw/zinc/33/85/88/328338588.db2.gz	SABKWWJJPWDIPH-AWEZNQCLSA-N	1	0	274.364	1.662	50	0		CDAARO
O=C(NCCn1ccnn1)C1([NH+]2CCCC2)CCCCC1	ZINC000534659053	328341867	/nfs/dbraw/zinc/34/18/67/328341867.db2.gz	IFUIJTMWWQAGRB-UHFFFAOYSA-N	1	0	291.399	1.193	50	0		CDAARO
CC(C)C[C@H]([NH2+]C1CCOCC1)c1ncnn1C	ZINC000534674479	328349121	/nfs/dbraw/zinc/34/91/21/328349121.db2.gz	SEHGPJCYQDBBOJ-LBPRGKRZSA-N	1	0	252.362	1.671	50	0		CDAARO
[NH3+][C@@H](C(=O)N1CCC[C@@H](Cn2ccnn2)C1)c1ccccc1	ZINC000182696388	323296251	/nfs/dbraw/zinc/29/62/51/323296251.db2.gz	KDGHQCXWMSIECM-UKRRQHHQSA-N	1	0	299.378	1.217	50	0		CDAARO
CCC[C@@H]1CN(C(=O)[C@H]([NH3+])c2ccccc2)CCO1	ZINC000182850676	323304829	/nfs/dbraw/zinc/30/48/29/323304829.db2.gz	VQVKFKIGNXCKNL-ZIAGYGMSSA-N	1	0	262.353	1.714	50	0		CDAARO
CO[C@@H]1CCN(C(=O)CCc2ccsc2)[C@@H](C[NH3+])C1	ZINC000195557564	323571940	/nfs/dbraw/zinc/57/19/40/323571940.db2.gz	WAAWANDTJORIIL-CHWSQXEVSA-N	1	0	282.409	1.645	50	0		CDAARO
Clc1ccc(C[NH2+]CCN2CCOCC2)cc1	ZINC000019871929	326857591	/nfs/dbraw/zinc/85/75/91/326857591.db2.gz	KYCCQYLTLCWVHE-UHFFFAOYSA-N	1	0	254.761	1.762	50	0		CDAARO
O=C1O[C@@H](C[NH+]2CCCC2)Cn2c3ccoc3cc21	ZINC000002531962	328752426	/nfs/dbraw/zinc/75/24/26/328752426.db2.gz	PWTQYATUDKDBEU-JTQLQIEISA-N	1	0	260.293	1.869	50	0		CDAARO
COCC1CC[NH+](CC[C@@H]2CCS(=O)(=O)C2)CC1	ZINC000677686017	482750208	/nfs/dbraw/zinc/75/02/08/482750208.db2.gz	WGCNMHHBJUXWTM-CYBMUJFWSA-N	1	0	275.414	1.170	50	0		CDAARO
[NH3+][C@H]1[C@H]2C=C[C@H](C2)[C@H]1C(=O)NCCOc1ccccc1F	ZINC000670439273	482980007	/nfs/dbraw/zinc/98/00/07/482980007.db2.gz	AMDGBPDLLNYQOG-BVIHXZOGSA-N	1	0	290.338	1.470	50	0		CDAARO
C[C@@H](C(=O)N1CCCC1)[N@H+](C)CC1(CO)CCC1	ZINC000670449735	483009780	/nfs/dbraw/zinc/00/97/80/483009780.db2.gz	LDNSIKKOMBCZFY-LBPRGKRZSA-N	1	0	254.374	1.092	50	0		CDAARO
CCn1ccc(C[N@@H+]2CC[C@@H](O)CC(C)(C)C2)n1	ZINC000670469207	483063484	/nfs/dbraw/zinc/06/34/84/483063484.db2.gz	BSOYRSRWRXFQSU-CYBMUJFWSA-N	1	0	251.374	1.886	50	0		CDAARO
Cc1[nH]nc(C2CC2)c1C(=O)NC[C@]1(C)CC[N@@H+](C)C1	ZINC000670472562	483081179	/nfs/dbraw/zinc/08/11/79/483081179.db2.gz	NMYGQOPQBQAQSY-HNNXBMFYSA-N	1	0	276.384	1.667	50	0		CDAARO
C[NH+](C)CCN(Cc1ccccn1)C(=O)NC1CC1	ZINC000083851066	483209498	/nfs/dbraw/zinc/20/94/98/483209498.db2.gz	IRRQVJOECHGDQY-UHFFFAOYSA-N	1	0	262.357	1.317	50	0		CDAARO
CCC[N@H+](CCO)Cc1cc2c(c(OC)c1)OCO2	ZINC000023281279	521667265	/nfs/dbraw/zinc/66/72/65/521667265.db2.gz	DUAHRPKWGRCJCJ-UHFFFAOYSA-N	1	0	267.325	1.628	50	0		CDAARO
CCOc1cccc(OCCOCC[NH2+]CCO)c1	ZINC000022309633	521402181	/nfs/dbraw/zinc/40/21/81/521402181.db2.gz	GTPNVLLYNWWRQO-UHFFFAOYSA-N	1	0	269.341	1.063	50	0		CDAARO
Cc1ccc([C@@H](O)CN2CC[N@@H+](C)C[C@H]2C)cc1C	ZINC000300403800	538230786	/nfs/dbraw/zinc/23/07/86/538230786.db2.gz	DIPUAHUTSUGSST-ZBFHGGJFSA-N	1	0	262.397	1.973	50	0		CDAARO
Cn1cc(NC(=O)N2CCN(c3cc[nH+]cc3)CC2)cn1	ZINC000076063158	538435980	/nfs/dbraw/zinc/43/59/80/538435980.db2.gz	FVMHYAGDKADTCA-UHFFFAOYSA-N	1	0	286.339	1.169	50	0		CDAARO
C[C@H]1CC[C@@H](c2ccc(NS(C)(=O)=O)cc2)C[NH2+]1	ZINC000757216175	577036181	/nfs/dbraw/zinc/03/61/81/577036181.db2.gz	YFZMMQOOIVEXHT-CMPLNLGQSA-N	1	0	268.382	1.914	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@@H]([NH3+])c2ccc(F)cc2)C1	ZINC000958528860	613973492	/nfs/dbraw/zinc/97/34/92/613973492.db2.gz	WXYNHYPWMITVTN-LBPRGKRZSA-N	1	0	296.342	1.807	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](CNCc2nc(C)c(C)n2C)C1	ZINC000952968974	616348742	/nfs/dbraw/zinc/34/87/42/616348742.db2.gz	QEZHXLDQSAXUGA-OAHLLOKOSA-N	1	0	294.443	1.485	50	0		CDAARO
Cc1onc(NC(=O)NC[C@H]2C[C@@H]([NH+](C)C)C2)c1C	ZINC000888093972	617753102	/nfs/dbraw/zinc/75/31/02/617753102.db2.gz	QOLDQFYSULROSG-PHIMTYICSA-N	1	0	266.345	1.753	50	0		CDAARO
C[C@H](Oc1cccnc1)C(=O)N1[C@H](C)C[C@@H](C[NH3+])C[C@@H]1C	ZINC000888095977	617757382	/nfs/dbraw/zinc/75/73/82/617757382.db2.gz	MPMINJQHOOISDC-CRWXNKLISA-N	1	0	291.395	1.823	50	0		CDAARO
COC1(OC)CC[N@H+](Cc2ccc(F)cc2)C[C@H]1O	ZINC000874434866	632390491	/nfs/dbraw/zinc/39/04/91/632390491.db2.gz	GPTXNINNRJHQHY-CYBMUJFWSA-N	1	0	269.316	1.381	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CN(C)c2cncc(C)n2)C1	ZINC001772700430	1159436378	/nfs/dbraw/zinc/43/63/78/1159436378.db2.gz	DTXFBBGIPFYUPJ-CYBMUJFWSA-N	1	0	264.373	1.190	50	0		CDAARO
Cc1ccc(-c2noc(C[N@H+]3C[C@@H]4[C@@H](O)C[C@@H]4C3)n2)cc1	ZINC001772705596	1159440521	/nfs/dbraw/zinc/44/05/21/1159440521.db2.gz	UUFJNLSMRDAKET-RDBSUJKOSA-N	1	0	285.347	1.858	50	0		CDAARO
COc1ccc(C[NH+]2CCC([C@H](O)CO)CC2)cc1F	ZINC001772711517	1159445801	/nfs/dbraw/zinc/44/58/01/1159445801.db2.gz	DEQJHOXNOAZBIG-CQSZACIVSA-N	1	0	283.343	1.400	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3cccc(O)c3)C[C@H]2O)[nH]n1	ZINC001704279990	1177678092	/nfs/dbraw/zinc/67/80/92/1177678092.db2.gz	DNTAJNJSPFQTSL-CZUORRHYSA-N	1	0	287.363	1.459	50	0		CDAARO
CCC[NH+](CCC)[C@@H](C)C(=O)N(CCO)Cc1ncc[nH]1	ZINC001704335862	1177693524	/nfs/dbraw/zinc/69/35/24/1177693524.db2.gz	HQNFSQXYFJBDCJ-ZDUSSCGKSA-N	1	0	296.415	1.241	50	0		CDAARO
Cc1nscc1C(=O)NC[C@@H]1CCC[N@@H+](C)C1	ZINC000179688331	782498427	/nfs/dbraw/zinc/49/84/27/782498427.db2.gz	RBULIVQJRYTJAN-JTQLQIEISA-N	1	0	253.371	1.523	50	0		CDAARO
Cc1cc2cc(CN3CC[NH+](CCO)CC3)ccc2o1	ZINC000020861942	782840756	/nfs/dbraw/zinc/84/07/56/782840756.db2.gz	ADMOBKYPBCIZSD-UHFFFAOYSA-N	1	0	274.364	1.851	50	0		CDAARO
C[C@]1(Cn2cnc3ccccc3c2=O)[NH2+]CCc2nc[nH]c21	ZINC000067894260	780359991	/nfs/dbraw/zinc/35/99/91/780359991.db2.gz	MXSDGHMKUREPQR-MRXNPFEDSA-N	1	0	295.346	1.181	50	0		CDAARO
O=S1(=O)CC[C@@H]([NH2+]Cc2ccccc2C(F)(F)F)C1	ZINC000019899709	780623703	/nfs/dbraw/zinc/62/37/03/780623703.db2.gz	WIPXKGCPOJGKFB-SNVBAGLBSA-N	1	0	293.310	1.982	50	0		CDAARO
O[C@@H]1C[C@H](O)C12CC[NH+](CCCc1ccccc1)CC2	ZINC000091793227	896401491	/nfs/dbraw/zinc/40/14/91/896401491.db2.gz	KKIXDQBMUYVBPW-IYBDPMFKSA-N	1	0	275.392	1.827	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](CO)[C@H](NC(=O)c2ccccc2)C1	ZINC000581799287	899634465	/nfs/dbraw/zinc/63/44/65/899634465.db2.gz	OIOQABIITGGXNZ-HZPDHXFCSA-N	1	0	290.407	1.755	50	0		CDAARO
Cc1cccc(OCCNC(=O)[C@H]2CCC[NH2+][C@@H]2C)c1	ZINC000094647853	901347834	/nfs/dbraw/zinc/34/78/34/901347834.db2.gz	CLFIGCIKDCSZNW-HIFRSBDPSA-N	1	0	276.380	1.878	50	0		CDAARO
Cc1csc(CN2C[C@H](C)O[C@@]3(CC[NH2+]C3)C2)n1	ZINC000952881817	910449056	/nfs/dbraw/zinc/44/90/56/910449056.db2.gz	MZRYPVMOLHSCBM-WCQYABFASA-N	1	0	267.398	1.404	50	0		CDAARO
C[C@@H](CN(C)CCO)[NH2+]CCc1nc2ccccc2[nH]1	ZINC000952984679	910551748	/nfs/dbraw/zinc/55/17/48/910551748.db2.gz	LVXDGLFDFXQONX-LBPRGKRZSA-N	1	0	276.384	1.008	50	0		CDAARO
Cc1cc(C[N@@H+]2CC3(C[C@@H]2C(=O)[O-])CC[NH2+]CC3)oc1C	ZINC000072146591	936652786	/nfs/dbraw/zinc/65/27/86/936652786.db2.gz	GNKAQWSXXCGFJM-CQSZACIVSA-N	1	0	292.379	1.925	50	0		CDAARO
C[C@H](CS(C)(=O)=O)N1CCC(C[NH+]2CCCC2)CC1	ZINC000821740678	925589499	/nfs/dbraw/zinc/58/94/99/925589499.db2.gz	YCTHRDWWLZQORB-CYBMUJFWSA-N	1	0	288.457	1.227	50	0		CDAARO
CCCn1nc(CC)nc1CN1CC[NH+](CC)CC1	ZINC000823033105	925668782	/nfs/dbraw/zinc/66/87/82/925668782.db2.gz	PBGDQWIINSYQAJ-UHFFFAOYSA-N	1	0	265.405	1.388	50	0		CDAARO
C[N@H+](CCn1cnnc1)C[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000823684422	925721046	/nfs/dbraw/zinc/72/10/46/925721046.db2.gz	UGVSGDKETQHIQH-CYBMUJFWSA-N	1	0	291.399	1.001	50	0		CDAARO
CN(CC(N)=O)Cc1cc(C[NH+]2CCCC2)cs1	ZINC000823719798	925722741	/nfs/dbraw/zinc/72/27/41/925722741.db2.gz	CABCVQIANOYBNU-UHFFFAOYSA-N	1	0	267.398	1.261	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)N1CCCC[C@@H]1CO	ZINC000828710936	926169439	/nfs/dbraw/zinc/16/94/39/926169439.db2.gz	QEJZVIKSMZQAGY-CYBMUJFWSA-N	1	0	254.374	1.236	50	0		CDAARO
CCO[C@@H]1C[C@](CO)([NH2+]Cc2nn(C)cc2C)C1(C)C	ZINC000877871578	937151703	/nfs/dbraw/zinc/15/17/03/937151703.db2.gz	SEDAGQCHAUSKJI-UKRRQHHQSA-N	1	0	281.400	1.384	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+](CC[S@](C)=O)C1	ZINC000585079724	930851412	/nfs/dbraw/zinc/85/14/12/930851412.db2.gz	GJCCCJQGRZZWAK-QUJCMNEKSA-N	1	0	288.457	1.382	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)N[C@@H]1C[C@@H]([NH+](C)C)C12CCC2	ZINC000585131309	931023951	/nfs/dbraw/zinc/02/39/51/931023951.db2.gz	RKBMJQCZPVQNFW-ZIAGYGMSSA-N	1	0	290.411	1.558	50	0		CDAARO
C[N@@H+](Cc1ncccc1O)C[C@H](O)c1ccccc1	ZINC000019144459	935711152	/nfs/dbraw/zinc/71/11/52/935711152.db2.gz	NUKVMJWPWGDDRQ-HNNXBMFYSA-N	1	0	258.321	1.953	50	0		CDAARO
Cc1nnc(SCC[NH2+]C[C@H]2CCOC2)s1	ZINC000053622898	936305530	/nfs/dbraw/zinc/30/55/30/936305530.db2.gz	VCPUYNGPLPZIPV-SECBINFHSA-N	1	0	259.400	1.565	50	0		CDAARO
CCc1ccc(C[NH2+]CCN2CCC[C@@H](CO)C2)o1	ZINC001506397123	975147868	/nfs/dbraw/zinc/14/78/68/975147868.db2.gz	NLHIREPPKRWDMI-CYBMUJFWSA-N	1	0	266.385	1.636	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(c2ncc(F)c(N3CCCC3)n2)C1	ZINC001506416747	975155429	/nfs/dbraw/zinc/15/54/29/975155429.db2.gz	LOCQEBCMWLECDW-GFCCVEGCSA-N	1	0	293.390	1.746	50	0		CDAARO
Cc1cnc(C)c(N2CC[N@@H+](CC(C)C)[C@@H](CCO)C2)n1	ZINC001506426366	975160935	/nfs/dbraw/zinc/16/09/35/975160935.db2.gz	OEFVWLUUMLLZPA-HNNXBMFYSA-N	1	0	292.427	1.622	50	0		CDAARO
CCS(=O)(=O)CCN(C)CC[C@@H]1CCCC[N@@H+]1C	ZINC000096441542	230373118	/nfs/dbraw/zinc/37/31/18/230373118.db2.gz	YLPOLZUUKUGTKY-ZDUSSCGKSA-N	1	0	276.446	1.227	50	0		CDAARO
C[NH2+]CCCNC(=O)c1cc(Br)ccc1O	ZINC000124371232	187134698	/nfs/dbraw/zinc/13/46/98/187134698.db2.gz	OXCQAHXAJFNPRJ-UHFFFAOYSA-N	1	0	287.157	1.494	50	0		CDAARO
Cc1n[nH]cc1C[NH2+][C@@H]1CCc2nnc(C(C)C)n2C1	ZINC000095958124	342468169	/nfs/dbraw/zinc/46/81/69/342468169.db2.gz	VTIZMDCTWAQGGZ-GFCCVEGCSA-N	1	0	274.372	1.538	50	0		CDAARO
O=C1C[C@H]2CC[C@@H](CN1Cc1noc(-c3ccccc3)n1)[NH2+]2	ZINC000095503866	185000930	/nfs/dbraw/zinc/00/09/30/185000930.db2.gz	XBLDFTFUYDXKNA-OLZOCXBDSA-N	1	0	298.346	1.590	50	0		CDAARO
C[C@@H]1C[C@@H]([NH3+])CCN1C(=O)Cc1noc2ccccc21	ZINC000129266316	230394489	/nfs/dbraw/zinc/39/44/89/230394489.db2.gz	JZUDIZMCCZSVLD-MNOVXSKESA-N	1	0	273.336	1.709	50	0		CDAARO
Cc1cccc(-n2cc(C(=O)N3CC[NH2+]C[C@H]3C)nn2)c1	ZINC000124623889	187146055	/nfs/dbraw/zinc/14/60/55/187146055.db2.gz	WERAZFGCWJNJHR-GFCCVEGCSA-N	1	0	285.351	1.010	50	0		CDAARO
CC1CCC(NC(=O)C[NH2+][C@H](CO)C2CC2)CC1	ZINC000095941346	185035675	/nfs/dbraw/zinc/03/56/75/185035675.db2.gz	BULOPMOBLQEEBZ-KGPNIALWSA-N	1	0	254.374	1.042	50	0		CDAARO
CC[C@@H]1CN([C@@H](C)c2cccnc2)CC[N@@H+]1C[C@H](C)O	ZINC000252504699	398218009	/nfs/dbraw/zinc/21/80/09/398218009.db2.gz	CUZOHBLINTUKTA-OFQRWUPVSA-N	1	0	277.412	1.920	50	0		CDAARO
CCC[N@@H+]1CCCC[C@@H]1C(=O)N[C@@H]1C=C[C@H](CO)C1	ZINC000095976849	185051356	/nfs/dbraw/zinc/05/13/56/185051356.db2.gz	LNWQJKFLYSDRLQ-BFHYXJOUSA-N	1	0	266.385	1.304	50	0		CDAARO
CCC[C@@H]1CN(C(=O)NC2CC=CC2)CC[N@@H+]1CCOC	ZINC000095980825	185053329	/nfs/dbraw/zinc/05/33/29/185053329.db2.gz	CKPSZBGHTUQGNU-OAHLLOKOSA-N	1	0	295.427	1.847	50	0		CDAARO
C[C@H]([NH2+]CC(=O)N1CCC[C@@H](C)C1)C1CCOCC1	ZINC000095985396	185055415	/nfs/dbraw/zinc/05/54/15/185055415.db2.gz	YYRTWGYDLFDMRU-OLZOCXBDSA-N	1	0	268.401	1.650	50	0		CDAARO
C[C@@H]1C[NH+](CCCNC(=O)c2cccc(O)c2)C[C@@H](C)O1	ZINC000096003500	185062009	/nfs/dbraw/zinc/06/20/09/185062009.db2.gz	ORUFUIDSBGHBPF-CHWSQXEVSA-N	1	0	292.379	1.621	50	0		CDAARO
CCc1nccn1CC(=O)N(CC)C[C@H]1CC[N@H+](C)C1	ZINC000240517205	361748204	/nfs/dbraw/zinc/74/82/04/361748204.db2.gz	NWOHSVVCTDQYIH-ZDUSSCGKSA-N	1	0	278.400	1.246	50	0		CDAARO
C[C@@H]1CN(CC[N@@H+]2CCC[C@@H](OCC3CC3)C2)CCO1	ZINC000241588054	361753300	/nfs/dbraw/zinc/75/33/00/361753300.db2.gz	OZFZLHWJQWUCMG-GDBMZVCRSA-N	1	0	282.428	1.598	50	0		CDAARO
CC(C)c1cc(C(=O)N2CC[C@@H]3CC[N@H+](C)C[C@@H]32)no1	ZINC000241897148	361754228	/nfs/dbraw/zinc/75/42/28/361754228.db2.gz	TVZQTXMPFFFWRZ-AAEUAGOBSA-N	1	0	277.368	1.964	50	0		CDAARO
Cc1cccc2c1ncnc2N1CCO[C@@H]2CC[N@@H+](C)C[C@@H]21	ZINC000242263391	361754901	/nfs/dbraw/zinc/75/49/01/361754901.db2.gz	XYPKNWLFYIBACQ-LSDHHAIUSA-N	1	0	298.390	1.848	50	0		CDAARO
Cc1cc(C(=O)N2CC[NH2+]C[C@H]2C)nc2ccccc12	ZINC000125155144	187172099	/nfs/dbraw/zinc/17/20/99/187172099.db2.gz	SECXCJMTDXCHOX-GFCCVEGCSA-N	1	0	269.348	1.977	50	0		CDAARO
CN1C(=O)N[C@](C)([C@@H]2CCC[N@H+](CC3CCCC3)C2)C1=O	ZINC000089914243	539087678	/nfs/dbraw/zinc/08/76/78/539087678.db2.gz	YSPBOWPVBMNVAE-CZUORRHYSA-N	1	0	293.411	1.829	50	0		CDAARO
C[C@@]1(O)CC[N@H+](Cc2cccc(OC(F)F)c2)C[C@@H]1O	ZINC000096141786	185106506	/nfs/dbraw/zinc/10/65/06/185106506.db2.gz	VGEOBQDBHAICHY-GXTWGEPZSA-N	1	0	287.306	1.606	50	0		CDAARO
C[C@@H](Cc1ccc(F)cc1)NC(=O)[C@@]1(F)CC[NH2+]C1	ZINC000195543191	342626718	/nfs/dbraw/zinc/62/67/18/342626718.db2.gz	URGUCRVKWWWDBN-IINYFYTJSA-N	1	0	268.307	1.575	50	0		CDAARO
CCc1nnc(NC(=O)CC[N@@H+]2CCC[C@@H](OC)C2)s1	ZINC000244574814	361853019	/nfs/dbraw/zinc/85/30/19/361853019.db2.gz	CRWUYYCJRBZKTB-SNVBAGLBSA-N	1	0	298.412	1.540	50	0		CDAARO
CCc1nnc(NC(=O)CC[N@@H+]2CCCO[C@H](C)C2)s1	ZINC000244633229	361855808	/nfs/dbraw/zinc/85/58/08/361855808.db2.gz	FZJDHFHHEJQUTR-SNVBAGLBSA-N	1	0	298.412	1.540	50	0		CDAARO
C[N@H+](CCn1cncn1)C[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000244715735	361857868	/nfs/dbraw/zinc/85/78/68/361857868.db2.gz	LBEZEJUFBVILEA-ZDUSSCGKSA-N	1	0	291.399	1.001	50	0		CDAARO
CCc1nnc(CN2CC[N@H+](C(C)C)[C@H](C)C2)[nH]1	ZINC000244708086	361859078	/nfs/dbraw/zinc/85/90/78/361859078.db2.gz	KNEGNHVHUUODTR-LLVKDONJSA-N	1	0	251.378	1.282	50	0		CDAARO
CO[C@H](C[NH3+])CC(=O)N1CCCN(C)c2ccccc21	ZINC000262906031	361881152	/nfs/dbraw/zinc/88/11/52/361881152.db2.gz	QELUZQHSQMRDQU-LBPRGKRZSA-N	1	0	277.368	1.223	50	0		CDAARO
COc1ccc([C@@H]2C[C@H]2C(=O)N2CCN(C)C[C@H]2C)cc1	ZINC000685939473	539045616	/nfs/dbraw/zinc/04/56/16/539045616.db2.gz	YGIMFILAPVATJM-UHOFOFEASA-N	1	0	288.391	1.961	50	0		CDAARO
O=C(c1ccccc1)N1CC[C@H]([NH2+]C2CCOCC2)C1	ZINC000098020258	539095752	/nfs/dbraw/zinc/09/57/52/539095752.db2.gz	LSUSYJAQRGJHIR-HNNXBMFYSA-N	1	0	274.364	1.670	50	0		CDAARO
C[C@H]([NH2+][C@H]1CCCNC(=O)C1)[C@H](c1ccccc1)N(C)C	ZINC000585116904	362044448	/nfs/dbraw/zinc/04/44/48/362044448.db2.gz	MCGGYGOXRBGGHZ-JLJPHGGASA-N	1	0	289.423	1.936	50	0		CDAARO
C[C@H](Cc1cnccn1)[NH2+]Cc1nncn1-c1ccccc1	ZINC000585116953	362045187	/nfs/dbraw/zinc/04/51/87/362045187.db2.gz	NIAQUGOTZBVQJJ-CYBMUJFWSA-N	1	0	294.362	1.778	50	0		CDAARO
C[N@H+](CCO)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000141791338	362089811	/nfs/dbraw/zinc/08/98/11/362089811.db2.gz	UHHVOWADPHQJKX-UHFFFAOYSA-N	1	0	258.362	1.310	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)[C@H]1CCCO1)c1ccccc1	ZINC000033028899	282245959	/nfs/dbraw/zinc/24/59/59/282245959.db2.gz	KESNIGSTNSUANP-ZIAGYGMSSA-N	1	0	262.353	1.585	50	0		CDAARO
c1cnnc(N2CC[NH+](C[C@H]3CC=CCC3)CC2)c1	ZINC000127929661	136386454	/nfs/dbraw/zinc/38/64/54/136386454.db2.gz	LARLXSXRBCLXIW-AWEZNQCLSA-N	1	0	258.369	1.955	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)COc2ccc(F)cc2F)C1	ZINC000178979907	362251240	/nfs/dbraw/zinc/25/12/40/362251240.db2.gz	UKNBKJMRSVLUSX-SNVBAGLBSA-N	1	0	284.306	1.412	50	0		CDAARO
C[C@H]1CN(C(=O)c2ccc3nccn3c2)C[C@H](C)[NH2+]1	ZINC000179152407	362252051	/nfs/dbraw/zinc/25/20/51/362252051.db2.gz	RGJNPNFPNSKBBT-QWRGUYRKSA-N	1	0	258.325	1.157	50	0		CDAARO
COc1ccc([C@@H]2CN(C)C(=O)[C@]23CCC[NH2+]C3)cc1	ZINC000044137135	345421651	/nfs/dbraw/zinc/42/16/51/345421651.db2.gz	DXBJNJAMXPGLDM-HOCLYGCPSA-N	1	0	274.364	1.621	50	0		CDAARO
c1ccc2[nH]c(CN3CC[N@@H+]4CCC[C@@H]4C3)nc2c1	ZINC000097632092	185641755	/nfs/dbraw/zinc/64/17/55/185641755.db2.gz	UXYBQSIVLQHLRD-GFCCVEGCSA-N	1	0	256.353	1.843	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN1C(=O)CCCc1ccccc1	ZINC000085470048	179075242	/nfs/dbraw/zinc/07/52/42/179075242.db2.gz	JBYKJAWMTFGVRY-INIZCTEOSA-N	1	0	290.407	1.798	50	0		CDAARO
Cc1csc(NC(=O)CN2CCC([NH+](C)C)CC2)n1	ZINC000089705751	179850120	/nfs/dbraw/zinc/85/01/20/179850120.db2.gz	UXJYDVABMZKWPU-UHFFFAOYSA-N	1	0	282.413	1.416	50	0		CDAARO
COCC1CCN(C(=O)C[C@H]2C[N@@H+](C(C)C)CCO2)CC1	ZINC000584885556	349342861	/nfs/dbraw/zinc/34/28/61/349342861.db2.gz	CVCHVFPPZQYLQZ-HNNXBMFYSA-N	1	0	298.427	1.371	50	0		CDAARO
C[NH+](C)[C@@H]1CCC[C@H]1NC(=O)c1ccc(F)c(O)c1	ZINC000584888564	349347344	/nfs/dbraw/zinc/34/73/44/349347344.db2.gz	PBMKDNGZZXYFFS-VXGBXAGGSA-N	1	0	266.316	1.744	50	0		CDAARO
Nc1ncc(C(=O)N2CCC[C@@H](C[NH+]3CCCC3)C2)s1	ZINC000584897972	349359912	/nfs/dbraw/zinc/35/99/12/349359912.db2.gz	AZJSNARXVXXCFP-NSHDSACASA-N	1	0	294.424	1.504	50	0		CDAARO
COc1ccnc(N2CC[NH+](CCc3ccncc3)CC2)c1	ZINC000104719601	186018489	/nfs/dbraw/zinc/01/84/89/186018489.db2.gz	WMSVKOIHEWNJAG-UHFFFAOYSA-N	1	0	298.390	1.850	50	0		CDAARO
CCC[N@@H+]1C[C@H]2CC[C@@H]1CN(C(=O)c1cccnn1)C2	ZINC000091269592	180117206	/nfs/dbraw/zinc/11/72/06/180117206.db2.gz	LXJHFECDRPWJKR-CHWSQXEVSA-N	1	0	274.368	1.423	50	0		CDAARO
CC[C@@]1(CO)CCCN(C(=O)C[NH+]2CCCC2)C1	ZINC000091593974	180201495	/nfs/dbraw/zinc/20/14/95/180201495.db2.gz	UJLTYAHEEFACQO-CQSZACIVSA-N	1	0	254.374	1.093	50	0		CDAARO
COc1ncc(C(=O)N2CC[C@H]([NH+]3CCCCC3)C2)cn1	ZINC000426359553	358457867	/nfs/dbraw/zinc/45/78/67/358457867.db2.gz	LPHANEAJFLAKDH-ZDUSSCGKSA-N	1	0	290.367	1.186	50	0		CDAARO
COc1cc(C[N@H+](CC(N)=O)C(C)C)ccc1C	ZINC000193618714	362985191	/nfs/dbraw/zinc/98/51/91/362985191.db2.gz	HXIIYSVVFKNENP-UHFFFAOYSA-N	1	0	250.342	1.699	50	0		CDAARO
CC[C@@H](C)CS(=O)(=O)NC[C@@H]([NH3+])c1ccccc1	ZINC000123795176	351286539	/nfs/dbraw/zinc/28/65/39/351286539.db2.gz	RHFAFYFXLURTRJ-DGCLKSJQSA-N	1	0	270.398	1.652	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CN(C(=O)c2ccc(F)cc2Cl)CCO1	ZINC000122886625	187057624	/nfs/dbraw/zinc/05/76/24/187057624.db2.gz	CCYDMVGBYIUFGG-PRHODGIISA-N	1	0	286.734	1.667	50	0		CDAARO
Cc1nonc1CN1CCC[C@@H](c2nnc3ccccn32)C1	ZINC000265633686	363359478	/nfs/dbraw/zinc/35/94/78/363359478.db2.gz	GPYIJDKIMOKHAW-GFCCVEGCSA-N	1	0	298.350	1.800	50	0		CDAARO
O=C(C[C@H](CO)[NH2+]Cc1ccccc1)NCc1ccccc1	ZINC000000034177	355880660	/nfs/dbraw/zinc/88/06/60/355880660.db2.gz	VXVMQZRTMSIEGT-QGZVFWFLSA-N	1	0	298.386	1.844	50	0		CDAARO
CCCC[NH2+]C[C@H](O)Cn1c2ccccc2sc1=O	ZINC000002496770	355971903	/nfs/dbraw/zinc/97/19/03/355971903.db2.gz	SXYOVIRNAGZSOM-NSHDSACASA-N	1	0	280.393	1.814	50	0		CDAARO
CCn1nc(C(C)C)cc1C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000299738876	356263460	/nfs/dbraw/zinc/26/34/60/356263460.db2.gz	HOSJSIKZPUQBTF-NSHDSACASA-N	1	0	264.373	1.447	50	0		CDAARO
c1sc(CN2CC[NH2+]CC2)cc1-c1cncnc1	ZINC000032565459	356265599	/nfs/dbraw/zinc/26/55/99/356265599.db2.gz	UHDVXCOVNOVLCT-UHFFFAOYSA-N	1	0	260.366	1.610	50	0		CDAARO
COc1cc(F)c(C[NH2+]C[C@H]2COCCO2)cc1OC	ZINC000032603547	356305260	/nfs/dbraw/zinc/30/52/60/356305260.db2.gz	MRHMGMGPWPTJCE-NSHDSACASA-N	1	0	285.315	1.348	50	0		CDAARO
Cc1cccc(CN2CCC[C@](O)(C[NH2+]C(C)C)C2=O)c1	ZINC000012572226	356309612	/nfs/dbraw/zinc/30/96/12/356309612.db2.gz	QKKHKKSMUSJUIP-KRWDZBQOSA-N	1	0	290.407	1.847	50	0		CDAARO
COc1ccccc1C(=O)NCCC[NH+]1CCCC1	ZINC000013673697	356353364	/nfs/dbraw/zinc/35/33/64/356353364.db2.gz	GLVRBZHLFJFJGW-UHFFFAOYSA-N	1	0	262.353	1.911	50	0		CDAARO
COc1cc(C[NH2+]C[C@H]2CCCO2)ccc1OCCO	ZINC000013730829	356354637	/nfs/dbraw/zinc/35/46/37/356354637.db2.gz	ILRNSINOUBSKTF-CYBMUJFWSA-N	1	0	281.352	1.335	50	0		CDAARO
Cc1cc(NCCC[NH+]2CCCCC2)n2ncnc2n1	ZINC000032743538	356356655	/nfs/dbraw/zinc/35/66/55/356356655.db2.gz	IFFPPAMKSAZDAR-UHFFFAOYSA-N	1	0	274.372	1.721	50	0		CDAARO
COc1cc(C[NH2+]Cc2ccco2)ccc1OCC(N)=O	ZINC000004488572	356364032	/nfs/dbraw/zinc/36/40/32/356364032.db2.gz	DCTCIDCCNXECQR-UHFFFAOYSA-N	1	0	290.319	1.442	50	0		CDAARO
CCCN1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000016991453	356451100	/nfs/dbraw/zinc/45/11/00/356451100.db2.gz	PGVASRAQBCTYQM-UHFFFAOYSA-N	1	0	268.382	1.403	50	0		CDAARO
O=c1cc(C[NH2+]CCO)c2ccc(Br)cc2o1	ZINC000023624596	356647731	/nfs/dbraw/zinc/64/77/31/356647731.db2.gz	JENRGXNIPUNQSE-UHFFFAOYSA-N	1	0	298.136	1.637	50	0		CDAARO
Cc1cccn2c(=O)cc(CN3CCOC[C@@H]3C)nc12	ZINC000026451529	356692877	/nfs/dbraw/zinc/69/28/77/356692877.db2.gz	XRRRQNGTTVHFKO-LBPRGKRZSA-N	1	0	273.336	1.224	50	0		CDAARO
C[NH+]1CCC(CNC(=O)C[C@@H]2CCCOC2)CC1	ZINC000193059292	356820090	/nfs/dbraw/zinc/82/00/90/356820090.db2.gz	CYSHVVHTUCAVAD-ZDUSSCGKSA-N	1	0	254.374	1.261	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000035133184	356829999	/nfs/dbraw/zinc/82/99/99/356829999.db2.gz	JEAOOJVVTOKESY-UHFFFAOYSA-N	1	0	257.337	1.946	50	0		CDAARO
c1csc(-c2nc(CN3CC[NH2+]CC3)no2)c1	ZINC000036946228	356891036	/nfs/dbraw/zinc/89/10/36/356891036.db2.gz	LQBQLCLJMPLYBS-UHFFFAOYSA-N	1	0	250.327	1.203	50	0		CDAARO
Cc1cc(C)cc(OCC(=O)NC2CC[NH+](C)CC2)c1	ZINC000047829390	357165477	/nfs/dbraw/zinc/16/54/77/357165477.db2.gz	QCSLESGIBXAYIT-UHFFFAOYSA-N	1	0	276.380	1.893	50	0		CDAARO
Cc1nc2sccn2c1C(=O)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065370106	357531647	/nfs/dbraw/zinc/53/16/47/357531647.db2.gz	JIAXUBFXZQPCJU-MNOVXSKESA-N	1	0	290.392	1.671	50	0		CDAARO
COc1cccc(C[C@H](C)[NH2+]CCc2nnc(N)s2)c1	ZINC000065397044	357536621	/nfs/dbraw/zinc/53/66/21/357536621.db2.gz	BNWLEHKLVMWCJU-JTQLQIEISA-N	1	0	292.408	1.892	50	0		CDAARO
CCn1cnnc1CCNC(=O)C1CC[NH+](C(C)C)CC1	ZINC000065397832	357537006	/nfs/dbraw/zinc/53/70/06/357537006.db2.gz	ADTMJZJKHRYFRF-UHFFFAOYSA-N	1	0	293.415	1.077	50	0		CDAARO
CNC(=O)CC1CC[NH+](CCC(F)(F)F)CC1	ZINC000065420783	357540555	/nfs/dbraw/zinc/54/05/55/357540555.db2.gz	KWLNGZIAMCOEAU-UHFFFAOYSA-N	1	0	252.280	1.787	50	0		CDAARO
C[C@@H](Cn1cncn1)[NH2+]CCN1CCc2ccccc2C1	ZINC000067818950	357628650	/nfs/dbraw/zinc/62/86/50/357628650.db2.gz	LZEGMTYEKXABJB-AWEZNQCLSA-N	1	0	285.395	1.315	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@@H]1CCC[NH2+][C@H]1C	ZINC000091496926	357604071	/nfs/dbraw/zinc/60/40/71/357604071.db2.gz	QDJCZGJAGSHCQR-CMPLNLGQSA-N	1	0	286.372	1.553	50	0		CDAARO
COc1ccc(F)cc1C(=O)NC[C@H]1CCC[N@H+](C)C1	ZINC000067974039	357641216	/nfs/dbraw/zinc/64/12/16/357641216.db2.gz	PUVHQIWTRBJFMF-LLVKDONJSA-N	1	0	280.343	1.906	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNC(=O)c2ccsc2)C1	ZINC000068494988	357649340	/nfs/dbraw/zinc/64/93/40/357649340.db2.gz	GNTJUYUKRZZUCJ-NSHDSACASA-N	1	0	268.382	1.446	50	0		CDAARO
CC[C@@H]1C[N@H+](CCCO)CCC(=O)N1Cc1ccccc1	ZINC000071754336	357779657	/nfs/dbraw/zinc/77/96/57/357779657.db2.gz	VONASJXIEIJQKQ-MRXNPFEDSA-N	1	0	290.407	1.882	50	0		CDAARO
Cc1cc(CNC[C@@]2(O)CCC[NH2+]C2)c(C(F)(F)F)o1	ZINC000072423591	357834100	/nfs/dbraw/zinc/83/41/00/357834100.db2.gz	QJJWFJCMAXOYTD-GFCCVEGCSA-N	1	0	292.301	1.811	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@H]2CN2CCOCC2)cc1	ZINC000092218180	357896495	/nfs/dbraw/zinc/89/64/95/357896495.db2.gz	SICXMWLZKCRXRD-INIZCTEOSA-N	1	0	290.407	1.992	50	0		CDAARO
CC[N@H+](CC(=O)Nc1ccc(O)cc1F)C1CC1	ZINC000097083420	357945783	/nfs/dbraw/zinc/94/57/83/357945783.db2.gz	BTCZJEZBCDCFOJ-UHFFFAOYSA-N	1	0	252.289	1.954	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(Cc2ccc(C(=O)OC)[nH]2)C1	ZINC000097095598	357953011	/nfs/dbraw/zinc/95/30/11/357953011.db2.gz	PEVXQZZFTPZMHT-NSHDSACASA-N	1	0	265.357	1.233	50	0		CDAARO
CCCN(CCC)C(=O)C[NH2+][C@H]1CCC[C@]1(C)CO	ZINC000097105303	357968299	/nfs/dbraw/zinc/96/82/99/357968299.db2.gz	GHTNERPXLJXPEW-DZGCQCFKSA-N	1	0	270.417	1.776	50	0		CDAARO
Cc1ccc(C[NH2+]CCN2CCOCC2)cc1F	ZINC000083393128	363594669	/nfs/dbraw/zinc/59/46/69/363594669.db2.gz	QWKOKKSZKMDZLW-UHFFFAOYSA-N	1	0	252.333	1.556	50	0		CDAARO
Cc1cccc(S(=O)(=O)N[C@@H]2CCC[NH2+]C2)c1Cl	ZINC000097234910	358050547	/nfs/dbraw/zinc/05/05/47/358050547.db2.gz	GMJWEADLBPXGEN-SNVBAGLBSA-N	1	0	288.800	1.679	50	0		CDAARO
C[C@@H]1C[NH+](C[C@@H](O)COCc2ccccc2)C[C@@H](C)O1	ZINC000019594715	358106792	/nfs/dbraw/zinc/10/67/92/358106792.db2.gz	YTWHNHAFBLEEKO-IIAWOOMASA-N	1	0	279.380	1.673	50	0		CDAARO
Cc1cc(NCc2cccc(Cn3cncn3)c2)nc(C)n1	ZINC000585145881	358239721	/nfs/dbraw/zinc/23/97/21/358239721.db2.gz	PBHDLYPZFNPZJR-UHFFFAOYSA-N	1	0	294.362	1.767	50	0		CDAARO
COc1ccc(-n2c(C[NH3+])nnc2SC[C@@H](C)O)cc1	ZINC000426411474	358632450	/nfs/dbraw/zinc/63/24/50/358632450.db2.gz	OQWRSANIWSLFRW-SECBINFHSA-N	1	0	294.380	1.208	50	0		CDAARO
Cc1cc(CNC(=O)CC2CC[NH+](C(C)C)CC2)n(C)n1	ZINC000095371577	358687607	/nfs/dbraw/zinc/68/76/07/358687607.db2.gz	RFDPHJARIXLGIE-UHFFFAOYSA-N	1	0	292.427	1.855	50	0		CDAARO
Cc1nn(C)c2nc(N3CCC[C@H]([NH+](C)C)C3)sc12	ZINC000095526637	358696279	/nfs/dbraw/zinc/69/62/79/358696279.db2.gz	UOQHTOFQFJULHJ-JTQLQIEISA-N	1	0	279.413	1.869	50	0		CDAARO
O=C([C@H]1CCCCO1)N1CCN(c2cc[nH+]cc2)CC1	ZINC000097294882	358765030	/nfs/dbraw/zinc/76/50/30/358765030.db2.gz	SRFGMIGHZVUART-CQSZACIVSA-N	1	0	275.352	1.299	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1C(=O)N(C)CCn1cccn1	ZINC000097527192	358782810	/nfs/dbraw/zinc/78/28/10/358782810.db2.gz	WGAYRUCJDHVLMH-ZDUSSCGKSA-N	1	0	264.373	1.216	50	0		CDAARO
O=C(NCCc1c[nH]cn1)c1ccc([C@@H]2CCC[NH2+]C2)cc1	ZINC000215305793	358883099	/nfs/dbraw/zinc/88/30/99/358883099.db2.gz	OSXNOLGTCPJOIE-OAHLLOKOSA-N	1	0	298.390	1.849	50	0		CDAARO
CCCn1ncc(C(=O)N(C)[C@@H]2CC[N@H+](C)C2)c1C	ZINC000216212604	358931427	/nfs/dbraw/zinc/93/14/27/358931427.db2.gz	CBAISEALWXFSIU-GFCCVEGCSA-N	1	0	264.373	1.378	50	0		CDAARO
CC[NH2+]CC[C@@H]1CCC(=O)N1CCCOC(C)C	ZINC000014958743	359071621	/nfs/dbraw/zinc/07/16/21/359071621.db2.gz	YAIIKSHECRDLAO-ZDUSSCGKSA-N	1	0	256.390	1.792	50	0		CDAARO
O=C(C[N@H+]1CCC[C@H](O)C1)N(Cc1ccncc1)C1CC1	ZINC000219519896	359101730	/nfs/dbraw/zinc/10/17/30/359101730.db2.gz	HKPRXJMGBOQLCZ-HNNXBMFYSA-N	1	0	289.379	1.029	50	0		CDAARO
O=C(CCCn1cncn1)NCCC12CCC[NH+]1CCC2	ZINC000220688178	359191050	/nfs/dbraw/zinc/19/10/50/359191050.db2.gz	YAKSJSOXUCWFAP-UHFFFAOYSA-N	1	0	291.399	1.193	50	0		CDAARO
CN1Cc2cccn2C[C@@H]1CNC(=O)c1ccsc1	ZINC000257179000	359154402	/nfs/dbraw/zinc/15/44/02/359154402.db2.gz	HRTSNGGIKHHYEK-ZDUSSCGKSA-N	1	0	275.377	1.794	50	0		CDAARO
CC[C@H](CNC(=O)c1cccc(C(N)=O)c1)[NH+]1CCCC1	ZINC000032661249	359227285	/nfs/dbraw/zinc/22/72/85/359227285.db2.gz	BPEDUOPMXQGLOX-CQSZACIVSA-N	1	0	289.379	1.390	50	0		CDAARO
CCCC[N@H+](C)CC1CCN(C(=O)[C@@H](C)[NH3+])CC1	ZINC000037825971	359234112	/nfs/dbraw/zinc/23/41/12/359234112.db2.gz	GZCHVOOUEOHLEA-GFCCVEGCSA-N	1	0	255.406	1.304	50	0		CDAARO
O=C(c1ccc(-n2ccnc2)nc1)N1CCCCC1	ZINC000026023098	359402307	/nfs/dbraw/zinc/40/23/07/359402307.db2.gz	ITQVGFDUZDWFHY-UHFFFAOYSA-N	1	0	256.309	1.893	50	0		CDAARO
OC[C@@H]1C[N@H+](Cc2ccoc2)C[C@H]1c1nc(C2CC2)no1	ZINC000257196090	359620904	/nfs/dbraw/zinc/62/09/04/359620904.db2.gz	XNWCIYORNHZZJK-QWHCGFSZSA-N	1	0	289.335	1.748	50	0		CDAARO
C[NH+](C)CCNC(=O)c1nc(-c2ccc3[nH]ccc3c2)no1	ZINC000012389796	359639878	/nfs/dbraw/zinc/63/98/78/359639878.db2.gz	HIETZGRJZBFBSW-UHFFFAOYSA-N	1	0	299.334	1.509	50	0		CDAARO
C[C@@H](C(=O)NC1CC1)N1CC[NH+](CC2CCC2)CC1	ZINC000089448684	359913462	/nfs/dbraw/zinc/91/34/62/359913462.db2.gz	WUPWLEOEUSIQIS-LBPRGKRZSA-N	1	0	265.401	1.071	50	0		CDAARO
Cc1ncc2c(c1CNC(=O)[C@@]1(C)CCCO1)CC[NH2+]C2	ZINC000072426978	359935029	/nfs/dbraw/zinc/93/50/29/359935029.db2.gz	IXFCDJBURUBPGJ-MRXNPFEDSA-N	1	0	289.379	1.221	50	0		CDAARO
O=C(c1cc2ncccn2n1)N1CC[C@@H]([NH+]2CCCCC2)C1	ZINC000631149124	360194804	/nfs/dbraw/zinc/19/48/04/360194804.db2.gz	JVAYKVAIRBMIMO-CYBMUJFWSA-N	1	0	299.378	1.430	50	0		CDAARO
O=C(c1cc2ncccn2n1)N1CC[C@H]([NH+]2CCCCC2)C1	ZINC000631149301	360195011	/nfs/dbraw/zinc/19/50/11/360195011.db2.gz	JVAYKVAIRBMIMO-ZDUSSCGKSA-N	1	0	299.378	1.430	50	0		CDAARO
CCCCNC(=O)C[N@H+](C)[C@@H]1[C@H]2CCO[C@H]2C1(C)C	ZINC000248139679	360402342	/nfs/dbraw/zinc/40/23/42/360402342.db2.gz	BIBJTIVMFSUSRC-MRVWCRGKSA-N	1	0	268.401	1.648	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@@H]1CCCN1C(=O)C[C@H](C)OC	ZINC000248143588	360404816	/nfs/dbraw/zinc/40/48/16/360404816.db2.gz	CVIZYKPQJFKNKM-MJBXVCDLSA-N	1	0	268.401	1.887	50	0		CDAARO
[NH3+][C@@H]1CN(C(=O)OCc2ccccc2)CC[C@H]1F	ZINC000032915022	360485744	/nfs/dbraw/zinc/48/57/44/360485744.db2.gz	JREMPGXODKGFEJ-VXGBXAGGSA-N	1	0	252.289	1.694	50	0		CDAARO
Cc1nc[nH]c1CNC(=O)CC[C@@H](C)[NH+]1CCCC1	ZINC000426491018	360575080	/nfs/dbraw/zinc/57/50/80/360575080.db2.gz	HAAGQLSXXGZPHA-LLVKDONJSA-N	1	0	264.373	1.599	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cnn(C(C)(C)C)c2C)C1	ZINC000178964550	189157671	/nfs/dbraw/zinc/15/76/71/189157671.db2.gz	JLYISJSWGMYGKT-LBPRGKRZSA-N	1	0	278.400	1.628	50	0		CDAARO
COCC[N@@H+](Cc1ccco1)C[C@H](O)COC(C)C	ZINC000036096399	360911372	/nfs/dbraw/zinc/91/13/72/360911372.db2.gz	HNWVNBURWGDPOM-ZDUSSCGKSA-N	1	0	271.357	1.514	50	0		CDAARO
Fc1cccc(CN2CCN([C@H]3CC[NH2+]C3)CC2)c1F	ZINC000097619250	361015658	/nfs/dbraw/zinc/01/56/58/361015658.db2.gz	DAJGLCSMSPWILN-ZDUSSCGKSA-N	1	0	281.350	1.444	50	0		CDAARO
CC(C)c1nc(CCNC(=O)[C@@H]2CCC[NH2+]CC2)no1	ZINC000299773919	200867657	/nfs/dbraw/zinc/86/76/57/200867657.db2.gz	GQNOSVVWNIKJDD-LLVKDONJSA-N	1	0	280.372	1.241	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC[C@@H]([NH3+])C2)c(Cl)c1	ZINC000036297047	361462428	/nfs/dbraw/zinc/46/24/28/361462428.db2.gz	YAYJZWFNDAARQK-SNVBAGLBSA-N	1	0	288.800	1.760	50	0		CDAARO
O=C(NCCc1cn[nH]c1)N1CC[C@H]([NH+]2CCCCC2)C1	ZINC000290858566	361601162	/nfs/dbraw/zinc/60/11/62/361601162.db2.gz	BHEFDMWEWRTDDB-AWEZNQCLSA-N	1	0	291.399	1.222	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc(F)c(F)c2)C[C@H]1CCO	ZINC000104330753	361587307	/nfs/dbraw/zinc/58/73/07/361587307.db2.gz	WXGWRWJZTHPTCV-GFCCVEGCSA-N	1	0	270.323	1.463	50	0		CDAARO
CC(C)COc1cncc(N2CC[C@@H]([NH+]3CC=CC3)C2)n1	ZINC000101554539	363937653	/nfs/dbraw/zinc/93/76/53/363937653.db2.gz	NQQOEJQULZZALJ-CQSZACIVSA-N	1	0	288.395	1.962	50	0		CDAARO
COc1ccc(C2(CNC(N)=[NH2+])CCCC2)cc1OC	ZINC000000488194	365146926	/nfs/dbraw/zinc/14/69/26/365146926.db2.gz	MMNDPPWWQBTVQT-UHFFFAOYSA-N	1	0	277.368	1.999	50	0	biogenic	CDAARO
CCCCC[NH2+][C@@H]1CS(=O)(=O)C[C@@H]1N1CCCC1	ZINC000089953456	366980740	/nfs/dbraw/zinc/98/07/40/366980740.db2.gz	BMVSEMLBNHMGAH-OLZOCXBDSA-N	1	0	274.430	1.028	50	0		CDAARO
CC(C)([NH2+]C[C@H]1CCS(=O)(=O)C1)c1ccccc1	ZINC000280098969	367258331	/nfs/dbraw/zinc/25/83/31/367258331.db2.gz	SVDWYKGQDTZZDX-GFCCVEGCSA-N	1	0	267.394	1.946	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC000094345306	367434599	/nfs/dbraw/zinc/43/45/99/367434599.db2.gz	LKMPYOYICALTEG-WRWORJQWSA-N	1	0	272.270	1.832	50	0		CDAARO
C1CC1N1CC[C@@H]([NH2+][C@H]2CCC[C@@H]3OCC[C@@H]32)C1	ZINC000252476881	367543186	/nfs/dbraw/zinc/54/31/86/367543186.db2.gz	DDKVDDDJKINLNF-RZFFKMDDSA-N	1	0	250.386	1.770	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNC(=O)c1cccc(=O)[nH]1	ZINC000282439768	367886056	/nfs/dbraw/zinc/88/60/56/367886056.db2.gz	IIMIPBJOSJLLOA-NSHDSACASA-N	1	0	263.341	1.391	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CCOc1ccc(S(N)(=O)=O)cc1	ZINC000027344189	368153368	/nfs/dbraw/zinc/15/33/68/368153368.db2.gz	MVEQZYMYFUKVBD-LBPRGKRZSA-N	1	0	298.408	1.587	50	0		CDAARO
C[C@@H]([NH2+]C[C@@H]1COC2(CCOCC2)O1)C(C)(C)C	ZINC000095991794	296130079	/nfs/dbraw/zinc/13/00/79/296130079.db2.gz	CVKNKIWCGDMUNL-VXGBXAGGSA-N	1	0	257.374	1.933	50	0		CDAARO
CN(C)C(=O)c1ccc(N(C)C[C@@H]2CCC[N@@H+]2C)nc1	ZINC000420630111	244294932	/nfs/dbraw/zinc/29/49/32/244294932.db2.gz	DJBVFQCRCAWEGF-ZDUSSCGKSA-N	1	0	276.384	1.314	50	0		CDAARO
O=C(Cc1cccnc1)N1CCC([C@H]2CC[NH2+]C2)CC1	ZINC000290065299	369773064	/nfs/dbraw/zinc/77/30/64/369773064.db2.gz	HXHGECYLGYBLCQ-HNNXBMFYSA-N	1	0	273.380	1.472	50	0		CDAARO
Cn1cc(CN2CC[N@H+](C)C[C@@H]2c2ccccc2)cn1	ZINC000084318489	370092209	/nfs/dbraw/zinc/09/22/09/370092209.db2.gz	MFFADHOVKMSGLC-MRXNPFEDSA-N	1	0	270.380	1.909	50	0		CDAARO
O=C(NC[C@@]1(O)CCC[NH2+]C1)c1ccc(F)cc1Cl	ZINC000299757478	372745618	/nfs/dbraw/zinc/74/56/18/372745618.db2.gz	KCSRNMJHMBFTCQ-CYBMUJFWSA-N	1	0	286.734	1.323	50	0		CDAARO
Cc1cc(C[C@H](C)NC(=O)Nc2cccc(C[NH3+])c2)[nH]n1	ZINC000299760556	372747299	/nfs/dbraw/zinc/74/72/99/372747299.db2.gz	HPXBREMWLHOSPU-JTQLQIEISA-N	1	0	287.367	1.930	50	0		CDAARO
O=C(C[C@H]1CC[NH2+]C1)NCCOc1cccc2cccnc21	ZINC000299775651	372751847	/nfs/dbraw/zinc/75/18/47/372751847.db2.gz	GIJYYCSSHSRPRR-CYBMUJFWSA-N	1	0	299.374	1.729	50	0		CDAARO
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]1[NH2+]CC(N)=O	ZINC000253417337	373725530	/nfs/dbraw/zinc/72/55/30/373725530.db2.gz	KJPNHIQEZNROHE-JFGNBEQYSA-N	1	0	285.388	1.095	50	0		CDAARO
C[NH2+][C@H]1CCN(Cc2cnc(-c3cnccn3)s2)C1	ZINC000097162617	541892394	/nfs/dbraw/zinc/89/23/94/541892394.db2.gz	OBLIMPZGKXZHQZ-JTQLQIEISA-N	1	0	275.381	1.394	50	0		CDAARO
O=C(NCC[NH+]1CCC(O)CC1)NC1CCCCC1	ZINC000206609913	374177862	/nfs/dbraw/zinc/17/78/62/374177862.db2.gz	QIIPREAVDNWKRG-UHFFFAOYSA-N	1	0	269.389	1.075	50	0		CDAARO
Cc1nc(C)c(C(=O)NCC[C@H]2CCC[N@H+]2C)o1	ZINC000215426650	374670275	/nfs/dbraw/zinc/67/02/75/374670275.db2.gz	IAVPSGRUCJEEOD-LLVKDONJSA-N	1	0	251.330	1.506	50	0		CDAARO
Cc1cc(S(=O)(=O)N[C@@H](C[NH3+])C2CC2)cnc1Cl	ZINC000095432121	374932664	/nfs/dbraw/zinc/93/26/64/374932664.db2.gz	MXULREVMJCTAKP-JTQLQIEISA-N	1	0	289.788	1.059	50	0		CDAARO
COC[C@H](O)C[N@H+](C)[C@H]1CCCN(c2ccccc2)C1	ZINC000127334090	375055631	/nfs/dbraw/zinc/05/56/31/375055631.db2.gz	KQMMHDJSKBQZED-JKSUJKDBSA-N	1	0	278.396	1.595	50	0		CDAARO
[NH3+][C@@H]1CCC[C@@H]1C(=O)NC[C@H](O)c1ccccc1F	ZINC000299739479	375199042	/nfs/dbraw/zinc/19/90/42/375199042.db2.gz	OWYDTWTWLSRIER-UHTWSYAYSA-N	1	0	266.316	1.103	50	0		CDAARO
C[C@H](C(=O)N1CC[C@H]([NH3+])C1)c1ccc(F)c(F)c1	ZINC000299739787	375200211	/nfs/dbraw/zinc/20/02/11/375200211.db2.gz	RIHRUPADCIHTTK-WPRPVWTQSA-N	1	0	254.280	1.628	50	0		CDAARO
C[C@@H]1C[C@@H]([NH2+]Cc2nncn2-c2ccccc2)[C@H](C)O1	ZINC000296284614	375367654	/nfs/dbraw/zinc/36/76/54/375367654.db2.gz	FKHXGCFFTVXXMQ-MBNYWOFBSA-N	1	0	272.352	1.923	50	0		CDAARO
Cc1nn(C)cc1C(=O)N1CC[C@H]([NH+]2CCCCC2)C1	ZINC000334456681	375421925	/nfs/dbraw/zinc/42/19/25/375421925.db2.gz	AXHMUKREZXOAIU-ZDUSSCGKSA-N	1	0	276.384	1.429	50	0		CDAARO
CCN(CC)[P+](=c1n(C)ccn1C)N(CC)CC	ZINC000003201213	375585142	/nfs/dbraw/zinc/58/51/42/375585142.db2.gz	UTSZJPRBZILMPP-UHFFFAOYSA-N	1	0	271.369	1.470	50	0		CDAARO
C[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)CCCn1ccnc1	ZINC000242389382	376021502	/nfs/dbraw/zinc/02/15/02/376021502.db2.gz	ZWRNOUPGVGKTED-KGLIPLIRSA-N	1	0	276.384	1.358	50	0		CDAARO
C1CC1c1noc(N2C[C@H]3C[N@@H+]4CCCC[C@H]4[C@@H]3C2)n1	ZINC000242100114	376021604	/nfs/dbraw/zinc/02/16/04/376021604.db2.gz	WEKSKOIGLMVQFK-UPJWGTAASA-N	1	0	274.368	1.868	50	0		CDAARO
Cc1cc(-n2nc(C3CC3)nc2-c2nc(N)n[nH]2)cc[nH+]1	ZINC000067965736	377335825	/nfs/dbraw/zinc/33/58/25/377335825.db2.gz	ASNKFXMGLCAASM-UHFFFAOYSA-N	1	0	282.311	1.215	50	0		CDAARO
OCCO[C@@H]1CCC[N@@H+]([C@@H]2Cc3ccccc3[C@H]2O)C1	ZINC000245652368	378809102	/nfs/dbraw/zinc/80/91/02/378809102.db2.gz	HUNUDVAKSCQCDI-FVQBIDKESA-N	1	0	277.364	1.118	50	0		CDAARO
CCn1c(=O)n(-c2ccccc2)c(C=O)c1-[n+]1ccccc1	ZINC000000494413	169656008	/nfs/dbraw/zinc/65/60/08/169656008.db2.gz	NJKUMOAMQMXVBS-UHFFFAOYSA-N	1	0	294.334	1.748	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1C[C@H](C)Oc2cc(F)ccc21	ZINC000118962399	390448672	/nfs/dbraw/zinc/44/86/72/390448672.db2.gz	SDJVZCNLFCSLGE-WPRPVWTQSA-N	1	0	252.289	1.677	50	0		CDAARO
C[C@H]1CCC[N@@H+]1CC(=O)NC[C@H](O)c1ccc(Cl)cc1	ZINC000095416573	390484296	/nfs/dbraw/zinc/48/42/96/390484296.db2.gz	PRUTUVHMMTWGAR-FZMZJTMJSA-N	1	0	296.798	1.974	50	0		CDAARO
CC[NH+]1CCC(N(C)C(=O)c2cc(N(C)C)ccn2)CC1	ZINC000097104145	390791837	/nfs/dbraw/zinc/79/18/37/390791837.db2.gz	FJPIEFPSDYJZGA-UHFFFAOYSA-N	1	0	290.411	1.704	50	0		CDAARO
Cc1nc(CN2CCC([N@@H+](C)CCN(C)C)CC2)c[nH]1	ZINC000215226024	390990066	/nfs/dbraw/zinc/99/00/66/390990066.db2.gz	KSVLPENUWFUWFW-UHFFFAOYSA-N	1	0	279.432	1.176	50	0		CDAARO
C[C@H](C1CCN(C(=O)c2cnco2)CC1)[NH+](C)C	ZINC000220609038	533590178	/nfs/dbraw/zinc/59/01/78/533590178.db2.gz	JNRJUIZPEXZFNK-SNVBAGLBSA-N	1	0	251.330	1.477	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@@H](c2ccccc2)C[C@@]12NC(=O)NC2=O	ZINC000005998472	391256105	/nfs/dbraw/zinc/25/61/05/391256105.db2.gz	JIVUQMZFYBMAHJ-IXPVHAAZSA-N	1	0	273.336	1.278	50	0		CDAARO
[NH3+][C@@H]1CC[C@H]2CN(C(=O)c3ccc(Br)o3)C[C@H]12	ZINC000248584401	391496019	/nfs/dbraw/zinc/49/60/19/391496019.db2.gz	FXOWRZULMKWGHY-XHNCKOQMSA-N	1	0	299.168	1.851	50	0		CDAARO
CC(CN1C[C@H](C)O[C@@H](C)C1)C[NH+]1C[C@H](C)O[C@@H](C)C1	ZINC000241884822	391680765	/nfs/dbraw/zinc/68/07/65/391680765.db2.gz	SYBPFBQJBJGVKB-VGWMRTNUSA-N	1	0	284.444	1.841	50	0		CDAARO
C[C@@H](C(=O)N1CCO[C@H](c2cccs2)C1)[C@H](C)[NH3+]	ZINC000192021646	130352585	/nfs/dbraw/zinc/35/25/85/130352585.db2.gz	KNRHXPRXHHUKOF-VWYCJHECSA-N	1	0	268.382	1.631	50	0		CDAARO
O=C(C1CC1)N1CCC[N@H+](CC[C@@H]2CCOC2)CC1	ZINC000438294662	391905727	/nfs/dbraw/zinc/90/57/27/391905727.db2.gz	SDGQRGOWUSIWFT-CYBMUJFWSA-N	1	0	266.385	1.357	50	0		CDAARO
O=C(COc1cccc(Cl)c1)N[C@@H]1[C@H]2C[NH2+]C[C@H]21	ZINC000250116177	131124200	/nfs/dbraw/zinc/12/42/00/131124200.db2.gz	NEWVGTBMFFJJNU-PJXYFTJBSA-N	1	0	266.728	1.053	50	0		CDAARO
C[C@H](NC(=O)C[C@@H]([NH3+])c1ccccc1)[C@H]1CCCO1	ZINC000252447222	131134758	/nfs/dbraw/zinc/13/47/58/131134758.db2.gz	HNYUXPNMXOUXHN-IACUBPJLSA-N	1	0	262.353	1.760	50	0		CDAARO
Cc1nc(CC(C)C)c(C(=O)N2CC[C@H]([NH3+])C2)s1	ZINC000269168281	132124246	/nfs/dbraw/zinc/12/42/46/132124246.db2.gz	RSHLWYYEYZKZMI-JTQLQIEISA-N	1	0	267.398	1.823	50	0		CDAARO
C[C@H]([NH2+]C[C@@H]1CC[C@@H](C(=O)N(C)C)O1)C(C)(C)C(F)F	ZINC000657939241	413098997	/nfs/dbraw/zinc/09/89/97/413098997.db2.gz	WGPMUWNCNGBYGI-DCAQKATOSA-N	1	0	292.370	1.892	50	0		CDAARO
CSCC[C@H](C)NC(=O)N1CC[C@@H]([NH+]2CC=CC2)C1	ZINC000101388696	397791872	/nfs/dbraw/zinc/79/18/72/397791872.db2.gz	MKBPMRSHANKTJG-QWHCGFSZSA-N	1	0	283.441	1.784	50	0		CDAARO
C[N@@H+]1CCN(Cc2cccc3cccnc32)C[C@H]1CCO	ZINC000104638304	397946014	/nfs/dbraw/zinc/94/60/14/397946014.db2.gz	YIIJCUAWVOISBX-MRXNPFEDSA-N	1	0	285.391	1.733	50	0		CDAARO
CCOC(=O)[C@@H]1CC[C@@H]([NH3+])[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000095742911	285873339	/nfs/dbraw/zinc/87/33/39/285873339.db2.gz	STWAQGKVYHZJCJ-MXWKQRLJSA-N	1	0	286.372	1.570	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1Nc1ncc(C)c(N(C)C)n1	ZINC000065387982	286072856	/nfs/dbraw/zinc/07/28/56/286072856.db2.gz	WKWQCFDWCKNISN-STQMWFEESA-N	1	0	293.415	1.371	50	0		CDAARO
C[C@@H](O)C[NH2+]CCOCCOc1ccc2c(c1)CCC2	ZINC000002879922	169840257	/nfs/dbraw/zinc/84/02/57/169840257.db2.gz	RIKBNNLIWJTPSS-CYBMUJFWSA-N	1	0	279.380	1.541	50	0		CDAARO
CCOCCC[NH2+]Cc1ccc2c(c1)n(C)c(=O)n2C	ZINC000004993749	170051508	/nfs/dbraw/zinc/05/15/08/170051508.db2.gz	BJHGFVXLOYAEKG-UHFFFAOYSA-N	1	0	277.368	1.393	50	0		CDAARO
Cc1nc2ccccc2n1CCC(=O)NCC[NH+](C)C	ZINC000005209763	170076256	/nfs/dbraw/zinc/07/62/56/170076256.db2.gz	AVMIBPMHZHYMHN-UHFFFAOYSA-N	1	0	274.368	1.413	50	0		CDAARO
CC(C)(C)NC(=O)COc1ccc(C[NH2+]CCO)cc1	ZINC000006313414	170190319	/nfs/dbraw/zinc/19/03/19/170190319.db2.gz	GXZYAWXMHODRPE-UHFFFAOYSA-N	1	0	280.368	1.062	50	0		CDAARO
C[NH+](C)CCNC(=S)Nc1ccc2c(c1)OCCO2	ZINC000006319850	170191099	/nfs/dbraw/zinc/19/10/99/170191099.db2.gz	SRKUZOVCDXHDDV-UHFFFAOYSA-N	1	0	281.381	1.306	50	0		CDAARO
C[NH+](C)CC(C)(C)CNc1nnnn1-c1ccccc1	ZINC000008178201	170322620	/nfs/dbraw/zinc/32/26/20/170322620.db2.gz	VGAGUIXPMKYYFX-UHFFFAOYSA-N	1	0	274.372	1.662	50	0		CDAARO
Cc1cccc(S(=O)(=O)N2CCC[C@@H]([NH3+])C2)c1	ZINC000019874268	170903776	/nfs/dbraw/zinc/90/37/76/170903776.db2.gz	ATORHJOYADWXAP-LLVKDONJSA-N	1	0	254.355	1.107	50	0		CDAARO
COC(=O)c1ccc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)cc1	ZINC000020307187	171142665	/nfs/dbraw/zinc/14/26/65/171142665.db2.gz	VWYNLFPCRJZKHX-CYBMUJFWSA-N	1	0	276.336	1.171	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC[C@@H]([NH3+])C2)cc1C	ZINC000020432298	171197507	/nfs/dbraw/zinc/19/75/07/171197507.db2.gz	FTUVTSVREIPFDV-GFCCVEGCSA-N	1	0	268.382	1.415	50	0		CDAARO
c1cc(OCC[NH2+]CCN2CCOCC2)cc2c1CCC2	ZINC000020482353	171223219	/nfs/dbraw/zinc/22/32/19/171223219.db2.gz	UPHWSKXHVQPRCQ-UHFFFAOYSA-N	1	0	290.407	1.476	50	0		CDAARO
CC[NH+]1CCN(CC(=O)NC2CCCCC2)CC1	ZINC000020608800	171267344	/nfs/dbraw/zinc/26/73/44/171267344.db2.gz	PJWSKGRFQCVGMY-UHFFFAOYSA-N	1	0	253.390	1.073	50	0		CDAARO
OCc1ccccc1OCCCN1CCOCC1	ZINC000020652695	171268852	/nfs/dbraw/zinc/26/88/52/171268852.db2.gz	GMNAUVHKPYTUQA-UHFFFAOYSA-N	1	0	251.326	1.280	50	0		CDAARO
C[C@H](Cc1ccccc1F)N1CC[NH+](CCO)CC1	ZINC000022455195	171388463	/nfs/dbraw/zinc/38/84/63/171388463.db2.gz	RCZWETNQVRYAGE-CYBMUJFWSA-N	1	0	266.360	1.367	50	0		CDAARO
C[C@@H]([NH2+]CN1C(=O)NC(C)(C)C1=O)c1ccccc1	ZINC000022635411	171395051	/nfs/dbraw/zinc/39/50/51/171395051.db2.gz	DNNAHCKGFXTEFK-SNVBAGLBSA-N	1	0	261.325	1.625	50	0		CDAARO
C[C@H]([NH2+]CN1C(=O)NC(C)(C)C1=O)c1ccccc1	ZINC000022635416	171395172	/nfs/dbraw/zinc/39/51/72/171395172.db2.gz	DNNAHCKGFXTEFK-JTQLQIEISA-N	1	0	261.325	1.625	50	0		CDAARO
Cc1cc(CN2CCC([N@@H+]3CC[C@H](O)C3)CC2)on1	ZINC000662151771	414536982	/nfs/dbraw/zinc/53/69/82/414536982.db2.gz	KZCFMCNVPFRKCZ-ZDUSSCGKSA-N	1	0	265.357	1.014	50	0		CDAARO
COc1cc(N[C@H]2COC[C@@H]2[NH+]2CCCCC2)ncn1	ZINC000065498639	175744483	/nfs/dbraw/zinc/74/44/83/175744483.db2.gz	BCUTWGXDFJWHFA-RYUDHWBXSA-N	1	0	278.356	1.150	50	0		CDAARO
CCOC(=O)C1(NC(=O)C2CC[NH+](C(C)C)CC2)CCC1	ZINC000065531357	175748424	/nfs/dbraw/zinc/74/84/24/175748424.db2.gz	XACOAWTWEYAVCH-UHFFFAOYSA-N	1	0	296.411	1.709	50	0		CDAARO
CC(C)n1c(=O)c2ccccc2n(CCC[NH+](C)C)c1=O	ZINC000071280550	176108796	/nfs/dbraw/zinc/10/87/96/176108796.db2.gz	LJTMNMADOGNART-UHFFFAOYSA-N	1	0	289.379	1.696	50	0		CDAARO
Cc1nccn1CCn1ccnc1C1CC[NH+](C)CC1	ZINC000071415713	176160403	/nfs/dbraw/zinc/16/04/03/176160403.db2.gz	KAQZFUGGXAAYPF-UHFFFAOYSA-N	1	0	273.384	1.897	50	0		CDAARO
CC(C)C[C@@H]([NH3+])C(=O)NCc1noc(-c2ccco2)n1	ZINC000071748990	176259304	/nfs/dbraw/zinc/25/93/04/176259304.db2.gz	GZRGDRXWGLFEJV-SECBINFHSA-N	1	0	278.312	1.319	50	0		CDAARO
CC(C)c1cncnc1NC[C@H]1COCC[N@H+](C)C1	ZINC000072144676	176324238	/nfs/dbraw/zinc/32/42/38/176324238.db2.gz	NRVWZSRZNCNULC-GFCCVEGCSA-N	1	0	264.373	1.590	50	0		CDAARO
O=C(C[C@@H]1COCC[NH2+]1)Nc1ccc2ncsc2c1	ZINC000072150290	176326508	/nfs/dbraw/zinc/32/65/08/176326508.db2.gz	ZLPCDNNGIKGMJU-SNVBAGLBSA-N	1	0	277.349	1.613	50	0		CDAARO
CCc1ncc(C(=O)N2CCC[C@@H]([NH+](C)C)CC2)cn1	ZINC000072153596	176328186	/nfs/dbraw/zinc/32/81/86/176328186.db2.gz	IOFRIBYHHIVQKC-CYBMUJFWSA-N	1	0	276.384	1.595	50	0		CDAARO
COc1ccc(-c2cc(C(=O)N[C@H]3CC[C@H]3[NH3+])[nH]n2)cc1	ZINC000072168780	176332637	/nfs/dbraw/zinc/33/26/37/176332637.db2.gz	DMDJJVDJLFUHOT-NEPJUHHUSA-N	1	0	286.335	1.305	50	0		CDAARO
C[C@@H]1CCCN(C(=O)C2CCSCC2)[C@@H]1C[NH3+]	ZINC000299739875	287328103	/nfs/dbraw/zinc/32/81/03/287328103.db2.gz	SOXPZDJAUARDJX-ZYHUDNBSSA-N	1	0	256.415	1.715	50	0		CDAARO
C[NH+](C)CCNC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000004031968	276762081	/nfs/dbraw/zinc/76/20/81/276762081.db2.gz	TVYSNBCQOJJJLJ-UHFFFAOYSA-N	1	0	250.386	1.881	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)C2=Cc3ccccc3OC2)CC1	ZINC000012976573	277047492	/nfs/dbraw/zinc/04/74/92/277047492.db2.gz	NCCUKBUCWAVNBX-UHFFFAOYSA-N	1	0	272.348	1.627	50	0		CDAARO
CC(C)(C)CN1CCC[C@@](O)(C[NH+]2CCCC2)C1=O	ZINC000015071231	277144088	/nfs/dbraw/zinc/14/40/88/277144088.db2.gz	AEAUGOZHAUSKGR-OAHLLOKOSA-N	1	0	268.401	1.482	50	0		CDAARO
COc1cccc2c1OCCC[N@H+](C[C@@H]1COCCO1)C2	ZINC000244626511	278038941	/nfs/dbraw/zinc/03/89/41/278038941.db2.gz	FNBYYUMCYCAQCZ-CQSZACIVSA-N	1	0	293.363	1.695	50	0		CDAARO
COc1ccnc(N2CC[C@@H]([NH+]3CCCCC3)C2)n1	ZINC000264547587	278066495	/nfs/dbraw/zinc/06/64/95/278066495.db2.gz	CFIJGRDLTQULHD-GFCCVEGCSA-N	1	0	262.357	1.550	50	0		CDAARO
C[C@@H](C(=O)N1CCO[C@@H](C)[C@@H]1C)[C@@H]([NH3+])c1ccccc1	ZINC000248921670	278194405	/nfs/dbraw/zinc/19/44/05/278194405.db2.gz	FFHNTCYWCXUHCO-UKTARXLSSA-N	1	0	276.380	1.958	50	0		CDAARO
C[C@H]([NH2+][C@@H](C)C1CCOCC1)C(=O)NC[C@@H]1CCCO1	ZINC000096492046	278267816	/nfs/dbraw/zinc/26/78/16/278267816.db2.gz	HDPGLGYLVYQNEE-OBJOEFQTSA-N	1	0	284.400	1.075	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H]2C1	ZINC000110714814	280209265	/nfs/dbraw/zinc/20/92/65/280209265.db2.gz	HXMAPJYHAWSQGG-REWJHTLYSA-N	1	0	298.427	1.992	50	0		CDAARO
C[C@@H]1CN(Cc2ccc3c(c2)C[NH2+]CCO3)C[C@H](C)O1	ZINC000299786804	288215018	/nfs/dbraw/zinc/21/50/18/288215018.db2.gz	NTUGLOLAZPTIRR-BETUJISGSA-N	1	0	276.380	1.778	50	0		CDAARO
Cc1cc(F)c(C(=O)N2CC[NH2+]C[C@H]2C)cc1F	ZINC000124343090	280512369	/nfs/dbraw/zinc/51/23/69/280512369.db2.gz	AJNAEPRPGXPSDB-SECBINFHSA-N	1	0	254.280	1.707	50	0		CDAARO
CC(C)c1ccccc1S(=O)(=O)N1CCC[C@H]1C[NH3+]	ZINC000193296779	280645268	/nfs/dbraw/zinc/64/52/68/280645268.db2.gz	XWMJXENGMAIQNI-LBPRGKRZSA-N	1	0	282.409	1.922	50	0		CDAARO
CC[C@]1(C(=O)N[C@@H](C)c2cn(C)nc2C)CCC[NH2+]1	ZINC000184102886	281302790	/nfs/dbraw/zinc/30/27/90/281302790.db2.gz	UBPBFPJBDAWGKB-IINYFYTJSA-N	1	0	264.373	1.438	50	0		CDAARO
CC[C@H]1C[NH2+][C@H](CCO)C[C@@H]1C(=O)OC(C)(C)C	ZINC000066055296	288318529	/nfs/dbraw/zinc/31/85/29/288318529.db2.gz	XHAFNWJVGYDHPM-TUAOUCFPSA-N	1	0	257.374	1.715	50	0		CDAARO
C[NH+](C)CC(=O)N[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1	ZINC000255190370	282059076	/nfs/dbraw/zinc/05/90/76/282059076.db2.gz	WVOPMTLREPZUBO-HAQNSBGRSA-N	1	0	299.415	1.500	50	0		CDAARO
C[NH+](C)CCCN1C(=O)[C@H]2CC[C@@](C)(C1=O)C2(C)C	ZINC000001694695	289115191	/nfs/dbraw/zinc/11/51/91/289115191.db2.gz	YYIRMWWWGWTKMF-ABAIWWIYSA-N	1	0	266.385	1.749	50	0		CDAARO
Cc1ncc(/C=C\C(=O)N2CC[NH2+][C@H](C)C2)s1	ZINC000255165272	289360230	/nfs/dbraw/zinc/36/02/30/289360230.db2.gz	KZUAHERBLIWACD-ZBJFTSOASA-N	1	0	251.355	1.285	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(C(=O)CCC2CCC2)[C@@H](C)C1	ZINC000242038581	290091263	/nfs/dbraw/zinc/09/12/63/290091263.db2.gz	VMGVFZZNWFPMLZ-STQMWFEESA-N	1	0	268.401	1.480	50	0		CDAARO
C[C@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)NC1CCC(C)CC1	ZINC000106846266	290156230	/nfs/dbraw/zinc/15/62/30/290156230.db2.gz	VLFZCQXTAJIYBG-SHWKFHJASA-N	1	0	282.428	1.917	50	0		CDAARO
NC(=O)C[N@@H+]1CC[C@]2(C1)CCCN(C1CCCCC1)C2=O	ZINC000091951643	295047117	/nfs/dbraw/zinc/04/71/17/295047117.db2.gz	XVYSCYNAWPXXRN-INIZCTEOSA-N	1	0	293.411	1.119	50	0		CDAARO
O=C(NCc1csc2c1CCCC2)[C@@H]1C=CC[NH2+]1	ZINC000534642932	328329177	/nfs/dbraw/zinc/32/91/77/328329177.db2.gz	GXJJDMDJLVQPTJ-LBPRGKRZSA-N	1	0	262.378	1.771	50	0		CDAARO
CO[C@H](C(=O)N1C[C@H]2CC[C@@H](C1)[C@H]2[NH3+])c1ccccc1	ZINC000534633588	328332674	/nfs/dbraw/zinc/33/26/74/328332674.db2.gz	QPIBVKURGVKZIQ-YJNKXOJESA-N	1	0	274.364	1.570	50	0		CDAARO
O=C(NCCCc1nc2ccccc2s1)[C@@H]1C=CC[NH2+]1	ZINC000534653606	328338508	/nfs/dbraw/zinc/33/85/08/328338508.db2.gz	ZEGUQUKDYPTHOB-LBPRGKRZSA-N	1	0	287.388	1.873	50	0		CDAARO
Cc1nnc(CN2CCCN(C)C3(CC[NH2+]CC3)C2)s1	ZINC000534650507	328336838	/nfs/dbraw/zinc/33/68/38/328336838.db2.gz	PLKJWZGANNGMCU-UHFFFAOYSA-N	1	0	295.456	1.106	50	0		CDAARO
O=C(NCC[C@H]1CCCC[NH2+]1)[C@H]1CC[C@H](O)CC1	ZINC000534656097	328339861	/nfs/dbraw/zinc/33/98/61/328339861.db2.gz	IVBWGYAYPYGKPP-JHJVBQTASA-N	1	0	254.374	1.186	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+]Cc1cccc2c[nH]nc21	ZINC000097237850	323207873	/nfs/dbraw/zinc/20/78/73/323207873.db2.gz	KWNARLWXGFZGMB-UHFFFAOYSA-N	1	0	261.325	1.852	50	0		CDAARO
COCc1cc(CNC2=[NH+]CCCCN2)ccc1F	ZINC000521396949	326829805	/nfs/dbraw/zinc/82/98/05/326829805.db2.gz	OPEBDECDDRDLAA-UHFFFAOYSA-N	1	0	265.332	1.801	50	0		CDAARO
CCn1cc(C(=O)Nc2ccccc2C[NH2+]C)cn1	ZINC000122623556	329527674	/nfs/dbraw/zinc/52/76/74/329527674.db2.gz	MINJLGDRZAKJOS-UHFFFAOYSA-N	1	0	258.325	1.875	50	0		CDAARO
CCc1nnsc1C(=O)N1CCCC[C@@H]1[C@@H](C)[NH3+]	ZINC000087455701	330373045	/nfs/dbraw/zinc/37/30/45/330373045.db2.gz	TXMLJYFMWXJBQI-PSASIEDQSA-N	1	0	268.386	1.442	50	0		CDAARO
c1cn2nc(N3CCC[C@H]([NH+]4CCCC4)C3)ccc2n1	ZINC000091453495	482567230	/nfs/dbraw/zinc/56/72/30/482567230.db2.gz	ANYYLNHRQGOTFB-ZDUSSCGKSA-N	1	0	271.368	1.794	50	0		CDAARO
CC[N@@H+]1CC[C@@H](CN(C)c2ncc(Cl)cn2)C1	ZINC000670444327	482993162	/nfs/dbraw/zinc/99/31/62/482993162.db2.gz	MMAKTXRWQCIKEB-JTQLQIEISA-N	1	0	254.765	1.908	50	0		CDAARO
CO[C@H]1CC[N@@H+](C2CCN(Cc3ccco3)CC2)C1	ZINC000670453311	483022778	/nfs/dbraw/zinc/02/27/78/483022778.db2.gz	UTNYKCKRUBVDOS-AWEZNQCLSA-N	1	0	264.369	1.965	50	0		CDAARO
COc1ccc2[nH]c(C[N@@H+]3C[C@H](O)[C@@H](OC)C3)c(C)c2c1	ZINC000670470246	483069966	/nfs/dbraw/zinc/06/99/66/483069966.db2.gz	FZGSQLOTGRYSQH-HOTGVXAUSA-N	1	0	290.363	1.676	50	0		CDAARO
Cn1cc([C@H]2OCC[C@H]2C[NH2+]Cc2cscn2)cn1	ZINC000084317609	483272051	/nfs/dbraw/zinc/27/20/51/483272051.db2.gz	GCCSGSNBCQKYOG-GWCFXTLKSA-N	1	0	278.381	1.744	50	0		CDAARO
CCCO[C@H]1CCCN(C(=O)[C@@H]2CC[C@H](C[NH3+])O2)CC1	ZINC000261910008	528608550	/nfs/dbraw/zinc/60/85/50/528608550.db2.gz	XLODXKCOCUXVRW-MJBXVCDLSA-N	1	0	284.400	1.300	50	0		CDAARO
CC[C@@H](Sc1nnc(C[NH3+])n1C)C(=O)NC(C)(C)C	ZINC000426634050	529254589	/nfs/dbraw/zinc/25/45/89/529254589.db2.gz	UCLGRLPDFYOKPO-MRVPVSSYSA-N	1	0	285.417	1.059	50	0		CDAARO
NC(=O)c1ccc(N2CCC([C@@H]3CC[NH2+]C3)CC2)nc1	ZINC000071388823	538427000	/nfs/dbraw/zinc/42/70/00/538427000.db2.gz	ROZJZUAKTMXTTM-GFCCVEGCSA-N	1	0	274.368	1.006	50	0		CDAARO
C[C@H](CNC(=O)c1ccc(NC(=O)C2CC2)s1)[NH+](C)C	ZINC000033093943	570247020	/nfs/dbraw/zinc/24/70/20/570247020.db2.gz	OQKHQXVZYPTTAY-SECBINFHSA-N	1	0	295.408	1.777	50	0		CDAARO
CC[NH+](CC)[C@H](CNC(=O)c1nccn1C)c1ccco1	ZINC000741263603	576548276	/nfs/dbraw/zinc/54/82/76/576548276.db2.gz	LPKKWBNEMSVIIR-GFCCVEGCSA-N	1	0	290.367	1.826	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@H]([NH3+])C2CCCCC2)C1	ZINC000958528896	613973490	/nfs/dbraw/zinc/97/34/90/613973490.db2.gz	YDLJQAIWESJSCG-GFCCVEGCSA-N	1	0	284.400	1.876	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@](O)([C@H]([NH3+])C2CC2)C1	ZINC000958528664	613975613	/nfs/dbraw/zinc/97/56/13/613975613.db2.gz	YNRQQSMQLYYSCJ-BXUZGUMPSA-N	1	0	270.373	1.486	50	0		CDAARO
CC(C)(C)c1cc(C[NH2+]CCN2CCCC[C@H]2CO)[nH]n1	ZINC000952972818	614047715	/nfs/dbraw/zinc/04/77/15/614047715.db2.gz	UTWDJJJCPDMNLM-AWEZNQCLSA-N	1	0	294.443	1.644	50	0		CDAARO
CC(C)[C@H]([NH3+])[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1	ZINC000958528423	614228463	/nfs/dbraw/zinc/22/84/63/614228463.db2.gz	OPCBBJZQVXDNLK-GXFFZTMASA-N	1	0	258.362	1.342	50	0		CDAARO
C[N@H+](Cc1cc[nH]n1)[C@@H]1CCC(=O)N(CC2CC2)CC1	ZINC000952983576	616165739	/nfs/dbraw/zinc/16/57/39/616165739.db2.gz	VWPZNLYNKMQRKO-CQSZACIVSA-N	1	0	276.384	1.633	50	0		CDAARO
Cc1c(CNC(=O)[C@H]2CCN(c3cc[nH+]cc3)C2)cnn1C	ZINC000888098056	617759619	/nfs/dbraw/zinc/75/96/19/617759619.db2.gz	BDCQROHZROUYDG-ZDUSSCGKSA-N	1	0	299.378	1.266	50	0		CDAARO
O=C(NCC[C@@H]1CCCCO1)[C@H]1[NH2+]CC12CCCC2	ZINC000888101496	617765084	/nfs/dbraw/zinc/76/50/84/617765084.db2.gz	CSBCTDAKKGAHOK-QWHCGFSZSA-N	1	0	266.385	1.594	50	0		CDAARO
Cc1ccc2c(C(=O)N[C@H]3CCC[N@@H+]4CCC[C@@H]34)cnn2c1	ZINC001772705410	1159439735	/nfs/dbraw/zinc/43/97/35/1159439735.db2.gz	WZTQIOPZXGXWDY-HOCLYGCPSA-N	1	0	298.390	1.999	50	0		CDAARO
CC(C)C[NH+]1CCC(CNc2nnc(CN)o2)CC1	ZINC001772705010	1159440007	/nfs/dbraw/zinc/44/00/07/1159440007.db2.gz	JVCNTPHLQDMNOT-UHFFFAOYSA-N	1	0	267.377	1.308	50	0		CDAARO
CCc1nccc(C[N@H+](C)[C@H]2C[C@H]3CNC(=O)C[C@H]3C2)n1	ZINC001704298511	1177678950	/nfs/dbraw/zinc/67/89/50/1177678950.db2.gz	ILLBUXZPKAICBJ-MBNYWOFBSA-N	1	0	288.395	1.386	50	0		CDAARO
CC[C@@]1(O)CCC[C@@H]2C[N@H+](Cc3nccn3C)C[C@@H]21	ZINC001704343467	1177695706	/nfs/dbraw/zinc/69/57/06/1177695706.db2.gz	HRVXQARWKQOFLK-VNHYZAJKSA-N	1	0	263.385	1.793	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N2CCC[C@@H](O)C2)c1C	ZINC000032519453	912721761	/nfs/dbraw/zinc/72/17/61/912721761.db2.gz	YGBLQPCDHGFEOO-LLVKDONJSA-N	1	0	250.346	1.121	50	0		CDAARO
Cc1cc(NCc2ccc3nsnc3c2)nc(N)[nH+]1	ZINC000032598159	913008611	/nfs/dbraw/zinc/00/86/11/913008611.db2.gz	DMXKMMYWEZSERL-UHFFFAOYSA-N	1	0	272.337	1.984	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1CC(=O)NCCCc1ncc[nH]1	ZINC000426361901	902489971	/nfs/dbraw/zinc/48/99/71/902489971.db2.gz	GNFXICMVKXHDIO-LBPRGKRZSA-N	1	0	264.373	1.333	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CC(=O)NCCCc1ncc[nH]1	ZINC000426361900	902490024	/nfs/dbraw/zinc/49/00/24/902490024.db2.gz	GNFXICMVKXHDIO-GFCCVEGCSA-N	1	0	264.373	1.333	50	0		CDAARO
O=C1N[C@H]2CCC[C@@H]1C[N@H+](CCCc1cccnc1)C2	ZINC000252509077	902551451	/nfs/dbraw/zinc/55/14/51/902551451.db2.gz	YCCHOJWSIIDPOO-CABCVRRESA-N	1	0	273.380	1.615	50	0		CDAARO
CC(C)(C(=O)N1CC(c2ccncc2)C1)[NH+]1CCCC1	ZINC000426746064	903046800	/nfs/dbraw/zinc/04/68/00/903046800.db2.gz	HWAUZYSSHXLNOM-UHFFFAOYSA-N	1	0	273.380	1.882	50	0		CDAARO
CN(CC1=CCCOC1)C(=O)NC[C@H]1[NH2+]CCCC1(C)C	ZINC000952852446	910407939	/nfs/dbraw/zinc/40/79/39/910407939.db2.gz	WHAFCIQZOCZVRT-CQSZACIVSA-N	1	0	295.427	1.753	50	0		CDAARO
C[C@@H]1CC[NH2+][C@H](C)[C@@H]1NC(=O)Cc1cccc(O)c1	ZINC000387947186	936640777	/nfs/dbraw/zinc/64/07/77/936640777.db2.gz	ALZIEVRDPMWTDR-UEKVPHQBSA-N	1	0	262.353	1.437	50	0		CDAARO
C/C=C/C[N@@H+]1CCC[C@@H](CNC(=O)CCn2cnnc2)C1	ZINC000820394976	925522362	/nfs/dbraw/zinc/52/23/62/925522362.db2.gz	PGKNBIKMWYSBNN-HSWBROFVSA-N	1	0	291.399	1.073	50	0		CDAARO
CCC1(C[NH2+][C@H](C)CNS(=O)(=O)C2CC2)CCC1	ZINC000822681481	925645350	/nfs/dbraw/zinc/64/53/50/925645350.db2.gz	MBIGKAXZLIONJU-LLVKDONJSA-N	1	0	274.430	1.627	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@H](C(=O)NCCC2(O)CCCC2)C1	ZINC000827733344	925961895	/nfs/dbraw/zinc/96/18/95/925961895.db2.gz	WXTAJQXKUAKIHL-AWEZNQCLSA-N	1	0	282.428	1.918	50	0		CDAARO
O=C(CCn1cnnc1)Nc1cccc(C[NH+]2CCCC2)c1	ZINC000828065464	926029997	/nfs/dbraw/zinc/02/99/97/926029997.db2.gz	FTGPOHUZUWAZGA-UHFFFAOYSA-N	1	0	299.378	1.903	50	0		CDAARO
OC[C@@H]1CCC[N@H+](CCNc2nccc3cccnc32)C1	ZINC000828711090	926168843	/nfs/dbraw/zinc/16/88/43/926168843.db2.gz	DEPIFKKRTBUUGB-CYBMUJFWSA-N	1	0	286.379	1.746	50	0		CDAARO
CON(C)CC[NH2+]Cc1ccnn1-c1ccc(F)cc1	ZINC000585118350	930979105	/nfs/dbraw/zinc/97/91/05/930979105.db2.gz	LKDDTPJVZXKYML-UHFFFAOYSA-N	1	0	278.331	1.594	50	0		CDAARO
Cc1noc([C@H]2C[N@@H+](C[C@@H]3CCCOCC3)CCN2C)n1	ZINC000585117580	930984738	/nfs/dbraw/zinc/98/47/38/930984738.db2.gz	MADCIYZAVFVIPT-ZIAGYGMSSA-N	1	0	294.399	1.483	50	0		CDAARO
O=C(C[C@@H](O)c1cccc(F)c1)NC[C@@H]1CCC[NH2+]1	ZINC000864092209	934606863	/nfs/dbraw/zinc/60/68/63/934606863.db2.gz	NFDSXKWCNRHJLN-QWHCGFSZSA-N	1	0	266.316	1.117	50	0		CDAARO
C[C@@H](CCc1ccccc1)[NH2+]CCN1CCOCC1	ZINC000019954126	935725442	/nfs/dbraw/zinc/72/54/42/935725442.db2.gz	FVXIKYAOFZNMHI-HNNXBMFYSA-N	1	0	262.397	1.930	50	0		CDAARO
Cc1cnc(NCC[N@@H+](C)C(C)C)nc1N(C)C	ZINC001529151797	968995039	/nfs/dbraw/zinc/99/50/39/968995039.db2.gz	MQIIBKPHKHMUTB-UHFFFAOYSA-N	1	0	251.378	1.603	50	0		CDAARO
CCc1cc(N2CCSCC2)nc(N2CCOCC2)[nH+]1	ZINC001529192497	969010321	/nfs/dbraw/zinc/01/03/21/969010321.db2.gz	WHQNPZCVZXWOMZ-UHFFFAOYSA-N	1	0	294.424	1.429	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)c1cc(NCCO)ncn1	ZINC001506400855	975150446	/nfs/dbraw/zinc/15/04/46/975150446.db2.gz	PJGRFBDXQNBXGJ-UHFFFAOYSA-N	1	0	293.415	1.191	50	0		CDAARO
COc1c(C)cnc(CN2C[C@@H]3CC[C@H](CC2=O)[NH2+]3)c1C	ZINC000095516505	185002052	/nfs/dbraw/zinc/00/20/52/185002052.db2.gz	DVFNZGLENOBGQY-OLZOCXBDSA-N	1	0	289.379	1.560	50	0		CDAARO
CCn1ncnc1[C@@H](C)NC(=O)C1CC[NH+](C(C)C)CC1	ZINC000095527639	185004808	/nfs/dbraw/zinc/00/48/08/185004808.db2.gz	PITAWFVBKFLTOJ-GFCCVEGCSA-N	1	0	293.415	1.596	50	0		CDAARO
CCn1ccc(CN2CC3(CC2=O)CC[NH+](C)CC3)n1	ZINC000095530733	185005227	/nfs/dbraw/zinc/00/52/27/185005227.db2.gz	XRVPEURMHPWRSV-UHFFFAOYSA-N	1	0	276.384	1.347	50	0		CDAARO
Cc1cnn(-c2ccc(C(=O)N3CC[NH2+]C[C@H]3C)cc2)c1	ZINC000124645918	187147006	/nfs/dbraw/zinc/14/70/06/187147006.db2.gz	BFJSWKPGENKZFC-CYBMUJFWSA-N	1	0	284.363	1.615	50	0		CDAARO
Cc1cc(C)n(CCC(=O)N[C@@H]2CC[N@@H+]3CCCC[C@H]23)n1	ZINC000095949387	185039363	/nfs/dbraw/zinc/03/93/63/185039363.db2.gz	VLKVGEYKTIZUIV-HUUCEWRRSA-N	1	0	290.411	1.633	50	0		CDAARO
C[C@@H](CC(=O)N1CCCCCC1)[NH2+][C@H]1CCCCNC1=O	ZINC000095967270	185046871	/nfs/dbraw/zinc/04/68/71/185046871.db2.gz	GXAJYDHZPVDVKV-KBPBESRZSA-N	1	0	295.427	1.426	50	0		CDAARO
CSc1ccc([C@H](C)[NH2+]C(CO)CO)cc1F	ZINC000095968597	185047737	/nfs/dbraw/zinc/04/77/37/185047737.db2.gz	YFXUMANEWRQYDC-QMMMGPOBSA-N	1	0	259.346	1.551	50	0		CDAARO
COc1ccccc1[C@H]1CCN(C(=O)CCC[NH3+])C1	ZINC000095971144	185048721	/nfs/dbraw/zinc/04/87/21/185048721.db2.gz	XRDSOGAHHAXBNS-LBPRGKRZSA-N	1	0	262.353	1.750	50	0		CDAARO
CCC[NH+]1CCC(NC[C@H](O)c2ccncc2)CC1	ZINC000095985131	185055702	/nfs/dbraw/zinc/05/57/02/185055702.db2.gz	MXUPRHXCXXCALZ-HNNXBMFYSA-N	1	0	263.385	1.579	50	0		CDAARO
Cc1cc(CCNC(=O)[C@@H]2CCC[NH2+]2)ccc1F	ZINC000095996573	185061039	/nfs/dbraw/zinc/06/10/39/185061039.db2.gz	YHHWSBXTOLEVJM-ZDUSSCGKSA-N	1	0	250.317	1.545	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@H](CN(C)c2nccc(N)n2)C1	ZINC000096141248	185106655	/nfs/dbraw/zinc/10/66/55/185106655.db2.gz	LUUFDGUMBHYSLK-GFCCVEGCSA-N	1	0	263.389	1.615	50	0		CDAARO
C[C@H](CNC(=O)N1[C@@H](C)CCC[C@@H]1C)N1CC[NH+](C)CC1	ZINC000092323885	539087911	/nfs/dbraw/zinc/08/79/11/539087911.db2.gz	OLAJWULWJPWSRV-SOUVJXGZSA-N	1	0	296.459	1.595	50	0		CDAARO
COC[C@@H]([NH2+]CC(=O)N1CCCCC1)c1ccccc1	ZINC000097033212	185155888	/nfs/dbraw/zinc/15/58/88/185155888.db2.gz	FNRWFWPRGCLFJB-OAHLLOKOSA-N	1	0	276.380	1.976	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@H]2CCC[C@H]2CO)cc1	ZINC000097034945	185157176	/nfs/dbraw/zinc/15/71/76/185157176.db2.gz	PYKUSLZVULZWMW-KBPBESRZSA-N	1	0	263.337	1.724	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+](CCOC(C)=O)C1	ZINC000585141415	342219265	/nfs/dbraw/zinc/21/92/65/342219265.db2.gz	VLVVWKCIDAIAKJ-JSGCOSHPSA-N	1	0	284.400	1.566	50	0		CDAARO
C[C@H]1C[C@@H](NCc2ccc3[nH]c(=O)[nH]c3c2)CC[N@@H+]1C	ZINC000585139878	342218610	/nfs/dbraw/zinc/21/86/10/342218610.db2.gz	GXSHNWUNOQWPRM-JQWIXIFHSA-N	1	0	274.368	1.841	50	0		CDAARO
NC(=O)[C@@H]1CC[N@H+](C[C@H]2C[C@@H]2c2ccc(F)cc2)C1	ZINC000585140651	342218690	/nfs/dbraw/zinc/21/86/90/342218690.db2.gz	HXAPIPIDIYPYEL-YRGRVCCFSA-N	1	0	262.328	1.736	50	0		CDAARO
COc1ccc2nc(C(=O)N3CC[NH2+]C[C@@H]3C)ccc2c1	ZINC000125568179	187191307	/nfs/dbraw/zinc/19/13/07/187191307.db2.gz	IFSDIMUQELVTFC-NSHDSACASA-N	1	0	285.347	1.677	50	0		CDAARO
COc1ccc(Cl)cc1CC(=O)N1CC[NH2+]C[C@@H]1C	ZINC000126193252	187223026	/nfs/dbraw/zinc/22/30/26/187223026.db2.gz	ZUCSPJIXYBCJNE-JTQLQIEISA-N	1	0	282.771	1.711	50	0		CDAARO
Cn1cccc1C(=O)N1CC[N@H+](C)[C@H](C(C)(C)C)C1	ZINC000585130647	362055361	/nfs/dbraw/zinc/05/53/61/362055361.db2.gz	XMGJQNJPZRJNOT-ZDUSSCGKSA-N	1	0	263.385	1.827	50	0		CDAARO
Cc1c(CNC(=O)[C@@H]2CC[N@@H+]2C2CCCC2)cnn1C	ZINC000585132243	362057334	/nfs/dbraw/zinc/05/73/34/362057334.db2.gz	RBOMXDWTRNPVFD-AWEZNQCLSA-N	1	0	276.384	1.362	50	0		CDAARO
C[C@H](O)C[C@H](C)CNC(=O)[C@H](C)[NH+]1CCCCCC1	ZINC000110652164	342432549	/nfs/dbraw/zinc/43/25/49/342432549.db2.gz	UCPWUTNGQFGRQB-IHRRRGAJSA-N	1	0	270.417	1.774	50	0		CDAARO
COc1cccc(/C(C)=C/C(=O)N2CC[C@H](C[NH3+])C2)c1	ZINC000178564360	362246952	/nfs/dbraw/zinc/24/69/52/362246952.db2.gz	HQMCXAKDXGOQTC-YQCJOKCJSA-N	1	0	274.364	1.906	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)c2ccc(OCC3CC3)cc2)C1	ZINC000178546042	362247264	/nfs/dbraw/zinc/24/72/64/362247264.db2.gz	BJZMOVOPVZHKGI-CYBMUJFWSA-N	1	0	274.364	1.896	50	0		CDAARO
COc1ncc(-c2cc(C)no2)c([C@@H]2CCC[NH2+]C2)n1	ZINC000095629436	343654505	/nfs/dbraw/zinc/65/45/05/343654505.db2.gz	VUZWSDBNAQNONL-SNVBAGLBSA-N	1	0	274.324	1.916	50	0		CDAARO
COc1cccc(Cl)c1C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179116565	362252733	/nfs/dbraw/zinc/25/27/33/362252733.db2.gz	UGDWSLONUKGEJH-SECBINFHSA-N	1	0	268.744	1.783	50	0		CDAARO
Cc1cccnc1NC(=O)N[C@H]1CC[N@@H+](C2CC2)C1	ZINC000049029543	345596310	/nfs/dbraw/zinc/59/63/10/345596310.db2.gz	KYELXJWOTKYGQE-NSHDSACASA-N	1	0	260.341	1.748	50	0		CDAARO
CCS(=O)(=O)Nc1ccc(C)cc1OCC[NH+](C)C	ZINC000097164227	185554167	/nfs/dbraw/zinc/55/41/67/185554167.db2.gz	CEDOTXSUTSBECF-UHFFFAOYSA-N	1	0	286.397	1.697	50	0		CDAARO
C[C@@H](O)CNC(=O)N[C@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000192438543	362625049	/nfs/dbraw/zinc/62/50/49/362625049.db2.gz	SDZWKYFUBQUEHT-HIFRSBDPSA-N	1	0	291.395	1.331	50	0		CDAARO
Cc1ccc(Cl)c(O[C@@H](C)C(=O)N[C@@H]2CC[NH2+]C2)c1	ZINC000127553647	187314801	/nfs/dbraw/zinc/31/48/01/187314801.db2.gz	DMKJWGPVLUJZNC-WDEREUQCSA-N	1	0	282.771	1.894	50	0		CDAARO
Cc1cccc(OCCN(C)C(=O)[C@@H]2CCC[C@H]2[NH3+])c1	ZINC000085368784	179038750	/nfs/dbraw/zinc/03/87/50/179038750.db2.gz	CWFWINFXTVDBBD-HUUCEWRRSA-N	1	0	276.380	1.960	50	0		CDAARO
CC[NH+](CC)CCN1C(=O)[C@H]2CC=C(Cl)C[C@@H]2C1=O	ZINC000100677010	185722081	/nfs/dbraw/zinc/72/20/81/185722081.db2.gz	ZHKYUMGEZLEDND-RYUDHWBXSA-N	1	0	284.787	1.846	50	0		CDAARO
CC(=O)N1CCC([NH2+]Cc2ccccc2-n2cccn2)CC1	ZINC000128931337	187399532	/nfs/dbraw/zinc/39/95/32/187399532.db2.gz	WNEOCAUWBVNMPF-UHFFFAOYSA-N	1	0	298.390	1.973	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CCC[C@@H]2C[NH3+])cc1F	ZINC000089091767	179699511	/nfs/dbraw/zinc/69/95/11/179699511.db2.gz	BJEIJVRQPLEWIP-ZWNOBZJWSA-N	1	0	286.372	1.540	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(F)(F)CC[C@@H]1C[NH3+]	ZINC000107271499	349340584	/nfs/dbraw/zinc/34/05/84/349340584.db2.gz	MUTWMGXYRJTIHT-MRVPVSSYSA-N	1	0	250.289	1.980	50	0		CDAARO
Cc1ncc(C(=O)N(C)CC[N@H+](C)C2CCCC2)c(=O)[nH]1	ZINC000584884704	349342544	/nfs/dbraw/zinc/34/25/44/349342544.db2.gz	AMYNAZGQKOGUPJ-UHFFFAOYSA-N	1	0	292.383	1.437	50	0		CDAARO
C[NH+](C)C1CCN(C(=O)c2cccc3c2CCC3=O)CC1	ZINC000584885892	349344022	/nfs/dbraw/zinc/34/40/22/349344022.db2.gz	RSYWWKLDMNEPBQ-UHFFFAOYSA-N	1	0	286.375	1.982	50	0		CDAARO
Cc1cc(C)n(CCCC(=O)N(C)C[C@H]2CC[N@H+](C)C2)n1	ZINC000584890836	349349906	/nfs/dbraw/zinc/34/99/06/349349906.db2.gz	RWKDGVIOFKBNFN-HNNXBMFYSA-N	1	0	292.427	1.690	50	0		CDAARO
COCC[N@@H+]1CC[C@H](C(=O)N2CCC3(CCCC3)C2)C1	ZINC000584891323	349350491	/nfs/dbraw/zinc/35/04/91/349350491.db2.gz	MCALXDFCDFLZOS-AWEZNQCLSA-N	1	0	280.412	1.747	50	0		CDAARO
CC(C)n1cnnc1CCNC(=O)[C@@H](C)C[NH+]1CCCC1	ZINC000584894060	349353981	/nfs/dbraw/zinc/35/39/81/349353981.db2.gz	GCUVRXAOMLIUNF-ZDUSSCGKSA-N	1	0	293.415	1.250	50	0		CDAARO
Cc1cc(=O)cc(C(=O)NC[C@@H](C(C)C)[NH+]2CCCC2)o1	ZINC000584894862	349355039	/nfs/dbraw/zinc/35/50/39/349355039.db2.gz	VWQIDAOJSVBFDQ-AWEZNQCLSA-N	1	0	292.379	1.798	50	0		CDAARO
CC[N@@H+]1CC[C@H](C(=O)N2CCC(CCCOC)CC2)C1	ZINC000584897538	349359182	/nfs/dbraw/zinc/35/91/82/349359182.db2.gz	YDORDUVRSVBKNH-HNNXBMFYSA-N	1	0	282.428	1.993	50	0		CDAARO
C[C@@H](NC(=O)CN(C)C1CC[NH2+]CC1)c1ccsc1	ZINC000584900147	349362315	/nfs/dbraw/zinc/36/23/15/349362315.db2.gz	UFRNXKMYSGNUFS-LLVKDONJSA-N	1	0	281.425	1.609	50	0		CDAARO
Nc1nc(NCCN2CCCOC2=O)c2c([nH+]1)CCCC2	ZINC000091451994	180158904	/nfs/dbraw/zinc/15/89/04/180158904.db2.gz	MYLXBTBUCGQEJO-UHFFFAOYSA-N	1	0	291.355	1.192	50	0		CDAARO
CCCN(C(=O)c1ccncc1Cl)[C@H]1CC[NH2+]C1	ZINC000091456949	180160378	/nfs/dbraw/zinc/16/03/78/180160378.db2.gz	CEGSYUSEYXLSKL-JTQLQIEISA-N	1	0	267.760	1.949	50	0		CDAARO
COCC[C@@]1(CO)CCC[N@H+](CCCSC)C1	ZINC000091693748	180229073	/nfs/dbraw/zinc/22/90/73/180229073.db2.gz	NPPXAGXXIYTYLM-ZDUSSCGKSA-N	1	0	261.431	1.851	50	0		CDAARO
Cc1cc(F)ccc1C[NH2+]C[C@H]1CN(C)CCO1	ZINC000105470865	186059733	/nfs/dbraw/zinc/05/97/33/186059733.db2.gz	ZEOXQFBITNPGOP-AWEZNQCLSA-N	1	0	252.333	1.554	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@@H]2CSc3ccccc32)C1	ZINC000092239250	180351194	/nfs/dbraw/zinc/35/11/94/180351194.db2.gz	WCVFTYSWBRFJRF-CMPLNLGQSA-N	1	0	262.378	1.683	50	0		CDAARO
COC(=O)C[C@H]1CCCC[N@@H+]1Cc1cc(C(N)=O)cs1	ZINC000092378760	180372025	/nfs/dbraw/zinc/37/20/25/180372025.db2.gz	NZQPULGHDJVNOA-LLVKDONJSA-N	1	0	296.392	1.765	50	0		CDAARO
C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC(=O)N(C)CCO	ZINC000108475492	186219158	/nfs/dbraw/zinc/21/91/58/186219158.db2.gz	INYQCPPIBGEEFN-DZGCQCFKSA-N	1	0	291.395	1.141	50	0		CDAARO
CS[C@@H]1CCC[C@H]1[N@H+](C)CCC(=O)N1CCOCC1	ZINC000110642563	186308683	/nfs/dbraw/zinc/30/86/83/186308683.db2.gz	OOCBMNKWPYPHHR-CHWSQXEVSA-N	1	0	286.441	1.451	50	0		CDAARO
O=S(=O)(NCC[C@@H]1CC[NH2+]C1)c1ccccc1F	ZINC000110796854	186325842	/nfs/dbraw/zinc/32/58/42/186325842.db2.gz	QKYXRKLSXWVABO-JTQLQIEISA-N	1	0	272.345	1.104	50	0		CDAARO
CC[N@H+]1C[C@H](NS(=O)(=O)c2ccccc2F)[C@@H](C)C1	ZINC000257365993	350964390	/nfs/dbraw/zinc/96/43/90/350964390.db2.gz	FKMHBESVYOFGRT-JQWIXIFHSA-N	1	0	286.372	1.444	50	0		CDAARO
C[C@@H]([NH2+]CC1(O)CCCCC1)C(=O)NC1CCCC1	ZINC000065396480	363030967	/nfs/dbraw/zinc/03/09/67/363030967.db2.gz	PDLKFNXGGAGPKL-GFCCVEGCSA-N	1	0	268.401	1.719	50	0		CDAARO
CC[NH+](CC)CCn1c(=O)[nH]c2ccccc2c1=O	ZINC000000139946	355890767	/nfs/dbraw/zinc/89/07/67/355890767.db2.gz	FLZPQDCVOQGGKZ-UHFFFAOYSA-N	1	0	261.325	1.032	50	0		CDAARO
CCc1cccc(OCCOCC[NH2+]CCO)c1	ZINC000003002208	355991168	/nfs/dbraw/zinc/99/11/68/355991168.db2.gz	FMHFOTPBFLXABQ-UHFFFAOYSA-N	1	0	253.342	1.226	50	0		CDAARO
CC(C)(C)OC(=O)N[C@@H](CCC[NH3+])C(=O)OC(C)(C)C	ZINC000002244291	355964605	/nfs/dbraw/zinc/96/46/05/355964605.db2.gz	XXIQPSQYSBWVII-JTQLQIEISA-N	1	0	288.388	1.960	50	0		CDAARO
CCCC[NH2+]C[C@@H](O)Cn1c2ccccc2sc1=O	ZINC000002496772	355971599	/nfs/dbraw/zinc/97/15/99/355971599.db2.gz	SXYOVIRNAGZSOM-LLVKDONJSA-N	1	0	280.393	1.814	50	0		CDAARO
COc1ccccc1C/C(C)=C\C(=O)N1CC[C@@H]([NH3+])C1	ZINC000255171154	356005539	/nfs/dbraw/zinc/00/55/39/356005539.db2.gz	WBSXXBXSWBGVMB-GAJOTYCWSA-N	1	0	274.364	1.744	50	0		CDAARO
COc1cccc([C@@H](O)C2CC[NH2+]CC2)c1OC	ZINC000004234522	356022699	/nfs/dbraw/zinc/02/26/99/356022699.db2.gz	LZRHDSQWBVFQMC-ZDUSSCGKSA-N	1	0	251.326	1.737	50	0		CDAARO
COc1ccc(Cl)cc1C[NH2+]CCOCCO	ZINC000010436227	356258636	/nfs/dbraw/zinc/25/86/36/356258636.db2.gz	YFLCSAOCFQXOER-UHFFFAOYSA-N	1	0	259.733	1.447	50	0		CDAARO
COC(=O)Cc1ccc(OC[C@H]2CCC[NH2+]C2)cc1	ZINC000014631279	356392716	/nfs/dbraw/zinc/39/27/16/356392716.db2.gz	MNHZADWRPWBFLV-ZDUSSCGKSA-N	1	0	263.337	1.781	50	0		CDAARO
O=C1C[C@H]([NH2+]CC2CC2)CN1Cc1ccc(F)cc1	ZINC000015062784	356404823	/nfs/dbraw/zinc/40/48/23/356404823.db2.gz	OCUINCZMXHGMLC-AWEZNQCLSA-N	1	0	262.328	1.926	50	0		CDAARO
Cc1cc(OCCOCCN2CC[NH2+]CC2)ccc1Cl	ZINC000020117998	356526340	/nfs/dbraw/zinc/52/63/40/356526340.db2.gz	ONCFQAYOFBTUHK-UHFFFAOYSA-N	1	0	298.814	1.949	50	0		CDAARO
COc1ccc2c(C[N@@H+]3CCC[C@H](O)C3)cc(=O)oc2c1	ZINC000023991926	356650521	/nfs/dbraw/zinc/65/05/21/356650521.db2.gz	SVVKXXSSYOLLDU-LBPRGKRZSA-N	1	0	289.331	1.758	50	0		CDAARO
C[C@@H](NC(=O)c1ccc(-n2ccnc2)nc1)C1CC1	ZINC000025595398	356679016	/nfs/dbraw/zinc/67/90/16/356679016.db2.gz	RRYJMFSTNLBAHR-SNVBAGLBSA-N	1	0	256.309	1.796	50	0		CDAARO
CC1CC[NH+](CCOc2ccc(S(N)(=O)=O)cc2)CC1	ZINC000027344043	356707082	/nfs/dbraw/zinc/70/70/82/356707082.db2.gz	CVPRLCLSNHUGDG-UHFFFAOYSA-N	1	0	298.408	1.445	50	0		CDAARO
Cc1ccccc1C[N@H+](C)CCN1C(=O)NC(C)(C)C1=O	ZINC000028081400	356717654	/nfs/dbraw/zinc/71/76/54/356717654.db2.gz	OWGAAJLYYCNOGP-UHFFFAOYSA-N	1	0	289.379	1.757	50	0		CDAARO
O=C(CC[NH+]1CCCC1)NC[C@@H]1OCCc2ccccc21	ZINC000000118778	356812619	/nfs/dbraw/zinc/81/26/19/356812619.db2.gz	DHEYIFFLMGXFGD-INIZCTEOSA-N	1	0	288.391	1.903	50	0		CDAARO
NC(=O)C1CC[NH+]([C@H]2CCc3ccccc3C2)CC1	ZINC000003683479	356815798	/nfs/dbraw/zinc/81/57/98/356815798.db2.gz	TZZDIBHBQBPEDS-HNNXBMFYSA-N	1	0	258.365	1.741	50	0		CDAARO
C[NH+]1CCC(O)(CNC(=O)[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC000080891153	357021034	/nfs/dbraw/zinc/02/10/34/357021034.db2.gz	BKYRGVRSCMYZEU-LSDHHAIUSA-N	1	0	288.391	1.363	50	0		CDAARO
CCCC[N@@H+]1CCC[C@@H](Cn2cc(CCO)nn2)C1	ZINC000048234016	357175584	/nfs/dbraw/zinc/17/55/84/357175584.db2.gz	OKEQZHQQEODURX-CYBMUJFWSA-N	1	0	266.389	1.325	50	0		CDAARO
O=C(NC[C@@H]1CCC[NH2+]1)c1cc(Cl)c(Cl)[nH]1	ZINC000053253179	357286358	/nfs/dbraw/zinc/28/63/58/357286358.db2.gz	PMWSITGJTCDSPD-LURJTMIESA-N	1	0	262.140	1.803	50	0		CDAARO
O=C1NCCN1C1CC[NH+](Cc2ccccc2)CC1	ZINC000052214949	357269692	/nfs/dbraw/zinc/26/96/92/357269692.db2.gz	JSGWSNDIQYWPTH-UHFFFAOYSA-N	1	0	259.353	1.676	50	0		CDAARO
COc1ccc(OCC[NH2+]CC(C)(C)CO)cc1	ZINC000065384296	357534115	/nfs/dbraw/zinc/53/41/15/357534115.db2.gz	JEESBKVRIRFGRN-UHFFFAOYSA-N	1	0	253.342	1.682	50	0		CDAARO
COCC(=O)N1CCCN(C/C(C)=C/c2ccco2)CC1	ZINC000065490672	357544660	/nfs/dbraw/zinc/54/46/60/357544660.db2.gz	LATNFWCRAAKCAK-SDNWHVSQSA-N	1	0	292.379	1.864	50	0		CDAARO
CC(C)[C@@H](Cn1ccnc1)NC(=O)c1ccc(=O)n(C)c1	ZINC000065491553	357544884	/nfs/dbraw/zinc/54/48/84/357544884.db2.gz	NXKNOLHDWNSZMH-CYBMUJFWSA-N	1	0	288.351	1.036	50	0		CDAARO
CCSc1nc(CC(=O)N[C@@H]2CC[C@@H]([NH3+])C2)cs1	ZINC000067755331	357624739	/nfs/dbraw/zinc/62/47/39/357624739.db2.gz	YDFQNWFXANFJEK-RKDXNWHRSA-N	1	0	285.438	1.794	50	0		CDAARO
Cc1ncsc1CCC(=O)N(C)CC[N@H+](C)C1CC1	ZINC000298816772	357601963	/nfs/dbraw/zinc/60/19/63/357601963.db2.gz	ATWFHJDEYNFMEZ-UHFFFAOYSA-N	1	0	281.425	1.937	50	0		CDAARO
COCC(=O)NC[C@H]1CC[N@H+](Cc2cc(C)ccc2C)C1	ZINC000067697432	357619009	/nfs/dbraw/zinc/61/90/09/357619009.db2.gz	JJEXBNTYDUPUMD-OAHLLOKOSA-N	1	0	290.407	1.888	50	0		CDAARO
COc1cccc(-c2nc(CN(C)C)no2)c1OC	ZINC000067727207	357621113	/nfs/dbraw/zinc/62/11/13/357621113.db2.gz	XXOBDMMXXZMKIW-UHFFFAOYSA-N	1	0	263.297	1.815	50	0		CDAARO
CC[C@H](C)OCC(=O)N(C)[C@H]1CC[N@H+](CC)C[C@@H]1C	ZINC000095433842	357648469	/nfs/dbraw/zinc/64/84/69/357648469.db2.gz	PZEIRGNHXSZMQJ-IHRRRGAJSA-N	1	0	270.417	1.990	50	0		CDAARO
C[C@@H]1CN(C(=O)COc2ccc(F)c(Cl)c2)CC[NH2+]1	ZINC000188418507	357663235	/nfs/dbraw/zinc/66/32/35/357663235.db2.gz	GGHDZHSZTLUSHX-SECBINFHSA-N	1	0	286.734	1.678	50	0		CDAARO
[NH3+]CC(=O)N1CCc2onc(-c3ccccc3F)c2C1	ZINC000067867781	357634127	/nfs/dbraw/zinc/63/41/27/357634127.db2.gz	PWEGIDQUMDCAJN-UHFFFAOYSA-N	1	0	275.283	1.324	50	0		CDAARO
Cn1ncc2c1CCC[C@@H]2NC(=O)C[C@@H]1CSCC[NH2+]1	ZINC000091135233	357709217	/nfs/dbraw/zinc/70/92/17/357709217.db2.gz	ZCEBYVVGTFDTTN-PWSUYJOCSA-N	1	0	294.424	1.009	50	0		CDAARO
CC(C)OCCCn1ccnc1-c1cc2n(n1)CC[NH2+]C2	ZINC000072436324	357835627	/nfs/dbraw/zinc/83/56/27/357835627.db2.gz	TVLGJUQUKHWTNE-UHFFFAOYSA-N	1	0	289.383	1.665	50	0		CDAARO
CN1C[C@]2(CC[N@H+](Cc3cccc4nonc43)C2)OC1=O	ZINC000072478721	357838133	/nfs/dbraw/zinc/83/81/33/357838133.db2.gz	JFFKWNZBPFVCDL-AWEZNQCLSA-N	1	0	288.307	1.249	50	0		CDAARO
NC(=O)[C@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1F	ZINC000097113849	357982800	/nfs/dbraw/zinc/98/28/00/357982800.db2.gz	QPQSDZYZTPNSQW-AAEUAGOBSA-N	1	0	250.317	1.959	50	0		CDAARO
COc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2C(N)=O)cc1	ZINC000097113860	357982807	/nfs/dbraw/zinc/98/28/07/357982807.db2.gz	OULPPPPNOYNOFP-UONOGXRCSA-N	1	0	262.353	1.829	50	0		CDAARO
COC(=O)C1(NCC[NH+]2CCCCC2)CCCC1	ZINC000097230460	358048984	/nfs/dbraw/zinc/04/89/84/358048984.db2.gz	FLPIIILPNLGQDV-UHFFFAOYSA-N	1	0	254.374	1.548	50	0		CDAARO
CCOC(=O)c1ccc(CN2CC[NH+](C)CC2)cn1	ZINC000080943377	358109363	/nfs/dbraw/zinc/10/93/63/358109363.db2.gz	CWQIPXOVFSXMFR-UHFFFAOYSA-N	1	0	263.341	1.006	50	0		CDAARO
C[NH+](C)[C@H]1CCCCN(C(=O)CCCn2cncn2)C1	ZINC000082097868	358147067	/nfs/dbraw/zinc/14/70/67/358147067.db2.gz	WXTFWHNQGSAVFC-ZDUSSCGKSA-N	1	0	279.388	1.001	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C[C@H](O)c1ccc(F)cc1	ZINC000097159520	358187295	/nfs/dbraw/zinc/18/72/95/358187295.db2.gz	ALEALCCKQCAEBK-AWEZNQCLSA-N	1	0	263.316	1.989	50	0		CDAARO
CN(C)[C@H](C(=O)NCC[NH+]1CCCC1)c1cccc(F)c1	ZINC000095354259	358683973	/nfs/dbraw/zinc/68/39/73/358683973.db2.gz	WJCQBAQRZFLVBX-HNNXBMFYSA-N	1	0	293.386	1.640	50	0		CDAARO
c1nc(CN2C[C@H]3CC[C@@H]2C[N@H+](Cc2cccnc2)C3)c[nH]1	ZINC000095359428	358684642	/nfs/dbraw/zinc/68/46/42/358684642.db2.gz	GURRVXUWSHCFDY-DOTOQJQBSA-N	1	0	297.406	1.901	50	0		CDAARO
C/C=C/CC(=O)N1CC[N@H+](C)[C@@]2(C1)CCC(=O)N(C)CC2	ZINC000095379124	358689787	/nfs/dbraw/zinc/68/97/87/358689787.db2.gz	FEJZNGQUSGDAKO-APHBUQMISA-N	1	0	293.411	1.108	50	0		CDAARO
CCN(Cc1cnn(C)c1)C(=O)C1CC[NH+](C(C)C)CC1	ZINC000095382132	358690353	/nfs/dbraw/zinc/69/03/53/358690353.db2.gz	PHVDBJQLAIDNRL-UHFFFAOYSA-N	1	0	292.427	1.889	50	0		CDAARO
Cc1nc(C(=O)NCC[C@H]2CCC[N@H+]2C)c(C)s1	ZINC000097553214	358785204	/nfs/dbraw/zinc/78/52/04/358785204.db2.gz	XEHYSTAGOFWNEF-LLVKDONJSA-N	1	0	267.398	1.974	50	0		CDAARO
C[N@@H+]1CCOC[C@H](CNC(=O)c2ccc(Cl)cc2O)C1	ZINC000215586846	358895374	/nfs/dbraw/zinc/89/53/74/358895374.db2.gz	CYPGRPFJDVPCHW-SNVBAGLBSA-N	1	0	298.770	1.354	50	0		CDAARO
CCCNc1ncc(CN(C)Cc2cnn(C)c2)cn1	ZINC000216062647	358921198	/nfs/dbraw/zinc/92/11/98/358921198.db2.gz	HEQFKZLCGMJWJQ-UHFFFAOYSA-N	1	0	274.372	1.664	50	0		CDAARO
Cc1cc(NC(=O)NCC[NH+]2CCCCC2)ccn1	ZINC000119662122	358945168	/nfs/dbraw/zinc/94/51/68/358945168.db2.gz	CNOORTUECSNZRO-UHFFFAOYSA-N	1	0	262.357	1.997	50	0		CDAARO
COc1cc2c(cc1CNC(=O)C[C@@H]1CC[NH2+]C1)CCC2	ZINC000216485483	358947532	/nfs/dbraw/zinc/94/75/32/358947532.db2.gz	ATYWOCKLVXZYIN-LBPRGKRZSA-N	1	0	288.391	1.800	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)Cc1ccccc1OC	ZINC000220434533	359173702	/nfs/dbraw/zinc/17/37/02/359173702.db2.gz	UOUGGMBEYADCDI-ZFWWWQNUSA-N	1	0	292.379	1.073	50	0		CDAARO
C[NH+](C)[C@@H]1CN(C(=O)c2cccs2)CC[C@@H]1CO	ZINC000257179787	359175240	/nfs/dbraw/zinc/17/52/40/359175240.db2.gz	JLVLYTYTKAOFGU-GHMZBOCLSA-N	1	0	268.382	1.133	50	0		CDAARO
CC[C@@H](CNC(=O)c1cccc(C(N)=O)c1)[NH+]1CCCC1	ZINC000032661247	359227291	/nfs/dbraw/zinc/22/72/91/359227291.db2.gz	BPEDUOPMXQGLOX-AWEZNQCLSA-N	1	0	289.379	1.390	50	0		CDAARO
CC[N@@H+]1CCC[C@H](NS(=O)(=O)c2ccc(N)cc2)C1	ZINC000048505740	359208639	/nfs/dbraw/zinc/20/86/39/359208639.db2.gz	DGLWZXSBTXMOOG-LBPRGKRZSA-N	1	0	283.397	1.031	50	0		CDAARO
COCCCC[N@@H+]1CC[C@H](CN2CCOCC2)C1	ZINC000089410226	359265292	/nfs/dbraw/zinc/26/52/92/359265292.db2.gz	LNQNPMDZJBRGRL-AWEZNQCLSA-N	1	0	256.390	1.067	50	0		CDAARO
NC(=O)CCC1CC[NH+](C[C@H]2CCCOC2)CC1	ZINC000347938759	359708404	/nfs/dbraw/zinc/70/84/04/359708404.db2.gz	AEPFNQSRQSRTIP-CYBMUJFWSA-N	1	0	254.374	1.391	50	0		CDAARO
OCC[C@H]1CSCC[N@@H+]1CCO[C@@H]1CCCCO1	ZINC000408514853	359904637	/nfs/dbraw/zinc/90/46/37/359904637.db2.gz	MWMBXNBOYZLUKN-QWHCGFSZSA-N	1	0	275.414	1.329	50	0		CDAARO
COc1cc(C)ccc1OCCC(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000521394616	359966705	/nfs/dbraw/zinc/96/67/05/359966705.db2.gz	MBHUTRAHQDYAQA-CYBMUJFWSA-N	1	0	292.379	1.593	50	0		CDAARO
CC1=CCC[C@H](C)[C@H]1C[N@@H+]1CCN2C(=O)NC[C@H]2C1	ZINC000249043851	360117772	/nfs/dbraw/zinc/11/77/72/360117772.db2.gz	DVCHTSDRHWOKMQ-IHRRRGAJSA-N	1	0	263.385	1.688	50	0		CDAARO
C[C@H](O)CN1CC[N@H+](CC2(O)CCCCC2)C[C@H]1C	ZINC000248287963	360481595	/nfs/dbraw/zinc/48/15/95/360481595.db2.gz	HFLFXXDKFZNQQM-KGLIPLIRSA-N	1	0	270.417	1.069	50	0		CDAARO
Cc1nc([C@@H]2CCOC2)cc(N(C)CC[NH+](C)C)n1	ZINC000426489413	360570580	/nfs/dbraw/zinc/57/05/80/360570580.db2.gz	VBABLXWKZZNNRO-GFCCVEGCSA-N	1	0	264.373	1.287	50	0		CDAARO
COc1cc(F)ccc1CNC(=O)[C@@H](C)[NH+](C)C	ZINC000426425233	360670003	/nfs/dbraw/zinc/67/00/03/360670003.db2.gz	LKABUNOBCDMSQD-SECBINFHSA-N	1	0	254.305	1.401	50	0		CDAARO
CCn1ccc(CN2CC[NH+](C3CCSCC3)CC2)n1	ZINC000244858480	361053097	/nfs/dbraw/zinc/05/30/97/361053097.db2.gz	VLZHIXMSQVNJIW-UHFFFAOYSA-N	1	0	294.468	1.916	50	0		CDAARO
C[C@H]([NH2+]C[C@H]1COC2(CCOCC2)O1)C(C)(C)C	ZINC000095991795	299320663	/nfs/dbraw/zinc/32/06/63/299320663.db2.gz	CVKNKIWCGDMUNL-RYUDHWBXSA-N	1	0	257.374	1.933	50	0		CDAARO
Cc1ccc(C[NH2+]C2CCN(S(C)(=O)=O)CC2)cc1	ZINC000030656275	364000846	/nfs/dbraw/zinc/00/08/46/364000846.db2.gz	FEJXDRCABGYTBT-UHFFFAOYSA-N	1	0	282.409	1.509	50	0		CDAARO
CN1C[C@H](C[NH+]2CCN(c3ccccc3)CC2)CC1=O	ZINC000618255942	364035546	/nfs/dbraw/zinc/03/55/46/364035546.db2.gz	LDIYOFZTYBDJBL-CQSZACIVSA-N	1	0	273.380	1.287	50	0		CDAARO
COc1ccc(C[NH2+]CCN2CCOCC2)cc1F	ZINC000036923682	364038255	/nfs/dbraw/zinc/03/82/55/364038255.db2.gz	PLAVMHHDIVINRB-UHFFFAOYSA-N	1	0	268.332	1.256	50	0		CDAARO
C[C@H]1CN(C(=O)NC2CC[NH+](C3CC3)CC2)CC(C)(C)O1	ZINC000065689712	364179231	/nfs/dbraw/zinc/17/92/31/364179231.db2.gz	HSMKCTNPAFBIBO-LBPRGKRZSA-N	1	0	295.427	1.822	50	0		CDAARO
Cc1cccc(C)c1OCC(=O)N(C)[C@H]1CC[NH2+]C1	ZINC000179120426	364979568	/nfs/dbraw/zinc/97/95/68/364979568.db2.gz	UKTWITWEXLCGFL-ZDUSSCGKSA-N	1	0	262.353	1.503	50	0		CDAARO
CC(C)CCC1CC[NH+](CCS(N)(=O)=O)CC1	ZINC000089821145	366941018	/nfs/dbraw/zinc/94/10/18/366941018.db2.gz	UXVVFIVJKRYIAU-UHFFFAOYSA-N	1	0	262.419	1.423	50	0		CDAARO
COc1ccc(CN(C)C(=O)C[C@@H]2CC[NH2+]C2)cc1F	ZINC000089743384	366925282	/nfs/dbraw/zinc/92/52/82/366925282.db2.gz	HGYDKGPHVLMDPV-NSHDSACASA-N	1	0	280.343	1.792	50	0		CDAARO
CCCC(=O)NC[C@@H]1CCC[N@@H+]([C@@H]2CCCC[C@@H]2O)C1	ZINC000089892424	366958321	/nfs/dbraw/zinc/95/83/21/366958321.db2.gz	XBULBUGNXGBABS-ZNMIVQPWSA-N	1	0	282.428	1.918	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@H]1[NH2+][C@@H](C)C(=O)NCC(C)C	ZINC000089948643	366976402	/nfs/dbraw/zinc/97/64/02/366976402.db2.gz	VMLJGRRQELUCBT-NWANDNLSSA-N	1	0	297.443	1.384	50	0		CDAARO
C[NH+]1CCC(C(=O)NC[C@](C)(O)C2CCCCC2)CC1	ZINC000252494806	367640924	/nfs/dbraw/zinc/64/09/24/367640924.db2.gz	OFLABKCVLITNCM-INIZCTEOSA-N	1	0	282.428	1.776	50	0		CDAARO
C[C@H]1OCC[C@@H]1[N@H+](CCO)CCSC(C)(C)C	ZINC000252493988	367641259	/nfs/dbraw/zinc/64/12/59/367641259.db2.gz	NIAQGSIKTZYRIL-NEPJUHHUSA-N	1	0	261.431	1.990	50	0		CDAARO
O=C(C[C@@H]1C=CCC1)N1CC[NH+]([C@H]2CCC[C@H]2O)CC1	ZINC000252507105	367652188	/nfs/dbraw/zinc/65/21/88/367652188.db2.gz	YJBVQZBEMNUPMY-QLFBSQMISA-N	1	0	278.396	1.400	50	0		CDAARO
Cc1c[nH+]c(C)n1CCNC(=O)CCc1c(C)noc1C	ZINC000575554465	369118045	/nfs/dbraw/zinc/11/80/45/369118045.db2.gz	DOTKGNQQBKEACY-UHFFFAOYSA-N	1	0	290.367	1.854	50	0		CDAARO
COC1(c2nc(CC(F)(F)F)no2)CC[NH2+]CC1	ZINC000225747394	189763704	/nfs/dbraw/zinc/76/37/04/189763704.db2.gz	AVCUTTRNEDBHDQ-UHFFFAOYSA-N	1	0	265.235	1.400	50	0		CDAARO
CCOCCC(=O)N[C@H](C)C[N@@H+]1CCc2ccccc2C1	ZINC000299768514	372750882	/nfs/dbraw/zinc/75/08/82/372750882.db2.gz	JWLMAYXXKPSLQI-CQSZACIVSA-N	1	0	290.407	1.976	50	0		CDAARO
Cc1cn2cccc(C(=O)NCC[C@H]3CCC[N@H+]3C)c2n1	ZINC000299780810	372756608	/nfs/dbraw/zinc/75/66/08/372756608.db2.gz	CTTCISCEPMOBGE-CYBMUJFWSA-N	1	0	286.379	1.857	50	0		CDAARO
COc1cc(NC(=O)N2CCC[C@H]([NH3+])C2)ccc1C	ZINC000299797811	372768745	/nfs/dbraw/zinc/76/87/45/372768745.db2.gz	OKNHEMSPXISPDU-NSHDSACASA-N	1	0	263.341	1.959	50	0		CDAARO
COC1(CC(=O)NCC2CC[NH+](C)CC2)CCC1	ZINC000240744099	189902975	/nfs/dbraw/zinc/90/29/75/189902975.db2.gz	HUMBBKQMJDZLAP-UHFFFAOYSA-N	1	0	254.374	1.404	50	0		CDAARO
O=C(CCC(F)(F)F)NCC[N@H+]1CCCC[C@@H]1CO	ZINC000670448715	483003341	/nfs/dbraw/zinc/00/33/41/483003341.db2.gz	MMAPWEWBRVOSPD-SNVBAGLBSA-N	1	0	282.306	1.292	50	0		CDAARO
CCC1=NO[C@H](C[NH+]2CCC(c3nncn3C)CC2)C1	ZINC000244840353	189913359	/nfs/dbraw/zinc/91/33/59/189913359.db2.gz	ULIWMYYMKFDXGL-ZDUSSCGKSA-N	1	0	277.372	1.549	50	0		CDAARO
CC[NH+](CC)CCNS(=O)(=O)c1ccc(C)cc1	ZINC000001734098	373337467	/nfs/dbraw/zinc/33/74/67/373337467.db2.gz	UDVZDSBQHHMVLW-UHFFFAOYSA-N	1	0	270.398	1.615	50	0		CDAARO
Cc1ccc(Nc2ccc(N3CC[NH2+]CC3)nn2)nc1	ZINC000206580329	374177457	/nfs/dbraw/zinc/17/74/57/374177457.db2.gz	HLHBWHJEWQQFDV-UHFFFAOYSA-N	1	0	270.340	1.333	50	0		CDAARO
COC(=O)CCC[N@@H+]1C[C@@H](O)C[C@@H]1C1CCCCC1	ZINC000095397897	374902554	/nfs/dbraw/zinc/90/25/54/374902554.db2.gz	LHOMIELMWPRDIO-UONOGXRCSA-N	1	0	269.385	1.955	50	0		CDAARO
COCCOc1ccc(C[NH2+][C@H]2C[C@@H](C)N(C)C2)cn1	ZINC000095420407	374923723	/nfs/dbraw/zinc/92/37/23/374923723.db2.gz	MEFLVUJUMLGTMG-OCCSQVGLSA-N	1	0	279.384	1.289	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1CCSCCS(C)(=O)=O	ZINC000095442172	374942711	/nfs/dbraw/zinc/94/27/11/374942711.db2.gz	LWCUJHKZYNNWRQ-SNVBAGLBSA-N	1	0	251.417	1.249	50	0		CDAARO
C[N@H+](CCNC(=O)N[C@@H](c1nccs1)C1CC1)C1CC1	ZINC000095405328	374909011	/nfs/dbraw/zinc/90/90/11/374909011.db2.gz	LLBQYCHLKXGTQD-GFCCVEGCSA-N	1	0	294.424	1.988	50	0		CDAARO
Cc1ncc2c(c1-c1noc([C@@H]3CCCN3C)n1)CC[NH2+]C2	ZINC000020868452	375011844	/nfs/dbraw/zinc/01/18/44/375011844.db2.gz	AVXJNUVYLYHELF-ZDUSSCGKSA-N	1	0	299.378	1.852	50	0		CDAARO
CCOc1ccccc1N1CC[NH+]([C@@H](C)[C@@H](C)O)CC1	ZINC000095964815	375042430	/nfs/dbraw/zinc/04/24/30/375042430.db2.gz	VGSSTNKXKXDXKU-UONOGXRCSA-N	1	0	278.396	1.977	50	0		CDAARO
CCCC[N@H+](C)CCNC(=O)N1CCOCC[C@H]1C	ZINC000095984080	375048475	/nfs/dbraw/zinc/04/84/75/375048475.db2.gz	BYNNUOIBEJPVQI-CYBMUJFWSA-N	1	0	271.405	1.539	50	0		CDAARO
O=C(CC[NH2+][C@@H]1CCCSC1)NCc1cccnc1	ZINC000097084509	375147133	/nfs/dbraw/zinc/14/71/33/375147133.db2.gz	LOHFIJMDOGKZMG-CYBMUJFWSA-N	1	0	279.409	1.573	50	0		CDAARO
CCC[C@H]([NH3+])C(=O)N1CCC[C@@H]1CN1C[C@H](C)O[C@@H](C)C1	ZINC000299740098	375200282	/nfs/dbraw/zinc/20/02/82/375200282.db2.gz	VQNUWUXIESAUJJ-XQLPTFJDSA-N	1	0	297.443	1.214	50	0		CDAARO
COc1ccccc1COC[C@@H](O)C[NH2+]C(C)(C)C	ZINC000002660993	375292018	/nfs/dbraw/zinc/29/20/18/375292018.db2.gz	JZKDASLHLVIEAD-ZDUSSCGKSA-N	1	0	267.369	1.961	50	0		CDAARO
O=C(CCc1ccsc1)NCC[C@H]1CC[NH2+]C1	ZINC000253433243	189992707	/nfs/dbraw/zinc/99/27/07/189992707.db2.gz	UKGRRRHJTBEJLD-LLVKDONJSA-N	1	0	252.383	1.797	50	0		CDAARO
COc1cccc(NC(=O)NCCC[NH+](C)C)c1	ZINC000002853514	375349426	/nfs/dbraw/zinc/34/94/26/375349426.db2.gz	ONHVLFROQJGQFF-UHFFFAOYSA-N	1	0	251.330	1.768	50	0		CDAARO
COC1CC[NH+](CC(=O)N2C[C@@H](C)C[C@H](C)C2)CC1	ZINC000053906862	375727501	/nfs/dbraw/zinc/72/75/01/375727501.db2.gz	IAWWWIKHPZCYJN-STQMWFEESA-N	1	0	268.401	1.602	50	0		CDAARO
CCc1ccccc1CN1CCN2CC[N@H+](C)C[C@H]2C1	ZINC000244608496	376033273	/nfs/dbraw/zinc/03/32/73/376033273.db2.gz	FDTNRLBSAMFAKK-KRWDZBQOSA-N	1	0	273.424	1.681	50	0		CDAARO
COc1ccccc1CNC(=O)C[NH2+]C[C@@H]1CCCO1	ZINC000004166678	377102240	/nfs/dbraw/zinc/10/22/40/377102240.db2.gz	NJNPCSBEIRIBRZ-ZDUSSCGKSA-N	1	0	278.352	1.080	50	0		CDAARO
COc1ccc(-c2ccc(NC(=O)C[NH3+])c(F)c2)cn1	ZINC000067740315	377235975	/nfs/dbraw/zinc/23/59/75/377235975.db2.gz	MGLFSDVPGAYGTM-UHFFFAOYSA-N	1	0	275.283	1.794	50	0		CDAARO
CCc1nsc(N[C@H]2CCC[N@H+](CCOC)C2)n1	ZINC000089295669	377813310	/nfs/dbraw/zinc/81/33/10/377813310.db2.gz	URYQWJGAEOWGMJ-JTQLQIEISA-N	1	0	270.402	1.623	50	0		CDAARO
OCCO[C@@H]1CCC[N@@H+]([C@H]2Cc3ccccc3[C@H]2O)C1	ZINC000245652377	378809624	/nfs/dbraw/zinc/80/96/24/378809624.db2.gz	HUNUDVAKSCQCDI-VNQPRFMTSA-N	1	0	277.364	1.118	50	0		CDAARO
Cn1nnnc1-c1cc(O)cc(CC[C@H]2CCCC[NH2+]2)c1	ZINC000071767519	379632983	/nfs/dbraw/zinc/63/29/83/379632983.db2.gz	HMAJALFUPRBBDI-CYBMUJFWSA-N	1	0	287.367	1.657	50	0		CDAARO
CCN(CCC[NH+]1CCCC1)C(=O)[C@H]1CCCN1C(C)=O	ZINC000239654427	284894646	/nfs/dbraw/zinc/89/46/46/284894646.db2.gz	BNKBLUPZIMKSAR-OAHLLOKOSA-N	1	0	295.427	1.332	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCCN1C(=O)c1ccnc(C2CC2)n1	ZINC000408519106	532981250	/nfs/dbraw/zinc/98/12/50/532981250.db2.gz	LJWJSOSXNMJTPQ-MFKMUULPSA-N	1	0	274.368	1.696	50	0		CDAARO
COC[C@@H](O)C[N@H+](C)[C@@H](C)Cc1ccc(C)cc1	ZINC000096415703	256789330	/nfs/dbraw/zinc/78/93/30/256789330.db2.gz	XMNJLMSLUYLLLZ-ZFWWWQNUSA-N	1	0	251.370	1.865	50	0		CDAARO
O[C@@H]1CN(Cc2cscn2)CC[C@H]1[NH2+]C1CCCC1	ZINC000426477986	285329327	/nfs/dbraw/zinc/32/93/27/285329327.db2.gz	JMCFWBLUDPPYGQ-ZIAGYGMSSA-N	1	0	281.425	1.611	50	0		CDAARO
Cc1cc(S(=O)(=O)NC(C)(C)C[NH3+])cnc1Cl	ZINC000095432018	184981860	/nfs/dbraw/zinc/98/18/60/184981860.db2.gz	SZXUCULZLPDZAG-UHFFFAOYSA-N	1	0	277.777	1.059	50	0		CDAARO
[NH3+]CCN1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000022913374	390240857	/nfs/dbraw/zinc/24/08/57/390240857.db2.gz	RGRQJSPXZNQDSL-UHFFFAOYSA-N	1	0	274.290	1.181	50	0		CDAARO
Cc1cc(N2CC[C@H](C[NH+]3CCOCC3)C2)nc(C)n1	ZINC000096429721	390516445	/nfs/dbraw/zinc/51/64/45/390516445.db2.gz	ARNQRIJCOPLCFS-CQSZACIVSA-N	1	0	276.384	1.252	50	0		CDAARO
c1cc2c(c(C[NH2+]CCCN3CCOCC3)c1)OCO2	ZINC000036168141	390618918	/nfs/dbraw/zinc/61/89/18/390618918.db2.gz	BTTPGYCAPDRDIE-UHFFFAOYSA-N	1	0	278.352	1.227	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@@H](CN(C)C(=O)c2csnc2N)C1	ZINC000299785047	391721605	/nfs/dbraw/zinc/72/16/05/391721605.db2.gz	LSXVNFWSVHZQKS-NSHDSACASA-N	1	0	296.440	1.775	50	0		CDAARO
C[C@H]1CCN(S(C)(=O)=O)CC[N@@H+]1Cc1ccccc1	ZINC000098014183	391819563	/nfs/dbraw/zinc/81/95/63/391819563.db2.gz	RJZFTPCRSHCZAQ-ZDUSSCGKSA-N	1	0	282.409	1.542	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CCc2cc(F)ccc2[C@H]1C	ZINC000245312373	391979657	/nfs/dbraw/zinc/97/96/57/391979657.db2.gz	ITYQGQXFTMSJIG-ZWNOBZJWSA-N	1	0	253.317	1.752	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)N2CCO[C@H](c3nccs3)C2)C1	ZINC000262626357	131244268	/nfs/dbraw/zinc/24/42/68/131244268.db2.gz	BTIYFBZHFMGJIJ-AXFHLTTASA-N	1	0	281.381	1.170	50	0		CDAARO
COC[C@H](C)[NH2+]Cc1ccccc1CN1CCCC1=O	ZINC000065419642	392882372	/nfs/dbraw/zinc/88/23/72/392882372.db2.gz	KNYUJFXRRMXMSN-ZDUSSCGKSA-N	1	0	276.380	1.934	50	0		CDAARO
Cc1cc2c(cc1C)O[C@H](C(=O)N[C@H]1CCC[C@H]1C[NH3+])C2	ZINC000262653839	292006622	/nfs/dbraw/zinc/00/66/22/292006622.db2.gz	ZCYHQIDXLDANKW-NOLJZWGESA-N	1	0	288.391	1.851	50	0		CDAARO
C1CC1N1CC[C@@H]([NH2+][C@H]2CCC[C@H]3OCC[C@H]32)C1	ZINC000095423806	393148393	/nfs/dbraw/zinc/14/83/93/393148393.db2.gz	DDKVDDDJKINLNF-UQOMUDLDSA-N	1	0	250.386	1.770	50	0		CDAARO
CSCC[N@H+](C)Cc1cnc(N2CCN(C)CC2)nc1	ZINC000093509566	135080794	/nfs/dbraw/zinc/08/07/94/135080794.db2.gz	YTSPNZNSOMCGKY-UHFFFAOYSA-N	1	0	295.456	1.023	50	0		CDAARO
C[C@H](NC(=O)N1CC[C@@H](C[NH+](C)C)C1)c1ccco1	ZINC000097101596	397966868	/nfs/dbraw/zinc/96/68/68/397966868.db2.gz	CBYLHNZOQCEATP-RYUDHWBXSA-N	1	0	265.357	1.934	50	0		CDAARO
COc1ccsc1C(=O)N1CCCC[C@H]1C[NH3+]	ZINC000128860393	286529134	/nfs/dbraw/zinc/52/91/34/286529134.db2.gz	CUZGYHNHUIPFNQ-VIFPVBQESA-N	1	0	254.355	1.710	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@H]1[NH2+][C@@H](C)C(=O)NC(C)(C)C	ZINC000089948631	287179721	/nfs/dbraw/zinc/17/97/21/287179721.db2.gz	MELUQDGOIMVLSN-IACUBPJLSA-N	1	0	297.443	1.526	50	0		CDAARO
CC(C)(C)OC(=O)N[C@@H](CC[NH3+])C(=O)OC(C)(C)C	ZINC000002392269	169790606	/nfs/dbraw/zinc/79/06/06/169790606.db2.gz	VTAQKRDOQHUEKC-VIFPVBQESA-N	1	0	274.361	1.570	50	0		CDAARO
COc1cc(OC)cc(C(=O)NC[C@H](C)C[NH+](C)C)c1	ZINC000002415050	169791171	/nfs/dbraw/zinc/79/11/71/169791171.db2.gz	BHYZOVAOCFFGTK-NSHDSACASA-N	1	0	280.368	1.631	50	0		CDAARO
CC[NH+](CC)CCCNC(=S)NC(=O)c1ccco1	ZINC000003258361	169873194	/nfs/dbraw/zinc/87/31/94/169873194.db2.gz	QCNZRUMKTSSLMB-UHFFFAOYSA-N	1	0	283.397	1.616	50	0		CDAARO
CC[C@@H](Oc1ccccc1)C(=O)NCC[NH+](C)C	ZINC000004811132	170021128	/nfs/dbraw/zinc/02/11/28/170021128.db2.gz	ZOTYRHYLZMBPCQ-CYBMUJFWSA-N	1	0	250.342	1.522	50	0		CDAARO
O=c1[nH]c2ccccc2c(=O)n1CC[NH+]1CCCCC1	ZINC000005117504	170067986	/nfs/dbraw/zinc/06/79/86/170067986.db2.gz	VOGKOHCHPHYURZ-UHFFFAOYSA-N	1	0	273.336	1.176	50	0		CDAARO
O=S(=O)(N[C@H]1CCC[NH2+]C1)c1cccc2cnccc21	ZINC000006745131	170238961	/nfs/dbraw/zinc/23/89/61/170238961.db2.gz	UACRIYVXOGJYRG-LBPRGKRZSA-N	1	0	291.376	1.265	50	0		CDAARO
C[NH+](C)CCNC(=O)c1cc2ccccc2cc1O	ZINC000008575948	170341279	/nfs/dbraw/zinc/34/12/79/170341279.db2.gz	PTYBNDTVHWXPPT-UHFFFAOYSA-N	1	0	258.321	1.837	50	0		CDAARO
O=C1C[C@H]([NH2+]CC2CC2)CN1CCc1ccc(F)cc1	ZINC000011816798	170443617	/nfs/dbraw/zinc/44/36/17/170443617.db2.gz	UOEFWZZVTXYLSA-HNNXBMFYSA-N	1	0	276.355	1.969	50	0		CDAARO
c1ccc(Cc2noc(CCCN3CC[NH2+]CC3)n2)cc1	ZINC000020282414	171132847	/nfs/dbraw/zinc/13/28/47/171132847.db2.gz	MSDNQAUZBVRGFD-UHFFFAOYSA-N	1	0	286.379	1.498	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNS(=O)(=O)c1cccc(N)c1	ZINC000020284717	171133517	/nfs/dbraw/zinc/13/35/17/171133517.db2.gz	WPGZGXDBDJDQQY-LBPRGKRZSA-N	1	0	283.397	1.031	50	0		CDAARO
CC[NH+]1CCN(Cc2cc(OC)ccc2OC)CC1	ZINC000022454586	171388412	/nfs/dbraw/zinc/38/84/12/171388412.db2.gz	QZCFWPPWVPOPFK-UHFFFAOYSA-N	1	0	264.369	1.841	50	0		CDAARO
Cc1cccc(OC[C@@H](O)CN2CC[NH+](C)CC2)c1C	ZINC000022467384	171388847	/nfs/dbraw/zinc/38/88/47/171388847.db2.gz	NQNHKGNRUYUGQN-HNNXBMFYSA-N	1	0	278.396	1.291	50	0		CDAARO
C[NH+]1CCC(NCc2cc3ccccc3[nH]c2=O)CC1	ZINC000037267004	173077865	/nfs/dbraw/zinc/07/78/65/173077865.db2.gz	RCSCNCAWZRPGDF-UHFFFAOYSA-N	1	0	271.364	1.712	50	0		CDAARO
O=S(=O)(NC[C@H]1CCC[NH2+]C1)c1cc(F)ccc1F	ZINC000037377315	173166300	/nfs/dbraw/zinc/16/63/00/173166300.db2.gz	NOLINZNXEXIYQF-VIFPVBQESA-N	1	0	290.335	1.243	50	0		CDAARO
CCCN(C(=O)c1cccc(OC)c1)[C@H]1CC[NH2+]C1	ZINC000037540144	173262065	/nfs/dbraw/zinc/26/20/65/173262065.db2.gz	JGFYDMSDKXDBRY-ZDUSSCGKSA-N	1	0	262.353	1.909	50	0		CDAARO
c1ccc(-n2nnnc2SCC2CC[NH2+]CC2)cc1	ZINC000043498114	175058177	/nfs/dbraw/zinc/05/81/77/175058177.db2.gz	RRIUCJIGJVGXBO-UHFFFAOYSA-N	1	0	275.381	1.754	50	0		CDAARO
O=C([C@@H]1C[NH2+]CCO1)N(Cc1ccsc1)C1CC1	ZINC000043800424	175106053	/nfs/dbraw/zinc/10/60/53/175106053.db2.gz	CCGXBDRGIPQFGR-LBPRGKRZSA-N	1	0	266.366	1.228	50	0		CDAARO
Cc1n[nH]c(C)c1CC[N@@H+]1CCC[C@@H](N2CCCC2=O)C1	ZINC000071764062	176261924	/nfs/dbraw/zinc/26/19/24/176261924.db2.gz	QXHCNWIPXOMPBP-CQSZACIVSA-N	1	0	290.411	1.656	50	0		CDAARO
O=C(C[C@H]1COCC[NH2+]1)Nc1cccc2c1CCCC2	ZINC000072152205	176327436	/nfs/dbraw/zinc/32/74/36/176327436.db2.gz	NYMWAGOWUHBKBR-ZDUSSCGKSA-N	1	0	274.364	1.882	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)c2cnn3ccccc23)CC1	ZINC000072161718	176329787	/nfs/dbraw/zinc/32/97/87/176329787.db2.gz	FEHWUHBKYKWUHS-NSHDSACASA-N	1	0	258.325	1.288	50	0		CDAARO
COCc1cc(CN2CC[C@H]3C[NH2+]C[C@H]32)ccc1OC	ZINC000077354394	177256472	/nfs/dbraw/zinc/25/64/72/177256472.db2.gz	JKQPVAIJEWGYTQ-DZGCQCFKSA-N	1	0	276.380	1.635	50	0		CDAARO
COc1cccc2ccc(N[C@@H]3CC[NH2+]C[C@H]3O)nc21	ZINC000077423968	177265651	/nfs/dbraw/zinc/26/56/51/177265651.db2.gz	YQQBTTUQWHDINI-VXGBXAGGSA-N	1	0	273.336	1.378	50	0		CDAARO
Cn1cnnc1C[NH2+][C@H](CCO)C1CCCCC1	ZINC000097138160	424631103	/nfs/dbraw/zinc/63/11/03/424631103.db2.gz	NVGHBEIVILTNMJ-GFCCVEGCSA-N	1	0	252.362	1.236	50	0		CDAARO
Cc1cc2c(cc1C)O[C@H](C(=O)NC1(C)CC[NH2+]CC1)C2	ZINC000193364004	267299114	/nfs/dbraw/zinc/29/91/14/267299114.db2.gz	ZMFIELCJVBOOAF-HNNXBMFYSA-N	1	0	288.391	1.865	50	0		CDAARO
CCS(=O)(=O)c1ccc(N2CCC[NH2+]CC2)cc1	ZINC000015443184	276393608	/nfs/dbraw/zinc/39/36/08/276393608.db2.gz	GCPZYZWMDCFEGX-UHFFFAOYSA-N	1	0	268.382	1.280	50	0		CDAARO
CC[C@@H]1CN(C(=O)C2CC2)CC[C@H]1[NH2+]Cc1nccn1C	ZINC000089949193	276477036	/nfs/dbraw/zinc/47/70/36/276477036.db2.gz	SUGJNMPXUHWHHN-TZMCWYRMSA-N	1	0	290.411	1.547	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1Cn1c(=O)cnc2ccccc21	ZINC000095385129	277045405	/nfs/dbraw/zinc/04/54/05/277045405.db2.gz	SIDUAHDJXPNJNS-GFCCVEGCSA-N	1	0	257.337	1.881	50	0		CDAARO
CN1CCC[N@H+](CCC(=O)NC2CCCCCC2)CC1	ZINC000065397217	277051465	/nfs/dbraw/zinc/05/14/65/277051465.db2.gz	PCBYNQCNNJPQFJ-UHFFFAOYSA-N	1	0	281.444	1.853	50	0		CDAARO
CC(C)=CC(=O)N1CC[NH+]([C@H]2CCSC2)CC1	ZINC000087488119	277322254	/nfs/dbraw/zinc/32/22/54/277322254.db2.gz	VQZNWNFTNKDFGY-LBPRGKRZSA-N	1	0	254.399	1.602	50	0		CDAARO
CC(C)NC(=O)NC(=O)[C@H](C)[NH+]1CCCCCC1	ZINC000008119236	277656593	/nfs/dbraw/zinc/65/65/93/277656593.db2.gz	UUJALNIKRYOYSB-NSHDSACASA-N	1	0	255.362	1.485	50	0		CDAARO
C[C@@H](CCO)[NH+]1CCC2(CC1)Nc1ccccc1NC2=O	ZINC000082133570	278234405	/nfs/dbraw/zinc/23/44/05/278234405.db2.gz	OGZZBEKQQOHULD-LBPRGKRZSA-N	1	0	289.379	1.656	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccc(C[NH3+])o2)CC(C)(C)O1	ZINC000094571082	288029764	/nfs/dbraw/zinc/02/97/64/288029764.db2.gz	CNYCSARHMCBPOH-SECBINFHSA-N	1	0	252.314	1.378	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@H]([NH2+]C2COC2)C1	ZINC000071792051	278394163	/nfs/dbraw/zinc/39/41/63/278394163.db2.gz	MVRZYWPCHJFVKP-JTQLQIEISA-N	1	0	256.346	1.374	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN([C@@H](C[NH3+])C(F)(F)F)CC1	ZINC000159832608	278399911	/nfs/dbraw/zinc/39/99/11/278399911.db2.gz	ZORBXJGFWLAHBD-VIFPVBQESA-N	1	0	297.321	1.429	50	0		CDAARO
CC[N@H+](CC(=O)N1CCCC[C@H]1c1nc[nH]n1)C1CC1	ZINC000096494453	279049982	/nfs/dbraw/zinc/04/99/82/279049982.db2.gz	ATRVYFOJZRBGPX-LBPRGKRZSA-N	1	0	277.372	1.343	50	0		CDAARO
OCc1ccc(C[NH2+]C[C@H]2CCCn3ccnc32)o1	ZINC000084436748	279248591	/nfs/dbraw/zinc/24/85/91/279248591.db2.gz	MMCZJTTYHNCDDX-LLVKDONJSA-N	1	0	261.325	1.636	50	0		CDAARO
CC[C@@H](CNC(=O)Nc1nncs1)[NH+]1CCCC1	ZINC000089943425	280143267	/nfs/dbraw/zinc/14/32/67/280143267.db2.gz	DMWNXNJVCSUKSK-VIFPVBQESA-N	1	0	269.374	1.534	50	0		CDAARO
Cc1ccc(Cl)cc1N1CCN(CC[NH3+])CC1	ZINC000020805594	280844852	/nfs/dbraw/zinc/84/48/52/280844852.db2.gz	FDLZHXUULFVVAN-UHFFFAOYSA-N	1	0	253.777	1.729	50	0		CDAARO
COc1ccccc1S(=O)(=O)N[C@@H](C[NH3+])C1CCCC1	ZINC000192029182	295379060	/nfs/dbraw/zinc/37/90/60/295379060.db2.gz	LPNJCIDWOGIXKQ-LBPRGKRZSA-N	1	0	298.408	1.491	50	0		CDAARO
C[C@@H]1C[C@@H]([NH2+]CCCNC(=O)OC(C)(C)C)CN1C	ZINC000095421834	297284193	/nfs/dbraw/zinc/28/41/93/297284193.db2.gz	XUILBISTRDRGNR-VXGBXAGGSA-N	1	0	271.405	1.583	50	0		CDAARO
Cc1cc(F)cc(S(=O)(=O)N[C@H]2CCC[C@H]2C[NH3+])c1	ZINC000195544572	301305288	/nfs/dbraw/zinc/30/52/88/301305288.db2.gz	BNIYWYFVJDFDOE-GWCFXTLKSA-N	1	0	286.372	1.540	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)N(C)C(C)(C)C[NH+]1CCCC1	ZINC000578121094	317473295	/nfs/dbraw/zinc/47/32/95/317473295.db2.gz	IYRLHTMDZIEVNN-UHFFFAOYSA-N	1	0	292.427	1.902	50	0		CDAARO
[NH3+][C@H]1[C@@H]2CC[C@H]1CN(c1cnc3ccccc3n1)C2	ZINC000534586275	328315494	/nfs/dbraw/zinc/31/54/94/328315494.db2.gz	BIAPCIMBCMCBEZ-HBYGRHMLSA-N	1	0	254.337	1.803	50	0		CDAARO
O=C(CCC(=O)NC1CCCCCC1)NC[C@@H]1CCC[NH2+]1	ZINC000534644052	328329792	/nfs/dbraw/zinc/32/97/92/328329792.db2.gz	GCFWBSDGUUIDLE-AWEZNQCLSA-N	1	0	295.427	1.474	50	0		CDAARO
O[C@]1(CNc2ncccc2C(F)(F)F)CCC[NH2+]C1	ZINC000534645502	328330852	/nfs/dbraw/zinc/33/08/52/328330852.db2.gz	ZGCCJZPLVBICOG-LLVKDONJSA-N	1	0	275.274	1.627	50	0		CDAARO
CC(C)[C@H](CNc1ncccc1C(N)=O)[NH+](C)C	ZINC000534632210	328331766	/nfs/dbraw/zinc/33/17/66/328331766.db2.gz	SRVASOLHZQEEBC-NSHDSACASA-N	1	0	250.346	1.179	50	0		CDAARO
Cc1ccc2[nH]c(CCCNC(=O)[C@H]3C=CC[NH2+]3)nc2c1C	ZINC000534663426	328351273	/nfs/dbraw/zinc/35/12/73/328351273.db2.gz	MHSYKGDLGIQTDF-CQSZACIVSA-N	1	0	298.390	1.757	50	0		CDAARO
Cc1ccc(OCCS(=O)(=O)NC2CC[NH2+]CC2)cc1	ZINC000534676205	328351740	/nfs/dbraw/zinc/35/17/40/328351740.db2.gz	XZVNTUAKUMKXAH-UHFFFAOYSA-N	1	0	298.408	1.045	50	0		CDAARO
Cc1cccc(S(=O)(=O)N(C)[C@@H](C)C[NH3+])c1Cl	ZINC000183172581	323322942	/nfs/dbraw/zinc/32/29/42/323322942.db2.gz	VNEJWWDHNKUUPH-VIFPVBQESA-N	1	0	276.789	1.616	50	0		CDAARO
COc1ccnc(N2CC[NH+](CC[C@H]3CCCO3)CC2)n1	ZINC000189127368	323462863	/nfs/dbraw/zinc/46/28/63/323462863.db2.gz	NWZFEYHJDWETAS-CYBMUJFWSA-N	1	0	292.383	1.176	50	0		CDAARO
CC(C)(C)OC(=O)NCCC(=O)NC[C@@H]1CCCC[NH2+]1	ZINC000095882072	327203419	/nfs/dbraw/zinc/20/34/19/327203419.db2.gz	CYFGCIDOJKBKNC-NSHDSACASA-N	1	0	285.388	1.160	50	0		CDAARO
CCn1cncc1CN1CC([N@@H+]2CCCC[C@@H]2C)C1	ZINC000244719184	1159707995	/nfs/dbraw/zinc/70/79/95/1159707995.db2.gz	LYKRMGXALITQMG-ZDUSSCGKSA-N	1	0	262.401	1.962	50	0		CDAARO
C[NH+](C)[C@H]1CCCCN(C(=O)Cn2cc(Cl)cn2)C1	ZINC000082087627	482759422	/nfs/dbraw/zinc/75/94/22/482759422.db2.gz	UHVLRHGLIFIBRS-LBPRGKRZSA-N	1	0	284.791	1.479	50	0		CDAARO
CN1CC[N@H+](CCC(=O)Nc2cccc(F)c2)CCC1=O	ZINC000585094443	482828870	/nfs/dbraw/zinc/82/88/70/482828870.db2.gz	DVPJAMDUBWHJKF-UHFFFAOYSA-N	1	0	293.342	1.318	50	0		CDAARO
CN1C(=O)N(C)C2(CC[NH+](CC3=CCCCC3)CC2)C1=O	ZINC000670445177	482996518	/nfs/dbraw/zinc/99/65/18/482996518.db2.gz	MNXIJOAOWJIXSK-UHFFFAOYSA-N	1	0	291.395	1.845	50	0		CDAARO
Cc1ncn(C)c1C(=O)NC[C@H]1CCC[N@H+]1C(C)C	ZINC000670456841	483035727	/nfs/dbraw/zinc/03/57/27/483035727.db2.gz	ZLZCTLWQNARNMI-GFCCVEGCSA-N	1	0	264.373	1.331	50	0		CDAARO
Cc1ncn(CC[NH2+][C@@H](C)Cn2ccnc2C)c1C	ZINC000670460748	483046080	/nfs/dbraw/zinc/04/60/80/483046080.db2.gz	BHWCNHSSJYTGBZ-NSHDSACASA-N	1	0	261.373	1.683	50	0		CDAARO
CCCOC[C@H]1CC[N@@H+](C2CCN(C(C)=O)CC2)C1	ZINC000670463634	483054407	/nfs/dbraw/zinc/05/44/07/483054407.db2.gz	MXTOBDVPRBOYRK-AWEZNQCLSA-N	1	0	268.401	1.746	50	0		CDAARO
O=C(NC[C@H]1C[N@@H+]2CCC[C@@H]2CO1)Nc1cccnc1	ZINC000084425145	483277440	/nfs/dbraw/zinc/27/74/40/483277440.db2.gz	AWIRCKFDCISURP-OLZOCXBDSA-N	1	0	276.340	1.066	50	0		CDAARO
CCC[C@]1(C)NC(=O)N(CC[C@H]2CCCC[N@@H+]2C)C1=O	ZINC000084740532	483322311	/nfs/dbraw/zinc/32/23/11/483322311.db2.gz	OPOXHXKECXOTKQ-DOMZBBRYSA-N	1	0	281.400	1.971	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)c2ccc(-c3ccncc3)cc2)C1	ZINC000426552159	534730056	/nfs/dbraw/zinc/73/00/56/534730056.db2.gz	YQYKAVVJYVJEBX-HNNXBMFYSA-N	1	0	267.332	1.922	50	0		CDAARO
Cn1ccnc1NC(=O)c1cccc(C[NH+](C)C)c1	ZINC000412733756	536028935	/nfs/dbraw/zinc/02/89/35/536028935.db2.gz	SDQNQOBDHOPLEY-UHFFFAOYSA-N	1	0	258.325	1.734	50	0		CDAARO
C/C=C/Cc1nnc(C(=O)N(C)C[C@H]2CCC[N@@H+]2C)o1	ZINC000071774863	538427314	/nfs/dbraw/zinc/42/73/14/538427314.db2.gz	NXPWMQXFFQXPNC-SGUJLRQBSA-N	1	0	278.356	1.354	50	0		CDAARO
CC[C@H](C(=O)N(C)Cc1cscn1)[N@H+](C)CC	ZINC000822541663	1161927979	/nfs/dbraw/zinc/92/79/79/1161927979.db2.gz	QBIQWZNZYRMEAV-LLVKDONJSA-N	1	0	255.387	1.832	50	0		CDAARO
C[NH+](C)CCN(Cc1c[nH]cn1)C(=O)C1C(C)(C)C1(C)C	ZINC001704329515	1177689491	/nfs/dbraw/zinc/68/94/91/1177689491.db2.gz	VVDGIXWUXJXPIE-UHFFFAOYSA-N	1	0	292.427	1.982	50	0		CDAARO
Cc1nc(/C=C/C(=O)N2CC[NH2+]C[C@H]2C)cs1	ZINC000125287465	783769368	/nfs/dbraw/zinc/76/93/68/783769368.db2.gz	BXLMSQYLSJBVON-CDAZIORVSA-N	1	0	251.355	1.285	50	0		CDAARO
COc1cccc2c1OC[C@@H]([NH2+][C@H]1CC[C@H](O)CC1)C2	ZINC000299872925	783999758	/nfs/dbraw/zinc/99/97/58/783999758.db2.gz	JOOGRKGECGZQSS-IHRRRGAJSA-N	1	0	277.364	1.892	50	0		CDAARO
CCCn1cnnc1CN(C)C[C@H]1CC[N@H+](CC)C1	ZINC000252479929	784575277	/nfs/dbraw/zinc/57/52/77/784575277.db2.gz	BQCSQWPZNNDBLS-CYBMUJFWSA-N	1	0	265.405	1.462	50	0		CDAARO
CC(C)c1nnc(NCc2cc3n(n2)CC[NH2+]C3)s1	ZINC000082109069	786608283	/nfs/dbraw/zinc/60/82/83/786608283.db2.gz	FJDVQSZHTHPXMG-UHFFFAOYSA-N	1	0	278.385	1.573	50	0		CDAARO
Cc1nc[nH]c1C[NH2+][C@@H]1CCCN(C(=O)c2ccco2)C1	ZINC000952968476	786644582	/nfs/dbraw/zinc/64/45/82/786644582.db2.gz	MEILGBGQVFKRLQ-GFCCVEGCSA-N	1	0	288.351	1.706	50	0		CDAARO
OC[C@@H]1CCC[N@H+](CCNc2ccc(Cl)cn2)C1	ZINC000952962389	787960712	/nfs/dbraw/zinc/96/07/12/787960712.db2.gz	BCHVVVUYYQGMAD-LLVKDONJSA-N	1	0	269.776	1.851	50	0		CDAARO
Cc1nn(C)c(C)c1[C@H](C)Nc1cc(C)[nH+]c(N)n1	ZINC000032534905	788042504	/nfs/dbraw/zinc/04/25/04/788042504.db2.gz	VWGCZCOLSSOABY-QMMMGPOBSA-N	1	0	260.345	1.891	50	0		CDAARO
O=C1CC[C@@H]([NH2+]Cc2cnc(C3CC3)o2)C2(CCC2)N1	ZINC000952994794	789531005	/nfs/dbraw/zinc/53/10/05/789531005.db2.gz	RJOJWVWPJWSPNR-GFCCVEGCSA-N	1	0	275.352	1.843	50	0		CDAARO
Cc1nccc(C[C@@H]2CC[C@H](C[N@@H+]3CCCOCC3)O2)n1	ZINC000952854567	910408919	/nfs/dbraw/zinc/40/89/19/910408919.db2.gz	ZWZSCMCJNYTJNZ-JKSUJKDBSA-N	1	0	291.395	1.597	50	0		CDAARO
CNC(=O)CC[N@H+](C)CC1([C@H]2CCCCO2)CCC1	ZINC000952882141	910447483	/nfs/dbraw/zinc/44/74/83/910447483.db2.gz	IVAJBQTTYOOCHG-CYBMUJFWSA-N	1	0	268.401	1.794	50	0		CDAARO
O=C1CC[C@@H]([NH2+]CCc2c[nH]cn2)CCN1CC1CC1	ZINC000952981395	910539496	/nfs/dbraw/zinc/53/94/96/910539496.db2.gz	SXAPDRFNLGTIIQ-CYBMUJFWSA-N	1	0	276.384	1.333	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNC(=O)c1noc(C)c1CO	ZINC000823113162	925670942	/nfs/dbraw/zinc/67/09/42/925670942.db2.gz	DJELJIDJJUBELW-NSHDSACASA-N	1	0	281.356	1.080	50	0		CDAARO
C[NH+]1CCN(CC(C)(C)Nc2ccncc2F)CC1	ZINC000823789122	925732717	/nfs/dbraw/zinc/73/27/17/925732717.db2.gz	IXGOFTHOUZHFRL-UHFFFAOYSA-N	1	0	266.364	1.081	50	0		CDAARO
COc1ncc(C[N@H+](C)[C@@H]2CCOC(C)(C)C2)cn1	ZINC000824852027	925840938	/nfs/dbraw/zinc/84/09/38/925840938.db2.gz	OEZPFQNLQHTAAQ-GFCCVEGCSA-N	1	0	265.357	1.875	50	0		CDAARO
CC(C)(O)Cn1ncnc1-c1ccc(CC[NH3+])cc1	ZINC000827421152	925940232	/nfs/dbraw/zinc/94/02/32/925940232.db2.gz	RLVDZBIEGPXDHA-UHFFFAOYSA-N	1	0	260.341	1.217	50	0		CDAARO
OCc1ccc2c(c1)C[N@@H+](C[C@@H]1CCCO1)CCO2	ZINC000828827021	926193851	/nfs/dbraw/zinc/19/38/51/926193851.db2.gz	KDHANUCPVVBLGZ-AWEZNQCLSA-N	1	0	263.337	1.552	50	0		CDAARO
CCn1cc(C[N@H+]2C[C@@H](Cc3ccccn3)[C@H](O)C2)cn1	ZINC001529159688	968996922	/nfs/dbraw/zinc/99/69/22/968996922.db2.gz	XOZMEWDNTPODPR-GDBMZVCRSA-N	1	0	286.379	1.333	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C[C@H]1COCCO1	ZINC001529167276	968999247	/nfs/dbraw/zinc/99/92/47/968999247.db2.gz	HQIHZNMGWBNTLC-AWEZNQCLSA-N	1	0	256.390	1.208	50	0		CDAARO
COCC[NH+]1CCC(CN(C)Cc2noc(C)n2)CC1	ZINC001529173506	969005507	/nfs/dbraw/zinc/00/55/07/969005507.db2.gz	XCVMYTSXSPLHMX-UHFFFAOYSA-N	1	0	282.388	1.168	50	0		CDAARO
C[NH+](C)Cc1ccc([C@H]2CCCN2C(=O)c2cn[nH]n2)cc1	ZINC001506399007	975149276	/nfs/dbraw/zinc/14/92/76/975149276.db2.gz	VQEXQXFKNVHSJV-OAHLLOKOSA-N	1	0	299.378	1.844	50	0		CDAARO
CCCCN(Cc1ccsc1)C(=O)[C@H]1C[C@@H](O)C[NH2+]1	ZINC001506402434	975150193	/nfs/dbraw/zinc/15/01/93/975150193.db2.gz	NFWDZKIUHMVLPT-CHWSQXEVSA-N	1	0	282.409	1.600	50	0		CDAARO
CC[C@@H](OC)C(=O)Nc1nnc(CC[NH+](C)C)s1	ZINC001506407417	975152693	/nfs/dbraw/zinc/15/26/93/975152693.db2.gz	RWLJHLLEFVMBKO-MRVPVSSYSA-N	1	0	272.374	1.006	50	0		CDAARO
C[C@H](CCN(C)c1nccnc1N(C)C)[NH+]1CCCC1	ZINC001506419060	975157164	/nfs/dbraw/zinc/15/71/64/975157164.db2.gz	WOGPJDYUMPOJQF-CYBMUJFWSA-N	1	0	277.416	1.853	50	0		CDAARO
C[N@@H+]1CC[C@@H](NC(=O)/C=C/c2cc(CO)cs2)C1	ZINC001506419397	975157251	/nfs/dbraw/zinc/15/72/51/975157251.db2.gz	ZVNVHGNRORSVOQ-KXMPLOMGSA-N	1	0	266.366	1.074	50	0		CDAARO
CN(C)c1nccnc1N(C)CC[N@H+](C)C1CCCC1	ZINC001506420727	975158072	/nfs/dbraw/zinc/15/80/72/975158072.db2.gz	CCESQGQYRRSTDL-UHFFFAOYSA-N	1	0	277.416	1.853	50	0		CDAARO
CC[C@@H](N[C@H]1CC[N@H+](CC2CCCC2)C1)C(=O)OC	ZINC000192853977	342468955	/nfs/dbraw/zinc/46/89/55/342468955.db2.gz	DNEFRJRNOPOUAD-UONOGXRCSA-N	1	0	268.401	1.792	50	0		CDAARO
CC[N@@H+]1CCN(C(=O)C2(COC)CCC2)CC1(C)C	ZINC000584887404	341999123	/nfs/dbraw/zinc/99/91/23/341999123.db2.gz	MXRLWFWKIAWJDM-UHFFFAOYSA-N	1	0	268.401	1.746	50	0		CDAARO
COc1cc(C)ccc1OCCC(=O)N1CC[NH2+]C[C@H]1C	ZINC000124634145	187146679	/nfs/dbraw/zinc/14/66/79/187146679.db2.gz	ZQQBAERYUBHDEE-CYBMUJFWSA-N	1	0	292.379	1.593	50	0		CDAARO
C[C@H](CSC(C)(C)C)[NH2+]CCS(C)(=O)=O	ZINC000095967522	185046859	/nfs/dbraw/zinc/04/68/59/185046859.db2.gz	PCXJSJHMPNDZJX-SECBINFHSA-N	1	0	253.433	1.541	50	0		CDAARO
COc1ccc([C@H]([NH2+]CCO)C2CCOCC2)cc1	ZINC000095986086	185056588	/nfs/dbraw/zinc/05/65/88/185056588.db2.gz	YGLCXGKIKROZGG-HNNXBMFYSA-N	1	0	265.353	1.745	50	0		CDAARO
COC(=O)c1ccccc1C[N@@H+]1CC[C@@H](C)[C@@H](O)C1	ZINC000096009865	185064653	/nfs/dbraw/zinc/06/46/53/185064653.db2.gz	VCBBIMYGAMXTRU-RISCZKNCSA-N	1	0	263.337	1.676	50	0		CDAARO
CO[C@H](C(=O)N1CC[C@@H](C[NH+]2CCCCC2)C1)C1CC1	ZINC000241644489	361753252	/nfs/dbraw/zinc/75/32/52/361753252.db2.gz	PRDTZXWALOFUGJ-ZFWWWQNUSA-N	1	0	280.412	1.746	50	0		CDAARO
OCCC[NH2+]C[C@@H](O)COc1ccc2ccccc2c1	ZINC000022205783	342088903	/nfs/dbraw/zinc/08/89/03/342088903.db2.gz	PAWPHKBFEKXPLC-OAHLLOKOSA-N	1	0	275.348	1.552	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)CCc1cccc(F)c1F	ZINC000125209658	187174955	/nfs/dbraw/zinc/17/49/55/187174955.db2.gz	IQGNXGRXPCTOCN-SNVBAGLBSA-N	1	0	268.307	1.718	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@H]1NC(=O)[C@H](C)Cc1ccccc1Cl	ZINC000195553989	342625828	/nfs/dbraw/zinc/62/58/28/342625828.db2.gz	SBSGREQCZXQENQ-HONMWMINSA-N	1	0	296.798	1.622	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1sccc1OC	ZINC000195544650	342626610	/nfs/dbraw/zinc/62/66/10/342626610.db2.gz	BEMGJBVPBNWPLP-QMMMGPOBSA-N	1	0	278.399	1.162	50	0		CDAARO
Cn1cc([C@@](C)(O)C[NH2+][C@H]2CCCSC2)cn1	ZINC000195558531	342628477	/nfs/dbraw/zinc/62/84/77/342628477.db2.gz	DQKWDRUYAFXQLI-RYUDHWBXSA-N	1	0	255.387	1.113	50	0		CDAARO
Cc1nnc(CN2CC[NH+](C3Cc4ccccc4C3)CC2)o1	ZINC000244724465	361859810	/nfs/dbraw/zinc/85/98/10/361859810.db2.gz	MURHATOEZADAMN-UHFFFAOYSA-N	1	0	298.390	1.663	50	0		CDAARO
COCCC[C@@H]1CCC[N@H+](CCn2cncn2)C1	ZINC000244840314	361866773	/nfs/dbraw/zinc/86/67/73/361866773.db2.gz	UKWOBQQHHHMJIA-ZDUSSCGKSA-N	1	0	252.362	1.417	50	0		CDAARO
C[C@H](C(=O)NCc1ccccc1)[N@H+](C)CC1(C)COC1	ZINC000244874178	361867386	/nfs/dbraw/zinc/86/73/86/361867386.db2.gz	WWBYEKGXONMYTN-CYBMUJFWSA-N	1	0	276.380	1.660	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OC1CCS(=O)(=O)CC1	ZINC000585133993	342215740	/nfs/dbraw/zinc/21/57/40/342215740.db2.gz	YAGABWFYGVILPI-NSHDSACASA-N	1	0	291.413	1.118	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@@](C)(C[NH2+]CCCO)C1	ZINC000585136791	342216027	/nfs/dbraw/zinc/21/60/27/342216027.db2.gz	SPLSBYVNGOSSFT-HNNXBMFYSA-N	1	0	286.416	1.996	50	0		CDAARO
Cc1cc(N2CC[NH2+][C@@H](c3ccccc3)C2)ncn1	ZINC000685945048	539046150	/nfs/dbraw/zinc/04/61/50/539046150.db2.gz	QKNASVCWSGQZFC-CQSZACIVSA-N	1	0	254.337	1.936	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N[C@@H]2C[N@@H+](C)C[C@H]2C)c1	ZINC000257365935	539096193	/nfs/dbraw/zinc/09/61/93/539096193.db2.gz	COKIHFULKDPGPD-ZYHUDNBSSA-N	1	0	286.372	1.363	50	0		CDAARO
C[C@H]1CC(=O)Nc2ccccc2N1C(=O)C[NH+]1CCCC1	ZINC000012934811	539101011	/nfs/dbraw/zinc/10/10/11/539101011.db2.gz	FSGSPLVFZNCXSD-LBPRGKRZSA-N	1	0	287.363	1.846	50	0		CDAARO
Cc1cc(C(N)=O)c(N2CCC([NH+](C)C)CC2)nc1C	ZINC000670441448	539114217	/nfs/dbraw/zinc/11/42/17/539114217.db2.gz	RIKAHOIUWRKLFB-UHFFFAOYSA-N	1	0	276.384	1.328	50	0		CDAARO
C[C@@H]1CN(C(=O)C2CC2)CC[C@H]1[NH2+]Cc1cccnc1	ZINC000084714967	342267933	/nfs/dbraw/zinc/26/79/33/342267933.db2.gz	PWVVJGQIMULXIL-IUODEOHRSA-N	1	0	273.380	1.818	50	0		CDAARO
O=C(Nc1ccccn1)N1CCC[N@@H+](C2CC2)CC1	ZINC000057987847	539160879	/nfs/dbraw/zinc/16/08/79/539160879.db2.gz	XCJWTCWIDCNDJM-UHFFFAOYSA-N	1	0	260.341	1.784	50	0		CDAARO
C[C@@H](Oc1ccccc1Cl)C(=O)N1CC[NH2+]C[C@@H]1C	ZINC000125786274	187200260	/nfs/dbraw/zinc/20/02/60/187200260.db2.gz	YMKZAHPEWDCTOY-WDEREUQCSA-N	1	0	282.771	1.928	50	0		CDAARO
CC[C@H](C)C[C@@H](C)NC(=O)NC[C@@H]1C[N@H+](C)CCN1C	ZINC000096440112	529677228	/nfs/dbraw/zinc/67/72/28/529677228.db2.gz	FBABSUKKOSXUSX-BFHYXJOUSA-N	1	0	284.448	1.356	50	0		CDAARO
Cc1nccn1[C@@H](C)C[NH+]1CCN(c2ncccn2)CC1	ZINC000019300821	282217346	/nfs/dbraw/zinc/21/73/46/282217346.db2.gz	MGFPDTDMOQJPHB-ZDUSSCGKSA-N	1	0	286.383	1.365	50	0		CDAARO
CCC1CCN(C(=O)C(C)(C)C[NH+]2CCOCC2)CC1	ZINC000585129529	362061705	/nfs/dbraw/zinc/06/17/05/362061705.db2.gz	MTALLUFOELZYCB-UHFFFAOYSA-N	1	0	282.428	1.993	50	0		CDAARO
CCN1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	ZINC000036413084	362130124	/nfs/dbraw/zinc/13/01/24/362130124.db2.gz	MIMKKEIOAQJEDW-UHFFFAOYSA-N	1	0	290.335	1.291	50	0		CDAARO
Cc1n[nH]cc1C[NH2+][C@@H]1CCCN(c2cccnn2)C1	ZINC000105904975	136378732	/nfs/dbraw/zinc/37/87/32/136378732.db2.gz	NFSQAAJDCWIDPG-CYBMUJFWSA-N	1	0	272.356	1.267	50	0		CDAARO
O=C1C[C@@H]([NH2+]C[C@H]2CCCO2)C(=O)N1c1ccccc1	ZINC000018078001	365798571	/nfs/dbraw/zinc/79/85/71/365798571.db2.gz	OMZNHAYDKPVXQO-CHWSQXEVSA-N	1	0	274.320	1.087	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](O)CN1Cc1ccc2ccccc2n1	ZINC000083891528	362255414	/nfs/dbraw/zinc/25/54/14/362255414.db2.gz	FPVWEWACEZEDLW-ZFWWWQNUSA-N	1	0	286.331	1.343	50	0		CDAARO
COCCc1noc(CN(C)CC[N@@H+]2C[C@H]3CC[C@@H]2C3)n1	ZINC000252487824	362386944	/nfs/dbraw/zinc/38/69/44/362386944.db2.gz	IBXRNYSDPSYHPD-QWHCGFSZSA-N	1	0	294.399	1.175	50	0		CDAARO
Cc1cc(C)n(C2CN(C(=O)[C@@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3[NH3+])C2)n1	ZINC000252500014	362388552	/nfs/dbraw/zinc/38/85/52/362388552.db2.gz	SLYPVIIRUBJUCX-OSRDXIQISA-N	1	0	286.379	1.033	50	0		CDAARO
CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CC[C@H](NS(C)(=O)=O)C1	ZINC000191075569	362399172	/nfs/dbraw/zinc/39/91/72/362399172.db2.gz	LVHKJWZGIVLNCW-MELADBBJSA-N	1	0	286.441	1.602	50	0		CDAARO
Cc1nn(-c2ccccc2)cc1CNC1(C(N)=O)CC1	ZINC000191487824	362443674	/nfs/dbraw/zinc/44/36/74/362443674.db2.gz	MUJAGWJOQCKAOC-UHFFFAOYSA-N	1	0	270.336	1.288	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CN(C)C(=O)c2cccn2C)C1	ZINC000230567948	345084885	/nfs/dbraw/zinc/08/48/85/345084885.db2.gz	UFVJTJOQRYESQC-CYBMUJFWSA-N	1	0	279.384	1.065	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(C(=O)NCC[C@@H]2CCCO2)C1	ZINC000129429887	345576752	/nfs/dbraw/zinc/57/67/52/345576752.db2.gz	DFOWEIOKSNEEQC-STQMWFEESA-N	1	0	269.389	1.149	50	0		CDAARO
C[N@H+]1C[C@H]2CN(C(=O)c3cc(C4CC4)on3)C[C@H]2C1	ZINC000192510519	362640653	/nfs/dbraw/zinc/64/06/53/362640653.db2.gz	VNRIGRJGPDUOIE-PHIMTYICSA-N	1	0	261.325	1.186	50	0		CDAARO
C[C@H]1CN(C)CC[N@@H+]1CC1CCN(C(=O)C2CCC2)CC1	ZINC000085468062	179073495	/nfs/dbraw/zinc/07/34/95/179073495.db2.gz	GTGXEZQNDVCEPI-AWEZNQCLSA-N	1	0	293.455	1.661	50	0		CDAARO
OC[C@H]1CCC[N@@H+]1C[C@H]1CCCN1c1ncc(Cl)cn1	ZINC000085689342	179115733	/nfs/dbraw/zinc/11/57/33/179115733.db2.gz	CWOLRFWBQSVZCT-CHWSQXEVSA-N	1	0	296.802	1.556	50	0		CDAARO
COC[C@@H](O)C[NH2+]Cc1ccc(Br)c(C)c1	ZINC000085706987	179121831	/nfs/dbraw/zinc/12/18/31/179121831.db2.gz	PSQJORCBLBVSTC-NSHDSACASA-N	1	0	288.185	1.854	50	0		CDAARO
Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)N2CCNC2=O)c(C)c1	ZINC000012852167	362780529	/nfs/dbraw/zinc/78/05/29/362780529.db2.gz	FVEULBGRAMRCOW-CYBMUJFWSA-N	1	0	289.379	1.676	50	0		CDAARO
CN(CC1(CO)CCCC1)C(=O)C[NH+]1CCCCC1	ZINC000584896196	349357563	/nfs/dbraw/zinc/35/75/63/349357563.db2.gz	PUFAEHOGEJQCRH-UHFFFAOYSA-N	1	0	268.401	1.483	50	0		CDAARO
CCO[C@H]1CN(C)C[C@@H]1[NH2+]C1CSCCSC1	ZINC000584884791	349342458	/nfs/dbraw/zinc/34/24/58/349342458.db2.gz	ZIYJFLKUSDTSNG-RYUDHWBXSA-N	1	0	276.471	1.144	50	0		CDAARO
COC(C)(C)CCNC(=O)[C@@H]1CC12CC[NH2+]CC2	ZINC000584884869	349342920	/nfs/dbraw/zinc/34/29/20/349342920.db2.gz	CLTNOFQJZGXXTG-NSHDSACASA-N	1	0	254.374	1.307	50	0		CDAARO
Cc1cc(C[NH2+][C@H](C)CNS(=O)(=O)C2CC2)cnc1C	ZINC000584885402	349343396	/nfs/dbraw/zinc/34/33/96/349343396.db2.gz	LPNQQBSVRQRICK-LLVKDONJSA-N	1	0	297.424	1.258	50	0		CDAARO
C[NH+](C)Cc1ccccc1CNC(=O)c1cnc(N)s1	ZINC000584886124	349343896	/nfs/dbraw/zinc/34/38/96/349343896.db2.gz	MPMCIPNXMMPDOH-UHFFFAOYSA-N	1	0	290.392	1.547	50	0		CDAARO
CC(=O)N1CCN(C(=O)CC[NH2+]C[C@@H]2CC=CCC2)CC1	ZINC000089954484	179892109	/nfs/dbraw/zinc/89/21/09/179892109.db2.gz	KCRNKPYQASXLME-OAHLLOKOSA-N	1	0	293.411	1.013	50	0		CDAARO
C[C@@H](C[NH+]1CCCC1)n1cnc2ncccc2c1=O	ZINC000584895881	349356594	/nfs/dbraw/zinc/35/65/94/349356594.db2.gz	FSAUKWZBUPVOAU-NSHDSACASA-N	1	0	258.325	1.448	50	0		CDAARO
O=C(c1cncc(O)c1)N1CCC[C@@H](C[NH+]2CCCC2)C1	ZINC000584900851	349363155	/nfs/dbraw/zinc/36/31/55/349363155.db2.gz	VSKGQNBVKMQLCZ-ZDUSSCGKSA-N	1	0	289.379	1.735	50	0		CDAARO
C[C@@H](CC(=O)Nc1ccc(F)cc1)[NH2+]C[C@@]1(O)CCOC1	ZINC000090849543	180046513	/nfs/dbraw/zinc/04/65/13/180046513.db2.gz	WNKPCQCMIMSDMB-NHYWBVRUSA-N	1	0	296.342	1.284	50	0		CDAARO
CCC[C@H]1CN(C(=O)CCn2ccnc2C)C[C@@H]1[NH3+]	ZINC000091441587	180156796	/nfs/dbraw/zinc/15/67/96/180156796.db2.gz	GKLJUJUBKKVSRW-STQMWFEESA-N	1	0	264.373	1.167	50	0		CDAARO
COc1ccc(C[NH+]2CCC3(CC2)[C@H](O)C[C@@H]3O)cc1F	ZINC000091575420	180196868	/nfs/dbraw/zinc/19/68/68/180196868.db2.gz	FQHVXWSJXXKVTG-GASCZTMLSA-N	1	0	295.354	1.542	50	0		CDAARO
CCCOC[C@H]1CCN(c2cc(C)[nH+]c(N)n2)C1	ZINC000091551265	180189126	/nfs/dbraw/zinc/18/91/26/180189126.db2.gz	MOTWRVDLUMCZJA-NSHDSACASA-N	1	0	250.346	1.620	50	0		CDAARO
O=C(CCC1CC1)N1C[C@H](CO)[C@H](C[NH+]2CCCC2)C1	ZINC000091985640	180298906	/nfs/dbraw/zinc/29/89/06/180298906.db2.gz	OEFJSIBEEVSKLV-HUUCEWRRSA-N	1	0	280.412	1.339	50	0		CDAARO
C[C@H](CNC(=O)[C@@H]1CCCO1)[N@@H+]1CCC[C@@H](C)C1	ZINC000106078688	186102123	/nfs/dbraw/zinc/10/21/23/186102123.db2.gz	AWRUZCFTTCNBCG-UPJWGTAASA-N	1	0	254.374	1.402	50	0		CDAARO
C[C@H](c1ccc(F)cc1F)N1CCN(C(=O)CC[NH3+])CC1	ZINC000107275146	186165317	/nfs/dbraw/zinc/16/53/17/186165317.db2.gz	WXFWHSGIDQABFH-LLVKDONJSA-N	1	0	297.349	1.519	50	0		CDAARO
CCn1nnc(C)c1C[N@@H+]1CC(C)(C)CC[C@@H]1CO	ZINC000621381072	350579133	/nfs/dbraw/zinc/57/91/33/350579133.db2.gz	KMODVJAFLHNYEH-GFCCVEGCSA-N	1	0	266.389	1.589	50	0		CDAARO
CC[N@H+]1C[C@H](NS(=O)(=O)c2ccccc2)[C@@H](C)C1	ZINC000257366038	350964511	/nfs/dbraw/zinc/96/45/11/350964511.db2.gz	HFWSWMJAPFITPE-AAEUAGOBSA-N	1	0	268.382	1.305	50	0		CDAARO
NC(=O)c1ccc(-c2nc([C@H]3CCCCCN3)no2)o1	ZINC000096001569	351468994	/nfs/dbraw/zinc/46/89/94/351468994.db2.gz	XFGSMIFXLUKLNW-MRVPVSSYSA-N	1	0	276.296	1.633	50	0		CDAARO
C[C@H]1O[C@@H](C(Cl)(Cl)Cl)N(CC[NH+](C)C)C1=O	ZINC000096026574	351474199	/nfs/dbraw/zinc/47/41/99/351474199.db2.gz	BCBYNSIATNYIDO-SVRRBLITSA-N	1	0	289.590	1.492	50	0		CDAARO
COCC[N@H+](C)C[C@H]1CCCN1C(=O)c1csnc1C	ZINC000097237476	351605987	/nfs/dbraw/zinc/60/59/87/351605987.db2.gz	VNFYGGCQUNQGKK-GFCCVEGCSA-N	1	0	297.424	1.634	50	0		CDAARO
[NH3+][C@@H]1CCN(S(=O)(=O)C2=Cc3ccccc3CC2)C1	ZINC000123609270	187100678	/nfs/dbraw/zinc/10/06/78/187100678.db2.gz	VTDRMUZOVDQLPT-CYBMUJFWSA-N	1	0	278.377	1.337	50	0		CDAARO
CS(=O)(=O)c1ccc(N2CCC[NH2+]CC2)c(F)c1	ZINC000001499314	355937564	/nfs/dbraw/zinc/93/75/64/355937564.db2.gz	APBOURYCDZUNHD-UHFFFAOYSA-N	1	0	272.345	1.029	50	0		CDAARO
C[C@H](Cc1ccc(F)cc1)[NH+]1CCC(C(N)=O)CC1	ZINC000000213305	355896540	/nfs/dbraw/zinc/89/65/40/355896540.db2.gz	OUQNQUDWLHFERV-LLVKDONJSA-N	1	0	264.344	1.954	50	0		CDAARO
COc1cccc(OC)c1OCC[NH2+]C[C@H](C)O	ZINC000002879716	355986743	/nfs/dbraw/zinc/98/67/43/355986743.db2.gz	LFYLJJJKCKFXFG-JTQLQIEISA-N	1	0	255.314	1.053	50	0		CDAARO
CC(=O)N(CCC[NH+](C)C)Cc1ccc2c(c1)OCO2	ZINC000002144787	355961116	/nfs/dbraw/zinc/96/11/16/355961116.db2.gz	ZYWXJSUOIXEMLP-UHFFFAOYSA-N	1	0	278.352	1.716	50	0	biogenic	CDAARO
O=C1C[C@@H]([NH2+]C2CC2)C(=O)N1c1ccc(Cl)cc1	ZINC000004653681	356039504	/nfs/dbraw/zinc/03/95/04/356039504.db2.gz	FOZCFVNDEUQBLJ-LLVKDONJSA-N	1	0	264.712	1.724	50	0		CDAARO
COc1ccc(C)nc1NC(=O)N1CC[C@H]([NH+](C)C)C1	ZINC000097378680	356103933	/nfs/dbraw/zinc/10/39/33/356103933.db2.gz	SIJYUKLXINHGLK-NSHDSACASA-N	1	0	278.356	1.566	50	0		CDAARO
Cn1cc(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)cn1	ZINC000014166125	356377639	/nfs/dbraw/zinc/37/76/39/356377639.db2.gz	OXPYKBQLDOQDBV-ZDUSSCGKSA-N	1	0	288.351	1.580	50	0		CDAARO
C[C@@H](CNC(=O)[C@]1(C)CC1(Cl)Cl)N1CCOCC1	ZINC000032817370	356379853	/nfs/dbraw/zinc/37/98/53/356379853.db2.gz	ROXJJFQFSOFHPH-ONGXEEELSA-N	1	0	295.210	1.407	50	0		CDAARO
COc1cccc(C(=O)NCC[NH+]2CCCCC2)c1OC	ZINC000016602569	356443007	/nfs/dbraw/zinc/44/30/07/356443007.db2.gz	VOYWOSKPFUILDS-UHFFFAOYSA-N	1	0	292.379	1.920	50	0		CDAARO
Cc1ccccc1OCC(=O)NC1CC[NH+](C)CC1	ZINC000016604089	356443017	/nfs/dbraw/zinc/44/30/17/356443017.db2.gz	RRNOASUWEPNPJN-UHFFFAOYSA-N	1	0	262.353	1.584	50	0		CDAARO
O=C(Cc1ccccc1F)NCC[NH+]1CCCCC1	ZINC000016603498	356443075	/nfs/dbraw/zinc/44/30/75/356443075.db2.gz	XTDIYUWVUVLQNA-UHFFFAOYSA-N	1	0	264.344	1.970	50	0		CDAARO
C[NH+]1CCN(CCOCCOc2cccc(Cl)c2)CC1	ZINC000019792578	356505487	/nfs/dbraw/zinc/50/54/87/356505487.db2.gz	UVVRMGVWWCVFJS-UHFFFAOYSA-N	1	0	298.814	1.983	50	0		CDAARO
COc1ccc(C)cc1NC(=O)CCN1CC[NH+](C)CC1	ZINC000019841617	356509875	/nfs/dbraw/zinc/50/98/75/356509875.db2.gz	JNCSEBFBOWKJCF-UHFFFAOYSA-N	1	0	291.395	1.580	50	0		CDAARO
COc1cccc(NC(=O)C[NH2+]C[C@@H]2CCCO2)c1	ZINC000020055612	356523855	/nfs/dbraw/zinc/52/38/55/356523855.db2.gz	UIONYIXXMOGTLF-ZDUSSCGKSA-N	1	0	264.325	1.402	50	0		CDAARO
Cc1cccc(C(=O)O[C@H](C)CN2CC[NH+](C)CC2)c1	ZINC000019897296	356514948	/nfs/dbraw/zinc/51/49/48/356514948.db2.gz	JECSPBDVVSAOTA-CQSZACIVSA-N	1	0	276.380	1.788	50	0		CDAARO
CC[NH+]1CCN(CC(=O)Nc2ccccc2Cl)CC1	ZINC000022937365	356625192	/nfs/dbraw/zinc/62/51/92/356625192.db2.gz	QKPSDCZALCNHOP-UHFFFAOYSA-N	1	0	281.787	1.916	50	0		CDAARO
CC(C)SCC(=O)N1CCC(n2cc(C[NH3+])nn2)CC1	ZINC000023478918	356643465	/nfs/dbraw/zinc/64/34/65/356643465.db2.gz	FBHNZCLMNGQQJU-UHFFFAOYSA-N	1	0	297.428	1.042	50	0		CDAARO
C[C@H]1C[N@H+](C)C[C@@H]1NS(=O)(=O)Cc1ccc(F)cc1	ZINC000078899060	538477007	/nfs/dbraw/zinc/47/70/07/538477007.db2.gz	KOLRNSALKIOEPA-GWCFXTLKSA-N	1	0	286.372	1.195	50	0		CDAARO
CN1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1	ZINC000035982650	356853830	/nfs/dbraw/zinc/85/38/30/356853830.db2.gz	ULOCGBQHDMCQDX-UHFFFAOYSA-N	1	0	292.763	1.415	50	0		CDAARO
COc1ccc(C[NH3+])cc1COC1CCOCC1	ZINC000050126126	357230854	/nfs/dbraw/zinc/23/08/54/357230854.db2.gz	IFWXZQCJNCNWHW-UHFFFAOYSA-N	1	0	251.326	1.850	50	0		CDAARO
CCCN(Cc1cccnc1)C(=O)C[C@@H]1C[NH2+]CCO1	ZINC000055310182	357331820	/nfs/dbraw/zinc/33/18/20/357331820.db2.gz	OTHSOCWNPCXNEY-CQSZACIVSA-N	1	0	277.368	1.199	50	0		CDAARO
O=C1NCN(c2ccc(Cl)cc2)C12CC[NH2+]CC2	ZINC000059229065	357423485	/nfs/dbraw/zinc/42/34/85/357423485.db2.gz	PSTZLFWHHJKOJF-UHFFFAOYSA-N	1	0	265.744	1.356	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N[C@@](C)(C[NH3+])C2CC2)c1	ZINC000095431213	357449246	/nfs/dbraw/zinc/44/92/46/357449246.db2.gz	GLTVNBUZUSGMTF-ZDUSSCGKSA-N	1	0	286.372	1.540	50	0		CDAARO
C[C@@H]([NH3+])c1nnnn1-c1cccc(Br)c1	ZINC000062494000	357475218	/nfs/dbraw/zinc/47/52/18/357475218.db2.gz	RAPPANCYTWPMAK-ZCFIWIBFSA-N	1	0	268.118	1.445	50	0		CDAARO
Cc1cnn([C@@H](C)CNC(=O)C[NH+]2CCCCCC2)c1	ZINC000065527068	357546919	/nfs/dbraw/zinc/54/69/19/357546919.db2.gz	NOPXNWGCKMPUFG-AWEZNQCLSA-N	1	0	278.400	1.745	50	0		CDAARO
CNC(=O)c1ccccc1-c1cccc2c1O[C@@H](C[NH3+])C2	ZINC000067742166	357623776	/nfs/dbraw/zinc/62/37/76/357623776.db2.gz	SXEBHWPTIBKMOG-GFCCVEGCSA-N	1	0	282.343	1.975	50	0		CDAARO
CC(C)(C)N1C[C@@H]([NH2+]C2CCSCC2)CC1=O	ZINC000080234919	538862788	/nfs/dbraw/zinc/86/27/88/538862788.db2.gz	CTKAYQXGSCGHCZ-NSHDSACASA-N	1	0	256.415	1.871	50	0		CDAARO
OCC(CO)[N@@H+]1CCC[C@H](c2nc3ccccc3[nH]2)C1	ZINC000067691667	357619342	/nfs/dbraw/zinc/61/93/42/357619342.db2.gz	QMIJRFVPDUGVLR-NSHDSACASA-N	1	0	275.352	1.096	50	0		CDAARO
C[C@@H](Cc1ccccc1F)C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188470970	357694224	/nfs/dbraw/zinc/69/42/24/357694224.db2.gz	SQUMBMYVZNCVAC-NWDGAFQWSA-N	1	0	264.344	1.825	50	0		CDAARO
c1cn(CCc2c[nH]cn2)c(-c2cc3n(n2)CCC[NH2+]C3)n1	ZINC000072436718	357835611	/nfs/dbraw/zinc/83/56/11/357835611.db2.gz	GVBDGELTQBZSNC-UHFFFAOYSA-N	1	0	297.366	1.206	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)NCCCn2nnc3ccccc32)C1	ZINC000072459059	357837222	/nfs/dbraw/zinc/83/72/22/357837222.db2.gz	VJXBGIQNMZTGST-NWDGAFQWSA-N	1	0	287.367	1.065	50	0		CDAARO
CCN1CC2(CCN(Cc3ncc[nH]3)CC2)OC1=O	ZINC000072478944	357837595	/nfs/dbraw/zinc/83/75/95/357837595.db2.gz	XTYLBCYALUYZJK-UHFFFAOYSA-N	1	0	264.329	1.216	50	0		CDAARO
c1cn(Cc2ccncc2)c(-c2cc3n(n2)CCC[NH2+]C3)n1	ZINC000072475262	357838115	/nfs/dbraw/zinc/83/81/15/357838115.db2.gz	OSXAYCSCWHVDCZ-UHFFFAOYSA-N	1	0	294.362	1.683	50	0		CDAARO
Cc1cccc(N2CCC[C@H]2C[N@@H+]2CCC[C@@H]2CO)n1	ZINC000097163350	358004300	/nfs/dbraw/zinc/00/43/00/358004300.db2.gz	ZCNNQUNJOGHLHP-LSDHHAIUSA-N	1	0	275.396	1.816	50	0		CDAARO
[NH3+][C@@H]1CCCCN(C(=O)Cc2ccc3c(c2)OCO3)C1	ZINC000082107645	358147156	/nfs/dbraw/zinc/14/71/56/358147156.db2.gz	GUCCWJQNSRVVIT-GFCCVEGCSA-N	1	0	276.336	1.298	50	0		CDAARO
C[NH+](C)[C@H]1CCCCN(C(=O)CCc2ccccn2)C1	ZINC000082127737	358148549	/nfs/dbraw/zinc/14/85/49/358148549.db2.gz	KHIQWCNEHBLNSE-HNNXBMFYSA-N	1	0	275.396	1.957	50	0		CDAARO
CC(C)C[C@@H](C[NH+](C)C)NC(=O)c1cnn(C)c1	ZINC000097359377	358209195	/nfs/dbraw/zinc/20/91/95/358209195.db2.gz	ZKVDNMIQNBGJRQ-LBPRGKRZSA-N	1	0	252.362	1.126	50	0		CDAARO
O=C(N[C@@H]1CCC[NH2+]C1)c1cnn(Cc2ccccc2)c1	ZINC000195542731	358559918	/nfs/dbraw/zinc/55/99/18/358559918.db2.gz	BLDMVAWREYPLTC-OAHLLOKOSA-N	1	0	284.363	1.413	50	0		CDAARO
CCc1cnc(NCC2([NH+](C)C)CCN(C)CC2)nc1	ZINC000095367037	358686517	/nfs/dbraw/zinc/68/65/17/358686517.db2.gz	LWBYEMGVFCMUGQ-UHFFFAOYSA-N	1	0	277.416	1.477	50	0		CDAARO
CCc1[nH+]c(N)nc(N(C)Cc2cc(C)on2)c1C	ZINC000095390497	358691971	/nfs/dbraw/zinc/69/19/71/358691971.db2.gz	ZXGUFHPQGIWPAU-UHFFFAOYSA-N	1	0	261.329	1.862	50	0		CDAARO
Cc1cc2cccc(C(=O)N(CCO)CC[NH+](C)C)c2o1	ZINC000097088013	358750234	/nfs/dbraw/zinc/75/02/34/358750234.db2.gz	MNZFZQMGKDHCNX-UHFFFAOYSA-N	1	0	290.363	1.737	50	0		CDAARO
O=C([C@@H]1CCCCO1)N1CCN(c2cc[nH+]cc2)CC1	ZINC000097294880	358765151	/nfs/dbraw/zinc/76/51/51/358765151.db2.gz	SRFGMIGHZVUART-AWEZNQCLSA-N	1	0	275.352	1.299	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)N(CCO)Cc1ccco1	ZINC000097307548	358766093	/nfs/dbraw/zinc/76/60/93/358766093.db2.gz	KLSLLGQVYRXURF-AWEZNQCLSA-N	1	0	280.368	1.475	50	0		CDAARO
Cc1nccn1CC1(CNC(=O)[C@@H]2CCCC[N@H+]2C)CC1	ZINC000097413390	358774359	/nfs/dbraw/zinc/77/43/59/358774359.db2.gz	XOCVSAORZYXODT-AWEZNQCLSA-N	1	0	290.411	1.572	50	0		CDAARO
CNC(=O)[C@@H]1CCCC[N@@H+]1Cc1cccc2nonc21	ZINC000097463563	358778280	/nfs/dbraw/zinc/77/82/80/358778280.db2.gz	QTSDYTXMCZYDFR-LBPRGKRZSA-N	1	0	274.324	1.323	50	0		CDAARO
CC[C@H]1Cc2ccccc2C[N@@H+]1CCCC(=O)NC(N)=O	ZINC000185802165	358786120	/nfs/dbraw/zinc/78/61/20/358786120.db2.gz	FIBJXYJXDUQMDZ-AWEZNQCLSA-N	1	0	289.379	1.798	50	0		CDAARO
Cc1n[nH]c(CN2CC[N@@H+]3CCC[C@@H]3C2)c1Cl	ZINC000097744802	358796942	/nfs/dbraw/zinc/79/69/42/358796942.db2.gz	QBAPXQKEEPXKQB-SNVBAGLBSA-N	1	0	254.765	1.652	50	0		CDAARO
Cc1nc(CN2CCCO[C@@H](C[NH+]3CCCCC3)C2)c[nH]1	ZINC000215375525	358886532	/nfs/dbraw/zinc/88/65/32/358886532.db2.gz	OMCIKQHISSAVRH-INIZCTEOSA-N	1	0	292.427	1.795	50	0		CDAARO
O=C(c1cn[nH]c1)N1CCC([NH+]2CCCCCC2)CC1	ZINC000215396136	358887506	/nfs/dbraw/zinc/88/75/06/358887506.db2.gz	OACMWTFMZDQHRQ-UHFFFAOYSA-N	1	0	276.384	1.890	50	0		CDAARO
CNC(=O)C[C@@H](C)[N@H+](C)Cc1cc(C(C)(C)C)n[nH]1	ZINC000215463504	358890145	/nfs/dbraw/zinc/89/01/45/358890145.db2.gz	IKHRIKBICYKFCR-SNVBAGLBSA-N	1	0	266.389	1.664	50	0		CDAARO
O=C(C[NH2+]C1CC1)N[C@@H](c1cccnc1)C(F)(F)F	ZINC000215679573	358898687	/nfs/dbraw/zinc/89/86/87/358898687.db2.gz	ZDDLZUPEXUZXMW-NSHDSACASA-N	1	0	273.258	1.553	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@@H](CO)N(Cc2ccncc2Cl)C1	ZINC000215684115	358899002	/nfs/dbraw/zinc/89/90/02/358899002.db2.gz	KFYAIQQOSRTUMD-NEPJUHHUSA-N	1	0	269.776	1.232	50	0		CDAARO
C[C@@H](C[NH2+][C@@H]1CC(C)(C)OC1(C)C)CS(C)(=O)=O	ZINC000119688451	358963052	/nfs/dbraw/zinc/96/30/52/358963052.db2.gz	LAXFCYYZKNBCRH-WDEREUQCSA-N	1	0	277.430	1.603	50	0		CDAARO
CC(C)[C@H](NC(=O)CCC[NH+]1CCCC1)c1ncnn1C	ZINC000219311839	359087278	/nfs/dbraw/zinc/08/72/78/359087278.db2.gz	GYXIASRXNNGWOW-AWEZNQCLSA-N	1	0	293.415	1.504	50	0		CDAARO
Cc1ccccc1OCC(=O)NCCC[NH+](C)C	ZINC000013613170	359174057	/nfs/dbraw/zinc/17/40/57/359174057.db2.gz	VAXXCZGPQAYDBY-UHFFFAOYSA-N	1	0	250.342	1.442	50	0		CDAARO
CN(Cc1ccccc1)c1cc(C2CC(O)C2)[nH+]c(N)n1	ZINC000222935881	359384997	/nfs/dbraw/zinc/38/49/97/359384997.db2.gz	GDVRRWLEHLTTPW-UHFFFAOYSA-N	1	0	284.363	1.934	50	0		CDAARO
CCOC(=O)[C@@H]1C[C@H]2C(=O)NCCCCCC[NH2+][C@H]2C1	ZINC000257182580	359457068	/nfs/dbraw/zinc/45/70/68/359457068.db2.gz	PQLRIMAJLGCXIT-UPJWGTAASA-N	1	0	282.384	1.224	50	0		CDAARO
O=C1C[C@@H](C[NH+]2CCC(C(F)(F)F)CC2)CN1	ZINC000585094218	482828664	/nfs/dbraw/zinc/82/86/64/482828664.db2.gz	RRGYYEAPTJSCTG-MRVPVSSYSA-N	1	0	250.264	1.397	50	0		CDAARO
O[C@]1(C[N@@H+]2CCc3cccc(F)c3C2)CCCOC1	ZINC000585094385	482828819	/nfs/dbraw/zinc/82/88/19/482828819.db2.gz	VKWIGXBWNFZAHH-HNNXBMFYSA-N	1	0	265.328	1.725	50	0		CDAARO
COCC(=O)N(C)C[C@H]1CC[N@H+](Cc2ccc(C)s2)C1	ZINC000408516781	359900105	/nfs/dbraw/zinc/90/01/05/359900105.db2.gz	XZAFEOQXGHQUHP-CYBMUJFWSA-N	1	0	296.436	1.983	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OCC(=O)N(C)C(C)C	ZINC000408525706	359935972	/nfs/dbraw/zinc/93/59/72/359935972.db2.gz	VQQISRNPFXNECT-LBPRGKRZSA-N	1	0	272.389	1.408	50	0		CDAARO
C[C@@H]1CCC[C@H](OCC(=O)N2CCCC[C@H]2C[NH3+])C1	ZINC000521394599	359966732	/nfs/dbraw/zinc/96/67/32/359966732.db2.gz	ZWAFPDOFBODFFX-RDBSUJKOSA-N	1	0	268.401	1.922	50	0		CDAARO
Cc1cc2cn[nH]c2c(C(=O)N2CCN(C)C[C@@H]2C)c1	ZINC000089610704	360183186	/nfs/dbraw/zinc/18/31/86/360183186.db2.gz	CMWJFEHRBGCJIC-NSHDSACASA-N	1	0	272.352	1.647	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@H]1CCCN(C(=O)c2ccn(C)n2)C1	ZINC000409421170	360230354	/nfs/dbraw/zinc/23/03/54/360230354.db2.gz	ULEBCZWXYWQVTD-ZDUSSCGKSA-N	1	0	287.367	1.711	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)C[C@H]1CCCO1	ZINC000248105826	360362319	/nfs/dbraw/zinc/36/23/19/360362319.db2.gz	FUIKKEACYSUBOZ-MGPQQGTHSA-N	1	0	266.385	1.641	50	0		CDAARO
O=C(Cc1ccc2c(c1)CCC2)NC[C@H]1CCC[NH2+]C1	ZINC000178484434	189119806	/nfs/dbraw/zinc/11/98/06/189119806.db2.gz	OWEJXJKJCMFMBO-AWEZNQCLSA-N	1	0	272.392	1.834	50	0		CDAARO
Cc1cc(=O)cc(C(=O)NCCCC[NH+]2CCCC2)[nH]1	ZINC000426486064	360675211	/nfs/dbraw/zinc/67/52/11/360675211.db2.gz	HPZBTMMXRGDZRS-UHFFFAOYSA-N	1	0	277.368	1.289	50	0		CDAARO
CCCCc1nc(CN2CCN([C@H]3CC[NH2+]C3)CC2)c[nH]1	ZINC000426720051	360698916	/nfs/dbraw/zinc/69/89/16/360698916.db2.gz	ZNDYKPSLQBIUAZ-HNNXBMFYSA-N	1	0	291.443	1.232	50	0		CDAARO
C[NH2+]Cc1nnc(SC[C@H]2CCCOC2)n1C	ZINC000426506567	360934789	/nfs/dbraw/zinc/93/47/89/360934789.db2.gz	GSZUPBXMBICMGN-VIFPVBQESA-N	1	0	256.375	1.053	50	0		CDAARO
Cn1c(SCCCCCCO)nnc1[C@H]1CCC[NH2+]C1	ZINC000426535913	361005096	/nfs/dbraw/zinc/00/50/96/361005096.db2.gz	QJBXIFJMVXBKOJ-LBPRGKRZSA-N	1	0	298.456	1.927	50	0		CDAARO
C[NH+](C)Cc1ccnc(NC(=O)[C@H]2CCc3c[nH]nc3C2)c1	ZINC000267306377	363791915	/nfs/dbraw/zinc/79/19/15/363791915.db2.gz	YWASVUNNJXUPRK-LBPRGKRZSA-N	1	0	299.378	1.610	50	0		CDAARO
CC(=O)c1ccc(N2CCN(C[C@H](C)O)C[C@@H]2C)nc1	ZINC000248664054	363898837	/nfs/dbraw/zinc/89/88/37/363898837.db2.gz	JALYUSJFNXSZPO-RYUDHWBXSA-N	1	0	277.368	1.176	50	0		CDAARO
CC(C)COc1cncc(N2CC[C@H]([NH+]3CC=CC3)C2)n1	ZINC000101554534	363937280	/nfs/dbraw/zinc/93/72/80/363937280.db2.gz	NQQOEJQULZZALJ-AWEZNQCLSA-N	1	0	288.395	1.962	50	0		CDAARO
O=C(C[N@H+]1CC[C@H](CO)C1)NCCCC1CCCCC1	ZINC000089818319	366939421	/nfs/dbraw/zinc/93/94/21/366939421.db2.gz	AXDYJVNDWIZIQH-HNNXBMFYSA-N	1	0	282.428	1.777	50	0		CDAARO
CCC[C@@H](C(=O)NCCc1c(C)noc1C)[NH+](C)C	ZINC000089949415	366978796	/nfs/dbraw/zinc/97/87/96/366978796.db2.gz	XGUUTYJLJVOMLB-ZDUSSCGKSA-N	1	0	267.373	1.680	50	0		CDAARO
COC(=O)N1CCC[C@H]([NH2+][C@H]2CCCSC2)C1	ZINC000097084522	283901164	/nfs/dbraw/zinc/90/11/64/283901164.db2.gz	IFAHXWCEDTWEFE-QWRGUYRKSA-N	1	0	258.387	1.702	50	0		CDAARO
C[C@H](Oc1cccc(F)c1)C(=O)N1C[C@@H]2C[N@@H+](C)C[C@@H]2C1	ZINC000252478954	367553385	/nfs/dbraw/zinc/55/33/85/367553385.db2.gz	AYAUAKRUMILIJY-RWMBFGLXSA-N	1	0	292.354	1.613	50	0		CDAARO
CCn1ccnc1C[NH2+][C@@H]1CCCN(c2ncccn2)C1	ZINC000012306155	367664118	/nfs/dbraw/zinc/66/41/18/367664118.db2.gz	AQJOIGFNJKMMNU-CYBMUJFWSA-N	1	0	286.383	1.452	50	0		CDAARO
C[C@@]([NH3+])(C(=O)N1CCN(c2ccc(F)cc2)CC1)C1CC1	ZINC000037614277	369353692	/nfs/dbraw/zinc/35/36/92/369353692.db2.gz	PJJSYTMGXHKTHH-INIZCTEOSA-N	1	0	291.370	1.602	50	0		CDAARO
COC(=O)[C@@H]1C[C@@H](O)C[N@@H+]1C[C@@H]1C(C)=CCC[C@H]1C	ZINC000249056474	284152885	/nfs/dbraw/zinc/15/28/85/284152885.db2.gz	GVMYSEUEEJARIT-SYQHCUMBSA-N	1	0	267.369	1.587	50	0		CDAARO
Cc1ccc(OC[C@H](O)C[NH2+][C@@H](C)CCO)c(C)c1	ZINC000019146168	370141813	/nfs/dbraw/zinc/14/18/13/370141813.db2.gz	DEOOYKKCFLVNMU-UONOGXRCSA-N	1	0	267.369	1.404	50	0		CDAARO
CC[C@@H]1CCCCCN1C(=O)[C@H]1CN(C)CCO1	ZINC000089948275	370197069	/nfs/dbraw/zinc/19/70/69/370197069.db2.gz	UUJYQBIYORHNFR-CHWSQXEVSA-N	1	0	254.374	1.498	50	0		CDAARO
O=C(Nc1ccc2ccccc2c1)N[C@@H]1C[NH2+]CC[C@H]1O	ZINC000299791024	372764801	/nfs/dbraw/zinc/76/48/01/372764801.db2.gz	CLYHRRVWWXSBKS-HUUCEWRRSA-N	1	0	285.347	1.684	50	0		CDAARO
O=C(NC[C@]1(O)CCC[NH2+]C1)c1ccc(F)cc1Cl	ZINC000299757480	372744937	/nfs/dbraw/zinc/74/49/37/372744937.db2.gz	KCSRNMJHMBFTCQ-ZDUSSCGKSA-N	1	0	286.734	1.323	50	0		CDAARO
CCc1nnc(CNC(=O)C[C@@H](C)n2ccnc2C)s1	ZINC000299778569	372754852	/nfs/dbraw/zinc/75/48/52/372754852.db2.gz	PSSDEZIZWJTFMB-SECBINFHSA-N	1	0	293.396	1.873	50	0		CDAARO
Cc1ccc(C)c(NC(=O)N[C@@H]2C[NH2+]CC[C@H]2O)c1	ZINC000299797613	372768960	/nfs/dbraw/zinc/76/89/60/372768960.db2.gz	NMQWYWLRNYOMIS-CHWSQXEVSA-N	1	0	263.341	1.148	50	0		CDAARO
C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1CCN1CCOCC1	ZINC000340884954	373095845	/nfs/dbraw/zinc/09/58/45/373095845.db2.gz	LLBNVFZMNNUFBF-QLFBSQMISA-N	1	0	252.402	1.972	50	0		CDAARO
Cc1c[nH]cc1C(=O)N1CCOC[C@H]1[C@H]1CCC[N@H+]1C	ZINC000520566404	373824175	/nfs/dbraw/zinc/82/41/75/373824175.db2.gz	XXVQAFHFSGAGHJ-KGLIPLIRSA-N	1	0	277.368	1.258	50	0		CDAARO
Cn1c(C[NH2+][C@H]2CCCC[C@H]2O)nc2ccccc21	ZINC000104313587	374267252	/nfs/dbraw/zinc/26/72/52/374267252.db2.gz	OJLPVMGSZNPXDL-GXTWGEPZSA-N	1	0	259.353	1.966	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@H]1NC(=O)Cc1cccc(F)c1F	ZINC000094712185	374644526	/nfs/dbraw/zinc/64/45/26/374644526.db2.gz	HGNDBGXPLWRIFQ-BXKDBHETSA-N	1	0	268.307	1.764	50	0		CDAARO
CC1(C)C[C@H]([NH2+]CCc2nnc3n2CCC3)C(C)(C)O1	ZINC000095419915	374922193	/nfs/dbraw/zinc/92/21/93/374922193.db2.gz	PGYZFRLHEAATCN-NSHDSACASA-N	1	0	278.400	1.703	50	0		CDAARO
Cc1cncc(C(=O)OC[C@@H]2C[N@H+](CC(C)C)CCO2)c1	ZINC000095426594	374927423	/nfs/dbraw/zinc/92/74/23/374927423.db2.gz	GJOOFQDUXCYPLV-HNNXBMFYSA-N	1	0	292.379	1.904	50	0		CDAARO
Cc1cccc(CN2CCN(C(=O)[C@H]3CC[NH2+]C3)CC2)c1	ZINC000055415135	375166665	/nfs/dbraw/zinc/16/66/65/375166665.db2.gz	GBLUMOVOXVKQPT-INIZCTEOSA-N	1	0	287.407	1.249	50	0		CDAARO
[NH3+]C[C@@H]1CCCN1C(=O)[C@H]1C[C@H]1c1cccc(F)c1	ZINC000299745963	375205262	/nfs/dbraw/zinc/20/52/62/375205262.db2.gz	UIGOMBJARAUVKC-IHRRRGAJSA-N	1	0	262.328	1.879	50	0		CDAARO
Nc1cc(N)[nH+]c(SCC(=O)Nc2cccc(F)c2)n1	ZINC000003425545	375692030	/nfs/dbraw/zinc/69/20/30/375692030.db2.gz	QSNUDUPDNHFZHY-UHFFFAOYSA-N	1	0	293.327	1.511	50	0		CDAARO
c1cc(C[N@@H+]2CCS[C@@H]3COCC[C@H]32)ccn1	ZINC000246245403	376581251	/nfs/dbraw/zinc/58/12/51/376581251.db2.gz	HDVUHCFWUIJPGR-CHWSQXEVSA-N	1	0	250.367	1.788	50	0		CDAARO
C=Cn1cc(C(=O)NCC[C@H]2C[N@H+](C(C)C)CCO2)cn1	ZINC000067855383	377266155	/nfs/dbraw/zinc/26/61/55/377266155.db2.gz	YOTRIFNEQKVDAQ-AWEZNQCLSA-N	1	0	292.383	1.213	50	0		CDAARO
O=C1CC[C@@H]([NH2+]CC2(CO)CCCC2)CCN1CC1CC1	ZINC000067964892	296325103	/nfs/dbraw/zinc/32/51/03/296325103.db2.gz	CKZNHIQRRKDDIS-OAHLLOKOSA-N	1	0	294.439	1.920	50	0		CDAARO
CC(C)C[N@@H+]1CCCN(C(=O)C2CCOCC2)CC1	ZINC000363379869	390392435	/nfs/dbraw/zinc/39/24/35/390392435.db2.gz	YPEFTQGHMLRPAE-UHFFFAOYSA-N	1	0	268.401	1.603	50	0		CDAARO
COC(=O)c1ccc(NC(=O)N2CC[C@H]([NH3+])C2)cc1Cl	ZINC000096150674	390913105	/nfs/dbraw/zinc/91/31/05/390913105.db2.gz	RMXCOPVDZJVBQQ-QMMMGPOBSA-N	1	0	297.742	1.692	50	0		CDAARO
Cc1cc(C(=O)N2C[C@@H]3CCC[NH2+][C@@H]3C2)cc(C)n1	ZINC000097551309	390917679	/nfs/dbraw/zinc/91/76/79/390917679.db2.gz	IPDBASIBVAOWMU-GXTWGEPZSA-N	1	0	259.353	1.522	50	0		CDAARO
CS(=O)(=O)CC1(C[NH2+]Cc2cccc(F)c2F)CC1	ZINC000096449361	533330179	/nfs/dbraw/zinc/33/01/79/533330179.db2.gz	WBOLBGUFMQJZGG-UHFFFAOYSA-N	1	0	289.347	1.879	50	0		CDAARO
CCc1nc2n(n1)CCC[C@@H]2N[C@H]1CCN(C(C)C)C1=O	ZINC000088559465	391425270	/nfs/dbraw/zinc/42/52/70/391425270.db2.gz	GAUZHQUIMYVTEY-RYUDHWBXSA-N	1	0	291.399	1.274	50	0		CDAARO
CO[C@]1(C)C[C@@H](N(C)C(=O)[C@@H]2CCC[NH2+]C2)C1(C)C	ZINC000121653702	391561303	/nfs/dbraw/zinc/56/13/03/391561303.db2.gz	OJRXYJZVMZASFW-LALPHHSUSA-N	1	0	268.401	1.648	50	0		CDAARO
C[N@@H+]1CCN2CCN(Cc3ccc4[nH]ccc4c3)C[C@H]2C1	ZINC000244874258	391681489	/nfs/dbraw/zinc/68/14/89/391681489.db2.gz	WXNUPSQUGQXIEI-MRXNPFEDSA-N	1	0	284.407	1.600	50	0		CDAARO
CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+](C[C@H]2COCCO2)C1	ZINC000431010249	391706215	/nfs/dbraw/zinc/70/62/15/391706215.db2.gz	NFVAZVCQMPNXPU-KKUMJFAQSA-N	1	0	298.427	1.419	50	0		CDAARO
C[C@@H]1C[C@H](C)CN(C(=O)C[N@@H+]2C[C@H]3CCC[C@H]32)C1	ZINC000252511491	391911643	/nfs/dbraw/zinc/91/16/43/391911643.db2.gz	HHERRFZGXGBAHR-XJFOESAGSA-N	1	0	250.386	1.975	50	0		CDAARO
O=C(Cn1ccc(C(F)(F)F)n1)NC[C@@H]1CCC[NH2+]C1	ZINC000261714902	131164217	/nfs/dbraw/zinc/16/42/17/131164217.db2.gz	JRUXWPPWFZHKPS-SECBINFHSA-N	1	0	290.289	1.018	50	0		CDAARO
C[C@@H]1Cc2ccccc2N1CCNC(=O)[C@H]1CC[C@H]([NH3+])C1	ZINC000263258882	131287610	/nfs/dbraw/zinc/28/76/10/131287610.db2.gz	LPYHWIFDPIVHDG-SNPRPXQTSA-N	1	0	287.407	1.681	50	0		CDAARO
[NH3+][C@@H]1CCC[C@@H](C(=O)N2CCO[C@H](c3nccs3)C2)C1	ZINC000269235344	132138648	/nfs/dbraw/zinc/13/86/48/132138648.db2.gz	GGQFUTAIAOWQKH-UTUOFQBUSA-N	1	0	295.408	1.561	50	0		CDAARO
CCC[C@@]1(COC)CCC[N@@H+]1Cc1nc(N(C)C)no1	ZINC000192824941	393169786	/nfs/dbraw/zinc/16/97/86/393169786.db2.gz	MECNINORBDYHDC-AWEZNQCLSA-N	1	0	282.388	1.917	50	0		CDAARO
C[C@@H](O)C[NH+]1CCN(C/C=C\c2ccccc2)CC1	ZINC000096295234	393174897	/nfs/dbraw/zinc/17/48/97/393174897.db2.gz	UGZQUESJJNOEBQ-GTBONMDNSA-N	1	0	260.381	1.698	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)C1	ZINC000178593023	148068105	/nfs/dbraw/zinc/06/81/05/148068105.db2.gz	HMCSCYBYYWSGLP-GFCCVEGCSA-N	1	0	297.358	1.667	50	0		CDAARO
CCS(=O)(=O)NCC[NH2+][C@@H]1CC[C@H](C)C[C@@H]1C	ZINC000097108737	286687253	/nfs/dbraw/zinc/68/72/53/286687253.db2.gz	OGXCHLIVQXYDQI-SDDRHHMPSA-N	1	0	262.419	1.340	50	0		CDAARO
COc1cc(CC[NH3+])c(OC)cc1Br	ZINC000002564752	169810093	/nfs/dbraw/zinc/81/00/93/169810093.db2.gz	YMHOBZXQZVXHBM-UHFFFAOYSA-N	1	0	260.131	1.968	50	0	in-man	CDAARO
CC(C)OCCC[NH2+]C[C@@H](O)COc1ccccc1	ZINC000003324730	169879340	/nfs/dbraw/zinc/87/93/40/169879340.db2.gz	PRTYRJYPGACTNO-CQSZACIVSA-N	1	0	267.369	1.831	50	0		CDAARO
c1cc(C[NH2+]C2CCCC2)n(CCN2CCOCC2)c1	ZINC000004680818	169997932	/nfs/dbraw/zinc/99/79/32/169997932.db2.gz	PJYOQDQKEBTVEG-UHFFFAOYSA-N	1	0	277.412	1.853	50	0		CDAARO
CCOc1cc(C[NH2+]C2CCCC2)ccc1OCC(N)=O	ZINC000006702446	170229796	/nfs/dbraw/zinc/22/97/96/170229796.db2.gz	HWXBYJNRPICEBK-UHFFFAOYSA-N	1	0	292.379	1.982	50	0		CDAARO
CC1(C)CC(NC(=S)NC[C@H]2CCCO2)CC(C)(C)[NH2+]1	ZINC000007570374	170291137	/nfs/dbraw/zinc/29/11/37/170291137.db2.gz	HIIQROULIDWTEP-GFCCVEGCSA-N	1	0	299.484	1.939	50	0		CDAARO
COc1cc(C(=O)N2CCC([NH3+])CC2)cc(OC)c1OC	ZINC000015423811	170665845	/nfs/dbraw/zinc/66/58/45/170665845.db2.gz	FTWFIAQACVVSRK-UHFFFAOYSA-N	1	0	294.351	1.276	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNS(=O)(=O)c1ccc(N)cc1	ZINC000020281505	171132908	/nfs/dbraw/zinc/13/29/08/171132908.db2.gz	XWUHLWBFLJYXIV-GFCCVEGCSA-N	1	0	283.397	1.031	50	0		CDAARO
Clc1ccc(-c2noc(CN3CC[NH2+]CC3)n2)cc1	ZINC000020280625	171133092	/nfs/dbraw/zinc/13/30/92/171133092.db2.gz	UTWGGPUOGOAQCO-UHFFFAOYSA-N	1	0	278.743	1.795	50	0		CDAARO
CC(C)CCc1noc(CN2CC[N@@H+]3CCC[C@@H]3C2)n1	ZINC000020453411	171208390	/nfs/dbraw/zinc/20/83/90/171208390.db2.gz	UEIFNKNYWXDPOE-CYBMUJFWSA-N	1	0	278.400	1.938	50	0		CDAARO
[NH3+][C@H](Cc1ccccc1)C(=O)NCc1cccnc1	ZINC000021503063	171306321	/nfs/dbraw/zinc/30/63/21/171306321.db2.gz	APQHKTDKDIVIPY-CQSZACIVSA-N	1	0	255.321	1.268	50	0		CDAARO
CC(C)(C)OC(=O)NCCC[C@H]([NH3+])[C@H](O)C(F)(F)F	ZINC000034537886	171843252	/nfs/dbraw/zinc/84/32/52/171843252.db2.gz	UHEFDJGMLCIEND-YUMQZZPRSA-N	1	0	286.294	1.542	50	0		CDAARO
CCCN(C(=O)Cc1ccccc1OC)[C@@H]1CC[NH2+]C1	ZINC000037540017	173261369	/nfs/dbraw/zinc/26/13/69/173261369.db2.gz	LEXRBRUTKQNQQF-CQSZACIVSA-N	1	0	276.380	1.838	50	0		CDAARO
OC[C@H]1CC[N@H+](Cc2ccc3[nH]ccc3c2)C[C@H]1O	ZINC000072137291	176322580	/nfs/dbraw/zinc/32/25/80/176322580.db2.gz	YHIGVBMIHLXLSA-UKRRQHHQSA-N	1	0	260.337	1.343	50	0		CDAARO
O=C(C[NH+]1CCCCCCC1)N1CCCn2cncc2C1	ZINC000072157899	176329248	/nfs/dbraw/zinc/32/92/48/176329248.db2.gz	PSZPXZPRGGVMBS-UHFFFAOYSA-N	1	0	290.411	1.882	50	0		CDAARO
CCCSc1ncc(CN2CC[C@H]3C[NH2+]C[C@H]32)cn1	ZINC000077425725	177265964	/nfs/dbraw/zinc/26/59/64/177265964.db2.gz	NRDNJKFYHWEPCO-QWHCGFSZSA-N	1	0	278.425	1.772	50	0		CDAARO
C([C@H]1CCOC1)N1CCC[N@@H+](C2CCCC2)CC1	ZINC000336555942	275397748	/nfs/dbraw/zinc/39/77/48/275397748.db2.gz	NFFCVTRBWWZRMA-CQSZACIVSA-N	1	0	252.402	1.973	50	0		CDAARO
C([NH2+]C(C1CC1)C1CC1)[C@@]1(N2CCOCC2)CCSC1	ZINC000095420882	275725527	/nfs/dbraw/zinc/72/55/27/275725527.db2.gz	GGLBDANBKUSCOZ-INIZCTEOSA-N	1	0	296.480	1.973	50	0		CDAARO
C1CC1N1CC[C@@H]([NH2+][C@H]2CCC[C@H]3OCC[C@@H]32)C1	ZINC000095423808	276849465	/nfs/dbraw/zinc/84/94/65/276849465.db2.gz	DDKVDDDJKINLNF-REBRKWNGSA-N	1	0	250.386	1.770	50	0		CDAARO
COC(=O)N1CCC([NH2+][C@H](C)[C@H]2CCCOC2)CC1	ZINC000096003154	277071120	/nfs/dbraw/zinc/07/11/20/277071120.db2.gz	PKPBMXWLQXWKAL-NEPJUHHUSA-N	1	0	270.373	1.622	50	0		CDAARO
CC(=O)NCCC(=O)N(CC[NH+]1CCCCCC1)C(C)C	ZINC000055341613	278097707	/nfs/dbraw/zinc/09/77/07/278097707.db2.gz	OPKXJAQTXBKGBJ-UHFFFAOYSA-N	1	0	297.443	1.626	50	0		CDAARO
CC1(C)C[N@H+](CCn2cncn2)Cc2ccccc2O1	ZINC000289138780	278333715	/nfs/dbraw/zinc/33/37/15/278333715.db2.gz	YJVNPOZBTJGXMC-UHFFFAOYSA-N	1	0	272.352	1.951	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(CC1)COCC[NH2+]2	ZINC000091296933	278383382	/nfs/dbraw/zinc/38/33/82/278383382.db2.gz	JDCXGSPMQUVCTJ-UHFFFAOYSA-N	1	0	256.346	1.376	50	0		CDAARO
Cc1[nH]ccc1C(=O)N[C@H]1[C@H]2CCO[C@H]2[C@@H]1[NH+]1CCCC1	ZINC000219518636	280186663	/nfs/dbraw/zinc/18/66/63/280186663.db2.gz	XXQFPCYHQJZKLN-LXTVHRRPSA-N	1	0	289.379	1.305	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H](c2ccccc2)N(C)C)C[C@@H](C)[NH2+]1	ZINC000246668697	280297722	/nfs/dbraw/zinc/29/77/22/280297722.db2.gz	FFVDZFSBPSKDOB-NFAWXSAZSA-N	1	0	275.396	1.498	50	0		CDAARO
CC12CN3CC(C)(CN(C1)C3c1ccccc1)C2[NH3+]	ZINC000019330164	281613742	/nfs/dbraw/zinc/61/37/42/281613742.db2.gz	YWGYWZBYBCHDOX-UHFFFAOYSA-N	1	0	257.381	1.670	50	0		CDAARO
COC[C@H](C)NC(=S)NC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000007983759	293033844	/nfs/dbraw/zinc/03/38/44/293033844.db2.gz	YOEXRPLVYGZEQQ-JTQLQIEISA-N	1	0	287.473	1.795	50	0		CDAARO
COc1nc(N2CCC[C@H](CC[NH3+])C2)ncc1F	ZINC000534578241	328310904	/nfs/dbraw/zinc/31/09/04/328310904.db2.gz	XVKIGBFUEKGOKD-SECBINFHSA-N	1	0	254.309	1.190	50	0		CDAARO
COCC1(C[NH2+][C@@H](C)Cn2nc(C)cc2C)CC1	ZINC000534579033	328311152	/nfs/dbraw/zinc/31/11/52/328311152.db2.gz	XRDPYLPZYJSDLA-LBPRGKRZSA-N	1	0	251.374	1.905	50	0		CDAARO
Cn1nccc1CSc1nnc([C@H]2CCC[NH2+]C2)n1C	ZINC000534582444	328312312	/nfs/dbraw/zinc/31/23/12/328312312.db2.gz	FREQCVIJQHLTBG-JTQLQIEISA-N	1	0	292.412	1.308	50	0		CDAARO
C[C@H](N=c1nc(N(C)C)[nH]s1)C1CC[NH+](C)CC1	ZINC000534591707	328318407	/nfs/dbraw/zinc/31/84/07/328318407.db2.gz	WICDVJIRJAWVMO-VIFPVBQESA-N	1	0	269.418	1.168	50	0		CDAARO
CC[N@H+](C)C1(CNC(=O)c2[nH]cnc2C)CCCC1	ZINC000534590274	328317816	/nfs/dbraw/zinc/31/78/16/328317816.db2.gz	ARYJWDHTJMOFCG-UHFFFAOYSA-N	1	0	264.373	1.712	50	0		CDAARO
C[C@H](C[NH+]1CCCCC1)C(=O)NCCc1ncc[nH]1	ZINC000534636204	328333757	/nfs/dbraw/zinc/33/37/57/328333757.db2.gz	OMSRGHUTQYTWKS-GFCCVEGCSA-N	1	0	264.373	1.190	50	0		CDAARO
CC1(C(=O)NC[C@H]2CC[N@@H+](C3CCCCC3)C2)COC1	ZINC000534635499	328333465	/nfs/dbraw/zinc/33/34/65/328333465.db2.gz	GWZJIZCYQCRASB-CYBMUJFWSA-N	1	0	280.412	1.794	50	0		CDAARO
COC[C@@H](O)C[NH2+][C@H](C)[C@@H]1COc2ccccc21	ZINC000185576292	323392780	/nfs/dbraw/zinc/39/27/80/323392780.db2.gz	FEMHEBPCTAKINK-MDZLAQPJSA-N	1	0	251.326	1.148	50	0		CDAARO
c1cn(Cc2cccnc2)c(-c2cc3n(n2)CCC[NH2+]C3)n1	ZINC000072438668	327110640	/nfs/dbraw/zinc/11/06/40/327110640.db2.gz	ADNXCXTZHOLXAO-UHFFFAOYSA-N	1	0	294.362	1.683	50	0		CDAARO
Cc1cccc(OCCC(=O)N(C)[C@H]2CC[NH2+]C2)c1C	ZINC000179121205	329205495	/nfs/dbraw/zinc/20/54/95/329205495.db2.gz	JNHCYIFNKVHZBH-AWEZNQCLSA-N	1	0	276.380	1.893	50	0		CDAARO
Cn1ncc2c1ncnc2N[C@H]1C[C@@H]([NH+](C)C)C1(C)C	ZINC000585092410	482828973	/nfs/dbraw/zinc/82/89/73/482828973.db2.gz	VJRQKINAHPVSQX-WDEREUQCSA-N	1	0	274.372	1.504	50	0		CDAARO
COc1cccc(C[N@H+](C)CC[C@@H]2CCS(=O)(=O)C2)c1	ZINC000670445457	482992687	/nfs/dbraw/zinc/99/26/87/482992687.db2.gz	LMWXSZJJKHKZJR-CYBMUJFWSA-N	1	0	297.420	1.952	50	0		CDAARO
Cc1ncn(CCNC(=O)C[NH+]2CCCCC2)c1C	ZINC000670448880	483004591	/nfs/dbraw/zinc/00/45/91/483004591.db2.gz	HKRGTIYHMKITII-UHFFFAOYSA-N	1	0	264.373	1.102	50	0		CDAARO
C[N@@H+](Cc1cnc(N)s1)C[C@H]1CC(=O)N(C(C)(C)C)C1	ZINC000670455267	483031216	/nfs/dbraw/zinc/03/12/16/483031216.db2.gz	KHWJGDMEHAJNFR-SNVBAGLBSA-N	1	0	296.440	1.804	50	0		CDAARO
CC[N@@H+]1CC[C@H](CNc2ncc(F)c(OC)n2)C1	ZINC000670458893	483041043	/nfs/dbraw/zinc/04/10/43/483041043.db2.gz	RBTAYVOFFPIDFD-SECBINFHSA-N	1	0	254.309	1.378	50	0		CDAARO
Nc1ncc(C[N@@H+]2CCC[C@H](c3ccncn3)C2)s1	ZINC000670461276	483043525	/nfs/dbraw/zinc/04/35/25/483043525.db2.gz	LQQJPCNUQDNZII-JTQLQIEISA-N	1	0	275.381	1.895	50	0		CDAARO
O[C@H]1C[C@H]2C[N@@H+](Cc3ccsc3)C[C@H]2C[C@@H]1O	ZINC000670471481	483075627	/nfs/dbraw/zinc/07/56/27/483075627.db2.gz	PCJSNXQXHWRWOD-RNJOBUHISA-N	1	0	253.367	1.312	50	0		CDAARO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)COC[C@H]1CCCO1	ZINC000084544267	483286597	/nfs/dbraw/zinc/28/65/97/483286597.db2.gz	DENPXIZWLDUSPJ-HUUCEWRRSA-N	1	0	298.427	1.419	50	0		CDAARO
CCOc1cccc(C[NH2+]CCN2CCOCC2)c1	ZINC000019871909	521362715	/nfs/dbraw/zinc/36/27/15/521362715.db2.gz	DBVGFUXWZIPTOJ-UHFFFAOYSA-N	1	0	264.369	1.507	50	0		CDAARO
[NH3+][C@H]1CCC[C@@H](CNS(=O)(=O)CCC2CCC2)C1	ZINC000261590484	527403246	/nfs/dbraw/zinc/40/32/46/527403246.db2.gz	XBYLMXXFOKGFKS-OLZOCXBDSA-N	1	0	274.430	1.614	50	0		CDAARO
CC(C)Oc1cccc([C@@H](O)CNC(=O)[C@H](C)[NH+](C)C)c1	ZINC000096475382	528241319	/nfs/dbraw/zinc/24/13/19/528241319.db2.gz	BPGFBNBJWDAVBZ-WFASDCNBSA-N	1	0	294.395	1.574	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)Cc2ccc(C)nc2)C1	ZINC000269100387	536451921	/nfs/dbraw/zinc/45/19/21/536451921.db2.gz	AYMAHNRAPDUINY-AWEZNQCLSA-N	1	0	261.369	1.391	50	0		CDAARO
[NH3+]C[C@@H]1CCCCN1C(=O)CN1CCc2sccc2C1	ZINC000097019537	567902869	/nfs/dbraw/zinc/90/28/69/567902869.db2.gz	NSMUZRUWZRUJLL-ZDUSSCGKSA-N	1	0	293.436	1.446	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]Cc1cccc(Cn2cncn2)c1	ZINC000097159309	567904955	/nfs/dbraw/zinc/90/49/55/567904955.db2.gz	MDTQQWMHWNBVSB-UHFFFAOYSA-N	1	0	296.378	1.956	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@@H]1c1ccc(NS(C)(=O)=O)cc1	ZINC000757215129	577036214	/nfs/dbraw/zinc/03/62/14/577036214.db2.gz	VAGOQANJCNJSJX-MFKMUULPSA-N	1	0	268.382	1.914	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@](O)([C@H]([NH3+])C2CCC2)C1	ZINC000958528661	613975658	/nfs/dbraw/zinc/97/56/58/613975658.db2.gz	YMVHQUHSTJPBGY-IUODEOHRSA-N	1	0	284.400	1.876	50	0		CDAARO
CCc1nccn1CCC[NH2+]Cc1cnc(OC)nc1	ZINC000952973355	615777386	/nfs/dbraw/zinc/77/73/86/615777386.db2.gz	NJBWQHDVGFEAFE-UHFFFAOYSA-N	1	0	275.356	1.424	50	0		CDAARO
C[C@H](Oc1cccnc1)C(=O)N1[C@H](C)CC(C[NH3+])C[C@H]1C	ZINC000888095978	617757817	/nfs/dbraw/zinc/75/78/17/617757817.db2.gz	MPMINJQHOOISDC-UPJWGTAASA-N	1	0	291.395	1.823	50	0		CDAARO
C[C@]1([NH3+])CCCC[C@@H]1C(=O)NCCCc1cc(=O)[nH][nH]1	ZINC000888096794	617759628	/nfs/dbraw/zinc/75/96/28/617759628.db2.gz	QWIRLWFPQLTZKE-RISCZKNCSA-N	1	0	280.372	1.072	50	0		CDAARO
CCc1cc(NCc2nonc2C)nc(N2CCCC2)[nH+]1	ZINC001704335635	1177692808	/nfs/dbraw/zinc/69/28/08/1177692808.db2.gz	CPMPCRGUHMWZOJ-UHFFFAOYSA-N	1	0	288.355	1.943	50	0		CDAARO
CCc1cc(NCc2nonc2C)nc(N(C)C)[nH+]1	ZINC001704343591	1177695665	/nfs/dbraw/zinc/69/56/65/1177695665.db2.gz	JWEITDRYKHRRPK-UHFFFAOYSA-N	1	0	262.317	1.409	50	0		CDAARO
C[N@@H+]1CCN(C(=O)[C@@]2(C)CCC(=O)NC2)C[C@H]1C(C)(C)C	ZINC000863947407	790431418	/nfs/dbraw/zinc/43/14/18/790431418.db2.gz	HBFIBGJBPYRUJB-LRDDRELGSA-N	1	0	295.427	1.091	50	0		CDAARO
CC(C)(C)OC(=O)N1C[C@@H]2CCCCN2C[C@H]1C[NH3+]	ZINC000238853198	790819363	/nfs/dbraw/zinc/81/93/63/790819363.db2.gz	IPIMDODCXFTYQT-NWDGAFQWSA-N	1	0	269.389	1.419	50	0		CDAARO
COc1ncc(-c2ccc(C3(O)C[NH2+]C3)cc2)cc1C	ZINC000935615934	789924242	/nfs/dbraw/zinc/92/42/42/789924242.db2.gz	AWXJSKUBYIBGHM-UHFFFAOYSA-N	1	0	270.332	1.856	50	0		CDAARO
[NH3+]CC[C@@H]1CN(c2cnc3ccc(Cl)cc3n2)CCO1	ZINC000032598412	791333517	/nfs/dbraw/zinc/33/35/17/791333517.db2.gz	KQCMMPFSAVPKOM-LLVKDONJSA-N	1	0	292.770	1.837	50	0		CDAARO
COc1cccc(OC)c1OCCC[NH2+]CCO	ZINC000002932766	795050152	/nfs/dbraw/zinc/05/01/52/795050152.db2.gz	KVLJZYZCRGAUPL-UHFFFAOYSA-N	1	0	255.314	1.055	50	0		CDAARO
Cc1nonc1CN[C@@H]1CCN(c2ccccc2)C1	ZINC000809744644	796092222	/nfs/dbraw/zinc/09/22/22/796092222.db2.gz	WDTHVDPECHWIFU-GFCCVEGCSA-N	1	0	258.325	1.747	50	0		CDAARO
COc1ccc(C[N@@H+]2CC[C@]3(CCC(=O)N3)C2)c(OC)c1	ZINC000675017124	899873751	/nfs/dbraw/zinc/87/37/51/899873751.db2.gz	KBWMZGSOICICEB-MRXNPFEDSA-N	1	0	290.363	1.558	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CNCc2cnccc2Cl)C1	ZINC000952869599	910421630	/nfs/dbraw/zinc/42/16/30/910421630.db2.gz	WJAMQSAAWQICAX-LBPRGKRZSA-N	1	0	283.803	1.793	50	0		CDAARO
CCNC(=O)CN(C)C[C@@H]1COC2(CCCCC2)O1	ZINC000952884014	910457703	/nfs/dbraw/zinc/45/77/03/910457703.db2.gz	RIWBIODBFKTDRS-GFCCVEGCSA-N	1	0	270.373	1.130	50	0		CDAARO
CC(=O)NC(C)(C)C[C@@H](C)[NH2+]CCC1(O)CCCC1	ZINC000820978104	925556385	/nfs/dbraw/zinc/55/63/85/925556385.db2.gz	NZLMTLHJTXSTOV-GFCCVEGCSA-N	1	0	270.417	1.965	50	0		CDAARO
CC[C@@H](NC(=O)CN1CC[NH+](CC)CC1)c1cccnc1	ZINC000822662307	925644155	/nfs/dbraw/zinc/64/41/55/925644155.db2.gz	JLQIOQWRGILXCA-OAHLLOKOSA-N	1	0	290.411	1.286	50	0		CDAARO
CCN1CCC(CNc2ccncc2F)([NH+](C)C)CC1	ZINC000823107385	925672517	/nfs/dbraw/zinc/67/25/17/925672517.db2.gz	VQRWRCKPXSLCHR-UHFFFAOYSA-N	1	0	280.391	1.471	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2cc(O)ccc2N)CCCCC1	ZINC000823653538	925711746	/nfs/dbraw/zinc/71/17/46/925711746.db2.gz	OGZSTBRUBKJLIV-UHFFFAOYSA-N	1	0	291.395	1.969	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+]1[C@H]1CCc2ccccc2C1	ZINC000824121229	925803588	/nfs/dbraw/zinc/80/35/88/925803588.db2.gz	JJUSZKLMMMKTBK-KKUMJFAQSA-N	1	0	275.348	1.152	50	0		CDAARO
C[N@@H+]1CCCC[C@H]1Cc1nc(CC(N)=O)nn1C(C)(C)C	ZINC000826842491	925919466	/nfs/dbraw/zinc/91/94/66/925919466.db2.gz	WVXWLBFACPJUBZ-NSHDSACASA-N	1	0	293.415	1.088	50	0		CDAARO
O=C(NC[C@@H]1CCCN(c2cc[nH+]cc2)C1)c1ccon1	ZINC000828228720	926089311	/nfs/dbraw/zinc/08/93/11/926089311.db2.gz	FOCOEADWGGVEKS-LBPRGKRZSA-N	1	0	286.335	1.716	50	0		CDAARO
c1cnn(CCC[NH+]2CCC(Cn3ccnc3)CC2)c1	ZINC000829083536	926232963	/nfs/dbraw/zinc/23/29/63/926232963.db2.gz	PYMUFLJMPBCTJV-UHFFFAOYSA-N	1	0	273.384	1.882	50	0		CDAARO
CO[C@H](C[N@@H+]1CCN(C)[C@H](c2nc(C)no2)C1)C(C)C	ZINC000585089071	930913006	/nfs/dbraw/zinc/91/30/06/930913006.db2.gz	APIITUJQVSOVPJ-QWHCGFSZSA-N	1	0	282.388	1.338	50	0		CDAARO
Cc1cc(C[NH2+][C@H]2C(=O)NCC2(C)C)ccc1F	ZINC000585116807	930969238	/nfs/dbraw/zinc/96/92/38/930969238.db2.gz	JFUFTICQVVDSJG-LBPRGKRZSA-N	1	0	250.317	1.748	50	0		CDAARO
CSC[C@H](C)C(=O)N[C@@H]1C[C@H]([NH+](C)C)C12CCC2	ZINC000585130859	931022534	/nfs/dbraw/zinc/02/25/34/931022534.db2.gz	DPPKEWIMOJCZRC-TUAOUCFPSA-N	1	0	270.442	1.975	50	0		CDAARO
COc1nc(N(C)CC[C@H](C)[NH+]2CCCC2)ncc1F	ZINC001529180688	969007524	/nfs/dbraw/zinc/00/75/24/969007524.db2.gz	ILYGFPHQGDJFFF-NSHDSACASA-N	1	0	282.363	1.935	50	0		CDAARO
CCc1nnc(CN2CCN(c3cc[nH+]cc3C)CC2)[nH]1	ZINC001506403491	975150479	/nfs/dbraw/zinc/15/04/79/975150479.db2.gz	BUJPOHHWTMPDDU-UHFFFAOYSA-N	1	0	286.383	1.393	50	0		CDAARO
CC(C)N(C)C[C@@H](C)[NH2+]CC1(Cn2cccn2)CC1	ZINC001506405979	975151732	/nfs/dbraw/zinc/15/17/32/975151732.db2.gz	YIXFHJRKPHKVBU-CQSZACIVSA-N	1	0	264.417	1.982	50	0		CDAARO
C[C@@H](CN(C)CCO)[NH2+]Cc1ccc(F)c(Cl)c1	ZINC001506415680	975152605	/nfs/dbraw/zinc/15/26/05/975152605.db2.gz	BIFCKSIWWZJJHV-JTQLQIEISA-N	1	0	274.767	1.881	50	0		CDAARO
Cc1ccc(N2CCN([C@@H]3C[NH+]4CCC3CC4)CC2)nc1	ZINC001506418596	975156902	/nfs/dbraw/zinc/15/69/02/975156902.db2.gz	SUYQYBKQUUISJA-MRXNPFEDSA-N	1	0	286.423	1.606	50	0		CDAARO
CC(=O)NC(C)(C)C[C@@H](C)[NH2+]CCc1nc(C)cc(C)n1	ZINC001506417787	975157285	/nfs/dbraw/zinc/15/72/85/975157285.db2.gz	BSKMJHBAFKZUFP-CYBMUJFWSA-N	1	0	292.427	1.919	50	0		CDAARO
CN(CCC[NH+]1CCCCC1)CCc1nccn1C	ZINC001506428115	975160559	/nfs/dbraw/zinc/16/05/59/975160559.db2.gz	MEUJROVLJBNULR-UHFFFAOYSA-N	1	0	264.417	1.770	50	0		CDAARO
CN(C(=O)c1cnc(C(C)(C)C)s1)[C@H]1CC[NH2+]C1	ZINC000179123076	342450530	/nfs/dbraw/zinc/45/05/30/342450530.db2.gz	ZHLMHXXLRJKRNR-VIFPVBQESA-N	1	0	267.398	1.875	50	0		CDAARO
C[C@H](C(=O)NC[C@H](C)Cn1ccnc1)[NH+]1CCCCCC1	ZINC000096446802	230374719	/nfs/dbraw/zinc/37/47/19/230374719.db2.gz	HBFKEXVBNRJNAD-LSDHHAIUSA-N	1	0	292.427	1.900	50	0		CDAARO
OC[C@@H]1CCC[N@@H+]1Cc1cccc(Cn2cccn2)c1	ZINC000220506351	230397324	/nfs/dbraw/zinc/39/73/24/230397324.db2.gz	XRBGPWYSZCHUOS-INIZCTEOSA-N	1	0	271.364	1.888	50	0		CDAARO
CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1nc(C)no1	ZINC000106789133	349491248	/nfs/dbraw/zinc/49/12/48/349491248.db2.gz	XWNFJSZOLVGVHX-QWHCGFSZSA-N	1	0	278.356	1.353	50	0		CDAARO
CC(C)OCCC[N@H+](CC(N)=O)Cc1ccccc1	ZINC000095953062	185040802	/nfs/dbraw/zinc/04/08/02/185040802.db2.gz	NLOPYBUGHYQFRJ-UHFFFAOYSA-N	1	0	264.369	1.789	50	0		CDAARO
CCCc1noc2ncc(C(=O)N[C@H]3CC[N@H+](C)C3)cc12	ZINC000095955375	185041616	/nfs/dbraw/zinc/04/16/16/185041616.db2.gz	HMWVSYOTWXFAOJ-NSHDSACASA-N	1	0	288.351	1.609	50	0		CDAARO
CN(CCCOc1ccc(F)cc1)C(=O)C(C)(C)[NH3+]	ZINC000095956846	185042972	/nfs/dbraw/zinc/04/29/72/185042972.db2.gz	HDXJHDDQHASESO-UHFFFAOYSA-N	1	0	268.332	1.790	50	0		CDAARO
CNS(=O)(=O)[C@@H]1CC[N@H+](CC(C)(C)c2ccccc2)C1	ZINC000095986834	185056311	/nfs/dbraw/zinc/05/63/11/185056311.db2.gz	MDLXZQAYDWHKRK-CQSZACIVSA-N	1	0	296.436	1.588	50	0		CDAARO
CC(=O)NCc1ccccc1C[N@@H+]1CCC[C@H]1CO	ZINC000096007047	185063368	/nfs/dbraw/zinc/06/33/68/185063368.db2.gz	WOSASUFEKXCFII-HNNXBMFYSA-N	1	0	262.353	1.279	50	0		CDAARO
CCCNC(=O)CN1CCC(Nc2cc[nH+]c(C)c2)CC1	ZINC000274365586	365637531	/nfs/dbraw/zinc/63/75/31/365637531.db2.gz	OTBZTORMQYBTDZ-UHFFFAOYSA-N	1	0	290.411	1.793	50	0		CDAARO
Cc1nn(C)cc1NC(=O)NCC[C@H]1CCC[N@@H+]1C	ZINC000096131947	185105054	/nfs/dbraw/zinc/10/50/54/185105054.db2.gz	NVCXRCGHFQXPKV-LLVKDONJSA-N	1	0	265.361	1.334	50	0		CDAARO
COC(=O)C(C)(C)[C@H]1CCCN(C(=O)[C@@H]([NH3+])C(C)C)C1	ZINC000195555049	342626122	/nfs/dbraw/zinc/62/61/22/342626122.db2.gz	MDZJRSBRGYJICT-RYUDHWBXSA-N	1	0	284.400	1.408	50	0		CDAARO
Cc1c(C(=O)N[C@H]2CC[NH2+]C2)cnn1-c1ccccc1C	ZINC000126250959	342150871	/nfs/dbraw/zinc/15/08/71/342150871.db2.gz	OYWPARVOGYNFNA-ZDUSSCGKSA-N	1	0	284.363	1.581	50	0		CDAARO
CCc1ccc(C[N@H+](C)C[C@@H](C)n2cncn2)nc1	ZINC000244659545	361854964	/nfs/dbraw/zinc/85/49/64/361854964.db2.gz	HEOJGAVMHSPJGU-GFCCVEGCSA-N	1	0	259.357	1.929	50	0		CDAARO
CC(C)c1nc(CN2CC[N@@H+]3CCCC[C@H]3C2)no1	ZINC000244690848	361856792	/nfs/dbraw/zinc/85/67/92/361856792.db2.gz	IYAIXZNKVAJVJV-LBPRGKRZSA-N	1	0	264.373	1.863	50	0		CDAARO
C[C@@H]1C[N@H+](CCC(=O)Nc2cccnc2)CCCO1	ZINC000244724381	361860916	/nfs/dbraw/zinc/86/09/16/361860916.db2.gz	MSURDZLHXSMUEE-GFCCVEGCSA-N	1	0	263.341	1.521	50	0		CDAARO
CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)[C@H]1CCCO1	ZINC000252668952	361888193	/nfs/dbraw/zinc/88/81/93/361888193.db2.gz	FZYFPWXUJAGXBU-CHWSQXEVSA-N	1	0	254.374	1.498	50	0		CDAARO
Cc1ncncc1C(=O)NCc1ccccc1-n1ccnc1	ZINC000351796402	361928811	/nfs/dbraw/zinc/92/88/11/361928811.db2.gz	VTYMHIBLBTXYNO-UHFFFAOYSA-N	1	0	293.330	1.901	50	0		CDAARO
C[N@H+](Cc1ccc(=O)[nH]c1)CC(C)(C)CN1CCOCC1	ZINC000585140849	342218812	/nfs/dbraw/zinc/21/88/12/342218812.db2.gz	KBHRIUYRYSVSQJ-UHFFFAOYSA-N	1	0	293.411	1.577	50	0		CDAARO
CNC(=O)C[C@H]1CC[N@H+](Cc2cccc(OC)c2F)C1	ZINC000670446862	539114295	/nfs/dbraw/zinc/11/42/95/539114295.db2.gz	ITJHXSCDOMZCGN-LLVKDONJSA-N	1	0	280.343	1.792	50	0		CDAARO
O=C(N[C@H]1CC[C@@H](CO)CC1)[C@H]1CC[N@@H+]1C1CCCC1	ZINC000585132448	362057365	/nfs/dbraw/zinc/05/73/65/362057365.db2.gz	WXOMAVJXOMEHDS-VNHYZAJKSA-N	1	0	280.412	1.671	50	0		CDAARO
O=C(N[C@@H]1CCCCC[C@@H]1CO)[C@H](C1CC1)[NH+]1CCCC1	ZINC000253369418	342416136	/nfs/dbraw/zinc/41/61/36/342416136.db2.gz	CHNYRCKKQZMMEE-OAGGEKHMSA-N	1	0	294.439	1.918	50	0		CDAARO
Cc1nc(C[NH2+][C@@H]2CCc3nnc(C)n3C2)cs1	ZINC000065563089	342409970	/nfs/dbraw/zinc/40/99/70/342409970.db2.gz	PEPRXCFBGDTEEU-SNVBAGLBSA-N	1	0	263.370	1.456	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1CCN(C(=O)OC(C)(C)C)[C@H](C)C1	ZINC000084733428	362270734	/nfs/dbraw/zinc/27/07/34/362270734.db2.gz	AVYBDDYSJFCLEG-VXGBXAGGSA-N	1	0	272.389	1.699	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1CCN(CCO)Cc1ccco1	ZINC000252502810	362390252	/nfs/dbraw/zinc/39/02/52/362390252.db2.gz	UTHVBBAUFHCBIB-CYBMUJFWSA-N	1	0	252.358	1.558	50	0		CDAARO
C[NH+]1C(C)(C)CC(NC(=O)Cn2ccnn2)CC1(C)C	ZINC000426531547	530046529	/nfs/dbraw/zinc/04/65/29/530046529.db2.gz	GSPADTFQPFSQGM-UHFFFAOYSA-N	1	0	279.388	1.046	50	0		CDAARO
c1cnn(CCCN2CC[NH+](C3CCCC3)CC2)c1	ZINC000252510102	345222139	/nfs/dbraw/zinc/22/21/39/345222139.db2.gz	ZBKMQBSLQCKCNU-UHFFFAOYSA-N	1	0	262.401	1.833	50	0		CDAARO
C[NH+](C)[C@H]1[C@@H]2CC[C@H]1CN(Cc1nccs1)C2	ZINC000101974415	185765156	/nfs/dbraw/zinc/76/51/56/185765156.db2.gz	UKCBUOHEZKFDPY-PJXYFTJBSA-N	1	0	251.399	1.915	50	0		CDAARO
C[NH+](C)[C@@H]1CCC[C@H]1NC(=O)c1ccc(Cl)cn1	ZINC000613659871	347851748	/nfs/dbraw/zinc/85/17/48/347851748.db2.gz	DPLFCFZIWINVCI-ZYHUDNBSSA-N	1	0	267.760	1.948	50	0		CDAARO
O=C(NCC(F)(F)F)c1cc(C2CC[NH2+]CC2)n[nH]1	ZINC000407947152	349979416	/nfs/dbraw/zinc/97/94/16/349979416.db2.gz	VDPBXZQDHDQOHJ-UHFFFAOYSA-N	1	0	276.262	1.169	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C(=O)C1(CO)CC1	ZINC000584896240	349357247	/nfs/dbraw/zinc/35/72/47/349357247.db2.gz	QSIPNTKTWQNKJS-UHFFFAOYSA-N	1	0	254.374	1.092	50	0		CDAARO
O=C1NCCC[C@H]1[NH2+]C1CCN(c2ccccc2F)CC1	ZINC000584887252	349345824	/nfs/dbraw/zinc/34/58/24/349345824.db2.gz	FFRISZXHZBWZHE-CQSZACIVSA-N	1	0	291.370	1.663	50	0		CDAARO
CCSC[C@@H](C)[NH2+]CCc1nc(N)cc(=O)[nH]1	ZINC000584891598	349350089	/nfs/dbraw/zinc/35/00/89/349350089.db2.gz	ZUSUJHRTYDKVEF-MRVPVSSYSA-N	1	0	256.375	1.038	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)CCOc1ccccc1	ZINC000584891266	349350201	/nfs/dbraw/zinc/35/02/01/349350201.db2.gz	VQWCBNCXVFYFMQ-GJZGRUSLSA-N	1	0	292.379	1.291	50	0		CDAARO
CN1CC[NH+](CC2(CNc3ccncc3F)CC2)CC1	ZINC000584895229	349355849	/nfs/dbraw/zinc/35/58/49/349355849.db2.gz	PQNUDNHHNKTZHP-UHFFFAOYSA-N	1	0	278.375	1.082	50	0		CDAARO
COCCC(=O)N1CCC[N@@H+](C2CCCCC2)CC1	ZINC000584895756	349356055	/nfs/dbraw/zinc/35/60/55/349356055.db2.gz	DJVIXZYCTIWBSD-UHFFFAOYSA-N	1	0	268.401	1.890	50	0		CDAARO
[NH3+]C1CCN(S(=O)(=O)c2cccc(Cl)c2F)CC1	ZINC000036753806	362946087	/nfs/dbraw/zinc/94/60/87/362946087.db2.gz	XFPFFBFBTOLNFQ-UHFFFAOYSA-N	1	0	292.763	1.591	50	0		CDAARO
C[C@H](CN1CCCCCC1)[NH2+]CCc1cnn(C)c1	ZINC000584898419	349359582	/nfs/dbraw/zinc/35/95/82/349359582.db2.gz	WYFXWDFKOBZBQN-CQSZACIVSA-N	1	0	264.417	1.817	50	0		CDAARO
Cc1cc(C)c(C[NH2+][C@@H](C)CN2CCOCC2)cn1	ZINC000584899382	349361251	/nfs/dbraw/zinc/36/12/51/349361251.db2.gz	XAQBJVAUHHGQRZ-AWEZNQCLSA-N	1	0	263.385	1.509	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](Cn2cc(-c3nccn3C)nn2)C1	ZINC000091563461	180192933	/nfs/dbraw/zinc/19/29/33/180192933.db2.gz	LXKKWUBHOZAMGC-ZDUSSCGKSA-N	1	0	288.399	1.657	50	0		CDAARO
O=c1cc(C[NH2+]CCc2cnccn2)[nH]c2c(F)cccc12	ZINC000091526603	180178784	/nfs/dbraw/zinc/17/87/84/180178784.db2.gz	RGWWSZKEYJIXNJ-UHFFFAOYSA-N	1	0	298.321	1.790	50	0		CDAARO
C[NH+]1CCC(c2nnc(Cn3ccnc3)n2C2CC2)CC1	ZINC000091636678	180211532	/nfs/dbraw/zinc/21/15/32/180211532.db2.gz	WEUDKCOYLFDWSQ-UHFFFAOYSA-N	1	0	286.383	1.667	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)CCc2ccc(O)cc2)C[C@@H]1C1CC1	ZINC000091679536	180226067	/nfs/dbraw/zinc/22/60/67/180226067.db2.gz	KXPMRJWQESRLFK-CABCVRRESA-N	1	0	274.364	1.521	50	0		CDAARO
Cn1ccnc1SCCNC(=O)[C@H]1CCCCC[N@@H+]1C	ZINC000091745813	180244689	/nfs/dbraw/zinc/24/46/89/180244689.db2.gz	DSUHTTHYCITFIA-GFCCVEGCSA-N	1	0	296.440	1.503	50	0		CDAARO
COc1ccc(C[NH2+]C[C@@H]2CN(C)CCO2)c(OC)c1	ZINC000105472141	186059538	/nfs/dbraw/zinc/05/95/38/186059538.db2.gz	IPJSIXVJKMRERR-CQSZACIVSA-N	1	0	280.368	1.124	50	0		CDAARO
CCC[C@H]1CN(C(=O)CCCN2CCCCC2=O)C[C@@H]1[NH3+]	ZINC000091746530	180244959	/nfs/dbraw/zinc/24/49/59/180244959.db2.gz	OQWMHCRWZCZWLD-KBPBESRZSA-N	1	0	295.427	1.365	50	0		CDAARO
Cc1[nH+]c(N)nc(NCCc2nc(C3CC3)no2)c1C	ZINC000092038234	180309985	/nfs/dbraw/zinc/30/99/85/180309985.db2.gz	GWSGXIXKNPKCIP-UHFFFAOYSA-N	1	0	274.328	1.591	50	0		CDAARO
Cc1ccc(NC(=O)C[N@H+]2CC[C@H]([C@H](C)O)C2)cc1C	ZINC000108331183	186212342	/nfs/dbraw/zinc/21/23/42/186212342.db2.gz	GEPLEIFDXSMMMT-KBPBESRZSA-N	1	0	276.380	1.945	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CN(C(=O)c2ccc(F)cc2F)CCO1	ZINC000122852953	187055989	/nfs/dbraw/zinc/05/59/89/187055989.db2.gz	AESPSNCJCAWSAN-PELKAZGASA-N	1	0	270.279	1.153	50	0		CDAARO
C[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(C(N)=O)cc1	ZINC000003583654	363173399	/nfs/dbraw/zinc/17/33/99/363173399.db2.gz	YSWABPUDJVXWHA-NSHDSACASA-N	1	0	275.352	1.598	50	0		CDAARO
CC[N@H+](CCO)C[C@@H](O)c1ccc(OC)c(OC)c1	ZINC000062353103	363187198	/nfs/dbraw/zinc/18/71/98/363187198.db2.gz	ASRYUTVBLACHBU-GFCCVEGCSA-N	1	0	269.341	1.051	50	0		CDAARO
CC[NH2+]C1(C(N)=O)CCN(Cc2ccccc2)CC1	ZINC000000393551	355908524	/nfs/dbraw/zinc/90/85/24/355908524.db2.gz	LPPPBYXGXSHYQJ-UHFFFAOYSA-N	1	0	261.369	1.116	50	0		CDAARO
[NH3+]CCN1C(=O)S/C(=C/c2ccc3c(c2)OCO3)C1=O	ZINC000000968999	355925677	/nfs/dbraw/zinc/92/56/77/355925677.db2.gz	ZAWGHGDNVXQOKU-IZZDOVSWSA-N	1	0	292.316	1.410	50	0		CDAARO
COc1ccc(C[NH2+]C[C@@H]2CCCO2)c(OC)c1	ZINC000000268567	355900126	/nfs/dbraw/zinc/90/01/26/355900126.db2.gz	UMUVEGLNWVUCTM-ZDUSSCGKSA-N	1	0	251.326	1.972	50	0		CDAARO
C[C@@H]1CC[C@@H]([NH2+]CCCNS(C)(=O)=O)C[C@@H]1C	ZINC000097379717	356108702	/nfs/dbraw/zinc/10/87/02/356108702.db2.gz	QTTDZFPKQLOFEQ-GRYCIOLGSA-N	1	0	262.419	1.340	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COC(C)(C)CC)CC1	ZINC000022917993	356263674	/nfs/dbraw/zinc/26/36/74/356263674.db2.gz	PCYIMOFJVYHDKU-CYBMUJFWSA-N	1	0	258.406	1.190	50	0		CDAARO
CSc1nn(CSC(N)=[NH2+])c(=S)s1	ZINC000004426868	356349519	/nfs/dbraw/zinc/34/95/19/356349519.db2.gz	ZLKPPAWEUFCDHN-UHFFFAOYSA-N	1	0	252.415	1.980	50	0		CDAARO
CSc1ccc(S(=O)(=O)NCCC[NH+](C)C)cc1	ZINC000013612175	356350124	/nfs/dbraw/zinc/35/01/24/356350124.db2.gz	GYOXRQCLVAGJTG-UHFFFAOYSA-N	1	0	288.438	1.639	50	0		CDAARO
OCCOc1ccc(C[NH2+]C[C@H](O)c2ccccc2)cc1	ZINC000013731066	356354597	/nfs/dbraw/zinc/35/45/97/356354597.db2.gz	XDJVWIXORPXWLC-KRWDZBQOSA-N	1	0	287.359	1.881	50	0		CDAARO
c1ccc2c(c1)N(CCN1CCOCC1)C1=[NH+]CCCN21	ZINC000013756126	356356894	/nfs/dbraw/zinc/35/68/94/356356894.db2.gz	WWOQSCPYJARAGQ-UHFFFAOYSA-N	1	0	286.379	1.405	50	0		CDAARO
CC[NH+](CC)CCNC(=O)C(=O)Nc1cccc(Cl)c1	ZINC000004583585	356432117	/nfs/dbraw/zinc/43/21/17/356432117.db2.gz	MXSDPOCHVIIZMY-UHFFFAOYSA-N	1	0	297.786	1.737	50	0		CDAARO
CC[NH+]1CCC(NC(=O)c2ccccc2OC)CC1	ZINC000016603178	356443059	/nfs/dbraw/zinc/44/30/59/356443059.db2.gz	KRIATSLCCFNBRM-UHFFFAOYSA-N	1	0	262.353	1.909	50	0		CDAARO
Cc1cc(OC[C@@H](O)CN2CC[NH+](C)CC2)ccc1Cl	ZINC000019363136	356482409	/nfs/dbraw/zinc/48/24/09/356482409.db2.gz	MFSWSQCIDNMMJJ-ZDUSSCGKSA-N	1	0	298.814	1.636	50	0		CDAARO
CC[NH+]1CCN(CCC(=O)Nc2ccccc2)CC1	ZINC000019528186	356490703	/nfs/dbraw/zinc/49/07/03/356490703.db2.gz	WGFUNXCKFXXEAP-UHFFFAOYSA-N	1	0	261.369	1.653	50	0		CDAARO
NC(=O)CN1CCC([NH2+]C2CCCCCCC2)CC1	ZINC000037140378	363468494	/nfs/dbraw/zinc/46/84/94/363468494.db2.gz	GBUBHLLPZQOUAW-UHFFFAOYSA-N	1	0	267.417	1.639	50	0		CDAARO
COc1cc(OC)c(OC)cc1C[N@@H+]1CCC[C@@H]1CO	ZINC000023279987	356639068	/nfs/dbraw/zinc/63/90/68/356639068.db2.gz	NXABZMMTJIWKHH-GFCCVEGCSA-N	1	0	281.352	1.669	50	0		CDAARO
Cc1cc(N2CCC[C@@H](OCc3cccnc3)C2)nc(N)[nH+]1	ZINC000032576338	356782414	/nfs/dbraw/zinc/78/24/14/356782414.db2.gz	HQCHKUUGTLJLSZ-CQSZACIVSA-N	1	0	299.378	1.948	50	0		CDAARO
CN(Cc1ncc[nH]1)C(=O)c1snnc1C(C)(C)C	ZINC000087455258	357294812	/nfs/dbraw/zinc/29/48/12/357294812.db2.gz	QVQJQKZOWFPNKF-UHFFFAOYSA-N	1	0	279.369	1.831	50	0		CDAARO
Cc1nc(SCC(=O)NCCCC[NH+]2CCCC2)n[nH]1	ZINC000055382909	357332712	/nfs/dbraw/zinc/33/27/12/357332712.db2.gz	QHLOAGFFLLIDRM-UHFFFAOYSA-N	1	0	297.428	1.197	50	0		CDAARO
CCC1(CC)[C@@H](OC)C[C@@H]1[N@H+](C)CCC(=O)NC	ZINC000095424701	357349497	/nfs/dbraw/zinc/34/94/97/357349497.db2.gz	BDCJDKAZBMTGPU-RYUDHWBXSA-N	1	0	256.390	1.648	50	0		CDAARO
O=C(Cc1cn2ccsc2n1)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065434058	357541632	/nfs/dbraw/zinc/54/16/32/357541632.db2.gz	UMTQULKIEDVRNS-NEPJUHHUSA-N	1	0	290.392	1.291	50	0		CDAARO
CO[C@@H](C)[C@H](C)NC(=O)N[C@H]1CC[N@H+](CC2CCCC2)C1	ZINC000188207504	357602200	/nfs/dbraw/zinc/60/22/00/357602200.db2.gz	BFIVBXCDDGYCJB-YDHLFZDLSA-N	1	0	297.443	1.974	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](CN(C)C(=O)c2ccc(=O)[nH]c2)C1	ZINC000067714865	357620377	/nfs/dbraw/zinc/62/03/77/357620377.db2.gz	GAPFLQYXWFUEKA-CYBMUJFWSA-N	1	0	291.395	1.425	50	0		CDAARO
CNc1ccnc(-c2cccc3c2O[C@H](C[NH3+])C3)n1	ZINC000067881756	357635150	/nfs/dbraw/zinc/63/51/50/357635150.db2.gz	XVMMUBCUITUTKT-JTQLQIEISA-N	1	0	256.309	1.448	50	0		CDAARO
O=C(c1ccc[nH]c1=O)N1CCCC2(CC[NH2+]CC2)CC1	ZINC000067907875	357635696	/nfs/dbraw/zinc/63/56/96/357635696.db2.gz	OROHJLJCGUNTFA-UHFFFAOYSA-N	1	0	289.379	1.371	50	0		CDAARO
CNC(=O)C[C@@H](C)[N@H+](C)Cc1ccc(-n2ccnc2)cc1	ZINC000067921524	357637330	/nfs/dbraw/zinc/63/73/30/357637330.db2.gz	FKUSNXIHZLETHW-CYBMUJFWSA-N	1	0	286.379	1.829	50	0		CDAARO
CCn1cnnc1CC[NH2+][C@H]1CCN(Cc2ccccc2)C1	ZINC000067946340	357638743	/nfs/dbraw/zinc/63/87/43/357638743.db2.gz	LSSPMWYBFHRRED-INIZCTEOSA-N	1	0	299.422	1.705	50	0		CDAARO
O=C(NCC1CCN(c2cc[nH+]cc2)CC1)c1cnccn1	ZINC000070928307	357738672	/nfs/dbraw/zinc/73/86/72/357738672.db2.gz	PMVSJOVEHUYVJB-UHFFFAOYSA-N	1	0	297.362	1.518	50	0		CDAARO
NC(=O)CCN1C[C@H]2CC[C@@H]1C[N@H+](Cc1ccccc1)C2	ZINC000091596096	283285056	/nfs/dbraw/zinc/28/50/56/283285056.db2.gz	NLUWXSPLABNPIY-JKSUJKDBSA-N	1	0	287.407	1.458	50	0		CDAARO
[NH3+]CCC(=O)N1C[C@@H](c2ccccc2)[C@@H]2[C@H]1C1CC[NH+]2CC1	ZINC000071763280	357778870	/nfs/dbraw/zinc/77/88/70/357778870.db2.gz	MLNRXEVXHAVJLK-CGTJXYLNSA-N	1	0	299.418	1.424	50	0		CDAARO
CC[C@H]1C[N@H+](CCCO)CCC(=O)N1Cc1ccccc1	ZINC000071754337	357779293	/nfs/dbraw/zinc/77/92/93/357779293.db2.gz	VONASJXIEIJQKQ-INIZCTEOSA-N	1	0	290.407	1.882	50	0		CDAARO
C[C@@H](CO)NC(=O)N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1	ZINC000097080685	357944867	/nfs/dbraw/zinc/94/48/67/357944867.db2.gz	RYXDPNHBGUSMKL-AVGNSLFASA-N	1	0	283.416	1.319	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@]2(C)CO)cc2c1OCCO2	ZINC000097105384	357968354	/nfs/dbraw/zinc/96/83/54/357968354.db2.gz	HRVHZNYRPYGGIJ-MRXNPFEDSA-N	1	0	293.363	1.813	50	0		CDAARO
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[N@H+](C)CC1	ZINC000097109706	357985012	/nfs/dbraw/zinc/98/50/12/357985012.db2.gz	VRXBYAYJWNKVCI-LLVKDONJSA-N	1	0	285.388	1.064	50	0		CDAARO
Cc1ccc([C@H](C)NCC(=O)NCc2cccnc2)o1	ZINC000097111279	357987107	/nfs/dbraw/zinc/98/71/07/357987107.db2.gz	LGYWQIDKSYWKQK-LBPRGKRZSA-N	1	0	273.336	1.950	50	0		CDAARO
C[C@H]1OCCN(CCC[N@@H+]2CCO[C@@H](C)[C@H]2C)[C@@H]1C	ZINC000247345915	358007252	/nfs/dbraw/zinc/00/72/52/358007252.db2.gz	XVCHFYDJCOZHCD-TUVASFSCSA-N	1	0	270.417	1.595	50	0		CDAARO
CO[C@@H](C)CC(=O)Nc1ccc2c(c1)N(C)CC[N@@H+](C)C2	ZINC000097046234	358110812	/nfs/dbraw/zinc/11/08/12/358110812.db2.gz	STWNYOIDHBAWAS-LBPRGKRZSA-N	1	0	291.395	1.932	50	0		CDAARO
C[N@@H+]1CC[C@@H](NC(=O)C(F)F)[C@@H]1c1ccccc1	ZINC000194814127	358541273	/nfs/dbraw/zinc/54/12/73/358541273.db2.gz	YTLVKVDVNPNSIH-MNOVXSKESA-N	1	0	254.280	1.813	50	0		CDAARO
Cc1nnc(CCNC(=O)CCC[NH+]2CCCCC2)s1	ZINC000095374060	358688695	/nfs/dbraw/zinc/68/86/95/358688695.db2.gz	RKWZQMDSBOWNCQ-UHFFFAOYSA-N	1	0	296.440	1.771	50	0		CDAARO
[NH3+][C@H]1CN(c2nccnc2N2CCCC2)C[C@@H]1C1CC1	ZINC000095390696	358692046	/nfs/dbraw/zinc/69/20/46/358692046.db2.gz	MZTLXHLWTSVRGO-OLZOCXBDSA-N	1	0	273.384	1.250	50	0		CDAARO
CCC[N@@H+]1C[C@H]2CC[C@@H]1CN(C(=O)c1cnc(C)nc1)C2	ZINC000095392191	358693046	/nfs/dbraw/zinc/69/30/46/358693046.db2.gz	MENARUSLONAHOP-UKRRQHHQSA-N	1	0	288.395	1.731	50	0		CDAARO
CC[NH+]1CCC(CC(=O)N[C@@H](C)c2ncnn2C)CC1	ZINC000095503110	358695678	/nfs/dbraw/zinc/69/56/78/358695678.db2.gz	TUHFYBMYXRLRHJ-NSHDSACASA-N	1	0	279.388	1.114	50	0		CDAARO
CC[N@H+](Cc1cccc(-n2cccn2)c1)[C@H]1COC[C@@H]1O	ZINC000097179447	358756498	/nfs/dbraw/zinc/75/64/98/358756498.db2.gz	BKUURBBMLMGSGS-HOTGVXAUSA-N	1	0	287.363	1.454	50	0		CDAARO
O=C1[C@@H]2[C@H](C(=O)N1Cc1ccccc1)[C@@H]1CC[C@H]2C[NH2+]1	ZINC000616582143	358760156	/nfs/dbraw/zinc/76/01/56/358760156.db2.gz	FOEMSRZJCARMAV-XDQVBPFNSA-N	1	0	270.332	1.170	50	0		CDAARO
CC(=O)c1cc(CC(=O)N2[C@@H]3CC[C@H]2C[NH2+]CC3)cs1	ZINC000097295372	358765280	/nfs/dbraw/zinc/76/52/80/358765280.db2.gz	RNKRSCPTJIDCSZ-OLZOCXBDSA-N	1	0	292.404	1.846	50	0		CDAARO
CC(C)c1ncc(C(=O)N2C[C@@H]3CCC[NH2+][C@@H]3C2)cn1	ZINC000096162694	358710888	/nfs/dbraw/zinc/71/08/88/358710888.db2.gz	YTEOEROYEHTIMF-WCQYABFASA-N	1	0	274.368	1.424	50	0		CDAARO
C[C@]1(O)CC[N@H+](CCCCOc2ccccc2)C[C@@H]1O	ZINC000096161621	358711294	/nfs/dbraw/zinc/71/12/94/358711294.db2.gz	AGBUSNAYHSSIKD-HOTGVXAUSA-N	1	0	279.380	1.663	50	0		CDAARO
C[C@]1(O)CC[N@@H+](C2CCc3ccccc3CC2)C[C@@H]1O	ZINC000096164915	358712015	/nfs/dbraw/zinc/71/20/15/358712015.db2.gz	JHRGLHLISFAANR-IRXDYDNUSA-N	1	0	275.392	1.752	50	0		CDAARO
O[C@H](C[N@@H+]1CCC[C@H]1Cn1cncn1)c1ccc(F)cc1	ZINC000247804006	358782425	/nfs/dbraw/zinc/78/24/25/358782425.db2.gz	XRHPDPBYXRTUDV-LSDHHAIUSA-N	1	0	290.342	1.615	50	0		CDAARO
COc1ccc(S(=O)(=O)CCCCC[NH3+])cc1	ZINC000084268659	358825230	/nfs/dbraw/zinc/82/52/30/358825230.db2.gz	NKHOHVFXVZTEKP-UHFFFAOYSA-N	1	0	257.355	1.598	50	0		CDAARO
C1=CCN(c2nc(-c3cccnc3)nc3c2CC[NH2+]CC3)C1	ZINC000101171050	358840293	/nfs/dbraw/zinc/84/02/93/358840293.db2.gz	COEBHPHPISUZSN-UHFFFAOYSA-N	1	0	293.374	1.603	50	0		CDAARO
CCc1ccc(CCNC(=O)C[C@H]2C[NH2+]CCO2)cc1	ZINC000216010226	358916963	/nfs/dbraw/zinc/91/69/63/358916963.db2.gz	KXRWYIBZAZEQRP-HNNXBMFYSA-N	1	0	276.380	1.286	50	0		CDAARO
CC[NH+]1CCC(NS(=O)(=O)c2ccc(C)cc2)CC1	ZINC000014096768	358877653	/nfs/dbraw/zinc/87/76/53/358877653.db2.gz	KENYZQIBLWUXPM-UHFFFAOYSA-N	1	0	282.409	1.758	50	0		CDAARO
O=C(NC[C@H]1CC[N@@H+](C2CCCCC2)C1)c1cn[nH]c1	ZINC000215451617	358889383	/nfs/dbraw/zinc/88/93/83/358889383.db2.gz	FHBROHGLDWYPLV-GFCCVEGCSA-N	1	0	276.384	1.794	50	0		CDAARO
CCCn1ncc(C(=O)N(C)[C@H]2CC[N@H+](C)C2)c1C	ZINC000216212646	358931541	/nfs/dbraw/zinc/93/15/41/358931541.db2.gz	CBAISEALWXFSIU-LBPRGKRZSA-N	1	0	264.373	1.378	50	0		CDAARO
CO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)CCCOc1ccccc1	ZINC000219356379	359091407	/nfs/dbraw/zinc/09/14/07/359091407.db2.gz	ZKXUIHRGMHTBMW-GJZGRUSLSA-N	1	0	292.379	1.291	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCc2nnc(-c3cnccn3)o2)C1	ZINC000257175226	359053837	/nfs/dbraw/zinc/05/38/37/359053837.db2.gz	NYDRMGAGDJEORR-NSHDSACASA-N	1	0	273.340	1.801	50	0		CDAARO
Cc1cc(=O)cc(C(=O)N[C@@H](C)C2CC[NH+](C)CC2)o1	ZINC000219932741	359138935	/nfs/dbraw/zinc/13/89/35/359138935.db2.gz	SLLPSBFHZLDYLX-NSHDSACASA-N	1	0	278.352	1.408	50	0		CDAARO
C[C@@H]1CN(C(=O)C[C@H]([NH3+])c2ccccc2)[C@H](C)CO1	ZINC000035787154	359150220	/nfs/dbraw/zinc/15/02/20/359150220.db2.gz	WHRCRHBGKIDIMY-BZPMIXESSA-N	1	0	262.353	1.712	50	0		CDAARO
C[N@@H+]1C[C@@H]2CC[C@H]1CN(C(=O)c1ccncc1F)C2	ZINC000221300872	359229843	/nfs/dbraw/zinc/22/98/43/359229843.db2.gz	AFVGZWFMQQTSPE-QWRGUYRKSA-N	1	0	263.316	1.387	50	0		CDAARO
C[C@@H](CC(=O)N(C)CCc1ccncc1)[NH+]1CCOCC1	ZINC000221402552	359245524	/nfs/dbraw/zinc/24/55/24/359245524.db2.gz	MGLMSNWLCZCNPC-AWEZNQCLSA-N	1	0	291.395	1.193	50	0		CDAARO
COC[C@H](O)C[N@@H+]1C[C@@H](c2ccsc2)C[C@H]1C	ZINC000247881607	359426072	/nfs/dbraw/zinc/42/60/72/359426072.db2.gz	CEZFHQKVRBAQLO-KGYLQXTDSA-N	1	0	255.383	1.933	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CCNC(=O)c1[nH]nc(N)c1Cl	ZINC000223489294	359429752	/nfs/dbraw/zinc/42/97/52/359429752.db2.gz	GEUJXEMFLKKZLK-MRVPVSSYSA-N	1	0	285.779	1.250	50	0		CDAARO
Cc1nccn1[C@H](C)C(=O)NCCC12CCC[NH+]1CCC2	ZINC000222921159	359383725	/nfs/dbraw/zinc/38/37/25/359383725.db2.gz	UNSATGCQLGHBSW-CYBMUJFWSA-N	1	0	290.411	1.887	50	0		CDAARO
Cc1ccsc1C(=O)N1CCOC[C@@H](C[NH+](C)C)C1	ZINC000223583674	359435957	/nfs/dbraw/zinc/43/59/57/359435957.db2.gz	NGAZJZCXIKGJDP-LBPRGKRZSA-N	1	0	282.409	1.707	50	0		CDAARO
CN1C(=O)[C@H]2C[N@H+](Cc3ccc(Cl)c(F)c3)C[C@H]2C1=O	ZINC000257185284	359512101	/nfs/dbraw/zinc/51/21/01/359512101.db2.gz	WLZSLNWGUARIAI-AOOOYVTPSA-N	1	0	296.729	1.526	50	0		CDAARO
CN(C)c1nc2c(c(=O)[nH]1)CC[N@H+](Cc1ccccc1)CC2	ZINC000257185955	359517480	/nfs/dbraw/zinc/51/74/80/359517480.db2.gz	YBXILQJUHCIHJA-UHFFFAOYSA-N	1	0	298.390	1.849	50	0		CDAARO
O[C@@H]1CCOC2(CC[NH+](Cc3ccoc3)CC2)C1	ZINC000257188249	359530775	/nfs/dbraw/zinc/53/07/75/359530775.db2.gz	DUZJPUCHDYADFT-CYBMUJFWSA-N	1	0	251.326	1.786	50	0		CDAARO
CO[C@H]1C[N@H+](C(C)C)[C@H]1C1CCN(C(=O)C(C)C)CC1	ZINC000257193509	359598751	/nfs/dbraw/zinc/59/87/51/359598751.db2.gz	RSWLZXLCLGVAJU-GJZGRUSLSA-N	1	0	282.428	1.989	50	0		CDAARO
CCOC[C@H]1CCN(C(=O)C[N@@H+]2CC[C@@H](C)C2)C1	ZINC000408517903	359902655	/nfs/dbraw/zinc/90/26/55/359902655.db2.gz	OOVDAYPLLGRWBJ-OLZOCXBDSA-N	1	0	254.374	1.213	50	0		CDAARO
COc1ccc(CN2C[C@@H](CO)[C@H]([NH+](C)C)C2)cc1OC	ZINC000409420139	360223298	/nfs/dbraw/zinc/22/32/98/360223298.db2.gz	UXXUHGYEECFPDQ-UONOGXRCSA-N	1	0	294.395	1.058	50	0		CDAARO
C[C@@H]1CCCC[C@H]1OCC(=O)N[C@H]1CC[N@H+](C)C1	ZINC000248020889	360320196	/nfs/dbraw/zinc/32/01/96/360320196.db2.gz	MEUQCTGFRADTET-FRRDWIJNSA-N	1	0	254.374	1.402	50	0		CDAARO
[NH3+]C[C@@H]1CN(C(=O)c2ccccc2Cl)CCO1	ZINC000011887348	360400639	/nfs/dbraw/zinc/40/06/39/360400639.db2.gz	WHHHJTKYTVWFKJ-SECBINFHSA-N	1	0	254.717	1.140	50	0		CDAARO
CC(C)(C(=O)NCCCn1cc(Cl)cn1)[NH+]1CCCC1	ZINC000426435395	360531758	/nfs/dbraw/zinc/53/17/58/360531758.db2.gz	KWJVIXGKTUYPRP-UHFFFAOYSA-N	1	0	298.818	1.917	50	0		CDAARO
Cc1ncn(CCNC(=O)C2(C)CC[NH+](C)CC2)c1C	ZINC000426526844	360679700	/nfs/dbraw/zinc/67/97/00/360679700.db2.gz	HXOKSQNOQRBMKE-UHFFFAOYSA-N	1	0	278.400	1.348	50	0		CDAARO
[NH3+][C@@H]1CCCN(Cc2cccc(Cn3cccn3)c2)C1	ZINC000426563105	360684131	/nfs/dbraw/zinc/68/41/31/360684131.db2.gz	JIWCNZPKIQOKJW-MRXNPFEDSA-N	1	0	270.380	1.855	50	0		CDAARO
C[C@H](CCC(=O)N(C)CCc1cnn(C)c1)[NH+]1CCCC1	ZINC000426612250	360688455	/nfs/dbraw/zinc/68/84/55/360688455.db2.gz	DTUVBKOVKAFSHK-CQSZACIVSA-N	1	0	292.427	1.686	50	0		CDAARO
Cn1cnc(C(=O)NC2CC[NH+](Cc3ccncc3)CC2)c1	ZINC000178997090	189160436	/nfs/dbraw/zinc/16/04/36/189160436.db2.gz	LWXKWHFKGMIMTR-UHFFFAOYSA-N	1	0	299.378	1.210	50	0		CDAARO
COc1cccc([C@@H]2C[C@@H]2C(=O)N2CC[C@@H](C[NH3+])C2)c1	ZINC000246662981	360907342	/nfs/dbraw/zinc/90/73/42/360907342.db2.gz	DPRVYRVTQLZBDW-CQDKDKBSSA-N	1	0	274.364	1.606	50	0		CDAARO
[NH3+][C@@H]1CS(=O)(=O)Cc2ccc(Br)cc21	ZINC000012957344	283604743	/nfs/dbraw/zinc/60/47/43/283604743.db2.gz	PULIRAMXTGWLKW-SECBINFHSA-N	1	0	276.155	1.377	50	0		CDAARO
COCc1ccc(C[N@H+](CC(N)=O)C(C)C)cc1	ZINC000179657926	189211349	/nfs/dbraw/zinc/21/13/49/189211349.db2.gz	VZLJYMUSVFFZGR-UHFFFAOYSA-N	1	0	250.342	1.529	50	0		CDAARO
CCO[C@@H](C)c1nc(C)c(C(=O)N(C)[C@H]2CC[NH2+]C2)s1	ZINC000299740027	200852473	/nfs/dbraw/zinc/85/24/73/200852473.db2.gz	USSVKWJDKLVXGE-QWRGUYRKSA-N	1	0	297.424	1.983	50	0		CDAARO
Cc1nnc(CSc2nnc(C[NH3+])n2CC(C)C)[nH]1	ZINC000426634187	361339125	/nfs/dbraw/zinc/33/91/25/361339125.db2.gz	LWGIDIWRDYJVQP-UHFFFAOYSA-N	1	0	281.389	1.112	50	0		CDAARO
Cc1ccccc1CNC(=O)C[NH2+][C@H](C)[C@H]1CCCO1	ZINC000183086620	189346190	/nfs/dbraw/zinc/34/61/90/189346190.db2.gz	AOVOGUFCVXVSDS-UKRRQHHQSA-N	1	0	276.380	1.768	50	0		CDAARO
Cc1nc[nH]c1CNC(=O)c1ccc(C[NH+](C)C)cc1	ZINC000380184078	361617162	/nfs/dbraw/zinc/61/71/62/361617162.db2.gz	SKNQBHDTKWYXQA-UHFFFAOYSA-N	1	0	272.352	1.710	50	0		CDAARO
OC[C@@H]1CCCN1c1cc(N[C@H]2CCCOC2)ncn1	ZINC000264501507	363952493	/nfs/dbraw/zinc/95/24/93/363952493.db2.gz	QHAVHPHDCDBJCV-RYUDHWBXSA-N	1	0	278.356	1.029	50	0		CDAARO
CNC(=O)c1cccnc1NC[C@@H](c1ccco1)[NH+](C)C	ZINC000301381618	364243145	/nfs/dbraw/zinc/24/31/45/364243145.db2.gz	ZJYLZKSDFCKPCI-LBPRGKRZSA-N	1	0	288.351	1.749	50	0		CDAARO
Cc1ccc(C[N@@H+](C)Cc2cc(=O)n(C)c(=O)n2C)cc1	ZINC000014708197	364399653	/nfs/dbraw/zinc/39/96/53/364399653.db2.gz	CILZFMRUEVXBPF-UHFFFAOYSA-N	1	0	287.363	1.024	50	0		CDAARO
CCn1cnnc1[C@@H]1CCCN(Cc2ccn(C)n2)C1	ZINC000271181702	364964078	/nfs/dbraw/zinc/96/40/78/364964078.db2.gz	ZWEKZEPGBGDIHB-GFCCVEGCSA-N	1	0	274.372	1.411	50	0		CDAARO
COC(=O)CC1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1	ZINC000089886834	366953660	/nfs/dbraw/zinc/95/36/60/366953660.db2.gz	MHOKJCRWCGYSAY-OLZOCXBDSA-N	1	0	255.358	1.565	50	0		CDAARO
CC(=O)N1CC[C@@H]([NH2+]Cc2cccc3c2OCO3)[C@H](C)C1	ZINC000089937617	366972910	/nfs/dbraw/zinc/97/29/10/366972910.db2.gz	VHGBZKGSHZIIDT-BXUZGUMPSA-N	1	0	290.363	1.762	50	0		CDAARO
CCC(CC)NC(=O)C[N@@H+]1CCC[C@](C)(CO)C1	ZINC000089943170	366976277	/nfs/dbraw/zinc/97/62/77/366976277.db2.gz	FOICFBOJFSSCDE-AWEZNQCLSA-N	1	0	256.390	1.386	50	0		CDAARO
O=S(=O)(Cc1ccc(F)cc1)N1CC[N@@H+]2CCC[C@H]2C1	ZINC000252442406	367430989	/nfs/dbraw/zinc/43/09/89/367430989.db2.gz	ZVPQXPKGUPZIOW-AWEZNQCLSA-N	1	0	298.383	1.436	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@H]1CCC[NH2+]C1	ZINC000037377085	367540778	/nfs/dbraw/zinc/54/07/78/367540778.db2.gz	QMBWFTLDKWWGEU-NSHDSACASA-N	1	0	272.345	1.164	50	0		CDAARO
C[N@@H+]1CCCN(c2cncc(Br)c2)CC1	ZINC000083877983	368266630	/nfs/dbraw/zinc/26/66/30/368266630.db2.gz	ZKCNVPPSUNPPDJ-UHFFFAOYSA-N	1	0	270.174	1.986	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1CCNC(=O)c1cc(C)n(C)n1	ZINC000575553596	369117091	/nfs/dbraw/zinc/11/70/91/369117091.db2.gz	AXQJTFMSUUZRHL-UHFFFAOYSA-N	1	0	287.367	1.541	50	0		CDAARO
C[C@H]1CN(C(=O)N[C@@H]2CC[N@H+](CC3CCCC3)C2)CCO1	ZINC000076088317	369492268	/nfs/dbraw/zinc/49/22/68/369492268.db2.gz	DBSHYGAXSQOWOI-DZGCQCFKSA-N	1	0	295.427	1.681	50	0		CDAARO
CCNC(=O)NC(=O)[C@@H](C)[NH+]1CCCCCCC1	ZINC000012601231	371381247	/nfs/dbraw/zinc/38/12/47/371381247.db2.gz	NFTWVDWHYBFRTK-LLVKDONJSA-N	1	0	255.362	1.487	50	0		CDAARO
C[C@H]1CN(S(C)(=O)=O)CC[C@H]1[NH2+]Cc1ccco1	ZINC000252670912	371450814	/nfs/dbraw/zinc/45/08/14/371450814.db2.gz	MAUTVROELVZHPM-CMPLNLGQSA-N	1	0	272.370	1.039	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@@H](CNCc2cocn2)C1	ZINC000192280868	371837798	/nfs/dbraw/zinc/83/77/98/371837798.db2.gz	JJSIJXKSZCHBIP-ZDUSSCGKSA-N	1	0	253.346	1.121	50	0		CDAARO
O=C(NC[C@H]1CCC2(CC[NH2+]CC2)O1)c1cccnc1	ZINC000299791096	372764375	/nfs/dbraw/zinc/76/43/75/372764375.db2.gz	CPMVAICYPVITFJ-CYBMUJFWSA-N	1	0	275.352	1.113	50	0		CDAARO
C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCN(S(C)(=O)=O)C2)C[C@@H]1C	ZINC000253370408	373677080	/nfs/dbraw/zinc/67/70/80/373677080.db2.gz	QKFKGEZVYFDTDN-RQJABVFESA-N	1	0	288.457	1.682	50	0		CDAARO
CCc1cc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3[NH2+]2)on1	ZINC000253369822	373677843	/nfs/dbraw/zinc/67/78/43/373677843.db2.gz	IKWNUZXGTOKNGZ-HONMWMINSA-N	1	0	277.368	1.774	50	0		CDAARO
C[C@@H]1C[C@H](C)C[N@@H+](CCNC(=O)[C@H]2CCCO2)C1	ZINC000106077843	373750270	/nfs/dbraw/zinc/75/02/70/373750270.db2.gz	CSEXSBQZRCLGLX-FRRDWIJNSA-N	1	0	254.374	1.260	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1Cn1c(N)c2ccccc2nc1=O	ZINC000253524076	373865303	/nfs/dbraw/zinc/86/53/03/373865303.db2.gz	SARPHHGOECHQAD-NSHDSACASA-N	1	0	272.352	1.706	50	0		CDAARO
CC(C)Cc1nc(CSc2nc(N)cc(N)[nH+]2)no1	ZINC000031821333	373938260	/nfs/dbraw/zinc/93/82/60/373938260.db2.gz	IQINNSLLLLJMPJ-UHFFFAOYSA-N	1	0	280.357	1.515	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	ZINC000088834106	374064304	/nfs/dbraw/zinc/06/43/04/374064304.db2.gz	IBRFSTQMDUUHIB-DTWKUNHWSA-N	1	0	252.280	1.915	50	0		CDAARO
COc1cc(OC)cc(C(=O)NC[C@@H](C)C[NH+](C)C)c1	ZINC000002415051	374399083	/nfs/dbraw/zinc/39/90/83/374399083.db2.gz	BHYZOVAOCFFGTK-LLVKDONJSA-N	1	0	280.368	1.631	50	0		CDAARO
CCc1cc(C)nc(N2CC[N@H+](CCOC)[C@@H](CC)C2)n1	ZINC000108391762	412829390	/nfs/dbraw/zinc/82/93/90/412829390.db2.gz	LWDADUFETCNMSC-HNNXBMFYSA-N	1	0	292.427	1.894	50	0		CDAARO
COC(=O)c1ccc(NC(=O)C[NH2+]Cc2ccncc2)cc1	ZINC000095351429	374887590	/nfs/dbraw/zinc/88/75/90/374887590.db2.gz	ILEOUAHJEOKIKW-UHFFFAOYSA-N	1	0	299.330	1.597	50	0		CDAARO
CCO[C@H]1C[C@@H]([NH2+]C2CCN(C(N)=O)CC2)C12CCC2	ZINC000095423215	374924231	/nfs/dbraw/zinc/92/42/31/374924231.db2.gz	SWZGEPMRPCSIBZ-OLZOCXBDSA-N	1	0	281.400	1.467	50	0		CDAARO
CC1CC[NH+](C[C@H](O)COc2cccc(C(N)=O)c2)CC1	ZINC000095439082	374939677	/nfs/dbraw/zinc/93/96/77/374939677.db2.gz	VFPBBPXVCJSXTO-AWEZNQCLSA-N	1	0	292.379	1.257	50	0		CDAARO
COC[C@@H](C)n1cc(C(=O)N2CC[NH2+]C(C)(C)C2)c(C)n1	ZINC000097059648	375143038	/nfs/dbraw/zinc/14/30/38/375143038.db2.gz	POIHXXVXBBCIFM-LLVKDONJSA-N	1	0	294.399	1.223	50	0		CDAARO
CCOc1ccc(CN(C)CC(=O)NC2CC2)cc1OC	ZINC000003349043	375656988	/nfs/dbraw/zinc/65/69/88/375656988.db2.gz	JWHDXCQOJDZMGN-UHFFFAOYSA-N	1	0	292.379	1.804	50	0		CDAARO
COC[C@@H](O)C[NH+]1CCN(c2cccc(C)c2)CC1	ZINC000031659675	375811981	/nfs/dbraw/zinc/81/19/81/375811981.db2.gz	TVXJHRJBMCTVJW-HNNXBMFYSA-N	1	0	264.369	1.124	50	0		CDAARO
C[C@@H]1CCN(c2cc(N3CCC[C@H]3CO)ncn2)C1	ZINC000257365227	190038500	/nfs/dbraw/zinc/03/85/00/190038500.db2.gz	SKYZLBQLIQXLEK-NEPJUHHUSA-N	1	0	262.357	1.284	50	0		CDAARO
CCOCC[N@@H+]1CCN(CCCN2CCCC2=O)C[C@H]1C	ZINC000241588493	376019353	/nfs/dbraw/zinc/01/93/53/376019353.db2.gz	PDPMZOJXUUQDAN-OAHLLOKOSA-N	1	0	297.443	1.042	50	0		CDAARO
C[N@@H+]1CC[C@@H](CNC(=O)CCc2cccs2)C1	ZINC000066652271	376508394	/nfs/dbraw/zinc/50/83/94/376508394.db2.gz	XSHJYLFIEVKNJK-NSHDSACASA-N	1	0	252.383	1.749	50	0		CDAARO
[NH3+][C@H]1CCN(Cc2cnc3c(-c4ccccc4)cnn3c2)C1	ZINC000067881393	377279044	/nfs/dbraw/zinc/27/90/44/377279044.db2.gz	JKCQQDRSHAJKIY-HNNXBMFYSA-N	1	0	293.374	1.929	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)NCc1cc[nH]n1)c1ccsc1	ZINC000089312269	377822300	/nfs/dbraw/zinc/82/23/00/377822300.db2.gz	NCOCXUOCXYMBEZ-LBPRGKRZSA-N	1	0	293.396	1.573	50	0		CDAARO
COCCNC(=O)C[NH2+]C12CC3CC(CC(C3)C1)C2	ZINC000008993981	377795216	/nfs/dbraw/zinc/79/52/16/377795216.db2.gz	LRQNGWSTDHMXPY-UHFFFAOYSA-N	1	0	266.385	1.307	50	0		CDAARO
CC[NH+]1CCN(c2nc(C(C)C)cc(=O)[nH]2)CC1	ZINC000009164826	378379866	/nfs/dbraw/zinc/37/98/66/378379866.db2.gz	GTWMMNOTTPTSLF-UHFFFAOYSA-N	1	0	250.346	1.035	50	0		CDAARO
C[C@H](O)C[NH+](Cc1ccccc1Cl)C[C@H](C)O	ZINC000000214577	169577680	/nfs/dbraw/zinc/57/76/80/169577680.db2.gz	LPFZHQQEAZUCTP-QWRGUYRKSA-N	1	0	257.761	1.904	50	0		CDAARO
COCC[N@@H+]1CCN(Cc2cc(C)on2)C[C@@H]1C	ZINC000106776616	532967082	/nfs/dbraw/zinc/96/70/82/532967082.db2.gz	JZFDAHVGYDUEBI-NSHDSACASA-N	1	0	253.346	1.136	50	0		CDAARO
C[C@H]1COCC[C@@H]1[NH2+]Cc1cccc(-n2cncn2)c1	ZINC000281020322	195072505	/nfs/dbraw/zinc/07/25/05/195072505.db2.gz	XNPWEXXQUFAHCZ-WFASDCNBSA-N	1	0	272.352	1.782	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)/C=C\c2c(F)cccc2F)C1	ZINC000493287290	253419896	/nfs/dbraw/zinc/41/98/96/253419896.db2.gz	BZAJKQZYFPENSF-XRVBUDJMSA-N	1	0	252.264	1.538	50	0		CDAARO
O=c1[nH]c2cc(Cl)ccc2n1C1CC[NH2+]CC1	ZINC000005019445	285198382	/nfs/dbraw/zinc/19/83/82/285198382.db2.gz	DOAYWDKFDPSTSV-UHFFFAOYSA-N	1	0	251.717	1.908	50	0	world	CDAARO
C[C@](CO)([NH2+]CCCN1CCOC1=O)C1CCCCC1	ZINC000096420068	256760914	/nfs/dbraw/zinc/76/09/14/256760914.db2.gz	XLXYCVMUYSEVNA-OAHLLOKOSA-N	1	0	284.400	1.750	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+][C@@H](CO)c2cnn(C)c2)C1(C)C	ZINC000095988164	256882677	/nfs/dbraw/zinc/88/26/77/256882677.db2.gz	BOAASZMUNPXNTL-RWMBFGLXSA-N	1	0	267.373	1.247	50	0		CDAARO
CCOC(=O)C1CCN(C2CC[NH+](CC)CC2)CC1	ZINC000000280142	390135941	/nfs/dbraw/zinc/13/59/41/390135941.db2.gz	NJZXHMXKZPLVHU-UHFFFAOYSA-N	1	0	268.401	1.746	50	0		CDAARO
CC(C)(C)CC(=O)N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000096426630	390517599	/nfs/dbraw/zinc/51/75/99/390517599.db2.gz	ZKTIEAFKJRKILS-ZDUSSCGKSA-N	1	0	268.401	1.603	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)c1ccnc(C2CC2)n1	ZINC000408519107	390849660	/nfs/dbraw/zinc/84/96/60/390849660.db2.gz	LJWJSOSXNMJTPQ-ZWNOBZJWSA-N	1	0	274.368	1.696	50	0		CDAARO
C[C@@H]([NH2+]CC1OCCO1)c1ccc(N2CCCC2=O)cc1	ZINC000180247567	391823628	/nfs/dbraw/zinc/82/36/28/391823628.db2.gz	HWUVTBHHCZUFBA-GFCCVEGCSA-N	1	0	290.363	1.837	50	0		CDAARO
C[C@H]1OCC[C@@H]1[N@H+](CCO)Cc1cnn(C(C)(C)C)c1	ZINC000449675541	392854490	/nfs/dbraw/zinc/85/44/90/392854490.db2.gz	AKTLJBAADQPGJA-OCCSQVGLSA-N	1	0	281.400	1.610	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(C(=O)/C=C\c2cccnc2)C1	ZINC000493753853	393440836	/nfs/dbraw/zinc/44/08/36/393440836.db2.gz	LCUOTMBKUKPJBR-AFNCTOJWSA-N	1	0	259.353	1.553	50	0		CDAARO
COc1cc(N2CCN(c3cc[nH+]cc3C)CC2)ncn1	ZINC000065375413	134935746	/nfs/dbraw/zinc/93/57/46/134935746.db2.gz	LFCLOYYAWYBMBA-UHFFFAOYSA-N	1	0	285.351	1.515	50	0		CDAARO
[NH3+][C@H]1CCCc2nc(N3CCC(CO)CC3)ncc21	ZINC000091998099	135074319	/nfs/dbraw/zinc/07/43/19/135074319.db2.gz	FMVPZMDQWXSMND-LBPRGKRZSA-N	1	0	262.357	1.021	50	0		CDAARO
Cc1ccc(OCC(=O)N2CC[C@@H](C[NH3+])C2)c(C)c1	ZINC000178566355	140005658	/nfs/dbraw/zinc/00/56/58/140005658.db2.gz	XXKBJMWSSGWPIP-ZDUSSCGKSA-N	1	0	262.353	1.489	50	0		CDAARO
C[C@H]([NH2+]Cc1nnnn1C1CC1)C(C)(C)C(F)F	ZINC000657922394	413089773	/nfs/dbraw/zinc/08/97/73/413089773.db2.gz	ODQPFZLOHIVCMU-ZETCQYMHSA-N	1	0	259.304	1.777	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@@H]1CC[NH2+]C[C@@H]1C	ZINC000094345631	292124438	/nfs/dbraw/zinc/12/44/38/292124438.db2.gz	ROVYWRQYKMMRLT-CMPLNLGQSA-N	1	0	286.372	1.410	50	0		CDAARO
CC1(C)CC(N2CCC(=O)NC2=S)CC(C)(C)[NH2+]1	ZINC000000053123	397822938	/nfs/dbraw/zinc/82/29/38/397822938.db2.gz	LENXQJQKQUFHOY-UHFFFAOYSA-N	1	0	269.414	1.402	50	0		CDAARO
CCO[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CC[C@H]([NH3+])C2)C1(C)C	ZINC000299738617	286326082	/nfs/dbraw/zinc/32/60/82/286326082.db2.gz	CVWOUGYGGJKVLG-MROQNXINSA-N	1	0	268.401	1.776	50	0		CDAARO
COCCCNC(=O)[C@@H](C)N1CCC[C@@H]([NH+]2CCCC2)C1	ZINC000195530710	292359548	/nfs/dbraw/zinc/35/95/48/292359548.db2.gz	IKSFADJZHWLGNH-HUUCEWRRSA-N	1	0	297.443	1.088	50	0		CDAARO
O=C1C[C@@H]([NH2+]C[C@H]2CCCO2)C(=O)N1c1ccc(F)cc1	ZINC000004903747	170038788	/nfs/dbraw/zinc/03/87/88/170038788.db2.gz	JWUKCIQEXQYHGG-CHWSQXEVSA-N	1	0	292.310	1.226	50	0		CDAARO
Cn1c2ccc(C[NH2+]Cc3ccco3)cc2n(C)c1=O	ZINC000006678566	170225845	/nfs/dbraw/zinc/22/58/45/170225845.db2.gz	IDDDMIDGOAPOKH-UHFFFAOYSA-N	1	0	271.320	1.760	50	0		CDAARO
C[C@@H](Oc1ccc(Cl)cc1)C(=O)NCC[NH+](C)C	ZINC000010111691	170397703	/nfs/dbraw/zinc/39/77/03/170397703.db2.gz	OHVNMUXPEOJAAV-SNVBAGLBSA-N	1	0	270.760	1.785	50	0		CDAARO
COCCNC(=S)NC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000002202782	292556645	/nfs/dbraw/zinc/55/66/45/292556645.db2.gz	RWTAOXQHDTWSRV-UHFFFAOYSA-N	1	0	273.446	1.406	50	0		CDAARO
OCC[C@H]1C[NH2+]CCN1Cc1c[nH]c2ccccc12	ZINC000019368018	170777614	/nfs/dbraw/zinc/77/76/14/170777614.db2.gz	ILBFTINLKPCDMK-ZDUSSCGKSA-N	1	0	259.353	1.324	50	0		CDAARO
Brc1cccc(OCCN2CC[NH2+]CC2)c1	ZINC000020267772	171124427	/nfs/dbraw/zinc/12/44/27/171124427.db2.gz	FBZVPBWIPKFXRJ-UHFFFAOYSA-N	1	0	285.185	1.733	50	0		CDAARO
C[C@@H](c1nc(Cc2ccccc2)no1)N1CC[NH2+]CC1	ZINC000020282433	171133020	/nfs/dbraw/zinc/13/30/20/171133020.db2.gz	SHCILNFGZJHFNK-LBPRGKRZSA-N	1	0	272.352	1.627	50	0		CDAARO
CSCC(=O)N1CCC[C@@H](C[NH+]2CCCC2)C1	ZINC000020542183	171241894	/nfs/dbraw/zinc/24/18/94/171241894.db2.gz	BQBDUDIBXYUYGZ-LBPRGKRZSA-N	1	0	256.415	1.684	50	0		CDAARO
Cc1nnc(C[NH2+]C(C)(C)CN2CCOCC2)s1	ZINC000660808182	413505388	/nfs/dbraw/zinc/50/53/88/413505388.db2.gz	ISEBORPPMDFRGY-UHFFFAOYSA-N	1	0	270.402	1.047	50	0		CDAARO
CCOC(=O)[C@H](C[NH+](C)C)c1ccc(OC)cc1	ZINC000044699526	175235493	/nfs/dbraw/zinc/23/54/93/175235493.db2.gz	AYXZUXPFYCNRFQ-CYBMUJFWSA-N	1	0	251.326	1.904	50	0	in-vitro	CDAARO
CCOC(=O)CCNC(=O)CC[NH+]1CCCCCCC1	ZINC000055358474	175576889	/nfs/dbraw/zinc/57/68/89/175576889.db2.gz	LXATUIADXBNHNM-UHFFFAOYSA-N	1	0	284.400	1.712	50	0		CDAARO
Cc1cc(C[C@@H](C)NC(=O)C2CC[NH+](C(C)C)CC2)[nH]n1	ZINC000065494014	175743853	/nfs/dbraw/zinc/74/38/53/175743853.db2.gz	RPLQXNBWFAMGCA-GFCCVEGCSA-N	1	0	292.427	1.886	50	0		CDAARO
C[NH+](C)[C@]1(CNC(=O)c2cc(C3CC3)n[nH]2)CCSC1	ZINC000067955933	175803912	/nfs/dbraw/zinc/80/39/12/175803912.db2.gz	UKBOAJLFAMTGIH-AWEZNQCLSA-N	1	0	294.424	1.454	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCN(C(=O)C2(c3ccccc3)CC2)C1	ZINC000072163504	176330668	/nfs/dbraw/zinc/33/06/68/176330668.db2.gz	NTEXFHQQTWYWOQ-INIZCTEOSA-N	1	0	288.391	1.243	50	0		CDAARO
Cc1cnc(CNC(=O)c2ccccc2[C@H]2CC[NH2+]C2)cn1	ZINC000072166865	176331837	/nfs/dbraw/zinc/33/18/37/176331837.db2.gz	IYRJKFKOCNCMAQ-ZDUSSCGKSA-N	1	0	296.374	1.792	50	0		CDAARO
COc1ccc(C2=NOC3(CC[NH2+]CC3)N2)cc1F	ZINC000072226823	176343280	/nfs/dbraw/zinc/34/32/80/176343280.db2.gz	XMDLBJRSRIOOPX-UHFFFAOYSA-N	1	0	265.288	1.195	50	0		CDAARO
CCOC(=O)[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1O	ZINC000072267129	176352707	/nfs/dbraw/zinc/35/27/07/176352707.db2.gz	MUPAPEDKCKNYLY-KBPBESRZSA-N	1	0	263.337	1.433	50	0		CDAARO
Cc1cc(CCC(=O)N(C)C)nc([C@@H]2CCC[NH2+]C2)n1	ZINC000072344290	176372933	/nfs/dbraw/zinc/37/29/33/176372933.db2.gz	JMFDOODMQOYDTQ-GFCCVEGCSA-N	1	0	276.384	1.273	50	0		CDAARO
Cc1cc(CNC(=O)[C@@H]2C[NH2+]CCO2)c(C(F)(F)F)o1	ZINC000072426741	176402271	/nfs/dbraw/zinc/40/22/71/176402271.db2.gz	RBELPTFTZWOILN-VIFPVBQESA-N	1	0	292.257	1.211	50	0		CDAARO
c1ncn(CCN2CC[NH+](CCCc3ccccc3)CC2)n1	ZINC000077299134	177250327	/nfs/dbraw/zinc/25/03/27/177250327.db2.gz	AZOOEICESBNTJK-UHFFFAOYSA-N	1	0	299.422	1.529	50	0		CDAARO
Cc1ccsc1CCNC(=O)C[C@H]1C[NH2+]CCO1	ZINC000258909433	270309597	/nfs/dbraw/zinc/30/95/97/270309597.db2.gz	JKNISMQBBFVZAM-NSHDSACASA-N	1	0	268.382	1.094	50	0		CDAARO
c1ccc(CN2CCO[C@H](C[NH+]3CCCC3)C2)cc1	ZINC000071619120	260273346	/nfs/dbraw/zinc/27/33/46/260273346.db2.gz	ZMCFQWJMHRVTFS-MRXNPFEDSA-N	1	0	260.381	1.983	50	0		CDAARO
CC[NH+](CC)C[C@H](O)c1ccc2c(c1)NC(=O)CO2	ZINC000062353969	262411801	/nfs/dbraw/zinc/41/18/01/262411801.db2.gz	TVIYLZUEGXLJLF-LBPRGKRZSA-N	1	0	264.325	1.393	50	0		CDAARO
[NH3+]C[C@H]1CCCCN1C(=O)c1ccc2nccn2c1	ZINC000178491777	274951257	/nfs/dbraw/zinc/95/12/57/274951257.db2.gz	QAXRTICNGDDIHD-GFCCVEGCSA-N	1	0	258.325	1.288	50	0		CDAARO
C[N@@H+]1CCCN(C(=O)[C@@H]2COc3ccccc3C2)CC1	ZINC000012976920	277048585	/nfs/dbraw/zinc/04/85/85/277048585.db2.gz	CRASULWZBCLTAS-AWEZNQCLSA-N	1	0	274.364	1.402	50	0		CDAARO
COC1CC[NH+](CC(=O)N2CCCCCC2)CC1	ZINC000048230416	277194387	/nfs/dbraw/zinc/19/43/87/277194387.db2.gz	NGAUTQVCYQTGLS-UHFFFAOYSA-N	1	0	254.374	1.500	50	0		CDAARO
CSCCC[N@@H+]1CC[C@H]2OCc3cnnn3[C@H]2C1	ZINC000299774203	278128944	/nfs/dbraw/zinc/12/89/44/278128944.db2.gz	CCRDQTYWWRTDQZ-NWDGAFQWSA-N	1	0	268.386	1.177	50	0		CDAARO
C[C@H]1CN(C(=O)CO[C@H]2CCC[C@@H](C)C2)C[C@H]1[NH+](C)C	ZINC000084689625	279248666	/nfs/dbraw/zinc/24/86/66/279248666.db2.gz	FSLIQTBXLQIBFL-CBBWQLFWSA-N	1	0	282.428	1.990	50	0		CDAARO
Cc1cn[nH]c1C[NH2+]C[C@@H]1CC(=O)Nc2ccccc21	ZINC000368233315	280283179	/nfs/dbraw/zinc/28/31/79/280283179.db2.gz	XIQIKGVIKFALAP-NSHDSACASA-N	1	0	270.336	1.934	50	0		CDAARO
COc1nc(N2CCC[C@@H](CC[NH3+])C2)ncc1F	ZINC000534578242	328310893	/nfs/dbraw/zinc/31/08/93/328310893.db2.gz	XVKIGBFUEKGOKD-VIFPVBQESA-N	1	0	254.309	1.190	50	0		CDAARO
CC(C)[C@H](NC(=O)C[NH+]1CCCCCC1)c1ncnn1C	ZINC000534642710	328329147	/nfs/dbraw/zinc/32/91/47/328329147.db2.gz	QWTHHRHFJLXVKJ-AWEZNQCLSA-N	1	0	293.415	1.504	50	0		CDAARO
Cn1cc(CSc2nnc([C@@H]3CCC[NH2+]C3)n2C)cn1	ZINC000534632351	328331664	/nfs/dbraw/zinc/33/16/64/328331664.db2.gz	MXLFAFGNGFCRIM-LLVKDONJSA-N	1	0	292.412	1.308	50	0		CDAARO
Fc1ccc(OCCN2C[C@@H]3CC[NH2+][C@@H]3C2)cc1	ZINC000534653373	328338517	/nfs/dbraw/zinc/33/85/17/328338517.db2.gz	GHHYFQLTXWIAEL-SMDDNHRTSA-N	1	0	250.317	1.498	50	0		CDAARO
Cc1nn(C[C@H](C)[NH2+]CCn2ccnn2)c(C)c1Cl	ZINC000534655270	328339706	/nfs/dbraw/zinc/33/97/06/328339706.db2.gz	RCEFVHSCCQFSNI-VIFPVBQESA-N	1	0	282.779	1.423	50	0		CDAARO
CN(Cc1cccc2cnccc21)C(=O)[C@H]1C=CC[NH2+]1	ZINC000534675009	328346026	/nfs/dbraw/zinc/34/60/26/328346026.db2.gz	JHSSIIDHFZVIJL-OAHLLOKOSA-N	1	0	267.332	1.721	50	0		CDAARO
O=C(C[N@@H+]1C[C@@H]2CC[C@H]1C2)NCc1cccc(CO)c1	ZINC000534663368	328351225	/nfs/dbraw/zinc/35/12/25/328351225.db2.gz	QCYXEHXHHCXZQB-HIFRSBDPSA-N	1	0	274.364	1.279	50	0		CDAARO
CC[C@H](C(=O)N1CCC(OC[C@@H]2CCOC2)CC1)[NH+](C)C	ZINC000097372837	323207808	/nfs/dbraw/zinc/20/78/08/323207808.db2.gz	GRGOTYQUZWQTNR-UKRRQHHQSA-N	1	0	298.427	1.371	50	0		CDAARO
C[C@@H](CS(C)(=O)=O)[NH2+]CCCOC1CCCC1	ZINC000182687558	323295481	/nfs/dbraw/zinc/29/54/81/323295481.db2.gz	GZVBXCNQAVZFLG-NSHDSACASA-N	1	0	263.403	1.358	50	0		CDAARO
O=C(C1CCC1)N1CCC[N@H+](C[C@@H]2CCOC2)CC1	ZINC000670455940	483032813	/nfs/dbraw/zinc/03/28/13/483032813.db2.gz	RBIFKQBPRXVWNW-ZDUSSCGKSA-N	1	0	266.385	1.357	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(N2CCO[C@@H](C3CC3)C2)c1C	ZINC000670456204	483035711	/nfs/dbraw/zinc/03/57/11/483035711.db2.gz	JTMUDDLOJRCQPJ-CYBMUJFWSA-N	1	0	276.384	1.775	50	0		CDAARO
CC(C)(O)[C@@H]1CCN(C(=O)C[NH+]2CCCCCC2)C1	ZINC000670473271	483082501	/nfs/dbraw/zinc/08/25/01/483082501.db2.gz	NZVLWZVQHWYQMT-CYBMUJFWSA-N	1	0	268.401	1.482	50	0		CDAARO
COc1ccccc1C[C@@H](C)[NH2+]C[C@@H](C)N1CCOCC1	ZINC000097016486	534104244	/nfs/dbraw/zinc/10/42/44/534104244.db2.gz	GYVMXFPDPHNRQI-HUUCEWRRSA-N	1	0	292.423	1.937	50	0		CDAARO
CCNC(=O)NC(=O)C[NH2+][C@@H](C)C(C)(C)c1ccccc1	ZINC000096491401	528163810	/nfs/dbraw/zinc/16/38/10/528163810.db2.gz	QQXNGCQJMYKMEW-LBPRGKRZSA-N	1	0	291.395	1.788	50	0		CDAARO
CC(C)[N@H+](C)CC(=O)N[C@H]1c2ccccc2C[C@@H]1O	ZINC000096449518	528813831	/nfs/dbraw/zinc/81/38/31/528813831.db2.gz	BCUZKGOWZINSQJ-ZFWWWQNUSA-N	1	0	262.353	1.101	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@H]([NH3+])C2CCCC2)C1	ZINC000958528673	613973550	/nfs/dbraw/zinc/97/35/50/613973550.db2.gz	RZRCQHNRFHZMKY-LLVKDONJSA-N	1	0	270.373	1.486	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@@](O)([C@H]([NH3+])C2CC2)C1	ZINC000958528666	613975135	/nfs/dbraw/zinc/97/51/35/613975135.db2.gz	YNRQQSMQLYYSCJ-RISCZKNCSA-N	1	0	270.373	1.486	50	0		CDAARO
CC1(C)CC(CC(=O)N2CC[C@@H](CO)C2)CC(C)(C)[NH2+]1	ZINC000952972708	614517381	/nfs/dbraw/zinc/51/73/81/614517381.db2.gz	UOOVVOWDFIUBLO-GFCCVEGCSA-N	1	0	282.428	1.774	50	0		CDAARO
CC(C)[C@H](C[NH2+][C@@H]1CS(=O)(=O)C[C@H]1O)c1ccccc1	ZINC000904217912	626222885	/nfs/dbraw/zinc/22/28/85/626222885.db2.gz	WDBIGBLKAPCPJQ-RRFJBIMHSA-N	1	0	297.420	1.174	50	0		CDAARO
OC[C@@]12C[N@H+](Cc3ccc4c(c3)CCO4)C[C@@H]1COCC2	ZINC001772700299	1159436368	/nfs/dbraw/zinc/43/63/68/1159436368.db2.gz	BHPDNFWSGBDUNT-NVXWUHKLSA-N	1	0	289.375	1.452	50	0		CDAARO
CC(C)=CCC[N@H+]1C[C@@H](Cc2cnccn2)[C@H](O)C1	ZINC001704303635	1177680921	/nfs/dbraw/zinc/68/09/21/1177680921.db2.gz	MVDSOJYEOHABQR-UKRRQHHQSA-N	1	0	261.369	1.668	50	0		CDAARO
Cc1c[nH+]ccc1N1C[C@@H](Cc2ccccn2)[C@H](O)C1	ZINC001704311664	1177683629	/nfs/dbraw/zinc/68/36/29/1177683629.db2.gz	PAMNSJZMOGRROP-CZUORRHYSA-N	1	0	269.348	1.825	50	0		CDAARO
CNC(=O)c1cccnc1N1CC([NH+]2CCCCC2)C1	ZINC001704341532	1177694978	/nfs/dbraw/zinc/69/49/78/1177694978.db2.gz	WQSFWWQBUSEPFJ-UHFFFAOYSA-N	1	0	274.368	1.116	50	0		CDAARO
C/C(=C\C(=O)NCCN1CC[NH2+]CC1)c1cccc(F)c1	ZINC000178451309	796836445	/nfs/dbraw/zinc/83/64/45/796836445.db2.gz	YFQVIIOSJLWLKQ-ACCUITESSA-N	1	0	291.370	1.250	50	0		CDAARO
O=C(NCCc1ccc(F)cc1)[C@H]1[NH2+]CC12CCOCC2	ZINC000852772064	797841663	/nfs/dbraw/zinc/84/16/63/797841663.db2.gz	JOZMTKIUYIAMRK-CQSZACIVSA-N	1	0	292.354	1.253	50	0		CDAARO
C[C@H](CCC(=O)NCCc1ncc[nH]1)[NH+]1CCCC1	ZINC000426538719	902594977	/nfs/dbraw/zinc/59/49/77/902594977.db2.gz	YZFCIAUJJCVSPW-GFCCVEGCSA-N	1	0	264.373	1.333	50	0		CDAARO
c1cn(CCCNc2cc([C@@H]3CCOC3)ncn2)cn1	ZINC000426635594	902770438	/nfs/dbraw/zinc/77/04/38/902770438.db2.gz	WCLHYYHUYUGNLH-GFCCVEGCSA-N	1	0	273.340	1.101	50	0		CDAARO
CSc1nc(NCCc2nc(C)cc(=O)[nH]2)cc(N)[nH+]1	ZINC000952869939	910421400	/nfs/dbraw/zinc/42/14/00/910421400.db2.gz	PWHVFQREMGQTPW-UHFFFAOYSA-N	1	0	292.368	1.239	50	0		CDAARO
CCCCOC(=O)CN1C=NC2=[NH+][C@H](C)CCN21	ZINC000952883820	910457187	/nfs/dbraw/zinc/45/71/87/910457187.db2.gz	RBUKOHHAUFJULF-SNVBAGLBSA-N	1	0	252.318	1.039	50	0		CDAARO
C[C@H]1CN(C[C@H](O)Cn2cccn2)CC[N@@H+]1C1CCCC1	ZINC000952884277	910459813	/nfs/dbraw/zinc/45/98/13/910459813.db2.gz	WVZKDIBFAUUOIR-HOCLYGCPSA-N	1	0	292.427	1.193	50	0		CDAARO
C[C@@H](O)C[NH+]1CCC(CNC(=O)CCC2CCC2)CC1	ZINC000952968233	910533732	/nfs/dbraw/zinc/53/37/32/910533732.db2.gz	KVPYXNVHTPCENA-CYBMUJFWSA-N	1	0	282.428	1.776	50	0		CDAARO
OCC(F)(F)CNC1CC[NH+](Cc2ccccn2)CC1	ZINC000184686899	917687110	/nfs/dbraw/zinc/68/71/10/917687110.db2.gz	KJGPSKFPABQRPC-UHFFFAOYSA-N	1	0	285.338	1.263	50	0		CDAARO
CC(C)[C@H](CNc1nccnc1N(C)C)[NH+](C)C	ZINC000820694832	925544132	/nfs/dbraw/zinc/54/41/32/925544132.db2.gz	ZBKDSGYUNDSGMN-NSHDSACASA-N	1	0	251.378	1.541	50	0		CDAARO
CC[N@H+](C)[C@H](C)CCNC(=O)N1CC(c2ccncc2)C1	ZINC000823065549	925667555	/nfs/dbraw/zinc/66/75/55/925667555.db2.gz	LXKLDZUMBQJCPK-CYBMUJFWSA-N	1	0	290.411	1.921	50	0		CDAARO
CCN(C)C1(C[NH2+][C@@H](C)CS(C)(=O)=O)CCCC1	ZINC000823067838	925667755	/nfs/dbraw/zinc/66/77/55/925667755.db2.gz	LFKJPQSBNLRRQT-LBPRGKRZSA-N	1	0	276.446	1.274	50	0		CDAARO
Cc1n[nH]c(C)c1CCC[N@@H+](C)CCn1cnnc1C	ZINC000823704013	925723126	/nfs/dbraw/zinc/72/31/26/925723126.db2.gz	LRIGCCAQHHVJJO-UHFFFAOYSA-N	1	0	276.388	1.491	50	0		CDAARO
COc1ncc(C[N@H+](C)CCc2ccccn2)cn1	ZINC000824852082	925840000	/nfs/dbraw/zinc/84/00/00/925840000.db2.gz	QIQKZPZFKWDKBB-UHFFFAOYSA-N	1	0	258.325	1.555	50	0		CDAARO
O=C(c1c[nH]c(=O)[nH]1)N1CCC[N@@H+](C2CCCCC2)CC1	ZINC000828137136	926052310	/nfs/dbraw/zinc/05/23/10/926052310.db2.gz	XONPWZHMSMTHMN-UHFFFAOYSA-N	1	0	292.383	1.596	50	0		CDAARO
Cc1nc(C)c(C(=O)NCCC[N@@H+]2CCCC[C@H]2CO)o1	ZINC000828710820	926168642	/nfs/dbraw/zinc/16/86/42/926168642.db2.gz	KABLPCIIRWHFMZ-ZDUSSCGKSA-N	1	0	295.383	1.258	50	0		CDAARO
Cc1nc(NC(=O)N2CC[N@@H+](C(C)C)[C@@H](C)C2)nn1C	ZINC000048422465	937349210	/nfs/dbraw/zinc/34/92/10/937349210.db2.gz	CGZOWIPNAKZAGW-JTQLQIEISA-N	1	0	280.376	1.070	50	0		CDAARO
CC1(C)CN(C(=O)c2ccc(C(N)=O)cc2)CC(C)(C)[NH2+]1	ZINC000585086028	930886207	/nfs/dbraw/zinc/88/62/07/930886207.db2.gz	YBMCNKMNMDRARM-UHFFFAOYSA-N	1	0	289.379	1.388	50	0		CDAARO
C[C@@H](COCC(=O)NCCc1ccccn1)[NH+]1CCCC1	ZINC000585121481	930986291	/nfs/dbraw/zinc/98/62/91/930986291.db2.gz	QLNNRAWKDLONDP-AWEZNQCLSA-N	1	0	291.395	1.241	50	0		CDAARO
CCOc1cccc(CNC(=O)[C@]2(C)C[C@H](O)C[N@@H+]2C)c1	ZINC000585121921	930989490	/nfs/dbraw/zinc/98/94/90/930989490.db2.gz	GHQFWKTVQWXFEP-BBRMVZONSA-N	1	0	292.379	1.157	50	0		CDAARO
C[NH2+][C@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000864097322	934606076	/nfs/dbraw/zinc/60/60/76/934606076.db2.gz	STKOQDUZSWJHSA-KBPBESRZSA-N	1	0	264.369	1.110	50	0		CDAARO
COc1ccc(CNC(=O)[C@H]2CCC[NH2+][C@H]2C)cc1OC	ZINC000094647263	934936322	/nfs/dbraw/zinc/93/63/22/934936322.db2.gz	SYRJYKFHUWOFCK-AAEUAGOBSA-N	1	0	292.379	1.708	50	0		CDAARO
C[C@@](O)(C[N@@H+]1C[C@@H]2CCC[C@]2(C[NH3+])C1)c1ccccc1	ZINC000402816582	940910526	/nfs/dbraw/zinc/91/05/26/940910526.db2.gz	MUVZXKOEFIGQEJ-BBWFWOEESA-N	1	0	274.408	1.955	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3ccncc3)C[C@@H]2O)on1	ZINC001529093031	968978587	/nfs/dbraw/zinc/97/85/87/968978587.db2.gz	ZPXJLSOWBWPOFP-HIFRSBDPSA-N	1	0	273.336	1.413	50	0		CDAARO
C=Cc1ccc(NCC[N@H+]2CCCC[C@H]2CO)nc1	ZINC001529168203	969001462	/nfs/dbraw/zinc/00/14/62/969001462.db2.gz	ZENZAAAJKMYZOY-AWEZNQCLSA-N	1	0	261.369	1.983	50	0		CDAARO
O[C@H]1C[N@H+](Cc2cccnc2)C[C@H]1Cc1ccncc1	ZINC001529172764	969002417	/nfs/dbraw/zinc/00/24/17/969002417.db2.gz	HXKGAUQAIKQNEM-CVEARBPZSA-N	1	0	269.348	1.512	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](C(=O)Nc2cnn(C(C)C)c2)C1	ZINC001529172864	969003388	/nfs/dbraw/zinc/00/33/88/969003388.db2.gz	QQKJJIKYSMVELP-ZDUSSCGKSA-N	1	0	294.399	1.761	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]CCC(=O)N1CCCC1	ZINC001506412756	975153900	/nfs/dbraw/zinc/15/39/00/975153900.db2.gz	OCWVQANVFLOWJN-ZDUSSCGKSA-N	1	0	278.400	1.436	50	0		CDAARO
COc1nccnc1N1CCC[C@]2(CC[N@H+](C)C2)C1	ZINC001506415795	975155785	/nfs/dbraw/zinc/15/57/85/975155785.db2.gz	CRVWDGQJWBZBIA-CQSZACIVSA-N	1	0	262.357	1.407	50	0		CDAARO
CO[C@H]1C[N@@H+](C(C)C)C[C@@H]1Nc1cc(N)nc(SC)n1	ZINC001506431237	975161695	/nfs/dbraw/zinc/16/16/95/975161695.db2.gz	GTOYHXDGGLERDA-UWVGGRQHSA-N	1	0	297.428	1.300	50	0		CDAARO
Cc1noc(C)c1C[NH2+][C@H](C(=O)N1CCOCC1)C(C)C	ZINC000096492102	230382889	/nfs/dbraw/zinc/38/28/89/230382889.db2.gz	HYBGVALVUXJRIB-AWEZNQCLSA-N	1	0	295.383	1.264	50	0		CDAARO
O[C@H]1CN(c2noc(C3CC3)n2)CC[N@@H+](C2CCCC2)C1	ZINC000097831142	230387628	/nfs/dbraw/zinc/38/76/28/230387628.db2.gz	KSLZIBRJTFEERR-CYBMUJFWSA-N	1	0	292.383	1.373	50	0		CDAARO
CCc1nccn1CCC(=O)N(C)C[C@]1(C)CC[N@H+](C)C1	ZINC000584903202	341986608	/nfs/dbraw/zinc/98/66/08/341986608.db2.gz	FFGBPOOJFWZELL-MRXNPFEDSA-N	1	0	292.427	1.636	50	0		CDAARO
COc1cccn(CC[C@@H]2CCCC[N@@H+]2C)c1=O	ZINC000095520874	185002757	/nfs/dbraw/zinc/00/27/57/185002757.db2.gz	RJFUKRNYCZSDKA-LBPRGKRZSA-N	1	0	250.342	1.731	50	0		CDAARO
CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1nc(C)no1	ZINC000106789137	349491378	/nfs/dbraw/zinc/49/13/78/349491378.db2.gz	XWNFJSZOLVGVHX-CHWSQXEVSA-N	1	0	278.356	1.353	50	0		CDAARO
Cc1nn(CCC[NH2+]C2CCOCC2)c(C)c1C	ZINC000584903974	341994146	/nfs/dbraw/zinc/99/41/46/341994146.db2.gz	IQGWODBTJFRGDR-UHFFFAOYSA-N	1	0	251.374	1.967	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@@H]1[NH2+][C@H](C)C(=O)NCC(C)C	ZINC000107504583	398150395	/nfs/dbraw/zinc/15/03/95/398150395.db2.gz	VMLJGRRQELUCBT-YUELXQCFSA-N	1	0	297.443	1.384	50	0		CDAARO
C[C@@H](C(=O)N1C[C@@H](C)O[C@H](C)C1)N(C)CC[NH+]1CCCC1	ZINC000107541752	398151840	/nfs/dbraw/zinc/15/18/40/398151840.db2.gz	OPDMIPYESAZPME-KFWWJZLASA-N	1	0	297.443	1.038	50	0		CDAARO
COc1ccc(C[NH2+][C@H]2CCCC[C@H]2C(N)=O)cc1F	ZINC000097375124	342002787	/nfs/dbraw/zinc/00/27/87/342002787.db2.gz	WQBBRKGGPPIIHS-YPMHNXCESA-N	1	0	280.343	1.968	50	0		CDAARO
COC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)CN1CCOCC1	ZINC000095967312	185047040	/nfs/dbraw/zinc/04/70/40/185047040.db2.gz	QCZNLCHEZHZMMF-DOTOQJQBSA-N	1	0	292.423	1.554	50	0		CDAARO
COC(=O)N1CCC[C@H]([NH2+][C@@H](C)c2ccccn2)C1	ZINC000095980732	185053090	/nfs/dbraw/zinc/05/30/90/185053090.db2.gz	MIHWMBXPSKWOOP-RYUDHWBXSA-N	1	0	263.341	1.963	50	0		CDAARO
COc1ccnc(C[NH2+][C@@H]2CCC[C@]2(C)CO)c1OC	ZINC000241447052	361751974	/nfs/dbraw/zinc/75/19/74/361751974.db2.gz	NQTKSJYJWGMUTO-UKRRQHHQSA-N	1	0	280.368	1.740	50	0		CDAARO
C[C@H](CO)[N@@H+]1CCCN(C(=O)c2cc(C3CC3)on2)CC1	ZINC000242324461	361756044	/nfs/dbraw/zinc/75/60/44/361756044.db2.gz	ZBMCMSCCPQEYJU-LLVKDONJSA-N	1	0	293.367	1.081	50	0		CDAARO
CCC[NH2+]CCNS(=O)(=O)CCc1cccs1	ZINC000242305024	361756235	/nfs/dbraw/zinc/75/62/35/361756235.db2.gz	YUCLDQQCDDKBIO-UHFFFAOYSA-N	1	0	276.427	1.210	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)Cc1ccc(-n2cccn2)cc1	ZINC000124773821	187152901	/nfs/dbraw/zinc/15/29/01/187152901.db2.gz	UBVIIZFZGFKXLU-CYBMUJFWSA-N	1	0	284.363	1.235	50	0		CDAARO
CC[NH+](CC)C[C@@H](O)CN1CCN(c2ccccc2)CC1	ZINC000006831207	361786734	/nfs/dbraw/zinc/78/67/34/361786734.db2.gz	MOMXHXYSMHAGKJ-QGZVFWFLSA-N	1	0	291.439	1.511	50	0		CDAARO
C[C@@H](CS(C)(=O)=O)N(CCC[NH3+])c1cccc(F)c1	ZINC000194624760	342598135	/nfs/dbraw/zinc/59/81/35/342598135.db2.gz	YELDBEBNOMPRSL-NSHDSACASA-N	1	0	288.388	1.414	50	0		CDAARO
C[C@@H]1CCC(=O)N1CC(=O)NCC[NH+]1[C@H](C)CCC[C@H]1C	ZINC000040511633	342100907	/nfs/dbraw/zinc/10/09/07/342100907.db2.gz	SRENKLLCHKVTEE-MGPQQGTHSA-N	1	0	295.427	1.376	50	0		CDAARO
CCC(CC)n1nc(C)cc1C(=O)N[C@@H]1C[NH2+]C[C@@H]1OC	ZINC000195554112	342625863	/nfs/dbraw/zinc/62/58/63/342625863.db2.gz	CZXYRTUZISPNER-OCCSQVGLSA-N	1	0	294.399	1.269	50	0		CDAARO
O=S1(=O)CC[C@H](C[NH2+][C@@H]2CCc3ccc(F)cc32)C1	ZINC000095419621	539087952	/nfs/dbraw/zinc/08/79/52/539087952.db2.gz	HDHVKYHTZIWKFY-QMTHXVAHSA-N	1	0	283.368	1.837	50	0		CDAARO
Cc1nc(C)n(-c2ccc(C(=O)N3CC[NH2+]C[C@H]3C)cc2)n1	ZINC000125305941	187179003	/nfs/dbraw/zinc/17/90/03/187179003.db2.gz	ZSOXVSSVNPVSIQ-LLVKDONJSA-N	1	0	299.378	1.318	50	0		CDAARO
Cn1cc([C@@H]2OCC[C@@H]2C[NH2+]Cc2cccn2C)cn1	ZINC000089756758	342163901	/nfs/dbraw/zinc/16/39/01/342163901.db2.gz	INMQVYMPKMLXQP-IUODEOHRSA-N	1	0	274.368	1.626	50	0		CDAARO
CC(C)[N@@H+]1CC[C@H](CN(C)C(=O)CCc2cn[nH]c2)C1	ZINC000244773795	361862229	/nfs/dbraw/zinc/86/22/29/361862229.db2.gz	PGRJLZDDKCRLNV-CQSZACIVSA-N	1	0	278.400	1.531	50	0		CDAARO
CCO[C@H]1C[C@@](O)(C[NH2+]Cc2c(C)nn(C)c2C)C1(C)C	ZINC000188903433	342204155	/nfs/dbraw/zinc/20/41/55/342204155.db2.gz	CCIFIINIYUFDEQ-GOEBONIOSA-N	1	0	295.427	1.693	50	0		CDAARO
CC(C)Oc1cccc([C@H](C)[NH2+][C@@H](C)C(N)=O)c1	ZINC000097033092	185156020	/nfs/dbraw/zinc/15/60/20/185156020.db2.gz	RCTDPMPWLMYCBW-QWRGUYRKSA-N	1	0	250.342	1.998	50	0		CDAARO
CCc1ncc(C(=O)N[C@@H]2CCc3nc(C)cn3C2)s1	ZINC000097198831	342217036	/nfs/dbraw/zinc/21/70/36/342217036.db2.gz	XQVHOKPBZVTNKI-SNVBAGLBSA-N	1	0	290.392	1.955	50	0		CDAARO
Cn1cccc1C(=O)N1CC[N@H+](C)[C@@H](C(C)(C)C)C1	ZINC000585130646	362056169	/nfs/dbraw/zinc/05/61/69/362056169.db2.gz	XMGJQNJPZRJNOT-CYBMUJFWSA-N	1	0	263.385	1.827	50	0		CDAARO
Cc1c(CNC(=O)[C@H]2CC[N@@H+]2C2CCCC2)cnn1C	ZINC000585132244	362057735	/nfs/dbraw/zinc/05/77/35/362057735.db2.gz	RBOMXDWTRNPVFD-CQSZACIVSA-N	1	0	276.384	1.362	50	0		CDAARO
Cc1nn(C)c2nc(N3CCC([NH3+])CC3)sc12	ZINC000095516783	282285146	/nfs/dbraw/zinc/28/51/46/282285146.db2.gz	CGOYAZGLAITNPN-UHFFFAOYSA-N	1	0	251.359	1.266	50	0		CDAARO
O=C1C[C@H]([NH2+]C[C@@H]2CCCO2)C(=O)N1c1ccccc1	ZINC000018077998	365798704	/nfs/dbraw/zinc/79/87/04/365798704.db2.gz	OMZNHAYDKPVXQO-STQMWFEESA-N	1	0	274.320	1.087	50	0		CDAARO
C[N@H+](CCNC(=O)[C@H]1CCCOC1)Cc1ccc(F)cc1	ZINC000096451692	529916297	/nfs/dbraw/zinc/91/62/97/529916297.db2.gz	UFPLUBHHLNLWOG-AWEZNQCLSA-N	1	0	294.370	1.800	50	0		CDAARO
Cc1ncc(C(=O)N2C[C@@H](C)[NH2+][C@@H](C)C2)c(C(C)C)n1	ZINC000179162210	362253786	/nfs/dbraw/zinc/25/37/86/362253786.db2.gz	KBTJNVCMDVOYFG-PHIMTYICSA-N	1	0	276.384	1.731	50	0		CDAARO
Cc1cccc2[nH]c(CN(C)C(=O)C[NH+](C)C)nc21	ZINC000252490400	362386765	/nfs/dbraw/zinc/38/67/65/362386765.db2.gz	KSQPLTQVNYNCLV-UHFFFAOYSA-N	1	0	260.341	1.391	50	0		CDAARO
CC(C)COC(=O)N1CCC([NH2+]C[C@@H]2CCC[C@@H]2O)CC1	ZINC000089157736	346155125	/nfs/dbraw/zinc/15/51/25/346155125.db2.gz	IHEXHGMUIZGZMD-ZFWWWQNUSA-N	1	0	298.427	1.994	50	0		CDAARO
CC(=O)N1CC[C@@H]([NH2+]Cc2occc2C)[C@H](C)C1	ZINC000089701978	347607536	/nfs/dbraw/zinc/60/75/36/347607536.db2.gz	LFMUYMSYTNLEJY-DGCLKSJQSA-N	1	0	250.342	1.935	50	0		CDAARO
CC[N@H+](C)C1(CNc2cc(=O)[nH]cn2)CCCC1	ZINC000584887056	349345794	/nfs/dbraw/zinc/34/57/94/349345794.db2.gz	WFDFCVGRGBUDAO-UHFFFAOYSA-N	1	0	250.346	1.859	50	0		CDAARO
COc1ccc2ncn(C[C@H]3CC[N@@H+](C4CC4)C3)c(=O)c2c1	ZINC000584888608	349347123	/nfs/dbraw/zinc/34/71/23/349347123.db2.gz	FACGVPWHDQQTPB-LBPRGKRZSA-N	1	0	299.374	1.889	50	0		CDAARO
Cc1cccc(C[C@@H](C)NC(=O)CC[NH+]2CCCC2)n1	ZINC000584893715	349353544	/nfs/dbraw/zinc/35/35/44/349353544.db2.gz	SXVOCYSWNYEYCM-CQSZACIVSA-N	1	0	275.396	1.923	50	0		CDAARO
COCCN(C)CC(=O)N1CC[C@@H](C2CCCCC2)C1	ZINC000584898430	349359964	/nfs/dbraw/zinc/35/99/64/349359964.db2.gz	CZMCWGVIFQKVCH-OAHLLOKOSA-N	1	0	282.428	1.993	50	0		CDAARO
Cc1nnc(N2C[C@H]([NH+](C)C)[C@@H](C(C)C)C2)s1	ZINC000091365123	180142655	/nfs/dbraw/zinc/14/26/55/180142655.db2.gz	RPCYHBQUFIAMPR-MNOVXSKESA-N	1	0	254.403	1.869	50	0		CDAARO
OC[C@@H](O)C[NH+]1CCC(c2nccn2CC2CCC2)CC1	ZINC000091441132	180156742	/nfs/dbraw/zinc/15/67/42/180156742.db2.gz	URAHHGMDFVOUTR-HNNXBMFYSA-N	1	0	293.411	1.216	50	0		CDAARO
CNC(=O)CCC[NH2+]Cc1cc(=O)c2cc(C)ccc2[nH]1	ZINC000091587008	180200378	/nfs/dbraw/zinc/20/03/78/180200378.db2.gz	XEPKDKHMZAVHPV-UHFFFAOYSA-N	1	0	287.363	1.452	50	0		CDAARO
CC(C)[C@H]1CN(C(=O)CCc2ccco2)C[C@@H]1[NH3+]	ZINC000091725426	180242361	/nfs/dbraw/zinc/24/23/61/180242361.db2.gz	PASTUUYCPRIHQU-OLZOCXBDSA-N	1	0	250.342	1.654	50	0		CDAARO
CSCC[NH+]1CCC(Nc2ccncn2)CC1	ZINC000091817798	180263354	/nfs/dbraw/zinc/26/33/54/180263354.db2.gz	MGQBQIBMFUTLLU-UHFFFAOYSA-N	1	0	252.387	1.716	50	0		CDAARO
C[C@H](O)C[N@@H+]1CCN(C[C@H](O)c2ccccc2F)C[C@@H]1C	ZINC000106840930	186140088	/nfs/dbraw/zinc/14/00/88/186140088.db2.gz	SSGNZJTYUPBOKE-XEZPLFJOSA-N	1	0	296.386	1.246	50	0		CDAARO
Cc1nn(C)c2ncc(C[NH2+][C@H]3CCCC[C@H]3O)cc12	ZINC000107912623	186196955	/nfs/dbraw/zinc/19/69/55/186196955.db2.gz	IWDSUVXBPOJQLW-UONOGXRCSA-N	1	0	274.368	1.670	50	0		CDAARO
Cc1[nH+]c2cc(NC3CCS(=O)(=O)CC3)ccc2n1C	ZINC000583650742	366005800	/nfs/dbraw/zinc/00/58/00/366005800.db2.gz	ADWRXFOWAMVDQS-UHFFFAOYSA-N	1	0	293.392	1.871	50	0		CDAARO
COc1ccc(S(=O)(=O)N2CCC[C@H]([C@@H](C)[NH3+])C2)cc1	ZINC000111713147	186450481	/nfs/dbraw/zinc/45/04/81/186450481.db2.gz	DQMSATPTOWMMNV-NEPJUHHUSA-N	1	0	298.408	1.443	50	0		CDAARO
CCc1cc(N(CC)CC[NH+](CC)CC)n2ncnc2n1	ZINC000022324302	351595950	/nfs/dbraw/zinc/59/59/50/351595950.db2.gz	SNORPFRCBWYGPU-UHFFFAOYSA-N	1	0	290.415	1.855	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CN(C(=O)c2cccc(F)c2F)CCO1	ZINC000122896994	187058277	/nfs/dbraw/zinc/05/82/77/187058277.db2.gz	UXLQKZGYKUDKCA-GZMMTYOYSA-N	1	0	270.279	1.153	50	0		CDAARO
CNC(=O)c1ccc(C[NH2+]Cc2c(C)n[nH]c2C)cc1	ZINC000036864630	363281983	/nfs/dbraw/zinc/28/19/83/363281983.db2.gz	AJXIAOWRTOKYHV-UHFFFAOYSA-N	1	0	272.352	1.676	50	0		CDAARO
c1cnc(N2CCC([NH2+][C@H]3CN4CCC3CC4)CC2)nc1	ZINC000036932519	363295237	/nfs/dbraw/zinc/29/52/37/363295237.db2.gz	RYALVFDRFOYKIJ-HNNXBMFYSA-N	1	0	287.411	1.129	50	0		CDAARO
O=C([C@@H]1C[C@@H](O)C[NH2+]1)N1CCC(Cc2ccccc2)CC1	ZINC000036963187	363301534	/nfs/dbraw/zinc/30/15/34/363301534.db2.gz	LRCUBBGXTFLPIY-CVEARBPZSA-N	1	0	288.391	1.191	50	0		CDAARO
CC(=O)Nc1ccc(OC[C@@H](O)C[NH2+]C(C)C)cc1	ZINC000000967917	355925979	/nfs/dbraw/zinc/92/59/79/355925979.db2.gz	DURULFYMVIFBIR-ZDUSSCGKSA-N	1	0	266.341	1.383	50	0	world	CDAARO
CS(=O)(=O)c1ccc(N2CC[NH2+]CC2)c(Cl)c1	ZINC000000154132	355891951	/nfs/dbraw/zinc/89/19/51/355891951.db2.gz	WATJCGPNOWITOJ-UHFFFAOYSA-N	1	0	274.773	1.153	50	0		CDAARO
COc1cc(OC)cc(C(=O)N2CCN(C)CC2)c1	ZINC000000180934	355894791	/nfs/dbraw/zinc/89/47/91/355894791.db2.gz	JNWDQAIZWQWVIU-UHFFFAOYSA-N	1	0	264.325	1.091	50	0		CDAARO
CC(C)Oc1ccccc1OCCOCC[N@H+](C)CCO	ZINC000002981010	355989995	/nfs/dbraw/zinc/98/99/95/355989995.db2.gz	JKDSEQZTKBVCSN-UHFFFAOYSA-N	1	0	297.395	1.793	50	0		CDAARO
Fc1ccccc1C[NH2+]CCCN1CCOCC1	ZINC000002380320	355968238	/nfs/dbraw/zinc/96/82/38/355968238.db2.gz	OHCCFMGQDQLZRO-UHFFFAOYSA-N	1	0	252.333	1.638	50	0		CDAARO
COc1ccc(S(=O)(=O)NCC[C@H]2CCC[N@@H+]2C)cc1	ZINC000004165599	356020812	/nfs/dbraw/zinc/02/08/12/356020812.db2.gz	MYGXMEUQXVICEI-GFCCVEGCSA-N	1	0	298.408	1.458	50	0		CDAARO
CCN(CC)S(=O)(=O)c1ccc([C@H](C)[NH3+])cc1	ZINC000004200447	356021606	/nfs/dbraw/zinc/02/16/06/356021606.db2.gz	FIYBJCPCCOIVNL-JTQLQIEISA-N	1	0	256.371	1.737	50	0		CDAARO
C[C@H]([NH2+][C@@H](C)[C@@H]1CCCO1)C(=O)NCc1cccs1	ZINC000097374215	356094602	/nfs/dbraw/zinc/09/46/02/356094602.db2.gz	ZJBZFEDVJDBBQK-GVXVVHGQSA-N	1	0	282.409	1.910	50	0		CDAARO
Cc1cc(C)cc(OCC[N@@H+](C)CCC(N)=O)c1	ZINC000016421724	356439658	/nfs/dbraw/zinc/43/96/58/356439658.db2.gz	PRQIMTLBEUMTBD-UHFFFAOYSA-N	1	0	250.342	1.489	50	0		CDAARO
COc1ccc(CC(=O)NCC[NH+]2CCCCC2)cc1	ZINC000016604565	356443044	/nfs/dbraw/zinc/44/30/44/356443044.db2.gz	CKRGRTCUKBMFDW-UHFFFAOYSA-N	1	0	276.380	1.840	50	0		CDAARO
CNc1ccc(C(=O)NCC[C@@H]2CCCC[N@@H+]2C)cn1	ZINC000019148955	356476229	/nfs/dbraw/zinc/47/62/29/356476229.db2.gz	DJRCUTQNHGVPRA-ZDUSSCGKSA-N	1	0	276.384	1.728	50	0		CDAARO
Cc1ccc(N2C(=O)C[C@H]([NH2+]C[C@H]3CCCO3)C2=O)cc1	ZINC000019720182	356496886	/nfs/dbraw/zinc/49/68/86/356496886.db2.gz	ATIPQIZIPFWXSA-KGLIPLIRSA-N	1	0	288.347	1.396	50	0		CDAARO
CC(C)[N@H+](C)CCNC(=O)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C	ZINC000246934203	356511094	/nfs/dbraw/zinc/51/10/94/356511094.db2.gz	NIAVPQOZAALCDC-YNEHKIRRSA-N	1	0	283.416	1.439	50	0		CDAARO
C[NH+](C)CCN1c2ccc(Br)cc2C(=O)C1=O	ZINC000019966829	356519499	/nfs/dbraw/zinc/51/94/99/356519499.db2.gz	FHYUCWKGNMXXNA-UHFFFAOYSA-N	1	0	297.152	1.540	50	0		CDAARO
CN(C)C1(C(N)=O)CC[NH+](Cc2ccccc2)CC1	ZINC000000410137	363494482	/nfs/dbraw/zinc/49/44/82/363494482.db2.gz	CTTXVHBXEKXREE-UHFFFAOYSA-N	1	0	261.369	1.068	50	0		CDAARO
CC(C)CNC(=O)N1CCC(C[NH3+])(C(F)(F)F)CC1	ZINC000725264653	538455606	/nfs/dbraw/zinc/45/56/06/538455606.db2.gz	AHXHHNILOLKDMI-UHFFFAOYSA-N	1	0	281.322	1.955	50	0		CDAARO
Cc1nnnn1CCC[N@@H+]1CCC[C@@H]1c1ccccn1	ZINC000072150567	356629828	/nfs/dbraw/zinc/62/98/28/356629828.db2.gz	FQJFPGLTASPSQT-CQSZACIVSA-N	1	0	272.356	1.604	50	0		CDAARO
O=C(NCCC[NH+]1CCCC1)c1cc(=O)[nH]c2ccccc21	ZINC000061547452	357456709	/nfs/dbraw/zinc/45/67/09/357456709.db2.gz	PRIHSXPFCGKFPP-UHFFFAOYSA-N	1	0	299.374	1.744	50	0		CDAARO
CN1c2ccccc2[C@@]2(CCC[N@H+](CCCO)C2)C1=O	ZINC000072154950	283265994	/nfs/dbraw/zinc/26/59/94/283265994.db2.gz	NXCRLJYQZFPWDS-INIZCTEOSA-N	1	0	274.364	1.379	50	0		CDAARO
Cc1cc(NC[C@H](O)c2cccnc2)nc(N2CCCC2)[nH+]1	ZINC000065431996	357541539	/nfs/dbraw/zinc/54/15/39/357541539.db2.gz	MABOEFUEQYUAFZ-AWEZNQCLSA-N	1	0	299.378	1.926	50	0		CDAARO
COCC1(C(=O)N(Cc2nccn2C)C2CC2)CCC1	ZINC000065493623	357544157	/nfs/dbraw/zinc/54/41/57/357544157.db2.gz	APQDOIDBVOIEDB-UHFFFAOYSA-N	1	0	277.368	1.728	50	0		CDAARO
Cc1sc2nc(CC[NH3+])nc(NCCCCO)c2c1C	ZINC000065527972	357547209	/nfs/dbraw/zinc/54/72/09/357547209.db2.gz	KYKBSKUGIWPPIH-UHFFFAOYSA-N	1	0	294.424	1.994	50	0		CDAARO
CCn1c(=O)n(CCC=C(C)C)nc1[C@@H]1CCC[NH2+]C1	ZINC000067739812	357622365	/nfs/dbraw/zinc/62/23/65/357622365.db2.gz	ZPDFYVUHJKAOFY-CYBMUJFWSA-N	1	0	278.400	1.888	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccncc2Cl)C[C@H](C)[NH2+]1	ZINC000091456977	357601662	/nfs/dbraw/zinc/60/16/62/357601662.db2.gz	JCODPPZLVDVXQM-DTORHVGOSA-N	1	0	253.733	1.557	50	0		CDAARO
COc1cccc(C[NH+](C)C)c1OC(=O)N(C)C	ZINC000067340287	357605923	/nfs/dbraw/zinc/60/59/23/357605923.db2.gz	YEFWKYBFMDZWEO-UHFFFAOYSA-N	1	0	252.314	1.817	50	0		CDAARO
Cc1cc2c(c(-c3cncc(N(C)C)n3)c1)O[C@H](C[NH3+])C2	ZINC000067541287	357611763	/nfs/dbraw/zinc/61/17/63/357611763.db2.gz	JYTWIOFZGFFSNK-LBPRGKRZSA-N	1	0	284.363	1.780	50	0		CDAARO
Cc1cc(=O)[nH]c(CC[NH2+][C@H](C)COc2ccccc2)n1	ZINC000067712997	357620332	/nfs/dbraw/zinc/62/03/32/357620332.db2.gz	MJAVKEINTLDLJI-CYBMUJFWSA-N	1	0	287.363	1.678	50	0		CDAARO
CCN1c2ccc(C)cc2C(=O)NC12CC[NH2+]CC2	ZINC000070451498	357724440	/nfs/dbraw/zinc/72/44/40/357724440.db2.gz	HWDMDRNPMSDKIR-UHFFFAOYSA-N	1	0	259.353	1.644	50	0		CDAARO
CCOCCn1ccnc1-c1cc2n(n1)CCC[NH2+]C2	ZINC000072463790	357837365	/nfs/dbraw/zinc/83/73/65/357837365.db2.gz	PUHKJRFUAUNMSM-UHFFFAOYSA-N	1	0	275.356	1.276	50	0		CDAARO
COCCOCC[N@@H+]1CCCN(C(=O)c2ccoc2)CC1	ZINC000364191093	358069403	/nfs/dbraw/zinc/06/94/03/358069403.db2.gz	OHBRWFIKIYIUAM-UHFFFAOYSA-N	1	0	296.367	1.091	50	0		CDAARO
[NH3+]C[C@H]1CN(CCc2cccc(Cl)c2)C(=O)O1	ZINC000019669033	358103463	/nfs/dbraw/zinc/10/34/63/358103463.db2.gz	KKQKQIDBCYXSMH-NSHDSACASA-N	1	0	254.717	1.662	50	0		CDAARO
CCC[C@@H]1CN(S(=O)(=O)c2cccnc2)C[C@H]1[NH+](C)C	ZINC000082107005	358147136	/nfs/dbraw/zinc/14/71/36/358147136.db2.gz	QVMPTBNIGHCXAX-TZMCWYRMSA-N	1	0	297.424	1.432	50	0		CDAARO
O=c1onc(-c2ccncc2)n1CCC[NH+]1CCCCC1	ZINC000193451228	358295615	/nfs/dbraw/zinc/29/56/15/358295615.db2.gz	IYGWFARFKUELDX-UHFFFAOYSA-N	1	0	288.351	1.774	50	0		CDAARO
Cc1cccc(C)c1OCC(=O)N1CCC[C@H]([NH3+])C1	ZINC000195110170	358551203	/nfs/dbraw/zinc/55/12/03/358551203.db2.gz	UGNKEWBPIRZCAV-ZDUSSCGKSA-N	1	0	262.353	1.632	50	0		CDAARO
[NH3+][C@@H](Cc1ccccc1)C(=O)N1CC[C@]2(CCOC2)C1	ZINC000195542491	358559712	/nfs/dbraw/zinc/55/97/12/358559712.db2.gz	CJNPDKPSMKLDTL-HOCLYGCPSA-N	1	0	274.364	1.195	50	0		CDAARO
COc1ccc2c(c1)nc(C)cc2C(=O)NCC[NH3+]	ZINC000426411544	358632256	/nfs/dbraw/zinc/63/22/56/358632256.db2.gz	SSNBBDFMSKXYDG-UHFFFAOYSA-N	1	0	259.309	1.240	50	0		CDAARO
CCc1[nH+]c(N)nc(N(C)CC2(CO)CCCC2)c1C	ZINC000095362037	358686011	/nfs/dbraw/zinc/68/60/11/358686011.db2.gz	SMLFXNJAJWIAOP-UHFFFAOYSA-N	1	0	278.400	1.919	50	0		CDAARO
CCc1[nH+]c(N)nc(N2CCC[C@H](O)CC2)c1C	ZINC000095366426	358686385	/nfs/dbraw/zinc/68/63/85/358686385.db2.gz	HBPLEEYECCKLCQ-JTQLQIEISA-N	1	0	250.346	1.281	50	0		CDAARO
O=C(c1cccc(-c2nc3c([nH]2)C[NH2+]CC3)c1)N1CCCC1	ZINC000095368449	358687466	/nfs/dbraw/zinc/68/74/66/358687466.db2.gz	XCWCOVKRVJLOPS-UHFFFAOYSA-N	1	0	296.374	1.958	50	0		CDAARO
CCc1cnc(N)nc1NCCCC[NH+]1CCCC1	ZINC000095376179	358689395	/nfs/dbraw/zinc/68/93/95/358689395.db2.gz	LRLZCUCGOOPSGD-UHFFFAOYSA-N	1	0	263.389	1.909	50	0		CDAARO
CC(=O)N[C@@H]1CC[NH2+]C[C@@H]1c1nc(-c2ccccc2)no1	ZINC000096294901	358731823	/nfs/dbraw/zinc/73/18/23/358731823.db2.gz	SHPDOUMMEHSAGL-QWHCGFSZSA-N	1	0	286.335	1.318	50	0		CDAARO
O=C(N[C@@H]1CCC[NH2+]C1)c1cnc(Nc2ccccc2)nc1	ZINC000097522226	358781451	/nfs/dbraw/zinc/78/14/51/358781451.db2.gz	AFFDSIBBQCGHBL-CQSZACIVSA-N	1	0	297.362	1.702	50	0		CDAARO
CC[NH+]1CCC(C(=O)NC(C)(C)c2nnc(N)s2)CC1	ZINC000097527900	358782256	/nfs/dbraw/zinc/78/22/56/358782256.db2.gz	KDKVFYLMXGVPCN-UHFFFAOYSA-N	1	0	297.428	1.204	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2Cc3ccccc3[C@@H]2[NH3+])no1	ZINC000097775974	358798811	/nfs/dbraw/zinc/79/88/11/358798811.db2.gz	DCBLQJFNSZXHLS-AAEUAGOBSA-N	1	0	257.293	1.338	50	0		CDAARO
Cc1c(CN2CCC([NH+]3CCSCC3)CC2)cnn1C	ZINC000215421982	358888549	/nfs/dbraw/zinc/88/85/49/358888549.db2.gz	AZMMNBNIWQMWDQ-UHFFFAOYSA-N	1	0	294.468	1.742	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@@H](CO)N(Cc2cc3ccccc3o2)C1	ZINC000216014100	358917810	/nfs/dbraw/zinc/91/78/10/358917810.db2.gz	IHRAEARVYLXGPG-KGLIPLIRSA-N	1	0	274.364	1.930	50	0		CDAARO
C[N@@H+]1CCC[C@H](C(=O)NCc2nnc(-c3ccccc3)[nH]2)C1	ZINC000215431377	358889012	/nfs/dbraw/zinc/88/90/12/358889012.db2.gz	MGBCUHGBNCDBFB-ZDUSSCGKSA-N	1	0	299.378	1.430	50	0		CDAARO
C[NH+](C)C[C@H]1[C@@H]2CN(C(=O)c3nc4ccccc4[nH]3)C[C@H]12	ZINC000102732237	358889248	/nfs/dbraw/zinc/88/92/48/358889248.db2.gz	JOWMEXNBECRRCX-CNDDSTCGSA-N	1	0	284.363	1.443	50	0		CDAARO
CNC(=O)NC(=O)C[NH2+][C@@H](C)C12CC3CC(CC(C3)C1)C2	ZINC000024831110	358973547	/nfs/dbraw/zinc/97/35/47/358973547.db2.gz	WOEDYYZAABATBF-HXTFMFRQSA-N	1	0	293.411	1.637	50	0		CDAARO
C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)NC[C@H]1CCCO1	ZINC000095467195	358929204	/nfs/dbraw/zinc/92/92/04/358929204.db2.gz	HATHGFYMQLXGHK-GXTWGEPZSA-N	1	0	283.416	1.537	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CC(Oc2c(C)cccc2C)C1	ZINC000219418389	359096087	/nfs/dbraw/zinc/09/60/87/359096087.db2.gz	KDPAZFBWJNCTNM-ZDUSSCGKSA-N	1	0	262.353	1.630	50	0		CDAARO
CC[N@@H+]1CC[C@@H](NC(=O)c2c(F)cccc2OC)C1	ZINC000219740996	359119247	/nfs/dbraw/zinc/11/92/47/359119247.db2.gz	HVJLSHAICMNFPB-SNVBAGLBSA-N	1	0	266.316	1.658	50	0		CDAARO
OCCC[C@@H]1CCC[N@@H+]1CCOC[C@H]1CCCO1	ZINC000247862417	359192965	/nfs/dbraw/zinc/19/29/65/359192965.db2.gz	NCIBJVVAJGTZMR-UONOGXRCSA-N	1	0	257.374	1.419	50	0		CDAARO
O=c1cc(C[NH+]2CCC(O)CC2)nc2ccc(Cl)cn12	ZINC000026858556	359455223	/nfs/dbraw/zinc/45/52/23/359455223.db2.gz	OUZQLLMNKFNKHP-UHFFFAOYSA-N	1	0	293.754	1.305	50	0		CDAARO
c1cc(CN2CC[C@@]3(CC[NH2+]C3)C2)c2c(c1)OCCO2	ZINC000261943031	359592154	/nfs/dbraw/zinc/59/21/54/359592154.db2.gz	DZSWMFWNFBXRIO-MRXNPFEDSA-N	1	0	274.364	1.643	50	0		CDAARO
CN(C)C(=[N+](C)C)[n+]1nn([O-])c2cc(Cl)ccc21	ZINC000016163096	360099768	/nfs/dbraw/zinc/09/97/68/360099768.db2.gz	MYLOEAZQOFCTSQ-UHFFFAOYSA-N	1	0	269.736	1.877	50	0		CDAARO
CCn1ccnc1CN1CCC[C@H]1[C@H]1CCCN1C(C)=O	ZINC000247940135	360257026	/nfs/dbraw/zinc/25/70/26/360257026.db2.gz	MWQRMJZYCDNCBN-LSDHHAIUSA-N	1	0	290.411	1.878	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)C[C@@H](C)OC	ZINC000248143586	360405393	/nfs/dbraw/zinc/40/53/93/360405393.db2.gz	CVIZYKPQJFKNKM-MGPQQGTHSA-N	1	0	268.401	1.887	50	0		CDAARO
Cc1c(CNC(=O)N2CCC[C@@H]([NH+](C)C)CC2)cnn1C	ZINC000426677331	360695348	/nfs/dbraw/zinc/69/53/48/360695348.db2.gz	ARBPJJSBJWQMQG-CQSZACIVSA-N	1	0	293.415	1.354	50	0		CDAARO
C[C@H](CCC(=O)NCc1cnn(C)c1)[NH+]1CCCC1	ZINC000426662262	360694352	/nfs/dbraw/zinc/69/43/52/360694352.db2.gz	OFPVWAKHAZBVRO-GFCCVEGCSA-N	1	0	264.373	1.301	50	0		CDAARO
COc1ccc2c(CC(=O)N3CC[C@@H](C[NH3+])C3)coc2c1	ZINC000178556299	189126423	/nfs/dbraw/zinc/12/64/23/189126423.db2.gz	GDMHYSYXAQOADY-NSHDSACASA-N	1	0	288.347	1.791	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2ccc(COC)cc2)C1	ZINC000179011775	189161880	/nfs/dbraw/zinc/16/18/80/189161880.db2.gz	WQSCGDNXEPGKFO-ZDUSSCGKSA-N	1	0	262.353	1.515	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2sc(C)cc2OC)C1	ZINC000179018684	189161933	/nfs/dbraw/zinc/16/19/33/189161933.db2.gz	NVRVSDSSNXRXIB-JTQLQIEISA-N	1	0	268.382	1.747	50	0		CDAARO
C[C@H](OCC1CC1)C(=O)N1CCC[C@H](C)[C@H]1C[NH3+]	ZINC000299738568	200849724	/nfs/dbraw/zinc/84/97/24/200849724.db2.gz	CGJOUPOPMORZRW-GMXVVIOVSA-N	1	0	254.374	1.387	50	0		CDAARO
C[C@@H]1C[N@H+](C)[C@H](c2ccccc2)C[C@]12NC(=O)NC2=O	ZINC000005164407	361564741	/nfs/dbraw/zinc/56/47/41/361564741.db2.gz	JIVUQMZFYBMAHJ-GMXABZIVSA-N	1	0	273.336	1.278	50	0		CDAARO
Cc1c([C@H](C)NC(=O)[C@@H]2C[C@H]3CCCC[C@H]3[NH2+]2)cnn1C	ZINC000249332394	364537442	/nfs/dbraw/zinc/53/74/42/364537442.db2.gz	XAPHCLGEBSWALL-BTQDYEIMSA-N	1	0	290.411	1.826	50	0		CDAARO
OCC(CO)(CO)[NH2+]Cc1ccc(-c2ccccc2)cc1	ZINC000004657538	364814919	/nfs/dbraw/zinc/81/49/19/364814919.db2.gz	BGXSFDGXJZUEMJ-UHFFFAOYSA-N	1	0	287.359	1.159	50	0		CDAARO
CSc1ncc(C(=O)N2CCC[C@@H]([NH+](C)C)CC2)cn1	ZINC000220420650	189723208	/nfs/dbraw/zinc/72/32/08/189723208.db2.gz	KMUYEIPWTWHOHP-GFCCVEGCSA-N	1	0	294.424	1.755	50	0		CDAARO
CCC[NH+]1CCN(C(=O)Nc2cnn(CCOC)c2)CC1	ZINC000089959102	366984387	/nfs/dbraw/zinc/98/43/87/366984387.db2.gz	WRQIIWVIJDMZDU-UHFFFAOYSA-N	1	0	295.387	1.089	50	0		CDAARO
C[C@H]1C[NH+](CCCCNC(=O)C2CC=CC2)C[C@H](C)O1	ZINC000089930311	366970806	/nfs/dbraw/zinc/97/08/06/366970806.db2.gz	VWWRJRGKUMGLKW-KBPBESRZSA-N	1	0	280.412	1.958	50	0		CDAARO
C[C@@H](CCc1ccco1)[NH2+][C@@H]1CC(=O)N(C2CC2)C1	ZINC000090180781	367024387	/nfs/dbraw/zinc/02/43/87/367024387.db2.gz	KYVIERBJCYEFTC-NWDGAFQWSA-N	1	0	262.353	1.954	50	0		CDAARO
COc1cc(N2CCC[C@@]3(CC[N@H+](C)C3)C2)ncn1	ZINC000067712568	367286181	/nfs/dbraw/zinc/28/61/81/367286181.db2.gz	OXCPIIGJSUMBJR-AWEZNQCLSA-N	1	0	262.357	1.407	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[N@@H+]1CC[C@H]2CCCC[C@H]2C1	ZINC000252444249	367432000	/nfs/dbraw/zinc/43/20/00/367432000.db2.gz	YOVRCEQNLOHWNK-TUAOUCFPSA-N	1	0	267.373	1.343	50	0		CDAARO
C[C@@H]1OCC[C@@H]1[NH2+]C[C@H]1CC(=O)N(C)[C@@H]1c1ccccc1	ZINC000252486737	367573524	/nfs/dbraw/zinc/57/35/24/367573524.db2.gz	MPSXSWRTXIHNIJ-PWXKEOIMSA-N	1	0	288.391	1.973	50	0		CDAARO
O=C(N[C@H](C[NH+]1CCCC1)c1ccccc1)c1cn[nH]n1	ZINC000072171210	284160684	/nfs/dbraw/zinc/16/06/84/284160684.db2.gz	MZLBTZFIJOSDAM-CQSZACIVSA-N	1	0	285.351	1.372	50	0		CDAARO
Cc1n[nH]cc1C[NH2+][C@H](C)C(=O)N1CCCCC1	ZINC000037784493	371443653	/nfs/dbraw/zinc/44/36/53/371443653.db2.gz	IVQTVKFSGNVCAJ-LLVKDONJSA-N	1	0	250.346	1.209	50	0		CDAARO
O=C(NCC1CC[NH+]([C@@H]2CCOC2)CC1)c1ccoc1	ZINC000575616301	371719286	/nfs/dbraw/zinc/71/92/86/371719286.db2.gz	MXHXYYRWWITDFN-CQSZACIVSA-N	1	0	278.352	1.510	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)C(N)=O)c1csc2ccccc21	ZINC000575621648	372060707	/nfs/dbraw/zinc/06/07/07/372060707.db2.gz	QCMWGWGONNSUMM-LLVKDONJSA-N	1	0	291.376	1.106	50	0		CDAARO
CCc1n[nH]cc1C(=O)NCCN1CCc2ccccc2C1	ZINC000298861028	372324814	/nfs/dbraw/zinc/32/48/14/372324814.db2.gz	FPKMYMZEMRHGGT-UHFFFAOYSA-N	1	0	298.390	1.760	50	0		CDAARO
CCCC(=O)Nc1cccc(NC(=O)N2CC[C@H]([NH3+])C2)c1	ZINC000299772627	372752096	/nfs/dbraw/zinc/75/20/96/372752096.db2.gz	AMRGVTXLWSDGCD-NSHDSACASA-N	1	0	290.367	1.990	50	0		CDAARO
Cc1nn[nH]c1C(=O)N[C@@H]1CCC[N@@H+](C2CCCC2)C1	ZINC000299778939	372754573	/nfs/dbraw/zinc/75/45/73/372754573.db2.gz	QVZIKLBWYKJRNI-LLVKDONJSA-N	1	0	277.372	1.250	50	0		CDAARO
CCc1nc(C)sc1C(=O)NC[C@@H]1COCC[N@H+](C)C1	ZINC000299781538	372757502	/nfs/dbraw/zinc/75/75/02/372757502.db2.gz	DTBFTDFTPFLEIH-NSHDSACASA-N	1	0	297.424	1.322	50	0		CDAARO
CC(=O)Nc1ccc(OC[C@@H](O)C[NH2+]C2CCCC2)cc1	ZINC000004320503	373672156	/nfs/dbraw/zinc/67/21/56/373672156.db2.gz	JBQPSRMRWULQNY-HNNXBMFYSA-N	1	0	292.379	1.917	50	0		CDAARO
CCC[C@@H]1C[C@H](C(=O)NCC[N@H+]2CC=CCC2)CCO1	ZINC000253431738	373745598	/nfs/dbraw/zinc/74/55/98/373745598.db2.gz	SZEJOWWYBCMIGM-HUUCEWRRSA-N	1	0	280.412	1.960	50	0		CDAARO
Cc1cc(CN2CC[N@H+](CC(C)(C)C)[C@@H](CCO)C2)[nH]n1	ZINC000019227732	374706136	/nfs/dbraw/zinc/70/61/36/374706136.db2.gz	YBILIRBYGBYONT-HNNXBMFYSA-N	1	0	294.443	1.633	50	0		CDAARO
COc1c(C(=O)N2CC[NH+](C(C)(C)C)CC2)c(C)nn1C	ZINC000095395642	374902393	/nfs/dbraw/zinc/90/23/93/374902393.db2.gz	VYIWVZIVTKYECX-UHFFFAOYSA-N	1	0	294.399	1.293	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)CCc1c(C)n[nH]c1C	ZINC000095479228	374970252	/nfs/dbraw/zinc/97/02/52/374970252.db2.gz	HCCWOMUUTDPTTI-CYBMUJFWSA-N	1	0	278.400	1.560	50	0		CDAARO
COc1ccc(C[N@@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)nn1	ZINC000282627800	375096497	/nfs/dbraw/zinc/09/64/97/375096497.db2.gz	AQBSAJVZXLCSMP-GXTWGEPZSA-N	1	0	287.367	1.765	50	0		CDAARO
C[C@@H](CC(=O)N1C[C@@H](C)[NH2+][C@H](C)C1)c1ccncc1	ZINC000299739471	375199096	/nfs/dbraw/zinc/19/90/96/375199096.db2.gz	OVJBBFJMLBVGIF-YNEHKIRRSA-N	1	0	261.369	1.784	50	0		CDAARO
CCC[C@H]([NH3+])C(=O)N1CCN(CC(F)(F)F)[C@H](C)C1	ZINC000299747619	375206926	/nfs/dbraw/zinc/20/69/26/375206926.db2.gz	DKKGVDYGIDFWLZ-ZJUUUORDSA-N	1	0	281.322	1.209	50	0		CDAARO
COCCC[NH2+][C@H]1CC(=O)N(c2ccc(C)cc2)C1=O	ZINC000002759356	375315094	/nfs/dbraw/zinc/31/50/94/375315094.db2.gz	IHVICQPNMCCYCX-ZDUSSCGKSA-N	1	0	276.336	1.253	50	0		CDAARO
CCOc1ccnc(N2CCC[C@H](CC[NH3+])C2)n1	ZINC000164807401	375825653	/nfs/dbraw/zinc/82/56/53/375825653.db2.gz	CSHRGPXTQVJDAM-LLVKDONJSA-N	1	0	250.346	1.441	50	0		CDAARO
C[C@H](OC[C@@H]1CCCCO1)C(=O)NC[C@H]1[NH2+]CCC[C@H]1C	ZINC000390834583	375874795	/nfs/dbraw/zinc/87/47/95/375874795.db2.gz	GEVSSWVQKSDKBC-CBBWQLFWSA-N	1	0	298.427	1.465	50	0		CDAARO
C[C@@H]1CCCC[C@@H]1NC(=O)C[N@@H+]1C[C@H](C(N)=O)CC[C@H]1C	ZINC000241157265	376016596	/nfs/dbraw/zinc/01/65/96/376016596.db2.gz	JWFSIKRIXKYOBV-SYQHCUMBSA-N	1	0	295.427	1.267	50	0		CDAARO
C[C@H](C(=O)NC[C@H](O)c1ccncc1)[N@H+]1[C@H](C)CC[C@@H]1C	ZINC000241316885	376019101	/nfs/dbraw/zinc/01/91/01/376019101.db2.gz	LVSAXZWTPIXJDJ-COMQUAJESA-N	1	0	291.395	1.493	50	0		CDAARO
C[C@@H]1OCC[C@H]1[NH2+][C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000245629523	376121868	/nfs/dbraw/zinc/12/18/68/376121868.db2.gz	ZPCLXIWDZKCOCF-IMJJTQAJSA-N	1	0	288.391	1.945	50	0		CDAARO
C[NH+]1CCN(Cc2c[nH]c3cc(Cl)ncc23)CC1	ZINC000038174461	376294232	/nfs/dbraw/zinc/29/42/32/376294232.db2.gz	AHKPKCJWCKWOID-UHFFFAOYSA-N	1	0	264.760	1.964	50	0		CDAARO
CCc1ccc(CNC(=O)CN2CC[N@H+](C)C[C@@H]2C)s1	ZINC000089286815	376877824	/nfs/dbraw/zinc/87/78/24/376877824.db2.gz	FHEKSOXSDITZDC-LBPRGKRZSA-N	1	0	295.452	1.563	50	0		CDAARO
CO[C@@H]1CC[C@@H]2OCC[N@H+](C[C@H]3CCCCO3)[C@H]2C1	ZINC000246596525	376954393	/nfs/dbraw/zinc/95/43/93/376954393.db2.gz	MPHNQPNMJZTTOF-KBXIAJHMSA-N	1	0	269.385	1.824	50	0		CDAARO
CC(C)[NH2+]C[C@H](O)CN[C@H](C)[C@H]1COc2ccccc2O1	ZINC000245380594	378074726	/nfs/dbraw/zinc/07/47/26/378074726.db2.gz	AANQMDAPDINSQM-DVOMOZLQSA-N	1	0	294.395	1.163	50	0		CDAARO
C[C@@H]1CCCC[C@@H]1OCC(=O)N1CC[C@H]([NH3+])C[C@@H]1C	ZINC000408519236	296341013	/nfs/dbraw/zinc/34/10/13/296341013.db2.gz	ZSWFHFLWXXYNAK-RFGFWPKPSA-N	1	0	268.401	1.920	50	0		CDAARO
COCCNC(=S)NC[C@H](C)[N@@H+]1CCCC[C@@H]1C	ZINC000036847546	285073165	/nfs/dbraw/zinc/07/31/65/285073165.db2.gz	FOGGBQFYTSWHRG-RYUDHWBXSA-N	1	0	273.446	1.360	50	0		CDAARO
COc1ccccc1C(=O)N1CCC(OCCC[NH3+])CC1	ZINC000094070933	184753624	/nfs/dbraw/zinc/75/36/24/184753624.db2.gz	PRJQNBWKBZXZJX-UHFFFAOYSA-N	1	0	292.379	1.665	50	0		CDAARO
[NH2+]=C1Nc2nc3ccccc3n2[C@@H](c2cccnc2)N1	ZINC000008973821	390187164	/nfs/dbraw/zinc/18/71/64/390187164.db2.gz	DXKWYOCAUDEVNS-LBPRGKRZSA-N	1	0	264.292	1.528	50	0		CDAARO
[NH3+]CC(=O)Nc1ccc(I)cc1	ZINC000020302442	390231673	/nfs/dbraw/zinc/23/16/73/390231673.db2.gz	PNWCWXLRXGAVFL-UHFFFAOYSA-N	1	0	276.077	1.188	50	0		CDAARO
C[N@H+](CC(=O)NCc1ccco1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C	ZINC000096419605	390513166	/nfs/dbraw/zinc/51/31/66/390513166.db2.gz	DNUXTISCYPNPDM-YUELXQCFSA-N	1	0	292.379	1.641	50	0		CDAARO
C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)c1cn[nH]n1	ZINC000096419359	390513195	/nfs/dbraw/zinc/51/31/95/390513195.db2.gz	XLAJFVVFGVHGFN-ZDUSSCGKSA-N	1	0	299.378	1.541	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1C[C@@H](C)Oc2cc(F)ccc21	ZINC000118962500	390449343	/nfs/dbraw/zinc/44/93/43/390449343.db2.gz	SDJVZCNLFCSLGE-SCZZXKLOSA-N	1	0	252.289	1.677	50	0		CDAARO
CC(=O)N1CCC(N(C)CC[N@H+]2CCCC[C@H]2C)CC1	ZINC000065371147	390550292	/nfs/dbraw/zinc/55/02/92/390550292.db2.gz	HWWWWDSHDWFZSG-CQSZACIVSA-N	1	0	281.444	1.804	50	0		CDAARO
CCOc1cccc(OCC[N@@H+]2CC[C@@H](C(=O)NC)C2)c1	ZINC000065532561	390552610	/nfs/dbraw/zinc/55/26/10/390552610.db2.gz	ZBSZKEGQNGBHTA-CYBMUJFWSA-N	1	0	292.379	1.532	50	0		CDAARO
CC(C)[NH2+]C[C@]1(O)CCCN(Cc2ccc(F)cc2)C1=O	ZINC000011879739	390915803	/nfs/dbraw/zinc/91/58/03/390915803.db2.gz	PZLMEMMAJILFCE-MRXNPFEDSA-N	1	0	294.370	1.677	50	0		CDAARO
CCCc1ncncc1C(=O)N(C)[C@@H]1CC[N@H+](C)C1	ZINC000215951902	391002268	/nfs/dbraw/zinc/00/22/68/391002268.db2.gz	TXWUEFKGLDLWNT-LLVKDONJSA-N	1	0	262.357	1.205	50	0		CDAARO
Cc1n[nH]nc1C(=O)N1CCC(C[NH+]2CCCC2)CC1	ZINC000189002892	391313397	/nfs/dbraw/zinc/31/33/97/391313397.db2.gz	XDGXMMNGOPZJRR-UHFFFAOYSA-N	1	0	277.372	1.061	50	0		CDAARO
CC(C)(C)[C@@H](O)C[NH2+][C@H]1CCN(CC(F)(F)F)C1	ZINC000088720949	391479750	/nfs/dbraw/zinc/47/97/50/391479750.db2.gz	LENAEGRRZFUAMQ-UWVGGRQHSA-N	1	0	268.323	1.620	50	0		CDAARO
CCN1CCC[C@H]1C[NH2+][C@@H](C)C(=O)NC1CCCC1	ZINC000020300540	391585438	/nfs/dbraw/zinc/58/54/38/391585438.db2.gz	ZWGSMRCMUMXBCS-JSGCOSHPSA-N	1	0	267.417	1.508	50	0		CDAARO
C[C@H](C(=O)NC(N)=O)[N@@H+]1CCC[C@H]1c1ccsc1	ZINC000252517928	131136546	/nfs/dbraw/zinc/13/65/46/131136546.db2.gz	VHDAOFYZGHRVBA-SCZZXKLOSA-N	1	0	267.354	1.468	50	0		CDAARO
CCCCCS(=O)(=O)NC[C@H]1CCC[N@@H+]1CCOC	ZINC000095465349	393147660	/nfs/dbraw/zinc/14/76/60/393147660.db2.gz	PZADEZOKMJRUSP-CYBMUJFWSA-N	1	0	292.445	1.207	50	0		CDAARO
Cn1ccccc1=[N+]1CCN(C(=O)c2cccs2)CC1	ZINC000095944751	393153198	/nfs/dbraw/zinc/15/31/98/393153198.db2.gz	OESJHYWPZOCWMP-UHFFFAOYSA-N	1	0	288.396	1.535	50	0		CDAARO
OCCC[C@@H]1CCC[N@@H+]1CCOC[C@@H]1CCCO1	ZINC000096421778	393185414	/nfs/dbraw/zinc/18/54/14/393185414.db2.gz	NCIBJVVAJGTZMR-KBPBESRZSA-N	1	0	257.374	1.419	50	0		CDAARO
C[C@H](NC(=O)[C@H]([NH3+])CC1CCCCC1)c1cnn(C)c1	ZINC000261827548	140394912	/nfs/dbraw/zinc/39/49/12/140394912.db2.gz	UKYIQNQIHNZSGT-SMDDNHRTSA-N	1	0	278.400	1.895	50	0		CDAARO
O=C(NC[C@@H]1C[C@H](F)C[NH2+]1)c1cn2cc(Cl)ccc2n1	ZINC000082161120	398014955	/nfs/dbraw/zinc/01/49/55/398014955.db2.gz	XNHUWMBGLGSMOW-UWVGGRQHSA-N	1	0	296.733	1.418	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)COc2ccc(F)cc2F)C1	ZINC000178597403	148068080	/nfs/dbraw/zinc/06/80/80/148068080.db2.gz	MTOBTABQYXPPGM-NSHDSACASA-N	1	0	284.306	1.554	50	0		CDAARO
[NH3+][C@H]1CCN(C(=O)NCCc2ccccc2F)C1	ZINC000334887555	150038147	/nfs/dbraw/zinc/03/81/47/150038147.db2.gz	UHPARNCFMLZBCR-NSHDSACASA-N	1	0	251.305	1.111	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)N1C[C@@H](C)O[C@@H](C)C1)[C@H](C)n1cccn1	ZINC000106845469	287014982	/nfs/dbraw/zinc/01/49/82/287014982.db2.gz	QADKZEOOKQKYHJ-RQJABVFESA-N	1	0	294.399	1.058	50	0		CDAARO
[NH3+]CCS[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1=O	ZINC000002225153	169782109	/nfs/dbraw/zinc/78/21/09/169782109.db2.gz	NFANMHFDNNUPEV-JTQLQIEISA-N	1	0	284.768	1.664	50	0		CDAARO
O=C(C[NH2+]C[C@@H]1CCCO1)Nc1ccccc1F	ZINC000004894701	170037378	/nfs/dbraw/zinc/03/73/78/170037378.db2.gz	PVGBPVJYLSPPON-JTQLQIEISA-N	1	0	252.289	1.533	50	0		CDAARO
C[NH+](C)CCNC(=O)c1ccc(Br)o1	ZINC000004906962	170039976	/nfs/dbraw/zinc/03/99/76/170039976.db2.gz	VANMKKYSCJQXMR-UHFFFAOYSA-N	1	0	261.119	1.334	50	0		CDAARO
CCOc1ccc(C[NH2+]CCSc2nnnn2C)cc1	ZINC000004998022	170052319	/nfs/dbraw/zinc/05/23/19/170052319.db2.gz	DBQGWDJJVSDFBU-UHFFFAOYSA-N	1	0	293.396	1.491	50	0		CDAARO
O=C(NCC[NH2+]Cc1cccnc1)c1ccccc1F	ZINC000006971599	170260122	/nfs/dbraw/zinc/26/01/22/170260122.db2.gz	QMGOLPMGYPHLQF-UHFFFAOYSA-N	1	0	273.311	1.740	50	0		CDAARO
O=S(=O)(NCCC[NH+]1CCCC1)c1ccc(F)cc1	ZINC000007728024	170299418	/nfs/dbraw/zinc/29/94/18/170299418.db2.gz	VSLXOPGHAKSBSJ-UHFFFAOYSA-N	1	0	286.372	1.590	50	0		CDAARO
[NH3+]C[C@H](c1ccco1)S(=O)(=O)c1ccc(F)cc1	ZINC000008031062	170315085	/nfs/dbraw/zinc/31/50/85/170315085.db2.gz	URJQPAUTQSLYPA-GFCCVEGCSA-N	1	0	269.297	1.892	50	0		CDAARO
Cc1cc(=O)n2nc(C[N@H+]3CCCC[C@H]3C)sc2n1	ZINC000008338766	170331940	/nfs/dbraw/zinc/33/19/40/170331940.db2.gz	KHTZGLGWRLBSMY-SNVBAGLBSA-N	1	0	278.381	1.834	50	0		CDAARO
O=C(c1c[nH]cn1)N1CCC([NH+]2CCSCC2)CC1	ZINC000020207062	171071087	/nfs/dbraw/zinc/07/10/87/171071087.db2.gz	YIJJEWLUWZFBJC-UHFFFAOYSA-N	1	0	280.397	1.063	50	0		CDAARO
Cc1cc(CN2CCC([C@@H](C)[NH+]3CCOCC3)CC2)no1	ZINC000020820151	171273816	/nfs/dbraw/zinc/27/38/16/171273816.db2.gz	LXFOKBXGURQZEA-CQSZACIVSA-N	1	0	293.411	1.916	50	0		CDAARO
COC[C@@H]1CCC[N@@H+]1Cc1ccccc1-c1nn[nH]n1	ZINC000020911557	171279046	/nfs/dbraw/zinc/27/90/46/171279046.db2.gz	JCRDGXZZKHMWID-LBPRGKRZSA-N	1	0	273.340	1.478	50	0		CDAARO
CCCS(=O)(=O)NCC1CC[NH+](C(C)C)CC1	ZINC000038582559	174148557	/nfs/dbraw/zinc/14/85/57/174148557.db2.gz	JUIDSPZBUZLNPA-UHFFFAOYSA-N	1	0	262.419	1.436	50	0		CDAARO
CCC(=O)c1ccccc1OCCN1CC[NH2+][C@H](C)C1	ZINC000040456372	174267554	/nfs/dbraw/zinc/26/75/54/174267554.db2.gz	MLFBEEPXDXFDKB-CYBMUJFWSA-N	1	0	276.380	1.952	50	0		CDAARO
CCN(CC)C(=O)[C@@H]1C[C@@H]([NH3+])CN1C(=O)CC1CCCC1	ZINC000067742278	175788438	/nfs/dbraw/zinc/78/84/38/175788438.db2.gz	KTWJWFXATSXLBG-KGLIPLIRSA-N	1	0	295.427	1.363	50	0		CDAARO
O=C(C[C@@H]1COCC[NH2+]1)NCc1ccc2c(c1)CCCO2	ZINC000072144778	176324705	/nfs/dbraw/zinc/32/47/05/176324705.db2.gz	IENAKKHJZLGRCR-CQSZACIVSA-N	1	0	290.363	1.006	50	0		CDAARO
O=C1NC[C@]2(CCC[N@H+](Cc3ccncc3)CC2)O1	ZINC000072166541	176331744	/nfs/dbraw/zinc/33/17/44/176331744.db2.gz	WULXJEXDKPUCJU-CQSZACIVSA-N	1	0	261.325	1.546	50	0		CDAARO
CCN1CC2(CC[NH+](C[C@H]3CCCO3)CC2)OC1=O	ZINC000077457274	177270891	/nfs/dbraw/zinc/27/08/91/177270891.db2.gz	UPFSYWZNODUCLI-GFCCVEGCSA-N	1	0	268.357	1.472	50	0		CDAARO
Cc1ccc(N2CC[C@@](O)(C[NH+]3CCCCC3)C2)nn1	ZINC000077541880	177279527	/nfs/dbraw/zinc/27/95/27/177279527.db2.gz	XYFGGKGWKDPHPK-OAHLLOKOSA-N	1	0	276.384	1.212	50	0		CDAARO
CC[NH+](CC)C[C@@H](O)c1ccc2c(c1)NC(=O)CO2	ZINC000062353971	262411762	/nfs/dbraw/zinc/41/17/62/262411762.db2.gz	TVIYLZUEGXLJLF-GFCCVEGCSA-N	1	0	264.325	1.393	50	0		CDAARO
CCC[N@@H+]1CCc2c(sc(N)c2C(=O)OC)C1	ZINC000019870444	276013919	/nfs/dbraw/zinc/01/39/19/276013919.db2.gz	BTPNLOTXIXMNND-UHFFFAOYSA-N	1	0	254.355	1.885	50	0		CDAARO
C[NH+](C)CCN1C(=O)C[C@@H]2Sc3ccccc3N=C21	ZINC000006177111	273795841	/nfs/dbraw/zinc/79/58/41/273795841.db2.gz	OAIXWUCWUDXCDX-LBPRGKRZSA-N	1	0	275.377	1.985	50	0		CDAARO
COc1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCCNC1=O	ZINC000095421367	277461150	/nfs/dbraw/zinc/46/11/50/277461150.db2.gz	XPUSFAWKQLEPJN-QWHCGFSZSA-N	1	0	260.337	1.551	50	0		CDAARO
COC[C@H]([NH2+]CC(=O)N1C[C@@H](C)C[C@H](C)C1)C1CC1	ZINC000097049017	277596423	/nfs/dbraw/zinc/59/64/23/277596423.db2.gz	RCSPZVRGNMXCIU-OBJOEFQTSA-N	1	0	268.401	1.506	50	0		CDAARO
CC(C)c1cc(C(=O)N2CC[C@H]3CC[N@H+](C)C[C@@H]32)no1	ZINC000241897151	278011689	/nfs/dbraw/zinc/01/16/89/278011689.db2.gz	TVZQTXMPFFFWRZ-YPMHNXCESA-N	1	0	277.368	1.964	50	0		CDAARO
CC(C)c1ccccc1S(=O)(=O)N1CCC[C@@H]1C[NH3+]	ZINC000193296767	278061030	/nfs/dbraw/zinc/06/10/30/278061030.db2.gz	XWMJXENGMAIQNI-GFCCVEGCSA-N	1	0	282.409	1.922	50	0		CDAARO
C[C@H](O)CN1CC[N@H+](CC2CCCCC2)C[C@H]1C	ZINC000241942333	278294787	/nfs/dbraw/zinc/29/47/87/278294787.db2.gz	ULQKDBHHUDRPGK-KGLIPLIRSA-N	1	0	254.418	1.954	50	0		CDAARO
CC(=O)Nc1cc(C(=O)N2CC([NH+](C)C)C2)ccc1C	ZINC000089644288	279263234	/nfs/dbraw/zinc/26/32/34/279263234.db2.gz	WUOPSKDQWSWRSV-UHFFFAOYSA-N	1	0	275.352	1.339	50	0		CDAARO
OC1(C[NH+]2CCC3(CC2)OCCO3)CCCCC1	ZINC000089818202	280399885	/nfs/dbraw/zinc/39/98/85/280399885.db2.gz	NMEPMNWGFUJTBD-UHFFFAOYSA-N	1	0	255.358	1.521	50	0		CDAARO
Cc1ccc2[nH]c([C@H]3CCCN3C(=O)[C@@H](C)[NH3+])nc2c1	ZINC000261863063	281026039	/nfs/dbraw/zinc/02/60/39/281026039.db2.gz	PVXRZIRYCDJWFH-ZWNOBZJWSA-N	1	0	272.352	1.882	50	0		CDAARO
O[C@]1(C[NH2+][C@H]2CCCOc3cc(F)ccc32)CCOC1	ZINC000182168534	304843585	/nfs/dbraw/zinc/84/35/85/304843585.db2.gz	MFLLOSXBYGQQFV-ZFWWWQNUSA-N	1	0	281.327	1.780	50	0		CDAARO
CCC[C@H](CNC(=O)c1n[nH]c(C)c1Cl)[NH+](C)C	ZINC000534590788	328317985	/nfs/dbraw/zinc/31/79/85/328317985.db2.gz	XMZVMAROZRJUBA-SECBINFHSA-N	1	0	272.780	1.832	50	0		CDAARO
Cc1ccccc1[C@H](CNc1cncc(C(N)=O)n1)[NH+](C)C	ZINC000534592698	328318719	/nfs/dbraw/zinc/31/87/19/328318719.db2.gz	DIEJXMWCZAMXID-AWEZNQCLSA-N	1	0	299.378	1.599	50	0		CDAARO
Cc1ccc(Cl)cc1NC(=O)NC[C@@H]1CC[NH2+]C[C@H]1O	ZINC000534634273	328333243	/nfs/dbraw/zinc/33/32/43/328333243.db2.gz	MKYXTRLUGHVZIZ-GXFFZTMASA-N	1	0	297.786	1.740	50	0		CDAARO
O=C([O-])C[NH+]1CCC([NH2+][C@H]2CCCSC2)CC1	ZINC000534652179	328337614	/nfs/dbraw/zinc/33/76/14/328337614.db2.gz	SBCOAWHZPGUMEX-NSHDSACASA-N	1	0	258.387	1.021	50	0		CDAARO
CC(C)C1=NO[C@@H](C(=O)NCC2(C[NH+]3CCCC3)CC2)C1	ZINC000534659165	328341896	/nfs/dbraw/zinc/34/18/96/328341896.db2.gz	WAEJNCWWXVFYIE-CQSZACIVSA-N	1	0	293.411	1.780	50	0		CDAARO
O=C(NCCCc1ccccn1)[C@@H]1CCC[NH2+]CC1	ZINC000534647858	328342943	/nfs/dbraw/zinc/34/29/43/328342943.db2.gz	JYUROLKJYFSUFA-CYBMUJFWSA-N	1	0	261.369	1.520	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CCN2CCC(CO)CC2)n1	ZINC000534656853	328340678	/nfs/dbraw/zinc/34/06/78/328340678.db2.gz	IDIHESPLDHINHH-CQSZACIVSA-N	1	0	294.443	1.182	50	0		CDAARO
[NH3+][C@H]1[C@@H]2CC[C@H]1CN(C[C@H]1COc3ccccc3O1)C2	ZINC000534670179	328346924	/nfs/dbraw/zinc/34/69/24/328346924.db2.gz	OXDBDOFROQXZPQ-RSUWNVLCSA-N	1	0	274.364	1.496	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@@H]1CCC(C)(C)C[C@@H]1C	ZINC000097099859	323207509	/nfs/dbraw/zinc/20/75/09/323207509.db2.gz	YRBLQUQCMWXHCS-NWDGAFQWSA-N	1	0	276.446	1.730	50	0		CDAARO
CCN(CCC[NH+]1CCCC1)S(=O)(=O)C1CC1	ZINC000188254244	323443612	/nfs/dbraw/zinc/44/36/12/323443612.db2.gz	SELFJMMUKXFFAJ-UHFFFAOYSA-N	1	0	260.403	1.286	50	0		CDAARO
O=C1CC[C@@H]([NH2+][C@H]2CCCOc3ccccc32)CN1	ZINC000096477784	329526892	/nfs/dbraw/zinc/52/68/92/329526892.db2.gz	RJLMKNUWBGBLOZ-YPMHNXCESA-N	1	0	260.337	1.769	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)Nc1cccc(C)n1	ZINC000275071414	1159439377	/nfs/dbraw/zinc/43/93/77/1159439377.db2.gz	WOHRGZMZHMAHAC-GFCCVEGCSA-N	1	0	262.357	1.996	50	0		CDAARO
CCn1cncc1CN1CC([N@@H+]2CCCC[C@H]2C)C1	ZINC000244719183	1159707829	/nfs/dbraw/zinc/70/78/29/1159707829.db2.gz	LYKRMGXALITQMG-CYBMUJFWSA-N	1	0	262.401	1.962	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]CC1(N2CCOCC2)CCCCC1	ZINC000097159229	482459000	/nfs/dbraw/zinc/45/90/00/482459000.db2.gz	LHZRTJAXYZQWOE-UHFFFAOYSA-N	1	0	292.427	1.843	50	0		CDAARO
CCOc1ccnc(NCCC[N@@H+]2CCCC[C@H]2CO)n1	ZINC000670434316	482969204	/nfs/dbraw/zinc/96/92/04/482969204.db2.gz	FXCNPDJLRSPRQE-ZDUSSCGKSA-N	1	0	294.399	1.524	50	0		CDAARO
C[NH+]1CCC(C)(C(=O)NCCC2(O)CCCC2)CC1	ZINC000670464107	483053115	/nfs/dbraw/zinc/05/31/15/483053115.db2.gz	OHXUYUJLPBLQEB-UHFFFAOYSA-N	1	0	268.401	1.530	50	0		CDAARO
CCn1cc([C@H]2OCC[C@H]2C[NH2+]Cc2cnn(C)c2)cn1	ZINC000083843560	483204401	/nfs/dbraw/zinc/20/44/01/483204401.db2.gz	RHVHFZGIUTZSEO-ZFWWWQNUSA-N	1	0	289.383	1.504	50	0		CDAARO
Cc1ccc(NCC[NH2+]Cc2cccc3c[nH]nc32)nn1	ZINC000084019324	483234317	/nfs/dbraw/zinc/23/43/17/483234317.db2.gz	XTFINTMYQHDGEH-UHFFFAOYSA-N	1	0	282.351	1.863	50	0		CDAARO
CCC[N@@H+]1CC[C@@H](N(Cc2ncc(C)o2)C(C)=O)C1	ZINC000084755283	483324018	/nfs/dbraw/zinc/32/40/18/483324018.db2.gz	QKIUFJKMMHABDX-CYBMUJFWSA-N	1	0	265.357	1.816	50	0		CDAARO
CCOC(=O)c1ccc(C[NH2+][C@@H]2CCC(=O)N(C)C2)o1	ZINC000095988335	521476437	/nfs/dbraw/zinc/47/64/37/521476437.db2.gz	KJXNNFLWLCKLBJ-SNVBAGLBSA-N	1	0	280.324	1.167	50	0		CDAARO
[NH3+]CC[C@H]1CN(C(=O)Cc2cccc(Cl)c2)CCO1	ZINC000219862759	534654678	/nfs/dbraw/zinc/65/46/78/534654678.db2.gz	VKFXPYAMHMAYGQ-ZDUSSCGKSA-N	1	0	282.771	1.459	50	0		CDAARO
O=C1OCCN1CC[N@@H+](CCO)[C@@H]1CCc2ccccc21	ZINC000096455344	534807087	/nfs/dbraw/zinc/80/70/87/534807087.db2.gz	VBHLTVSXPBOXPP-OAHLLOKOSA-N	1	0	290.363	1.420	50	0		CDAARO
CC[NH+](CC)[C@@H]1CCN(C(=O)N[C@H](C)CSC)C1	ZINC000096440481	528253335	/nfs/dbraw/zinc/25/33/35/528253335.db2.gz	JAVJKSZHPJTCGK-VXGBXAGGSA-N	1	0	273.446	1.864	50	0		CDAARO
C[N@H+](Cc1ccccc1)C1CCS(=O)(=O)CC1	ZINC000079470036	538761148	/nfs/dbraw/zinc/76/11/48/538761148.db2.gz	VRFTUFRUDVHIRR-UHFFFAOYSA-N	1	0	253.367	1.696	50	0		CDAARO
COC(=O)C1(C[NH2+]C2Cc3ccccc3C2)CCOCC1	ZINC000097142022	567904797	/nfs/dbraw/zinc/90/47/97/567904797.db2.gz	RLKHWVBZSAHSQU-UHFFFAOYSA-N	1	0	289.375	1.713	50	0		CDAARO
C[C@@H](c1ccsc1)N1CC[NH+](CCCO)CC1	ZINC000097142293	567905143	/nfs/dbraw/zinc/90/51/43/567905143.db2.gz	NRDSRPGKUXRJKN-LBPRGKRZSA-N	1	0	254.399	1.809	50	0		CDAARO
COc1ccc(-n2nc(CC(C)C)nc2CC[NH3+])cc1	ZINC000952991954	617220692	/nfs/dbraw/zinc/22/06/92/617220692.db2.gz	XYWVSCJVSLWOFG-UHFFFAOYSA-N	1	0	274.368	1.976	50	0		CDAARO
C[N@@H+]1C[C@H](C(=O)N2CC=CCC2)[C@@H](C(F)(F)F)C1	ZINC000952992019	616399765	/nfs/dbraw/zinc/39/97/65/616399765.db2.gz	HVGWLJGCGPURMA-UWVGGRQHSA-N	1	0	262.275	1.515	50	0		CDAARO
COC(=O)[C@@H](C[NH2+][C@@H](C)CCn1cccn1)CC1CC1	ZINC000952963280	616966093	/nfs/dbraw/zinc/96/60/93/616966093.db2.gz	FPHRKFDHDZBHKI-GXTWGEPZSA-N	1	0	279.384	1.841	50	0		CDAARO
CC(C)[C@H]([NH2+]CCCOCC(F)F)c1nncn1C	ZINC000888096048	617757490	/nfs/dbraw/zinc/75/74/90/617757490.db2.gz	IPFRWUOUYJOJQO-NSHDSACASA-N	1	0	276.331	1.774	50	0		CDAARO
O=C(CC[NH2+]C1CC1)NC[C@H](O)c1ccc(F)cc1	ZINC000848395393	631002005	/nfs/dbraw/zinc/00/20/05/631002005.db2.gz	FOLHXNUWNLWDPB-ZDUSSCGKSA-N	1	0	266.316	1.117	50	0		CDAARO
COC1(OC)CC[N@H+](Cc2ccc(F)cc2)C[C@@H]1O	ZINC000874434867	632390980	/nfs/dbraw/zinc/39/09/80/632390980.db2.gz	GPTXNINNRJHQHY-ZDUSSCGKSA-N	1	0	269.316	1.381	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+]1[C@@H]1CCc2ccccc2C1	ZINC000022034701	1158562791	/nfs/dbraw/zinc/56/27/91/1158562791.db2.gz	JJUSZKLMMMKTBK-ILXRZTDVSA-N	1	0	275.348	1.152	50	0		CDAARO
CC(=O)c1cnc(N2CCOC[C@H](C[NH+](C)C)C2)nc1C	ZINC001772701297	1159436924	/nfs/dbraw/zinc/43/69/24/1159436924.db2.gz	NIMGRKKLFCKQOK-CYBMUJFWSA-N	1	0	292.383	1.002	50	0		CDAARO
CN(C)c1nc(NC[C@H](c2ccco2)[NH+](C)C)ncc1F	ZINC001772700538	1159437023	/nfs/dbraw/zinc/43/70/23/1159437023.db2.gz	GKNJTZUXXJRKMH-LLVKDONJSA-N	1	0	293.346	1.990	50	0		CDAARO
O=C(NCCCn1cncn1)C1([NH+]2CCCC2)CCCC1	ZINC000220118037	811081205	/nfs/dbraw/zinc/08/12/05/811081205.db2.gz	OVNUYQJTBHZCFQ-UHFFFAOYSA-N	1	0	291.399	1.193	50	0		CDAARO
NS(=O)(=O)c1ccc(CCNc2cc[nH+]cc2)cc1	ZINC000050107392	811935716	/nfs/dbraw/zinc/93/57/16/811935716.db2.gz	IKKVYFPDWAVQND-UHFFFAOYSA-N	1	0	277.349	1.384	50	0		CDAARO
[NH3+]Cc1cn(C[C@@H]2CCC[N@H+](Cc3ccoc3)C2)nn1	ZINC000023153346	812808330	/nfs/dbraw/zinc/80/83/30/812808330.db2.gz	CDTKNANCITWCKM-GFCCVEGCSA-N	1	0	275.356	1.242	50	0		CDAARO
OC[C@@H]1CCCN(CC[NH2+]Cc2ccc3[nH]ccc3c2)C1	ZINC000952969369	813363185	/nfs/dbraw/zinc/36/31/85/813363185.db2.gz	DXRBOAOXRZOKAZ-OAHLLOKOSA-N	1	0	287.407	1.962	50	0		CDAARO
COc1ccccc1CN(C(=O)[C@@H]1CCC[NH2+]1)C1CC1	ZINC000037816855	813817110	/nfs/dbraw/zinc/81/71/10/813817110.db2.gz	PGMVGDSNHYKKJP-AWEZNQCLSA-N	1	0	274.364	1.938	50	0		CDAARO
CCCc1cc(NC[C@@]2(O)CCC[NH2+]CC2)nc(C)n1	ZINC000072133355	814159113	/nfs/dbraw/zinc/15/91/13/814159113.db2.gz	LOTGIDXRCKBOOO-OAHLLOKOSA-N	1	0	278.400	1.654	50	0		CDAARO
Cc1nnc(CN2CC([N@H+]3CCCC[C@H]3C)C2)s1	ZINC000299781904	816934023	/nfs/dbraw/zinc/93/40/23/816934023.db2.gz	MLGIQLBCZYYVQY-SNVBAGLBSA-N	1	0	266.414	1.905	50	0		CDAARO
c1cncc([C@@H](C[NH+]2CCSCC2)N2CCOCC2)c1	ZINC000020118216	899240803	/nfs/dbraw/zinc/24/08/03/899240803.db2.gz	DHMNSCKKNAJGGA-OAHLLOKOSA-N	1	0	293.436	1.504	50	0		CDAARO
CCC(=O)c1ccc(OCCN2CC[NH+](C)CC2)cc1	ZINC000020639343	899252728	/nfs/dbraw/zinc/25/27/28/899252728.db2.gz	REHWMFIHOABAAO-UHFFFAOYSA-N	1	0	276.380	1.906	50	0		CDAARO
C[N@H+](CCC[C@H]1CCCO1)CCN1CCCC1=O	ZINC001506407123	908932556	/nfs/dbraw/zinc/93/25/56/908932556.db2.gz	IQDLRIFAYUBZQX-ZDUSSCGKSA-N	1	0	254.374	1.500	50	0		CDAARO
Cc1cc(C(=O)N2CCC[N@@H+]3CCC[C@H]3C2)nc(C)n1	ZINC000952860419	910413431	/nfs/dbraw/zinc/41/34/31/910413431.db2.gz	PPDAQSPGFFFKTQ-ZDUSSCGKSA-N	1	0	274.368	1.404	50	0		CDAARO
CCCC[C@@H]1C=CCN1C(=O)[C@@H]1CCC[N@H+](CC(N)=O)C1	ZINC000952867557	910463257	/nfs/dbraw/zinc/46/32/57/910463257.db2.gz	OYMAASWJWSBAPR-ZIAGYGMSSA-N	1	0	293.411	1.141	50	0		CDAARO
C[C@H](Cc1ccno1)[NH2+]C[C@](C)(O)C(=O)OC(C)(C)C	ZINC000952995710	910584250	/nfs/dbraw/zinc/58/42/50/910584250.db2.gz	WDPDXUXBWCUKNO-YGRLFVJLSA-N	1	0	284.356	1.288	50	0		CDAARO
CC(C)(CC(=O)NC[C@@H]1CC[NH2+]C[C@H]1O)c1ccccc1	ZINC000072174273	936652649	/nfs/dbraw/zinc/65/26/49/936652649.db2.gz	FFDYHDQOQMHJMW-DZGCQCFKSA-N	1	0	290.407	1.441	50	0		CDAARO
CC(C)CC1(CNC(=O)CN2CC[C@H]([NH+](C)C)C2)CCC1	ZINC000821011631	925560644	/nfs/dbraw/zinc/56/06/44/925560644.db2.gz	HMECZYAKBVGDOG-HNNXBMFYSA-N	1	0	295.471	1.955	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNC(=O)c1[nH]ncc1Cl	ZINC000823113247	925670108	/nfs/dbraw/zinc/67/01/08/925670108.db2.gz	YLMBYKXUAGMDCA-SECBINFHSA-N	1	0	270.764	1.667	50	0		CDAARO
CC[N@@H+]1Cc2ccccc2C[C@H]1C(=O)N1CC=CC1	ZINC000823118877	925670538	/nfs/dbraw/zinc/67/05/38/925670538.db2.gz	SSYLHKQKPKOYFX-HNNXBMFYSA-N	1	0	256.349	1.832	50	0		CDAARO
Cc1cnc(CN(C)C[C@H]2CC[N@H+](C)C2(C)C)cn1	ZINC000823690291	925722779	/nfs/dbraw/zinc/72/27/79/925722779.db2.gz	UJUANCQCHAFVCK-CYBMUJFWSA-N	1	0	262.401	1.947	50	0		CDAARO
Cc1cnccc1C(=O)N1CCOC[C@@H](C[NH+](C)C)C1	ZINC000823690255	925723686	/nfs/dbraw/zinc/72/36/86/925723686.db2.gz	SZHYYSMMFJURCG-ZDUSSCGKSA-N	1	0	277.368	1.040	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)NC[C@]1(C)CC[N@@H+](C)C1	ZINC000823754958	925725517	/nfs/dbraw/zinc/72/55/17/925725517.db2.gz	LMYCYYHYEPJNFO-AWEZNQCLSA-N	1	0	264.373	1.027	50	0		CDAARO
C[C@@H](NC(=O)CN1CCC[N@H+](C)CC1)C1=CCCCC1	ZINC000823778354	925730150	/nfs/dbraw/zinc/73/01/50/925730150.db2.gz	JIOXDKODKQYXIU-CQSZACIVSA-N	1	0	279.428	1.629	50	0		CDAARO
COc1cccc(C[N@H+](C)CCn2cnnc2C)c1	ZINC000824781046	925833898	/nfs/dbraw/zinc/83/38/98/925833898.db2.gz	OPMHOHWMJFISQK-UHFFFAOYSA-N	1	0	260.341	1.727	50	0		CDAARO
COc1ncc(CN2CC([N@@H+]3CCCC[C@H]3C)C2)cn1	ZINC000824851791	925840872	/nfs/dbraw/zinc/84/08/72/925840872.db2.gz	HJORMADWDUQLEL-GFCCVEGCSA-N	1	0	276.384	1.544	50	0		CDAARO
Cc1ccc2[nH]c(CNC(=O)N3CC[C@@H]([NH3+])C3)nc2c1C	ZINC000826951621	925926245	/nfs/dbraw/zinc/92/62/45/925926245.db2.gz	QQRGEZZKVDIWNW-LLVKDONJSA-N	1	0	287.367	1.422	50	0		CDAARO
O=C1C[C@H](Nc2cc[nH+]cc2)CN1Cc1ccccc1	ZINC000828248050	926082805	/nfs/dbraw/zinc/08/28/05/926082805.db2.gz	KIQQJGLRZXJFGS-HNNXBMFYSA-N	1	0	267.332	1.717	50	0		CDAARO
CC(C)(CN1CCOCC1)C[N@@H+]1CC[C@H](O)CC(C)(C)C1	ZINC000828630087	926153296	/nfs/dbraw/zinc/15/32/96/926153296.db2.gz	YEDFEVZBEYMHIL-HNNXBMFYSA-N	1	0	298.471	1.828	50	0		CDAARO
Cc1ccncc1C(=O)NCCC[N@@H+]1CCCC[C@@H]1CO	ZINC000828710764	926169465	/nfs/dbraw/zinc/16/94/65/926169465.db2.gz	BUTZVRMHPKOJST-CQSZACIVSA-N	1	0	291.395	1.357	50	0		CDAARO
CCN(C(=O)N1CCC[C@@H](C[N@@H+]2CC[C@H](O)C2)C1)C(C)C	ZINC000585139411	931043243	/nfs/dbraw/zinc/04/32/43/931043243.db2.gz	WMPGBSNRVZNQOT-GJZGRUSLSA-N	1	0	297.443	1.615	50	0		CDAARO
C[C@H]1COC[C@@H]1[NH2+]CCN(C)C(=O)OC(C)(C)C	ZINC000688049553	934528131	/nfs/dbraw/zinc/52/81/31/934528131.db2.gz	RBWOHHXEFWJESD-QWRGUYRKSA-N	1	0	258.362	1.478	50	0		CDAARO
CCCC[C@H]([NH3+])C(=O)Nc1c(C)c(CC)nn1C	ZINC001529114558	968983630	/nfs/dbraw/zinc/98/36/30/968983630.db2.gz	PHSHTSBWKABFJU-JTQLQIEISA-N	1	0	252.362	1.747	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[NH2+]CCCn2ccnn2)n1	ZINC001529113217	968983671	/nfs/dbraw/zinc/98/36/71/968983671.db2.gz	CNYLJVBDINVVTO-GFCCVEGCSA-N	1	0	262.361	1.160	50	0		CDAARO
CC(C)[C@H](CNc1cc2nncn2c(N)n1)[NH+]1CCCC1	ZINC001529168009	969001589	/nfs/dbraw/zinc/00/15/89/969001589.db2.gz	UAGMRNRODKYAGK-NSHDSACASA-N	1	0	289.387	1.239	50	0		CDAARO
Oc1cccc(C[N@@H+]2C[C@@H](Cc3cnccn3)[C@H](O)C2)c1	ZINC001529195508	969012154	/nfs/dbraw/zinc/01/21/54/969012154.db2.gz	LGQDCJBODVWHOX-CZUORRHYSA-N	1	0	285.347	1.218	50	0		CDAARO
Cc1ncsc1CC[N@H+](C)CCn1cnnc1	ZINC001460753222	969539002	/nfs/dbraw/zinc/53/90/02/969539002.db2.gz	NJNVGBNSKJXVDP-UHFFFAOYSA-N	1	0	251.359	1.218	50	0		CDAARO
Cc1nnc(NC2CC[NH+](CCO)CC2)c2ccccc12	ZINC001506397353	975147908	/nfs/dbraw/zinc/14/79/08/975147908.db2.gz	QQPKLPHOGBJESG-UHFFFAOYSA-N	1	0	286.379	1.807	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(c2cc(NC3CC3)nc(N)n2)C1	ZINC001506419137	975156690	/nfs/dbraw/zinc/15/66/90/975156690.db2.gz	YFRISXXBPHRVMX-JTQLQIEISA-N	1	0	276.388	1.021	50	0		CDAARO
CN(C)c1ccnc(NCCC2(O)CCCC2)n1	ZINC001506422615	975157999	/nfs/dbraw/zinc/15/79/99/975157999.db2.gz	DOJLGKOYAPCQQW-UHFFFAOYSA-N	1	0	250.346	1.650	50	0		CDAARO
CC[N@@H+]1CCC[C@]2(CCCN(CCS(C)(=O)=O)C2)C1	ZINC001506425606	975160500	/nfs/dbraw/zinc/16/05/00/975160500.db2.gz	DHRRMACLEYURSR-AWEZNQCLSA-N	1	0	288.457	1.229	50	0		CDAARO
CC(C)([NH3+])C(=O)N1CCc2[nH]c(-c3ccccc3)nc2C1	ZINC000095511278	185001862	/nfs/dbraw/zinc/00/18/62/185001862.db2.gz	IGYQKQYKJILMSR-UHFFFAOYSA-N	1	0	284.363	1.699	50	0		CDAARO
CCOCCC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@@H+]1CC	ZINC000106662104	349446260	/nfs/dbraw/zinc/44/62/60/349446260.db2.gz	OJKLIMXULXNFIL-UONOGXRCSA-N	1	0	268.401	1.888	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1cnc(-c2ncccn2)s1	ZINC000124581778	187144055	/nfs/dbraw/zinc/14/40/55/187144055.db2.gz	AUYSESBPXPEREV-SECBINFHSA-N	1	0	289.364	1.034	50	0		CDAARO
Cc1csc2c1ncn(C[C@H]1COCC[N@@H+](C)C1)c2=O	ZINC000584887018	341999066	/nfs/dbraw/zinc/99/90/66/341999066.db2.gz	DYNKQAKAFMZHSG-NSHDSACASA-N	1	0	293.392	1.345	50	0		CDAARO
Cc1cc([C@@H](C)[NH2+]CCN(C)S(C)(=O)=O)c(C)s1	ZINC000097373647	342002706	/nfs/dbraw/zinc/00/27/06/342002706.db2.gz	GCJKEMAYAXTRAW-SNVBAGLBSA-N	1	0	290.454	1.907	50	0		CDAARO
Cc1cc([C@H]2CCC[N@@H+]([C@@H]3CCN(C)C3=O)C2)[nH]n1	ZINC000084110863	539086154	/nfs/dbraw/zinc/08/61/54/539086154.db2.gz	WOQNZAFQRHURBK-WCQYABFASA-N	1	0	262.357	1.128	50	0		CDAARO
O=C(N[C@@H]1CCCCC[C@H]1CO)[C@@H](C1CC1)[NH+]1CCCC1	ZINC000097376495	342002950	/nfs/dbraw/zinc/00/29/50/342002950.db2.gz	CHNYRCKKQZMMEE-ARFHVFGLSA-N	1	0	294.439	1.918	50	0		CDAARO
COc1ccnc(N2CC[NH+](CC[C@@H]3CCCO3)CC2)n1	ZINC000189127351	365569014	/nfs/dbraw/zinc/56/90/14/365569014.db2.gz	NWZFEYHJDWETAS-ZDUSSCGKSA-N	1	0	292.383	1.176	50	0		CDAARO
CCOc1ccc(NC(=O)[C@H](C)[NH+](C)C)cc1CO	ZINC000095977742	185052015	/nfs/dbraw/zinc/05/20/15/185052015.db2.gz	HIQFQHZJZRIYDA-JTQLQIEISA-N	1	0	266.341	1.466	50	0		CDAARO
CO[C@]1(C)C[C@H](N(C)C(=O)[C@H]2CC[C@@H]([NH3+])C2)C1(C)C	ZINC000262628374	361743288	/nfs/dbraw/zinc/74/32/88/361743288.db2.gz	JPXDPODOXGTKQA-OZTPJHRESA-N	1	0	268.401	1.776	50	0		CDAARO
Cc1sc2ccccc2c1S(=O)(=O)N1CC[C@H]([NH3+])C1	ZINC000125079482	187168306	/nfs/dbraw/zinc/16/83/06/187168306.db2.gz	ZPTRTOBZDRPYND-JTQLQIEISA-N	1	0	296.417	1.931	50	0		CDAARO
Cc1ccc(OCCOCCN2CC[NH+](C)CC2)c(C)c1	ZINC000022184829	342088946	/nfs/dbraw/zinc/08/89/46/342088946.db2.gz	XIHFCHPRLQCVNH-UHFFFAOYSA-N	1	0	292.423	1.946	50	0		CDAARO
C[NH+](C)C[C@@H](O)COc1ccccc1Br	ZINC000004819475	342089021	/nfs/dbraw/zinc/08/90/21/342089021.db2.gz	ZKQUXALFXFYAGB-SECBINFHSA-N	1	0	274.158	1.750	50	0		CDAARO
COCC[NH2+]CC(=O)N1CC[C@@H](C)CC[C@H]1C(C)C	ZINC000195543555	342626602	/nfs/dbraw/zinc/62/66/02/342626602.db2.gz	YZJAPHCEABGTRI-KBPBESRZSA-N	1	0	270.417	1.896	50	0		CDAARO
CC[C@@H](COc1ccccc1)NC(=O)C[C@@H]1C[NH2+]CCO1	ZINC000195543509	342626634	/nfs/dbraw/zinc/62/66/34/342626634.db2.gz	GQGBOMLGJNVUAQ-DZGCQCFKSA-N	1	0	292.379	1.339	50	0		CDAARO
CC(C)C[C@H](NC(=O)C[C@@H]1C[NH2+]CCO1)C(C)(C)C	ZINC000195543580	342626727	/nfs/dbraw/zinc/62/67/27/342626727.db2.gz	FCIJEPBWVFZCPZ-OLZOCXBDSA-N	1	0	270.417	1.942	50	0		CDAARO
NC(=[NH2+])COc1ccc(C(=O)NC2CCCC2)cc1	ZINC000083254785	178371186	/nfs/dbraw/zinc/37/11/86/178371186.db2.gz	HTAHWFNFLITUNJ-UHFFFAOYSA-N	1	0	261.325	1.674	50	0		CDAARO
CCc1nnc(NC(=O)CC[N@@H+]2CC[C@H](COC)C2)s1	ZINC000244795755	361864524	/nfs/dbraw/zinc/86/45/24/361864524.db2.gz	RMZGGMUVFTTZDV-JTQLQIEISA-N	1	0	298.412	1.397	50	0		CDAARO
c1cncc(-c2noc([C@@H]3C[NH2+]CC34CCOCC4)n2)c1	ZINC000097945044	342166351	/nfs/dbraw/zinc/16/63/51/342166351.db2.gz	SQFWBAPXUFKWSO-LBPRGKRZSA-N	1	0	286.335	1.615	50	0		CDAARO
C[C@@H]1CN(c2nc3ccccc3[nH]2)C[C@H]1[NH+]1CCOCC1	ZINC000270554378	361931864	/nfs/dbraw/zinc/93/18/64/361931864.db2.gz	HFBHTQJUZQVQGY-IUODEOHRSA-N	1	0	286.379	1.720	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@H]2CCC[C@H](C(N)=O)C2)cc1	ZINC000097034918	185157523	/nfs/dbraw/zinc/15/75/23/185157523.db2.gz	DYLDOWJPAVZMJG-KBPBESRZSA-N	1	0	290.363	1.607	50	0		CDAARO
CC[C@H]1CN(S(C)(=O)=O)CC[C@@H]1[NH2+]Cc1cccnc1	ZINC000084736393	342268378	/nfs/dbraw/zinc/26/83/78/342268378.db2.gz	QQAFSBPWIABEJM-KBPBESRZSA-N	1	0	297.424	1.231	50	0		CDAARO
CC(C)(C[N@@H+]1CC[C@@H](C(N)=O)C1)Oc1ccccc1	ZINC000585116604	362044588	/nfs/dbraw/zinc/04/45/88/362044588.db2.gz	CLEPCMPVHBCKFT-GFCCVEGCSA-N	1	0	262.353	1.651	50	0		CDAARO
C[NH+](C)CC[C@H]1CN(C(=O)CCc2ccsc2)CCO1	ZINC000012835513	362113605	/nfs/dbraw/zinc/11/36/05/362113605.db2.gz	NVYCHDDFDGSATC-AWEZNQCLSA-N	1	0	296.436	1.860	50	0		CDAARO
CC(C)CNC(=O)[C@@H]([NH3+])Cc1c[nH]c2ccccc12	ZINC000005461592	343711185	/nfs/dbraw/zinc/71/11/85/343711185.db2.gz	CAPBNIFVVGTSCX-ZDUSSCGKSA-N	1	0	259.353	1.810	50	0		CDAARO
O=C(N[C@H]1C[NH2+]C[C@H](F)C1)OCc1ccccc1	ZINC000110915981	343762039	/nfs/dbraw/zinc/76/20/39/343762039.db2.gz	ABEYDAZZAVWOEL-VXGBXAGGSA-N	1	0	252.289	1.613	50	0		CDAARO
C[C@@H]1CN(C(=O)Cc2ccccc2Br)CC[NH2+]1	ZINC000084719037	362269041	/nfs/dbraw/zinc/26/90/41/362269041.db2.gz	YGZAZVQXFWYICQ-SNVBAGLBSA-N	1	0	297.196	1.812	50	0		CDAARO
CCOC[C@@H](O)C[NH+]1CCC(OCC(C)C)CC1	ZINC000084801178	362274988	/nfs/dbraw/zinc/27/49/88/362274988.db2.gz	JYACWBWBDUSZQB-ZDUSSCGKSA-N	1	0	259.390	1.521	50	0		CDAARO
COc1cccc(CCC(=O)N2CCC[C@@H]([NH3+])C2)c1	ZINC000191371402	362424147	/nfs/dbraw/zinc/42/41/47/362424147.db2.gz	GYDUOTWXRSDSQV-CYBMUJFWSA-N	1	0	262.353	1.578	50	0		CDAARO
C[NH+](C)CCNC(=O)Cn1cc(NCC(C)(C)C)cn1	ZINC000095462160	362563514	/nfs/dbraw/zinc/56/35/14/362563514.db2.gz	KVIIOPUIJZONJL-UHFFFAOYSA-N	1	0	281.404	1.019	50	0		CDAARO
Cc1cccc(C(=O)NCC2CC[NH2+]CC2)c1F	ZINC000120680192	362712616	/nfs/dbraw/zinc/71/26/16/362712616.db2.gz	UNVDBAREAXBBGB-UHFFFAOYSA-N	1	0	250.317	1.864	50	0		CDAARO
CO[C@H](C)C(=O)NCCCC[NH+]1C[C@H](C)O[C@@H](C)C1	ZINC000085455796	179067937	/nfs/dbraw/zinc/06/79/37/179067937.db2.gz	CUBSDDODTHRBQN-RWMBFGLXSA-N	1	0	272.389	1.027	50	0		CDAARO
CCn1cc(C[NH2+]C[C@H]2CCO[C@@H]2c2cnn(C)c2)cn1	ZINC000089306031	346755716	/nfs/dbraw/zinc/75/57/16/346755716.db2.gz	AYWCLUAOFFXEQM-HIFRSBDPSA-N	1	0	289.383	1.504	50	0		CDAARO
CC1CC[NH+](Cc2cc(=O)n3ccccc3n2)CC1	ZINC000015378707	365926673	/nfs/dbraw/zinc/92/66/73/365926673.db2.gz	NHBKAPDDWRMVPV-UHFFFAOYSA-N	1	0	257.337	1.926	50	0		CDAARO
C[NH2+][C@]1(c2nnnn2-c2ccccc2)CCOC(C)(C)C1	ZINC000005164878	290836671	/nfs/dbraw/zinc/83/66/71/290836671.db2.gz	AYFZWHGTBVLBLC-OAHLLOKOSA-N	1	0	287.367	1.666	50	0		CDAARO
NC(=[NH2+])NCCCO[C@@H]1CCC[C@H](C(F)(F)F)C1	ZINC000095918047	348747102	/nfs/dbraw/zinc/74/71/02/348747102.db2.gz	OETBCKZVZFNTCU-DTWKUNHWSA-N	1	0	267.295	1.997	50	0		CDAARO
C[NH+](C)CC1(O)CCN(C(=O)[C@@H]2CC23CCCC3)CC1	ZINC000584886645	349344981	/nfs/dbraw/zinc/34/49/81/349344981.db2.gz	BLDKWYAQNXTVAH-ZDUSSCGKSA-N	1	0	280.412	1.482	50	0		CDAARO
Cc1c[nH+]ccc1N1CCN(C(=O)c2cnc(C)nc2)CC1	ZINC000584889083	349348157	/nfs/dbraw/zinc/34/81/57/349348157.db2.gz	WZGYDBGNBYJYJU-UHFFFAOYSA-N	1	0	297.362	1.451	50	0		CDAARO
Cc1nc(CN(C)C[C@H]2CCCC[N@@H+]2C)n(C)c1C	ZINC000584891859	349351029	/nfs/dbraw/zinc/35/10/29/349351029.db2.gz	WKCDJQUETCEADX-CQSZACIVSA-N	1	0	264.417	1.953	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C(=O)C[C@H]1CCOC1	ZINC000584894457	349354244	/nfs/dbraw/zinc/35/42/44/349354244.db2.gz	ZUJQOCZXMLZVAE-CYBMUJFWSA-N	1	0	268.401	1.746	50	0		CDAARO
Cc1nonc1CNC(=O)CC[C@H](C)[NH+]1CCCC1	ZINC000584900050	349362176	/nfs/dbraw/zinc/36/21/76/349362176.db2.gz	WTXQNKDOHVJFLD-JTQLQIEISA-N	1	0	266.345	1.259	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc(F)cc2)C[C@H]1CCO	ZINC000104383157	185988405	/nfs/dbraw/zinc/98/84/05/185988405.db2.gz	XWSLHIHKHPCHTJ-CQSZACIVSA-N	1	0	252.333	1.324	50	0		CDAARO
Cc1cc(C)c2[nH]c(CN3CC[C@@H]([NH3+])C3)cc(=O)c2c1	ZINC000091289302	180122354	/nfs/dbraw/zinc/12/23/54/180122354.db2.gz	QYFXHAVXXGBTON-GFCCVEGCSA-N	1	0	271.364	1.678	50	0		CDAARO
Cn1cc(CCCN2CC3(CC[NH2+]CC3)CCC2=O)cn1	ZINC000091645858	180215058	/nfs/dbraw/zinc/21/50/58/180215058.db2.gz	YOWCLIMQUZVFIM-UHFFFAOYSA-N	1	0	290.411	1.345	50	0		CDAARO
CC1CCN(C(=O)CCN2C[C@H]([NH3+])[C@@H](C3CC3)C2)CC1	ZINC000091665334	180220929	/nfs/dbraw/zinc/22/09/29/180220929.db2.gz	YLNRYWIXIACDRB-CABCVRRESA-N	1	0	279.428	1.304	50	0		CDAARO
COCC[C@]1(O)CC[N@H+](CCCn2ccnc2)C[C@H]1C	ZINC000091781082	180253880	/nfs/dbraw/zinc/25/38/80/180253880.db2.gz	BQBXAOFLTVGXMX-HUUCEWRRSA-N	1	0	281.400	1.383	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)NCCCOc1cccnc1	ZINC000091871448	180277575	/nfs/dbraw/zinc/27/75/75/180277575.db2.gz	KFQOOGSVUHDRQW-HNNXBMFYSA-N	1	0	291.395	1.841	50	0		CDAARO
Cc1c(C(=O)NC[C@@H](C)[N@@H+]2CCC[C@@H](C)C2)cnn1C	ZINC000106078791	186101655	/nfs/dbraw/zinc/10/16/55/186101655.db2.gz	IKJPBGIRMLNEBQ-VXGBXAGGSA-N	1	0	278.400	1.579	50	0		CDAARO
CNC(=O)CN1CCC([NH2+]Cc2ccc(C)c(F)c2)CC1	ZINC000106409971	186115736	/nfs/dbraw/zinc/11/57/36/186115736.db2.gz	HZCLCEAXGFKETP-UHFFFAOYSA-N	1	0	293.386	1.434	50	0		CDAARO
CCC[NH+]1CCC(CC(=O)N[C@H]2CCCCNC2=O)CC1	ZINC000065388055	362960883	/nfs/dbraw/zinc/96/08/83/362960883.db2.gz	GENOEUGOWPVOLN-AWEZNQCLSA-N	1	0	295.427	1.283	50	0		CDAARO
C[C@H](NC(=O)C[NH2+][C@@H](C)[C@H]1CCOC1)c1ccccc1	ZINC000108334425	186213072	/nfs/dbraw/zinc/21/30/72/186213072.db2.gz	LNRFGXWFHTXHJL-YDHLFZDLSA-N	1	0	276.380	1.878	50	0		CDAARO
C[NH+](C)CCCS(=O)(=O)N[C@@H]1CCCc2ccccc21	ZINC000583651411	366010067	/nfs/dbraw/zinc/01/00/67/366010067.db2.gz	KZPQCGVPMHFRIU-OAHLLOKOSA-N	1	0	296.436	1.935	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCCN1C(=O)/C=C/c1cncc(F)c1	ZINC000121981789	187008755	/nfs/dbraw/zinc/00/87/55/187008755.db2.gz	WSRBQGVYEWUSNW-YNVXZPTESA-N	1	0	277.343	1.962	50	0		CDAARO
CCNC(=O)C[NH+]1CCC(Cn2ccnc2C)CC1	ZINC000090472803	358477071	/nfs/dbraw/zinc/47/70/71/358477071.db2.gz	CQIXHVVFLDZXKQ-UHFFFAOYSA-N	1	0	264.373	1.040	50	0		CDAARO
O=C1NCC[C@@H]1[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1	ZINC000248800099	366149375	/nfs/dbraw/zinc/14/93/75/366149375.db2.gz	ZZTWAMPBWNLWEN-VHDGCEQUSA-N	1	0	274.364	1.632	50	0		CDAARO
COc1ccc(OCC(=O)OC2CC[NH+](C)CC2)cc1	ZINC000000525314	355914633	/nfs/dbraw/zinc/91/46/33/355914633.db2.gz	FCNCDIPLMNLCBP-UHFFFAOYSA-N	1	0	279.336	1.711	50	0		CDAARO
CCC[NH2+]C1(C(N)=O)CCN(Cc2ccccc2)CC1	ZINC000001698825	355948046	/nfs/dbraw/zinc/94/80/46/355948046.db2.gz	SXXNRWUIGQVITE-UHFFFAOYSA-N	1	0	275.396	1.506	50	0		CDAARO
Cn1c2ccc(C[NH2+]Cc3cccnc3)cc2n(C)c1=O	ZINC000002209722	355963524	/nfs/dbraw/zinc/96/35/24/355963524.db2.gz	CQOJCKGPGOXOGJ-UHFFFAOYSA-N	1	0	282.347	1.562	50	0		CDAARO
COCCN1CCC[C@@](O)(C[NH2+]C2CCCCCC2)C1=O	ZINC000012315861	356292637	/nfs/dbraw/zinc/29/26/37/356292637.db2.gz	IBCCJAVMIJFAQM-MRXNPFEDSA-N	1	0	298.427	1.299	50	0		CDAARO
CCC(C)(C)[NH2+]Cc1ccc(OCC(N)=O)c(OC)c1	ZINC000013724674	356354773	/nfs/dbraw/zinc/35/47/73/356354773.db2.gz	XJKYZKOEKOATGM-UHFFFAOYSA-N	1	0	280.368	1.838	50	0		CDAARO
C[NH+]1CCC(NS(=O)(=O)Cc2ccccc2)CC1	ZINC000014252216	356382058	/nfs/dbraw/zinc/38/20/58/356382058.db2.gz	UJUVXWALJUDWDH-UHFFFAOYSA-N	1	0	268.382	1.200	50	0		CDAARO
C[NH+](C)CCCNC(=O)c1ccc(N2CCOCC2)cc1	ZINC000014398304	356387943	/nfs/dbraw/zinc/38/79/43/356387943.db2.gz	HAKZRYWYMODPQT-UHFFFAOYSA-N	1	0	291.395	1.205	50	0		CDAARO
C[NH2+]C1(c2nnnn2-c2cccc(C)c2)CCCC1	ZINC000004576035	356424180	/nfs/dbraw/zinc/42/41/80/356424180.db2.gz	XJAMQTUQCHSLRD-UHFFFAOYSA-N	1	0	257.341	1.959	50	0		CDAARO
Cc1cccc(N2CCN(C(=O)[C@H]3CCC[NH2+]3)CC2)c1	ZINC000019411489	356484653	/nfs/dbraw/zinc/48/46/53/356484653.db2.gz	LHVIIXYSYOYUAV-OAHLLOKOSA-N	1	0	273.380	1.396	50	0		CDAARO
CC(C)(C[NH2+]Cc1ccsc1)N1CCOCC1	ZINC000020120594	356526458	/nfs/dbraw/zinc/52/64/58/356526458.db2.gz	UYVQQVHXAZFADH-UHFFFAOYSA-N	1	0	254.399	1.949	50	0		CDAARO
CC(C)NC(=O)NCC1(C(F)(F)F)CC[NH2+]CC1	ZINC000725264696	538455692	/nfs/dbraw/zinc/45/56/92/538455692.db2.gz	JSAKGVZBRUCPOY-UHFFFAOYSA-N	1	0	267.295	1.626	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COC2CCCCC2)CC1	ZINC000023114604	356628715	/nfs/dbraw/zinc/62/87/15/356628715.db2.gz	IWNOILKQPFIRQQ-AWEZNQCLSA-N	1	0	270.417	1.334	50	0		CDAARO
COC(=O)c1cccc(NC(=O)NC2CC[NH2+]CC2)c1	ZINC000414890080	356702821	/nfs/dbraw/zinc/70/28/21/356702821.db2.gz	ZDAUSBJQODUVSZ-UHFFFAOYSA-N	1	0	277.324	1.347	50	0		CDAARO
COc1cc(C(=O)NCC[NH+](C)C)cc(OC)c1OC	ZINC000000064386	356812691	/nfs/dbraw/zinc/81/26/91/356812691.db2.gz	MULYKOBTDUQNCP-UHFFFAOYSA-N	1	0	282.340	1.004	50	0		CDAARO
CC(C)(C)OC(=O)N1C[C@H](O)[C@@H]([NH2+]Cc2ccccc2)C1	ZINC000034441999	356814708	/nfs/dbraw/zinc/81/47/08/356814708.db2.gz	GVYATPKTSSTHKN-KBPBESRZSA-N	1	0	292.379	1.756	50	0		CDAARO
CCCN(CC(F)(F)F)C(=O)[C@@H]1CCC[NH2+]C1	ZINC000037812074	356934383	/nfs/dbraw/zinc/93/43/83/356934383.db2.gz	UYQPLYOAIDJVSC-SECBINFHSA-N	1	0	252.280	1.787	50	0		CDAARO
COc1cccc(/C(C)=C\C(=O)N2CC[C@H]([NH3+])C2)c1	ZINC000255728799	356956456	/nfs/dbraw/zinc/95/64/56/356956456.db2.gz	BWNDACKVUCVFJI-ZWXCPPHNSA-N	1	0	260.337	1.658	50	0		CDAARO
Cc1ccccc1NC(=O)c1n[nH]c2c1C[NH2+]CC2	ZINC000042784020	357080277	/nfs/dbraw/zinc/08/02/77/357080277.db2.gz	DWMNJTZJGGJLSF-UHFFFAOYSA-N	1	0	256.309	1.616	50	0		CDAARO
CCN(C/C=C/c1ccccc1)C(=O)C[C@H]1C[NH2+]CCO1	ZINC000055060776	357328840	/nfs/dbraw/zinc/32/88/40/357328840.db2.gz	WQMDMGWCRFPOME-FSNWXROXSA-N	1	0	288.391	1.927	50	0		CDAARO
C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NS(=O)(=O)CCCF	ZINC000096470338	357479357	/nfs/dbraw/zinc/47/93/57/357479357.db2.gz	OBEDVIDFJCQIIR-FRRDWIJNSA-N	1	0	294.436	1.632	50	0		CDAARO
COc1cc(NC[C@]2([NH+](C)C)CCSC2)ncn1	ZINC000065498271	357545872	/nfs/dbraw/zinc/54/58/72/357545872.db2.gz	ISFSUCZAOUVIKS-GFCCVEGCSA-N	1	0	268.386	1.334	50	0		CDAARO
[NH3+][C@H]1CCCN(c2nc(-c3ccccc3)cc(=O)[nH]2)C1	ZINC000067172889	357597367	/nfs/dbraw/zinc/59/73/67/357597367.db2.gz	JPHBDCPARAXLQA-LBPRGKRZSA-N	1	0	270.336	1.364	50	0		CDAARO
CC(C)Oc1ccccc1CC(=O)N1CC[NH2+][C@H](C)C1	ZINC000188370872	357643537	/nfs/dbraw/zinc/64/35/37/357643537.db2.gz	LPIQYNMFSQSERM-CYBMUJFWSA-N	1	0	276.380	1.837	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@H]2C[C@H]2c2cccc(F)c2F)CC[NH2+]1	ZINC000188471362	357694146	/nfs/dbraw/zinc/69/41/46/357694146.db2.gz	WQAFDAMNCVCIHL-USWWRNFRSA-N	1	0	280.318	1.889	50	0		CDAARO
CCN1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	ZINC000033248312	357807390	/nfs/dbraw/zinc/80/73/90/357807390.db2.gz	NSLXSVSPHWCKEQ-JYRVWZFOSA-N	1	0	280.393	1.625	50	0		CDAARO
Cc1ccc([C@@H](C)NCC(=O)NCc2cccnc2)o1	ZINC000097111277	357987041	/nfs/dbraw/zinc/98/70/41/357987041.db2.gz	LGYWQIDKSYWKQK-GFCCVEGCSA-N	1	0	273.336	1.950	50	0		CDAARO
CC(C)C[C@H](C[NH+](C)C)NS(=O)(=O)CCCF	ZINC000097166156	358005832	/nfs/dbraw/zinc/00/58/32/358005832.db2.gz	QAFNBIKXEOQRLQ-LLVKDONJSA-N	1	0	268.398	1.242	50	0		CDAARO
CCOc1cc2c(cc1CN1CC[C@@H]([NH3+])[C@H](O)C1)CCC2	ZINC000082109122	358147158	/nfs/dbraw/zinc/14/71/58/358147158.db2.gz	JJHSVPVOPKKBAO-HZPDHXFCSA-N	1	0	290.407	1.468	50	0		CDAARO
C[C@H]([NH2+]Cc1nncn1C)[C@@H]1COc2ccccc21	ZINC000097112617	358190750	/nfs/dbraw/zinc/19/07/50/358190750.db2.gz	RFXIUKTYHAAVOH-JQWIXIFHSA-N	1	0	258.325	1.469	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N1CC[C@@H](C)C[C@@H](C)C1	ZINC000195554719	358557371	/nfs/dbraw/zinc/55/73/71/358557371.db2.gz	ZNIDWQFCRZJEFR-UTUOFQBUSA-N	1	0	258.431	1.961	50	0		CDAARO
CCc1noc([C@@H]2CCC[N@@H+](C3CCOCC3)C2)n1	ZINC000095373640	358688495	/nfs/dbraw/zinc/68/84/95/358688495.db2.gz	SWPWMGQFEBMHOG-LLVKDONJSA-N	1	0	265.357	1.990	50	0		CDAARO
CCc1cnc(NCCC[N@@H+]2CCC[C@H](CO)C2)nc1	ZINC000095383243	358690253	/nfs/dbraw/zinc/69/02/53/358690253.db2.gz	QOZALRNMNPGFCN-AWEZNQCLSA-N	1	0	278.400	1.545	50	0		CDAARO
c1c(-c2ccnc3ccccc32)nnn1C[C@H]1C[NH2+]CCO1	ZINC000095387151	358691348	/nfs/dbraw/zinc/69/13/48/358691348.db2.gz	CABAVMYMPKZESK-GFCCVEGCSA-N	1	0	295.346	1.482	50	0		CDAARO
O=C(NCc1cccc(-c2ccccc2)c1)[C@H]1C[NH2+]CCO1	ZINC000097244155	358760680	/nfs/dbraw/zinc/76/06/80/358760680.db2.gz	TXPIYYMRFHCYGQ-QGZVFWFLSA-N	1	0	296.370	1.958	50	0		CDAARO
COc1cccc(NC(=O)NC2CC[NH+](C)CC2)c1	ZINC000011558717	358723098	/nfs/dbraw/zinc/72/30/98/358723098.db2.gz	OXPMIYDOKRNAOM-UHFFFAOYSA-N	1	0	263.341	1.911	50	0		CDAARO
O=C(NCc1ccoc1)[C@@H]1CCC[N@@H+](C2CCOCC2)C1	ZINC000097655453	358790601	/nfs/dbraw/zinc/79/06/01/358790601.db2.gz	FYWFMAVFCLTDLE-CQSZACIVSA-N	1	0	292.379	1.787	50	0		CDAARO
O=C(c1cnc2c(c1)CCCC2)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000097674470	358792991	/nfs/dbraw/zinc/79/29/91/358792991.db2.gz	VRAQLUUFEHFVFE-CABCVRRESA-N	1	0	285.391	1.927	50	0		CDAARO
O[C@H]1CN(Cc2nccs2)C[C@@H]1[NH+]1CCCCC1	ZINC000097698640	358793786	/nfs/dbraw/zinc/79/37/86/358793786.db2.gz	XXSPOBAJJBYWPL-RYUDHWBXSA-N	1	0	267.398	1.174	50	0		CDAARO
O=C([C@@H]1C[NH2+]CCO1)N1CCC[C@H]1c1ccc(Cl)cc1	ZINC000178404612	366486086	/nfs/dbraw/zinc/48/60/86/366486086.db2.gz	KHDDSKBTMNXGNQ-KBPBESRZSA-N	1	0	294.782	1.992	50	0		CDAARO
CC(C)[C@@H]1C=CCN1Cc1cc2n(n1)CCC[NH2+]C2	ZINC000215306180	358883640	/nfs/dbraw/zinc/88/36/40/358883640.db2.gz	HZXJBHKVVUVUJI-HNNXBMFYSA-N	1	0	260.385	1.773	50	0		CDAARO
NC(=O)c1ccc(NC(=O)CC[NH+]2CCSCC2)cc1	ZINC000103467897	358924444	/nfs/dbraw/zinc/92/44/44/358924444.db2.gz	GZFLGJKGFWYYBP-UHFFFAOYSA-N	1	0	293.392	1.163	50	0		CDAARO
Cc1nn(CC(=O)NCC[NH+]2CCCC2)c(C)c1C	ZINC000216139795	358927425	/nfs/dbraw/zinc/92/74/25/358927425.db2.gz	VSDWFJSIERXNOE-UHFFFAOYSA-N	1	0	264.373	1.020	50	0		CDAARO
CN1CCN(C(=O)C[NH+]2CCCC2)C[C@H]1c1ccccc1	ZINC000216340885	358938420	/nfs/dbraw/zinc/93/84/20/358938420.db2.gz	NRXKZCOEMJLECG-INIZCTEOSA-N	1	0	287.407	1.598	50	0		CDAARO
CC(=O)N[C@@H]1C[N@H+](CCCc2ccccc2)C[C@H]1CO	ZINC000257176479	359071813	/nfs/dbraw/zinc/07/18/13/359071813.db2.gz	SYGWMAZVPDQSDC-JKSUJKDBSA-N	1	0	276.380	1.048	50	0		CDAARO
CC[C@H](Cn1ccnc1)NC(=O)CCn1cc(C)cn1	ZINC000219315309	359088654	/nfs/dbraw/zinc/08/86/54/359088654.db2.gz	SQTPUWALOQPOLU-CYBMUJFWSA-N	1	0	275.356	1.373	50	0		CDAARO
OC1CC(c2cc(NCC[NH+]3CCCC3)ncn2)C1	ZINC000219603916	359108027	/nfs/dbraw/zinc/10/80/27/359108027.db2.gz	BLOZNBYCQKDXSY-UHFFFAOYSA-N	1	0	262.357	1.223	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(S(=O)(=O)CC2CCCC2)C1	ZINC000262157265	359142012	/nfs/dbraw/zinc/14/20/12/359142012.db2.gz	ZKRWQOONGMEMGZ-CYBMUJFWSA-N	1	0	274.430	1.438	50	0		CDAARO
Cc1cc([C@@H]2CCCN2C(=O)[C@@H]2CCC[NH2+]C2)on1	ZINC000037820266	359230524	/nfs/dbraw/zinc/23/05/24/359230524.db2.gz	IKWLZMPEZQXATI-NEPJUHHUSA-N	1	0	263.341	1.646	50	0		CDAARO
C[NH+]1CCC(CC(=O)N2CCC3(CC[C@@H]3O)CC2)CC1	ZINC000257180643	359216537	/nfs/dbraw/zinc/21/65/37/359216537.db2.gz	DSJCJELYCZGCIM-AWEZNQCLSA-N	1	0	280.412	1.482	50	0		CDAARO
CNc1cc(C)[nH+]c(N[C@@H]2CCOC[C@H]2OCC2CC2)n1	ZINC000223302915	359415337	/nfs/dbraw/zinc/41/53/37/359415337.db2.gz	AUMDZVXRKCMEPG-CHWSQXEVSA-N	1	0	292.383	1.823	50	0		CDAARO
c1n[nH]cc1CCN1CC[NH+](C2CCCCC2)CC1	ZINC000223094879	359399151	/nfs/dbraw/zinc/39/91/51/359399151.db2.gz	DAINXGZBCUGNBM-UHFFFAOYSA-N	1	0	262.401	1.903	50	0		CDAARO
Nc1nc(NCCc2nccs2)cc(C2CC([NH3+])C2)n1	ZINC000223897364	359467977	/nfs/dbraw/zinc/46/79/77/359467977.db2.gz	CCXIWOHUEPAEBE-UHFFFAOYSA-N	1	0	290.396	1.375	50	0		CDAARO
CN1C(=O)[C@H]2C[N@H+](Cc3cc(F)ccc3F)C[C@H]2C1=O	ZINC000257186130	359522259	/nfs/dbraw/zinc/52/22/59/359522259.db2.gz	YKWVDUOSTAHVMF-PHIMTYICSA-N	1	0	280.274	1.011	50	0		CDAARO
Cc1cc(C[NH+]2CCC3(CC2)C[C@](C)(O)CCO3)n(C)n1	ZINC000257191036	359537396	/nfs/dbraw/zinc/53/73/96/359537396.db2.gz	OTILITVQLYQOOM-OAHLLOKOSA-N	1	0	293.411	1.625	50	0		CDAARO
COc1cccc(C[NH+]2CCC3(CC[C@@H]3O)CC2)n1	ZINC000257189326	359533280	/nfs/dbraw/zinc/53/32/80/359533280.db2.gz	NQBUXWGPSNLLTM-ZDUSSCGKSA-N	1	0	262.353	1.827	50	0		CDAARO
O[C@@H](C[NH+]1CCN(c2cccnn2)CC1)C1CCCCC1	ZINC000191329912	359616770	/nfs/dbraw/zinc/61/67/70/359616770.db2.gz	BVRDEBPTNFNUJD-HNNXBMFYSA-N	1	0	290.411	1.540	50	0		CDAARO
Cc1ccccc1[C@H](C)[NH2+]C[C@@H](O)CN1CCCC1=O	ZINC000089515075	360095279	/nfs/dbraw/zinc/09/52/79/360095279.db2.gz	NVHDEYIQPJKXHY-UONOGXRCSA-N	1	0	276.380	1.629	50	0		CDAARO
O=C(N[C@H]1C[NH2+]CC[C@H]1O)c1cc2c(cccc2Cl)[nH]1	ZINC000426501927	360677517	/nfs/dbraw/zinc/67/75/17/360677517.db2.gz	UKFFTXNMQBFELR-QWHCGFSZSA-N	1	0	293.754	1.274	50	0		CDAARO
Cc1nonc1CSc1nnc([C@@H]2CCC[NH2+]C2)n1C	ZINC000426513742	360678884	/nfs/dbraw/zinc/67/88/84/360678884.db2.gz	RVBSFHRJDBJIAI-SECBINFHSA-N	1	0	294.384	1.266	50	0		CDAARO
[NH3+][C@H]1CCCN(Cc2cccc(Cn3cccn3)c2)C1	ZINC000426563104	360684343	/nfs/dbraw/zinc/68/43/43/360684343.db2.gz	JIWCNZPKIQOKJW-INIZCTEOSA-N	1	0	270.380	1.855	50	0		CDAARO
CO[C@H]1CCCN(C(=O)Cc2ccc(OCC[NH3+])cc2)C1	ZINC000426728189	360700294	/nfs/dbraw/zinc/70/02/94/360700294.db2.gz	FKAKEQUROCLNMY-HNNXBMFYSA-N	1	0	292.379	1.204	50	0		CDAARO
CCn1nc(C)c(C(=O)N(C)[C@@H]2CC[NH2+]C2)c1Cl	ZINC000179126041	189171213	/nfs/dbraw/zinc/17/12/13/189171213.db2.gz	ITRDGUYVDFFBDL-SECBINFHSA-N	1	0	270.764	1.299	50	0		CDAARO
CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1Cc1cn2cccnc2n1	ZINC000180841521	189278715	/nfs/dbraw/zinc/27/87/15/189278715.db2.gz	LDIOZIFBJUHSOX-HUUCEWRRSA-N	1	0	285.395	1.788	50	0		CDAARO
COC[C@H](C)C(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1C	ZINC000248114212	361271328	/nfs/dbraw/zinc/27/13/28/361271328.db2.gz	IEMVWFOTKMOAIQ-YNEHKIRRSA-N	1	0	254.374	1.354	50	0		CDAARO
C[NH+](C)CCN(Cc1ccco1)C(=O)[C@H]1CCOC1	ZINC000088230477	364560470	/nfs/dbraw/zinc/56/04/70/364560470.db2.gz	DPEOLIKDLAIVIH-LBPRGKRZSA-N	1	0	266.341	1.206	50	0		CDAARO
CN1CC[N@H+](C)C[C@@H]1CNC(=O)NC(C)(C)CC(C)(C)C	ZINC000089642996	366896243	/nfs/dbraw/zinc/89/62/43/366896243.db2.gz	RUSSGIBEOXMKJL-ZDUSSCGKSA-N	1	0	298.475	1.746	50	0		CDAARO
Cc1ccc(-c2cc(C(=O)NCC[NH+](C)C)[nH]n2)s1	ZINC000089657297	366900775	/nfs/dbraw/zinc/90/07/75/366900775.db2.gz	DWYPFZHMSGTWJG-UHFFFAOYSA-N	1	0	278.381	1.738	50	0		CDAARO
O=C(NCC[N@H+]1CC=CCC1)c1ccc2c(c1)OCCO2	ZINC000280269792	367330890	/nfs/dbraw/zinc/33/08/90/367330890.db2.gz	PEUJHQNJSAENNK-UHFFFAOYSA-N	1	0	288.347	1.450	50	0		CDAARO
O=C(N[C@@H]1CCC[NH2+]C1)c1cnc2c(c1)CCCC2	ZINC000097619403	284027872	/nfs/dbraw/zinc/02/78/72/284027872.db2.gz	LCKLUJNTHSIUAR-CYBMUJFWSA-N	1	0	259.353	1.442	50	0		CDAARO
Cc1c[nH+]c(C2CC2)n1CCNC(=O)c1cccn1C	ZINC000575554404	369118064	/nfs/dbraw/zinc/11/80/64/369118064.db2.gz	RUCQXIFBYLCEHW-UHFFFAOYSA-N	1	0	272.352	1.837	50	0		CDAARO
O=C(C[C@H]1CCOC1)N1CCC(C[NH+]2CCCC2)CC1	ZINC000369552225	369805606	/nfs/dbraw/zinc/80/56/06/369805606.db2.gz	GYQZORYOTCLQRI-OAHLLOKOSA-N	1	0	280.412	1.747	50	0		CDAARO
Cc1ccnc(C[C@H](C)[N@H+](C)CCn2cc[nH]c2=O)c1	ZINC000244633288	189907915	/nfs/dbraw/zinc/90/79/15/189907915.db2.gz	GAMYYAAWEPFBDQ-ZDUSSCGKSA-N	1	0	274.368	1.443	50	0		CDAARO
COc1ccc([C@@H](C[NH+](C)C)NCc2cc[nH]n2)cc1	ZINC000253416608	373725183	/nfs/dbraw/zinc/72/51/83/373725183.db2.gz	YWGLBGIOZZQBDS-OAHLLOKOSA-N	1	0	274.368	1.811	50	0		CDAARO
CN(C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F)[C@H]1CC[NH2+]C1	ZINC000247448153	189939464	/nfs/dbraw/zinc/93/94/64/189939464.db2.gz	YRDHOFBTDRPKKO-ZMLRMANQSA-N	1	0	280.318	1.889	50	0		CDAARO
Cc1cc(N2CC[C@H](N(C)Cc3cccnc3)C2=O)n(C)n1	ZINC000104335958	374285192	/nfs/dbraw/zinc/28/51/92/374285192.db2.gz	HLBJMELPSGXYKK-AWEZNQCLSA-N	1	0	299.378	1.361	50	0		CDAARO
COc1ccc2c3c1O[C@@H]1C[C@@H](O)C=C[C@@]31CC[N@@H+](C)C2	ZINC000005525593	374370433	/nfs/dbraw/zinc/37/04/33/374370433.db2.gz	ASUTZQLVASHGKV-QEORTHHSSA-N	1	0	287.359	1.850	50	0	biogenic	CDAARO
Cn1cc(C(=O)N2CCC[N@H+](C)CC2)c2ccccc21	ZINC000012545306	374532473	/nfs/dbraw/zinc/53/24/73/374532473.db2.gz	FNFJYDWNUOSMLG-UHFFFAOYSA-N	1	0	271.364	1.956	50	0		CDAARO
COC(=O)CCC[N@H+](C)[C@H]1CCN(c2ccccc2)C1=O	ZINC000117340989	374535716	/nfs/dbraw/zinc/53/57/16/374535716.db2.gz	WHGLRWZZAAOTEQ-AWEZNQCLSA-N	1	0	290.363	1.677	50	0		CDAARO
C[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)[C@H]1C[NH3+]	ZINC000252231627	189974203	/nfs/dbraw/zinc/97/42/03/189974203.db2.gz	ZYLHJNFLAISVMB-OCCSQVGLSA-N	1	0	282.409	1.576	50	0		CDAARO
CN(C[C@@H]1CCCCO1)C(=O)[C@@H]1CCCCC[C@H]1[NH3+]	ZINC000108485425	412830480	/nfs/dbraw/zinc/83/04/80/412830480.db2.gz	BEENGRHAQNSIEJ-BFHYXJOUSA-N	1	0	268.401	1.922	50	0		CDAARO
C[C@H]1C[N@@H+]2CCCC[C@@H]2CN1C(=O)COCC1CC1	ZINC000095398124	374901514	/nfs/dbraw/zinc/90/15/14/374901514.db2.gz	QLQPAYDDKVQPOX-GXTWGEPZSA-N	1	0	266.385	1.498	50	0		CDAARO
CC(C)[C@@H](CN1CCOCC1)NCC(=O)OC(C)(C)C	ZINC000095941475	375037474	/nfs/dbraw/zinc/03/74/74/375037474.db2.gz	ZINGHXXKIFSACB-CYBMUJFWSA-N	1	0	286.416	1.275	50	0		CDAARO
Cn1cc(C(=O)NCCC[NH+](C)C)c2ccccc2c1=O	ZINC000096232489	375065829	/nfs/dbraw/zinc/06/58/29/375065829.db2.gz	YIDLZAZIMRGAIX-UHFFFAOYSA-N	1	0	287.363	1.220	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]C[C@]1(N2CCOCC2)CCSC1	ZINC000097160053	375150265	/nfs/dbraw/zinc/15/02/65/375150265.db2.gz	KJLHOAWXKHROTE-CQSZACIVSA-N	1	0	296.440	1.016	50	0		CDAARO
C[C@H](NC(=O)C[NH+]1CCC(C(N)=O)CC1)c1ccccc1	ZINC000002643575	375284980	/nfs/dbraw/zinc/28/49/80/375284980.db2.gz	WRXDFCYUNTUIRM-LBPRGKRZSA-N	1	0	289.379	1.061	50	0		CDAARO
CC[NH+](CC)CCNS(=O)(=O)c1ccccc1F	ZINC000002726126	375304658	/nfs/dbraw/zinc/30/46/58/375304658.db2.gz	DWACGKNOPVYPHQ-UHFFFAOYSA-N	1	0	274.361	1.446	50	0	in-vitro	CDAARO
O=C(NCCN1CCc2ccccc2C1)c1cccnc1	ZINC000031337917	375780639	/nfs/dbraw/zinc/78/06/39/375780639.db2.gz	XWCOUWOCHPJEBZ-UHFFFAOYSA-N	1	0	281.359	1.870	50	0		CDAARO
Cc1nc(/C=C\C(=O)N2CC[C@H]([NH3+])C[C@H]2C)cs1	ZINC000606441995	375823203	/nfs/dbraw/zinc/82/32/03/375823203.db2.gz	JBKRZSAPZFZXKL-YUPSMKLTSA-N	1	0	265.382	1.803	50	0		CDAARO
Cc1ccnc(Sc2nnc(C3CC[NH2+]CC3)n2C)n1	ZINC000265463329	375827091	/nfs/dbraw/zinc/82/70/91/375827091.db2.gz	AQJIJKALYSSIHP-UHFFFAOYSA-N	1	0	290.396	1.532	50	0		CDAARO
O=C(NC[C@@]1(O)CCC[NH2+]CC1)OCc1ccccc1	ZINC000261508724	190040108	/nfs/dbraw/zinc/04/01/08/190040108.db2.gz	WFNSIJPBNMYFGZ-OAHLLOKOSA-N	1	0	278.352	1.417	50	0		CDAARO
CC[NH+](CC)CCNC(=O)NC(=O)c1ccccc1	ZINC000001891120	376630525	/nfs/dbraw/zinc/63/05/25/376630525.db2.gz	NIWZORSJZCLYBO-UHFFFAOYSA-N	1	0	263.341	1.468	50	0		CDAARO
O=C1NCCN1CC[NH+]1CCC(Cc2ccccn2)CC1	ZINC000377274668	376944698	/nfs/dbraw/zinc/94/46/98/376944698.db2.gz	BGIIUULJTILXSY-UHFFFAOYSA-N	1	0	288.395	1.361	50	0		CDAARO
C[NH+](C)[C@@H](CNc1ccc2nnnn2n1)c1ccccc1	ZINC000008851440	377406349	/nfs/dbraw/zinc/40/63/49/377406349.db2.gz	XBPABUNQPVWYMR-LBPRGKRZSA-N	1	0	283.339	1.234	50	0		CDAARO
O=S(=O)(CC1CC[NH2+]CC1)c1ccc(F)cc1	ZINC000011967912	184533556	/nfs/dbraw/zinc/53/35/56/184533556.db2.gz	QFBTYVFUKYVVIE-UHFFFAOYSA-N	1	0	257.330	1.599	50	0		CDAARO
CC[C@H](C)[NH2+]C[C@@H](O)COCCOc1ccc(F)cc1	ZINC000041690321	184553196	/nfs/dbraw/zinc/55/31/96/184553196.db2.gz	DMADYEFBULAUGA-GXTWGEPZSA-N	1	0	285.359	1.970	50	0		CDAARO
[NH3+]C[C@@H]1CCCCN1C(=O)/C=C\c1cncc(F)c1	ZINC000493153302	253384562	/nfs/dbraw/zinc/38/45/62/253384562.db2.gz	LFPOISWNWCYEKS-ZFDPJTLLSA-N	1	0	263.316	1.574	50	0		CDAARO
Cc1cc2cc(NC(=O)[C@H]3C[NH2+]CCO3)ccc2[nH]1	ZINC000187319094	390429618	/nfs/dbraw/zinc/42/96/18/390429618.db2.gz	FAMBQZRPJYPJQL-CYBMUJFWSA-N	1	0	259.309	1.403	50	0		CDAARO
COCCNC(=O)NCc1ccc(F)c(C[NH+](C)C)c1	ZINC000096407022	390507709	/nfs/dbraw/zinc/50/77/09/390507709.db2.gz	UTCGSRNXIFEDQW-UHFFFAOYSA-N	1	0	283.347	1.333	50	0		CDAARO
CC(=O)N1CCC([N@H+](CCN(C)C)C[C@H]2CCCO2)CC1	ZINC000065467276	390551483	/nfs/dbraw/zinc/55/14/83/390551483.db2.gz	YNASXABFAISIMP-MRXNPFEDSA-N	1	0	297.443	1.040	50	0		CDAARO
C[C@@H]([NH2+]Cc1nncn1C)[C@H]1COc2ccccc21	ZINC000097112622	390796110	/nfs/dbraw/zinc/79/61/10/390796110.db2.gz	RFXIUKTYHAAVOH-ZYHUDNBSSA-N	1	0	258.325	1.469	50	0		CDAARO
[NH3+]C1(c2ccc(I)cc2)COC1	ZINC000095630844	390911395	/nfs/dbraw/zinc/91/13/95/390911395.db2.gz	AUBCJPALSKDXGY-UHFFFAOYSA-N	1	0	275.089	1.475	50	0		CDAARO
CC(C)COC(=O)N1CCC([NH2+][C@@H]2CCC[C@H]2CO)CC1	ZINC000089157192	391095004	/nfs/dbraw/zinc/09/50/04/391095004.db2.gz	ZTKUNKSAVDGOEC-DZGCQCFKSA-N	1	0	298.427	1.994	50	0		CDAARO
c1c(-c2nc(C3CC3)no2)nnn1C1CC[NH2+]CC1	ZINC000096516237	391104573	/nfs/dbraw/zinc/10/45/73/391104573.db2.gz	HFJDSGDRIOBAHL-UHFFFAOYSA-N	1	0	260.301	1.130	50	0		CDAARO
CC(C)NC(=O)[C@@H]1CCC[C@H]([NH2+][C@H]2CCN(C3CC3)C2)C1	ZINC000241644683	391680786	/nfs/dbraw/zinc/68/07/86/391680786.db2.gz	PSRNQYBYGGQHTJ-ILXRZTDVSA-N	1	0	293.455	1.896	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)CCc3cccs3)C[C@H]12	ZINC000252587584	131136054	/nfs/dbraw/zinc/13/60/54/131136054.db2.gz	ZIGZRERIIHCQSD-KGYLQXTDSA-N	1	0	264.394	1.876	50	0		CDAARO
CN(CCOc1ccccc1F)C(=O)[C@@H]1CCC[NH2+]1	ZINC000037497956	392892946	/nfs/dbraw/zinc/89/29/46/392892946.db2.gz	SMAJLVPYTBPUOS-LBPRGKRZSA-N	1	0	266.316	1.415	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)C2(c3ccccc3F)CC2)C1	ZINC000269161026	132122934	/nfs/dbraw/zinc/12/29/34/132122934.db2.gz	MEOJKNJOAMJWFS-NSHDSACASA-N	1	0	262.328	1.665	50	0		CDAARO
CC(C)N1CC[C@H]([N@H+](C)C[C@@H]2CCCOC2)C1=O	ZINC000095406530	393148252	/nfs/dbraw/zinc/14/82/52/393148252.db2.gz	QZQVVSPQQYPQHH-STQMWFEESA-N	1	0	254.374	1.354	50	0		CDAARO
[NH3+][C@H]1CCC[C@@H]1C(=O)N1CCN(c2ccccc2F)CC1	ZINC000085365302	134505341	/nfs/dbraw/zinc/50/53/41/134505341.db2.gz	DCBSSNIMRUJCSZ-JSGCOSHPSA-N	1	0	291.370	1.602	50	0		CDAARO
CC(C)[C@H]1CN(c2cc(N3CCCCC3)ncn2)C[C@@H]1[NH3+]	ZINC000091830991	135073825	/nfs/dbraw/zinc/07/38/25/135073825.db2.gz	IYEILLIYAXMZEP-KGLIPLIRSA-N	1	0	289.427	1.886	50	0		CDAARO
c1coc([C@H](CNc2ccc3nnnn3n2)[NH+]2CCCC2)c1	ZINC000024989496	397787048	/nfs/dbraw/zinc/78/70/48/397787048.db2.gz	FCKNPALWWKVCNO-NSHDSACASA-N	1	0	299.338	1.361	50	0		CDAARO
C[C@H]1CCC[C@@H]1[NH2+]Cc1cnc(N2CCOCC2)nc1	ZINC000105505297	398042365	/nfs/dbraw/zinc/04/23/65/398042365.db2.gz	DHZRXRMSZDDLFI-JSGCOSHPSA-N	1	0	276.384	1.591	50	0		CDAARO
CN1CCN(C(=O)C[N@@H+]2CCC3(CCCC3)C2)CC1	ZINC000093177441	147037957	/nfs/dbraw/zinc/03/79/57/147037957.db2.gz	FBWTWQMGIDVXAN-UHFFFAOYSA-N	1	0	265.401	1.027	50	0		CDAARO
COc1ccc(OC)c2c(C)cc(N3CC[NH2+]CC3)nc12	ZINC000004717563	286344692	/nfs/dbraw/zinc/34/46/92/286344692.db2.gz	WLGAKDMARSNSKO-UHFFFAOYSA-N	1	0	287.363	1.970	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN(C2CC[NH2+]CC2)CC1	ZINC000002541483	169806292	/nfs/dbraw/zinc/80/62/92/169806292.db2.gz	IMFPSYLOYADSFR-UHFFFAOYSA-N	1	0	269.389	1.291	50	0		CDAARO
COCCC[NH2+]CCOCCOc1ccc(F)cc1	ZINC000002975067	169846240	/nfs/dbraw/zinc/84/62/40/169846240.db2.gz	FIEDZVXCOPHWRO-UHFFFAOYSA-N	1	0	271.332	1.847	50	0		CDAARO
C[C@@H]1CCC[N@H+](C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000005073609	170064523	/nfs/dbraw/zinc/06/45/23/170064523.db2.gz	HCCKNZYVNMCZOW-OLZOCXBDSA-N	1	0	293.363	1.887	50	0		CDAARO
c1ccn2c(c1)nnc2CC[NH2+]Cc1cccnc1	ZINC000020128180	171014334	/nfs/dbraw/zinc/01/43/34/171014334.db2.gz	PPTRYFSUAKHDJY-UHFFFAOYSA-N	1	0	253.309	1.457	50	0		CDAARO
CCC[NH+]1CCN(CC(=O)Nc2ccccc2OC)CC1	ZINC000020595191	171263884	/nfs/dbraw/zinc/26/38/84/171263884.db2.gz	BAFAKARXNWRBFK-UHFFFAOYSA-N	1	0	291.395	1.661	50	0		CDAARO
CCC(=O)c1ccccc1OCCN1CCN(C)CC1	ZINC000020652689	171268735	/nfs/dbraw/zinc/26/87/35/171268735.db2.gz	WTSCCYPWWSYFTA-UHFFFAOYSA-N	1	0	276.380	1.906	50	0		CDAARO
C[C@@H]1C(=O)OC[C@H]1C(=O)N1CCC[C@@H](C[NH+]2CCCC2)C1	ZINC000020727277	171270894	/nfs/dbraw/zinc/27/08/94/171270894.db2.gz	RADYVFJDGDWEBN-MELADBBJSA-N	1	0	294.395	1.130	50	0		CDAARO
CC1CC[NH+](CCCNc2ccc3nnnn3n2)CC1	ZINC000022202747	171372703	/nfs/dbraw/zinc/37/27/03/171372703.db2.gz	KWIATMDAQSQYQD-UHFFFAOYSA-N	1	0	275.360	1.053	50	0		CDAARO
CCOc1ccc2oc(=O)cc(CN3CC[NH2+]CC3)c2c1	ZINC000022917700	171403102	/nfs/dbraw/zinc/40/31/02/171403102.db2.gz	CJHWOLKPDGBELM-UHFFFAOYSA-N	1	0	288.347	1.597	50	0	biogenic,in-vitro	CDAARO
Cc1ccc(OCCN2CC[NH+](CCO)CC2)c(Cl)c1	ZINC000033359704	171786206	/nfs/dbraw/zinc/78/62/06/171786206.db2.gz	JMQLWCYZYPTCKV-UHFFFAOYSA-N	1	0	298.814	1.637	50	0		CDAARO
C[C@H]([NH2+]C1CCN(C(N)=O)CC1)c1ccc2c(c1)OCO2	ZINC000037283481	173091137	/nfs/dbraw/zinc/09/11/37/173091137.db2.gz	VJTYBACORWPULN-JTQLQIEISA-N	1	0	291.351	1.609	50	0		CDAARO
CC(=O)N1CCC([NH2+]CCCc2c[nH]nc2C)CC1	ZINC000047889218	175415385	/nfs/dbraw/zinc/41/53/85/175415385.db2.gz	PFNOLSCRYPCZMN-UHFFFAOYSA-N	1	0	264.373	1.251	50	0		CDAARO
CN(CCNC(=O)C1CC[NH+](C)CC1)c1ccccc1	ZINC000071385363	176147006	/nfs/dbraw/zinc/14/70/06/176147006.db2.gz	XOVKYGMVIHLVMP-UHFFFAOYSA-N	1	0	275.396	1.581	50	0		CDAARO
O=C(NC[C@@]1(O)CCC[NH2+]CC1)Nc1ccccc1	ZINC000072154735	176328438	/nfs/dbraw/zinc/32/84/38/176328438.db2.gz	PEGQZDCHPUIUCM-CQSZACIVSA-N	1	0	263.341	1.313	50	0		CDAARO
CCCc1ccc(C[N@@H+]2CC[C@H](CO)[C@@H](O)C2)o1	ZINC000072157027	176328709	/nfs/dbraw/zinc/32/87/09/176328709.db2.gz	WZUFRTLZYJTPRI-RISCZKNCSA-N	1	0	253.342	1.407	50	0		CDAARO
O=C([O-])[C@H]1CC2(C[N@H+]1Cc1cccc(O)c1)CC[NH2+]CC2	ZINC000072163443	176330372	/nfs/dbraw/zinc/33/03/72/176330372.db2.gz	QPKDCJJNEIIWHJ-CQSZACIVSA-N	1	0	290.363	1.421	50	0		CDAARO
O=c1[nH]c(COc2cccc(F)c2)nc2c1CC[NH2+]C2	ZINC000077469912	177271856	/nfs/dbraw/zinc/27/18/56/177271856.db2.gz	DRCFOKHGZNKMEO-UHFFFAOYSA-N	1	0	275.283	1.134	50	0		CDAARO
C[NH+](C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(C(N)=O)cc1	ZINC000408512921	261068502	/nfs/dbraw/zinc/06/85/02/261068502.db2.gz	ZKQYSISPWLJXGF-ZIAGYGMSSA-N	1	0	289.379	1.388	50	0		CDAARO
CCCCCS(=O)(=O)NC[C@@H]1CCC[N@@H+]1CCOC	ZINC000095465348	276228254	/nfs/dbraw/zinc/22/82/54/276228254.db2.gz	PZADEZOKMJRUSP-ZDUSSCGKSA-N	1	0	292.445	1.207	50	0		CDAARO
CCOCC(=O)N1C[C@@H](c2ccc(C)cc2)[C@H]([NH+](C)C)C1	ZINC000077506036	276312865	/nfs/dbraw/zinc/31/28/65/276312865.db2.gz	ZMECVOMENIHBMW-JKSUJKDBSA-N	1	0	290.407	1.888	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+][C@H]2CCN(C)C2=O)C1(CC)CC	ZINC000245338988	276475367	/nfs/dbraw/zinc/47/53/67/276475367.db2.gz	PUUCDHAYXHDYSL-YNEHKIRRSA-N	1	0	268.401	1.791	50	0		CDAARO
C[N@@H+]1CCCN(c2ccc(-c3nn[nH]n3)cc2Cl)CC1	ZINC000408494357	277052300	/nfs/dbraw/zinc/05/23/00/277052300.db2.gz	FFUYMOZKEWZFJU-UHFFFAOYSA-N	1	0	292.774	1.662	50	0		CDAARO
C[NH+]1CCOCCOc2ccccc2OCCOCC1	ZINC000003895789	277117179	/nfs/dbraw/zinc/11/71/79/277117179.db2.gz	KWGIEMFOSHVZCN-UHFFFAOYSA-N	1	0	281.352	1.423	50	0		CDAARO
COC(=O)C1CCC([NH2+][C@@H]2CCC[C@@H](C(N)=O)C2)CC1	ZINC000192443083	277311955	/nfs/dbraw/zinc/31/19/55/277311955.db2.gz	HCKPNJHIVPOGLZ-POOIEITISA-N	1	0	282.384	1.352	50	0		CDAARO
COc1cc2c(c(OC)c1OC)C[C@@H]([NH3+])CCC2	ZINC000005248865	277844557	/nfs/dbraw/zinc/84/45/57/277844557.db2.gz	ALQILQWUPQNHCC-JTQLQIEISA-N	1	0	251.326	1.919	50	0		CDAARO
COc1cccc(C(=O)N2CCC[C@H]([NH+](C)C)CC2)c1O	ZINC000072148299	278007318	/nfs/dbraw/zinc/00/73/18/278007318.db2.gz	WCPDENDCKQHZHG-LBPRGKRZSA-N	1	0	292.379	1.957	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC2(CC[C@@H](C[NH3+])O2)CC1	ZINC000091303589	278384130	/nfs/dbraw/zinc/38/41/30/278384130.db2.gz	LXUKJCKJBCDGOJ-NSHDSACASA-N	1	0	270.373	1.894	50	0		CDAARO
CC(C)(C)OC(=O)NCC1(C[NH3+])CC(F)(F)C1	ZINC000095743151	278427133	/nfs/dbraw/zinc/42/71/33/278427133.db2.gz	JYPHQTHNCQRXCW-UHFFFAOYSA-N	1	0	250.289	1.885	50	0		CDAARO
Cn1cc([C@@H]2OCC[C@H]2C[NH2+]Cc2ccco2)cn1	ZINC000089755329	279266543	/nfs/dbraw/zinc/26/65/43/279266543.db2.gz	XYQRVOAYRTXDFW-SMDDNHRTSA-N	1	0	261.325	1.881	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@H]1[NH2+][C@H](C)C(=O)NC(C)(C)C	ZINC000107584148	280396323	/nfs/dbraw/zinc/39/63/23/280396323.db2.gz	MELUQDGOIMVLSN-MRVWCRGKSA-N	1	0	297.443	1.526	50	0		CDAARO
Cc1nc([C@@H]2NC(=[NH2+])Nc3nc4ccccc4n32)cs1	ZINC000007030665	281995450	/nfs/dbraw/zinc/99/54/50/281995450.db2.gz	KBOSUZLBTABJHJ-LLVKDONJSA-N	1	0	284.348	1.898	50	0		CDAARO
C[C@H](C(=O)[O-])[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1	ZINC000299750538	289388243	/nfs/dbraw/zinc/38/82/43/289388243.db2.gz	NTCABUITIDBDLJ-ZIAGYGMSSA-N	1	0	268.401	1.903	50	0		CDAARO
CN1C[C@H]([NH2+][C@H]2CC(C)(C)OC2(C)C)CCC1=O	ZINC000094424539	290310137	/nfs/dbraw/zinc/31/01/37/290310137.db2.gz	HEMMYKQKTAOQIR-MNOVXSKESA-N	1	0	254.374	1.543	50	0		CDAARO
NC(N)S[C@H](C[NH+]1CCCCC1)C(F)(F)F	ZINC000019321129	303353614	/nfs/dbraw/zinc/35/36/14/303353614.db2.gz	ZNFKQGOUOBQICP-SSDOTTSWSA-N	1	0	257.325	1.337	50	0		CDAARO
c1sc(-c2cnccn2)nc1CN[C@H]1CCOC1	ZINC000534585000	328314884	/nfs/dbraw/zinc/31/48/84/328314884.db2.gz	NHHBHXVYQGACBU-VIFPVBQESA-N	1	0	262.338	1.479	50	0		CDAARO
C[C@@H](NC(=O)CN(C)C1CC[NH2+]CC1)C1=CCCCC1	ZINC000534632082	328331657	/nfs/dbraw/zinc/33/16/57/328331657.db2.gz	VWTQITNYZBEEHH-CYBMUJFWSA-N	1	0	279.428	1.675	50	0		CDAARO
CC(C)[N@H+](C)CCNC(=O)N[C@@H](C)[C@H](O)c1ccccc1	ZINC000534658761	328341258	/nfs/dbraw/zinc/34/12/58/328341258.db2.gz	UAYUMKPLECDVQW-ZFWWWQNUSA-N	1	0	293.411	1.748	50	0		CDAARO
CN(C(=O)CN1C[C@H]2CC[C@@H](C1)[C@@H]2[NH3+])C1CCCCC1	ZINC000534658869	328341570	/nfs/dbraw/zinc/34/15/70/328341570.db2.gz	ACFYXGFGHNESCM-YWVIFJGQSA-N	1	0	279.428	1.447	50	0		CDAARO
CCc1nccn1CCCNC(=O)[C@@H]1CCC[NH2+]CC1	ZINC000534670111	328347082	/nfs/dbraw/zinc/34/70/82/328347082.db2.gz	ARJKCDNTKKUXRM-CYBMUJFWSA-N	1	0	278.400	1.342	50	0		CDAARO
CC[N@@H+]1C[C@H](NC(=O)c2ccccc2SC)[C@@H](OC)C1	ZINC000534672401	328347973	/nfs/dbraw/zinc/34/79/73/328347973.db2.gz	NCCAPGCDFJVEHQ-STQMWFEESA-N	1	0	294.420	1.857	50	0		CDAARO
Cc1cc(NC(=O)[C@H]([NH2+]C2CCOCC2)C(C)C)n(C)n1	ZINC000097238098	323207800	/nfs/dbraw/zinc/20/78/00/323207800.db2.gz	NRHXKIIVKXDJDG-CQSZACIVSA-N	1	0	294.399	1.460	50	0		CDAARO
COCCc1nc([C@H]2C[NH2+]CCO2)n(C2CCCCC2)n1	ZINC000096150049	327203922	/nfs/dbraw/zinc/20/39/22/327203922.db2.gz	KTBBOEWHDXLWEN-CYBMUJFWSA-N	1	0	294.399	1.633	50	0		CDAARO
CCc1[nH+]c(N)nc(N[C@H](C)c2ncnn2C)c1C	ZINC001772708337	1159442252	/nfs/dbraw/zinc/44/22/52/1159442252.db2.gz	GAUVOKUZZKCRBY-MRVPVSSYSA-N	1	0	261.333	1.231	50	0		CDAARO
CC1([C@@H]2CCC[N@H+](CCn3ccnc3)C2)OCCO1	ZINC000097086634	482455801	/nfs/dbraw/zinc/45/58/01/482455801.db2.gz	LNWJLJDCPXHLCS-CYBMUJFWSA-N	1	0	265.357	1.358	50	0		CDAARO
O=C1CC[C@H]([N@@H+]2CCc3nocc3C2)CCN1CC1CC1	ZINC000670440216	482985699	/nfs/dbraw/zinc/98/56/99/482985699.db2.gz	KHFPKXGMLZSGPL-AWEZNQCLSA-N	1	0	289.379	1.824	50	0		CDAARO
O[C@H]1CN(CCC(F)(F)F)C[C@@H]1[NH+]1CCCCC1	ZINC000670452712	483023307	/nfs/dbraw/zinc/02/33/07/483023307.db2.gz	IAGHGHOYKDMWJG-QWRGUYRKSA-N	1	0	266.307	1.470	50	0		CDAARO
COc1nc(NCCC[N@@H+]2CCC[C@@H](CO)C2)ncc1F	ZINC000670445934	482995058	/nfs/dbraw/zinc/99/50/58/482995058.db2.gz	BRBYUAXEZLHCDW-LLVKDONJSA-N	1	0	298.362	1.131	50	0		CDAARO
C[NH+]1CCC(C2CCN(C(=O)C[C@H]3CCOC3)CC2)CC1	ZINC000670460413	483043929	/nfs/dbraw/zinc/04/39/29/483043929.db2.gz	GBDYCEYLMLZJOL-CQSZACIVSA-N	1	0	294.439	1.993	50	0		CDAARO
C[C@@H](C[NH+]1CCCC1)C(=O)NCc1cnc2cnccn12	ZINC000670467418	483058879	/nfs/dbraw/zinc/05/88/79/483058879.db2.gz	SLEPAHBVCRWWLN-LBPRGKRZSA-N	1	0	287.367	1.077	50	0		CDAARO
CN(C)C1=NC2(CC[NH+](CC3=CCCCC3)CC2)C(=O)N1	ZINC000670468812	483062086	/nfs/dbraw/zinc/06/20/86/483062086.db2.gz	XXLQTVLCAWHISV-UHFFFAOYSA-N	1	0	290.411	1.369	50	0		CDAARO
CCCCc1ncc(C[N@H+](C)C[C@@H]2CC(=O)N(C)C2)[nH]1	ZINC000670469388	483063189	/nfs/dbraw/zinc/06/31/89/483063189.db2.gz	NMRNSDLIFYJQPP-LBPRGKRZSA-N	1	0	278.400	1.662	50	0		CDAARO
CCn1c(C)nnc1CN(C)[C@H]1CC[N@H+](CCCOC)C1	ZINC000083836855	483202735	/nfs/dbraw/zinc/20/27/35/483202735.db2.gz	GUHVFPDBXURKOR-AWEZNQCLSA-N	1	0	295.431	1.149	50	0		CDAARO
Cc1cccc(C)c1OC[C@H](O)C[NH2+]C(C)(C)CO	ZINC000026781266	483227704	/nfs/dbraw/zinc/22/77/04/483227704.db2.gz	FDEURGVXBASNCR-CYBMUJFWSA-N	1	0	267.369	1.404	50	0		CDAARO
CC(C)(CCO)C[NH2+][C@@H]1CCN(CC(F)(F)F)C1	ZINC000084325906	483272311	/nfs/dbraw/zinc/27/23/11/483272311.db2.gz	YXTSMLQHNUTDOU-SNVBAGLBSA-N	1	0	268.323	1.621	50	0		CDAARO
CC(C)NC(=O)C[NH2+][C@@H](C)CC(=O)Nc1ccccc1	ZINC000084620497	483299241	/nfs/dbraw/zinc/29/92/41/483299241.db2.gz	OZKJZYSJWVDITA-LBPRGKRZSA-N	1	0	277.368	1.518	50	0		CDAARO
C[C@H](CNC(=O)[C@H]1C[C@@H]1c1ccccc1F)[NH+](C)C	ZINC000084638297	483304686	/nfs/dbraw/zinc/30/46/86/483304686.db2.gz	AQMPYSMONIEUKG-RTXFEEFZSA-N	1	0	264.344	1.996	50	0		CDAARO
CCC(=O)N1CC[C@H]([NH2+]Cc2c[nH]nc2C)[C@H](CC)C1	ZINC000084736280	483320568	/nfs/dbraw/zinc/32/05/68/483320568.db2.gz	ZGNYSJSCJZNGMM-OCCSQVGLSA-N	1	0	278.400	1.845	50	0		CDAARO
C[C@H](Cn1cccn1)[NH2+]C[C@H]1CC(=O)Nc2ccccc21	ZINC000097162382	545522404	/nfs/dbraw/zinc/52/24/04/545522404.db2.gz	HPZXYKGDYQYPPC-CHWSQXEVSA-N	1	0	284.363	1.987	50	0		CDAARO
O=C(NC[C@@H]1OCCc2sccc21)[C@H]1CCC[NH2+]1	ZINC000072501374	538343171	/nfs/dbraw/zinc/34/31/71/538343171.db2.gz	JDLWHCNSYXUGPE-MNOVXSKESA-N	1	0	266.366	1.230	50	0		CDAARO
NC(=O)c1ccc(N2CCC([C@H]3CC[NH2+]C3)CC2)nc1	ZINC000071388824	538426956	/nfs/dbraw/zinc/42/69/56/538426956.db2.gz	ROZJZUAKTMXTTM-LBPRGKRZSA-N	1	0	274.368	1.006	50	0		CDAARO
CO[C@H](C)C(=O)N[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C	ZINC000097142617	538437609	/nfs/dbraw/zinc/43/76/09/538437609.db2.gz	KQORFPAOOVBLEK-NFAWXSAZSA-N	1	0	276.380	1.658	50	0		CDAARO
CC(C)(O)CC[NH+]1CCC(CNC(=O)c2ccoc2)CC1	ZINC000952963213	614184490	/nfs/dbraw/zinc/18/44/90/614184490.db2.gz	IYSWYLZEZJQYOE-UHFFFAOYSA-N	1	0	294.395	1.882	50	0		CDAARO
CCCN(CCc1ccccc1)C(=O)[C@H]1C=CC[NH2+]1	ZINC000952979293	614583605	/nfs/dbraw/zinc/58/36/05/614583605.db2.gz	IEOLHNWTGCRZCM-OAHLLOKOSA-N	1	0	258.365	1.996	50	0		CDAARO
CC[C@@H](O)C[NH+]1CCC(CNC(=O)C2CCC2)CC1	ZINC000952968303	615540460	/nfs/dbraw/zinc/54/04/60/615540460.db2.gz	FTVKGIVGNNZWAF-CQSZACIVSA-N	1	0	268.401	1.386	50	0		CDAARO
CC1([NH3+])CN(C(=O)/C=C/c2c(F)cccc2F)C1	ZINC000888096366	617758548	/nfs/dbraw/zinc/75/85/48/617758548.db2.gz	DGIHDAWTMZJTGM-AATRIKPKSA-N	1	0	252.264	1.538	50	0		CDAARO
C[NH+]1CCN(C(C)(C)CNC(=O)[C@@H]2CC2(C)C)CC1	ZINC000952981405	616232851	/nfs/dbraw/zinc/23/28/51/616232851.db2.gz	IBJJLUWQJPJVJI-LBPRGKRZSA-N	1	0	267.417	1.175	50	0		CDAARO
CC(C)([NH3+])c1nnc(N2CCc3ccccc3C2)o1	ZINC001772703212	1159438029	/nfs/dbraw/zinc/43/80/29/1159438029.db2.gz	YVUANZNGEOCRGS-UHFFFAOYSA-N	1	0	258.325	1.826	50	0		CDAARO
Cc1n[nH]c(C)c1CNc1nnc(C(C)(C)[NH3+])o1	ZINC001772704737	1159439308	/nfs/dbraw/zinc/43/93/08/1159439308.db2.gz	HBOUFLMNKAPSBX-UHFFFAOYSA-N	1	0	250.306	1.215	50	0		CDAARO
CCN(CC)C(=O)C[N@@H+]1CCC[C@@]2(CCC[C@H]2O)C1	ZINC001704338204	1177693561	/nfs/dbraw/zinc/69/35/61/1177693561.db2.gz	OBTSSQONTLEMIS-HIFRSBDPSA-N	1	0	268.401	1.482	50	0		CDAARO
CCCO[C@H]1CCC[N@H+](CCn2cc[nH]c2=O)C1	ZINC001704352063	1177699195	/nfs/dbraw/zinc/69/91/95/1177699195.db2.gz	WQUUSKRYUJKZSY-LBPRGKRZSA-N	1	0	253.346	1.480	50	0		CDAARO
C[N@H+](CCCn1cnnn1)Cc1ccccc1-n1cccn1	ZINC001704353746	1177699770	/nfs/dbraw/zinc/69/97/70/1177699770.db2.gz	RKAAVKIJJQZQHJ-UHFFFAOYSA-N	1	0	297.366	1.381	50	0		CDAARO
Cc1cccc(CC[N@H+]2C[C@@H](Cc3ccccn3)[C@H](O)C2)n1	ZINC001704359641	1177700846	/nfs/dbraw/zinc/70/08/46/1177700846.db2.gz	XDQFTZKTTSWDIT-CRAIPNDOSA-N	1	0	297.402	1.863	50	0		CDAARO
Cc1ncc2c(c1CNC(=O)Cc1cccnc1)CC[NH2+]C2	ZINC000072463302	818739698	/nfs/dbraw/zinc/73/96/98/818739698.db2.gz	VBFWWAQGUHCREY-UHFFFAOYSA-N	1	0	296.374	1.290	50	0		CDAARO
C[C@@H]1CCC[C@@H]([NH+]2CCN(CCOCCO)CC2)C1	ZINC000019635956	819356667	/nfs/dbraw/zinc/35/66/67/819356667.db2.gz	HZSLFDRTPGGPNO-HUUCEWRRSA-N	1	0	270.417	1.192	50	0		CDAARO
O[C@H]1CCC[N@H+](CCCNCc2ccc(Cl)o2)C1	ZINC000952992107	819881263	/nfs/dbraw/zinc/88/12/63/819881263.db2.gz	WZDKZDZCBZIOIT-NSHDSACASA-N	1	0	272.776	1.869	50	0		CDAARO
CC[NH+](CC)[C@H]1CCN(CCn2nccc2C)C1	ZINC000244882546	822119969	/nfs/dbraw/zinc/11/99/69/822119969.db2.gz	XTWISRVKOZLYRU-AWEZNQCLSA-N	1	0	250.390	1.608	50	0		CDAARO
O=C(C[NH2+]C1CSCCSC1)N1CCCC1	ZINC001506406991	975151744	/nfs/dbraw/zinc/15/17/44/975151744.db2.gz	SXILLGMXRHGDDR-UHFFFAOYSA-N	1	0	260.428	1.047	50	0		CDAARO
Cc1cc(-n2nc(C(C)C)nc2C2(C(N)=O)CC2)cc[nH+]1	ZINC000065425636	822489944	/nfs/dbraw/zinc/48/99/44/822489944.db2.gz	VESANEXYLMGIBY-UHFFFAOYSA-N	1	0	285.351	1.611	50	0		CDAARO
C[C@H](NCc1ccc(CC[NH3+])cc1)c1nncn1C	ZINC000952862208	910417588	/nfs/dbraw/zinc/41/75/88/910417588.db2.gz	NHEIHQLDDLUHSQ-NSHDSACASA-N	1	0	259.357	1.167	50	0		CDAARO
C[C@@H]1CN(C(=O)c2ccc(OCCO)cc2)[C@@H](C)C[N@@H+]1C	ZINC000952884886	910457063	/nfs/dbraw/zinc/45/70/63/910457063.db2.gz	OTDLDEAFNLYKHH-OLZOCXBDSA-N	1	0	292.379	1.222	50	0		CDAARO
CCC1CCC(CNC(=O)[C@]2([NH3+])CC[C@H](O)C2)CC1	ZINC000952884275	910458667	/nfs/dbraw/zinc/45/86/67/910458667.db2.gz	XTXQQAOIFVBRIA-DVTFPSANSA-N	1	0	268.401	1.561	50	0		CDAARO
CCOc1ncccc1CNc1ncnc2c1CC[NH2+]CC2	ZINC000072419939	936655097	/nfs/dbraw/zinc/65/50/97/936655097.db2.gz	GGUOISMILYYACQ-UHFFFAOYSA-N	1	0	299.378	1.571	50	0		CDAARO
Cc1nonc1CN(C)C[C@@H]1CC[N@@H+](C(C)C)C1	ZINC000823719830	925722569	/nfs/dbraw/zinc/72/25/69/925722569.db2.gz	KWSPDGIPKOOORS-LBPRGKRZSA-N	1	0	252.362	1.540	50	0		CDAARO
COCC1(CNC(=O)[C@H](C)[NH+]2CCCCC2)CCC1	ZINC000824347217	925817390	/nfs/dbraw/zinc/81/73/90/925817390.db2.gz	SGLOSJNWDKVJNP-ZDUSSCGKSA-N	1	0	268.401	1.794	50	0		CDAARO
CS(=O)(=O)NC1(C[NH+]2CCCCC2)CCCCC1	ZINC000824864475	925838274	/nfs/dbraw/zinc/83/82/74/925838274.db2.gz	RFFDASMQEJRIEV-UHFFFAOYSA-N	1	0	274.430	1.724	50	0		CDAARO
Cc1ncc(C[NH2+]C[C@@H]2COCO2)n1-c1ccccc1	ZINC000585116963	930969807	/nfs/dbraw/zinc/96/98/07/930969807.db2.gz	NLSVLBBMJWQHLY-OAHLLOKOSA-N	1	0	273.336	1.643	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@@H+](C3CCCCC3)C[C@@H]2O)[nH]n1	ZINC001529158344	968996977	/nfs/dbraw/zinc/99/69/77/968996977.db2.gz	AGFDFEOUHOUPIG-DOMZBBRYSA-N	1	0	263.385	1.886	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3cnn(C)c3C)C[C@H]2O)on1	ZINC001529159707	968997994	/nfs/dbraw/zinc/99/79/94/968997994.db2.gz	XXQCPIMIRZSQDZ-IUODEOHRSA-N	1	0	290.367	1.060	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CN(C)c2ccc(C(C)=O)cn2)C1	ZINC001529167928	968999302	/nfs/dbraw/zinc/99/93/02/968999302.db2.gz	SUXNTKAQOUOIOX-CQSZACIVSA-N	1	0	291.395	1.689	50	0		CDAARO
[NH3+]CC(=O)N1C[C@@H](c2ccccc2)O[C@@H](C2CC2)C1	ZINC001529168111	969000798	/nfs/dbraw/zinc/00/07/98/969000798.db2.gz	XQQMKTCKJDSVTB-UONOGXRCSA-N	1	0	260.337	1.324	50	0		CDAARO
C[NH+](C)Cc1ccc([C@@H]2CCCN2C(=O)c2cn[nH]n2)cc1	ZINC001506399006	975149233	/nfs/dbraw/zinc/14/92/33/975149233.db2.gz	VQEXQXFKNVHSJV-HNNXBMFYSA-N	1	0	299.378	1.844	50	0		CDAARO
Cc1nn(CCC[NH2+][C@H](C)CN(C)CCO)c(C)c1C	ZINC001506406885	975151795	/nfs/dbraw/zinc/15/17/95/975151795.db2.gz	HDXQRYFZBWBXCR-GFCCVEGCSA-N	1	0	282.432	1.101	50	0		CDAARO
C[C@@H](Cc1ccsc1)[N@H+](C)CCn1cncn1	ZINC000096448431	230375101	/nfs/dbraw/zinc/37/51/01/230375101.db2.gz	PGXWVLQWMSXZAF-NSHDSACASA-N	1	0	250.371	1.903	50	0		CDAARO
Cc1nc(=O)[nH]c(C)c1CCC(=O)N1CCCC[C@@H]([NH3+])C1	ZINC000082106066	177920542	/nfs/dbraw/zinc/92/05/42/177920542.db2.gz	SZDIIQFUDGKSGQ-GFCCVEGCSA-N	1	0	292.383	1.071	50	0		CDAARO
COCCN1CCC[C@@H]1C[NH2+]C1Cc2ccccc2C1	ZINC000096477033	230379670	/nfs/dbraw/zinc/37/96/70/230379670.db2.gz	PIIXXKWEZBQVFH-QGZVFWFLSA-N	1	0	274.408	1.854	50	0		CDAARO
Cc1cccc(CNC(=O)C[C@@H](C)[NH+]2CCOCC2)n1	ZINC000219827015	230396852	/nfs/dbraw/zinc/39/68/52/230396852.db2.gz	UEMKQPFEMQTVBV-CYBMUJFWSA-N	1	0	277.368	1.117	50	0		CDAARO
CC(=O)N1CCC[C@@H]1[C@H]1CCCN1[C@H](C)c1nnc(C)o1	ZINC000106789058	349491491	/nfs/dbraw/zinc/49/14/91/349491491.db2.gz	RNZMYDCLKLYZIU-LERXQTSPSA-N	1	0	292.383	1.914	50	0		CDAARO
O=C(C1CCCC1)N1CC[N@H+](CC2CC2)[C@H](CCO)C1	ZINC000584904049	341994092	/nfs/dbraw/zinc/99/40/92/341994092.db2.gz	RFWDFTWCQZPAQB-OAHLLOKOSA-N	1	0	280.412	1.482	50	0		CDAARO
C[C@H](NC(=O)CCC[NH+]1CCCCCC1)c1nncn1C	ZINC000584903983	341994136	/nfs/dbraw/zinc/99/41/36/341994136.db2.gz	SKCMVTBGLWBFNX-ZDUSSCGKSA-N	1	0	293.415	1.649	50	0		CDAARO
COC(=O)CCCC(=O)N1CCC([N@@H+]2CCC[C@H]2C)CC1	ZINC000095943088	185037297	/nfs/dbraw/zinc/03/72/97/185037297.db2.gz	XGSCEHJLHCOPOT-CYBMUJFWSA-N	1	0	296.411	1.805	50	0		CDAARO
Cc1ncsc1CC[N@H+](C)CCn1cc[nH]c1=O	ZINC000240499931	361748301	/nfs/dbraw/zinc/74/83/01/361748301.db2.gz	NPBBGKBHHUAUSD-UHFFFAOYSA-N	1	0	266.370	1.116	50	0		CDAARO
CSC[C@@H]1CCCN(C(=O)CC2CC[NH2+]CC2)C1	ZINC000394073968	342090023	/nfs/dbraw/zinc/09/00/23/342090023.db2.gz	WXAWGQPVZMTAPA-CYBMUJFWSA-N	1	0	270.442	1.978	50	0		CDAARO
Cc1nc(C(=O)NCC[N@@H+]2CCCC[C@@H]2CO)cs1	ZINC000096140508	185105365	/nfs/dbraw/zinc/10/53/65/185105365.db2.gz	GMODJLUSAVOYPQ-LLVKDONJSA-N	1	0	283.397	1.028	50	0		CDAARO
[NH3+][C@H](C(=O)N1CCO[C@H](c2ccco2)C1)c1ccccc1	ZINC000195554330	342625939	/nfs/dbraw/zinc/62/59/39/342625939.db2.gz	VXYWCOPAKANRIG-GJZGRUSLSA-N	1	0	286.331	1.880	50	0		CDAARO
[NH3+][C@@H](CC(=O)N1CC[C@@]2(CCOC2)C1)c1ccccc1	ZINC000195544242	342626722	/nfs/dbraw/zinc/62/67/22/342626722.db2.gz	RVJQCDJBVJEHSH-GOEBONIOSA-N	1	0	274.364	1.716	50	0		CDAARO
C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)C[C@@H]1CSCCS1	ZINC000095440462	539088049	/nfs/dbraw/zinc/08/80/49/539088049.db2.gz	RFGFFKOVVZHFNM-IJLUTSLNSA-N	1	0	288.482	1.776	50	0		CDAARO
Cc1nc(CN[C@@H](C)C2(N3CCOCC3)CCCC2)no1	ZINC000125959067	342146596	/nfs/dbraw/zinc/14/65/96/342146596.db2.gz	CYYTUXAMOQDMOJ-LBPRGKRZSA-N	1	0	294.399	1.501	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1C(=O)NCCC[C@H]1CCCC[C@H]1O	ZINC000252515172	361855980	/nfs/dbraw/zinc/85/59/80/361855980.db2.gz	HSRYAQWTUWNIRM-MGPQQGTHSA-N	1	0	268.401	1.528	50	0		CDAARO
Cn1ccc(NC(=O)C[N@H+](C)C2Cc3ccccc3C2)n1	ZINC000244678935	361856734	/nfs/dbraw/zinc/85/67/34/361856734.db2.gz	IMRXEBLTLPTYPT-UHFFFAOYSA-N	1	0	284.363	1.458	50	0		CDAARO
Cc1nnc([C@H]2CCC[N@H+](CCC(=O)NC(C)(C)C)C2)[nH]1	ZINC000244724118	361859983	/nfs/dbraw/zinc/85/99/83/361859983.db2.gz	MNWZZBBSNCABNV-LBPRGKRZSA-N	1	0	293.415	1.597	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1C1CN(CCCn2cccn2)C1	ZINC000244778698	361863010	/nfs/dbraw/zinc/86/30/10/361863010.db2.gz	PUYQKWKPJDVYMA-CQSZACIVSA-N	1	0	262.401	1.832	50	0		CDAARO
CC1(C[NH2+][C@@H](CO)Cc2ccccc2)CCOCC1	ZINC000097098962	342189832	/nfs/dbraw/zinc/18/98/32/342189832.db2.gz	NNDDDYVADCIHJI-OAHLLOKOSA-N	1	0	263.381	1.996	50	0		CDAARO
CC(C)NC(=O)CCOC(=O)c1ccn2c[nH+]cc2c1	ZINC000097231082	342205370	/nfs/dbraw/zinc/20/53/70/342205370.db2.gz	ROIWOQIXEBVPCA-UHFFFAOYSA-N	1	0	275.308	1.406	50	0		CDAARO
CCCCC[N@@H+]1CCC[C@H]1CNC(=O)c1cnn(C)c1	ZINC000585136763	342216007	/nfs/dbraw/zinc/21/60/07/342216007.db2.gz	RMPHMYNQFBVTEV-AWEZNQCLSA-N	1	0	278.400	1.805	50	0		CDAARO
C[N@@H+]1CCN(CCCc2c(F)cccc2F)C[C@H]1CO	ZINC000585136505	342216041	/nfs/dbraw/zinc/21/60/41/342216041.db2.gz	IMBYXTNIHAFCET-LBPRGKRZSA-N	1	0	284.350	1.506	50	0		CDAARO
C[N@@H+]1CC[C@@H]2CN(CC(=O)NCC3CCCCC3)C[C@@H]2C1	ZINC000585136939	342216187	/nfs/dbraw/zinc/21/61/87/342216187.db2.gz	ZGCAAUUXRIMKNH-CVEARBPZSA-N	1	0	293.455	1.566	50	0		CDAARO
CC(C)(O)c1ccc(C[NH2+]CC2OCCCO2)cc1	ZINC000585137009	342216225	/nfs/dbraw/zinc/21/62/25/342216225.db2.gz	CRSUAQYYLMGWQD-UHFFFAOYSA-N	1	0	265.353	1.767	50	0		CDAARO
C[N@H+](CC(=O)NCc1nccs1)CC(C)(C)C	ZINC000585141203	342219554	/nfs/dbraw/zinc/21/95/54/342219554.db2.gz	QZXGMEXPSCLKEV-UHFFFAOYSA-N	1	0	255.387	1.737	50	0		CDAARO
COc1ccccc1C[NH2+][C@@H](C)Cn1nc(C)oc1=O	ZINC000585141216	342219099	/nfs/dbraw/zinc/21/90/99/342219099.db2.gz	RNVDXPMGCGXXDU-JTQLQIEISA-N	1	0	277.324	1.332	50	0		CDAARO
COc1cccc(C[NH2+][C@H](C)Cn2cncn2)c1F	ZINC000585079875	539103069	/nfs/dbraw/zinc/10/30/69/539103069.db2.gz	SGLYNQLOJUHTLQ-SNVBAGLBSA-N	1	0	264.304	1.604	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)N[C@H]1COc2ccccc2C1	ZINC000021944777	539126412	/nfs/dbraw/zinc/12/64/12/539126412.db2.gz	JNPAMFJHEJPUKK-CQSZACIVSA-N	1	0	289.379	1.385	50	0		CDAARO
Cc1ccc(CN2CC[NH2+]C[C@H]2[C@@H](C)O)cc1F	ZINC000072233480	342273202	/nfs/dbraw/zinc/27/32/02/342273202.db2.gz	ATGXCDYQDUKQRG-RISCZKNCSA-N	1	0	252.333	1.289	50	0		CDAARO
C[C@H]1CN(C(=O)C[N@H+](C)[C@@H]2CCc3ccccc32)CCO1	ZINC000040489810	539147564	/nfs/dbraw/zinc/14/75/64/539147564.db2.gz	RSUSNPMZYCPCIY-XJKSGUPXSA-N	1	0	288.391	1.853	50	0		CDAARO
Cc1nccc(-c2ccccc2)c1C(=O)NCC[NH3+]	ZINC000097099161	282181977	/nfs/dbraw/zinc/18/19/77/282181977.db2.gz	OPMXWBRPUJBQPK-UHFFFAOYSA-N	1	0	255.321	1.746	50	0		CDAARO
CC[C@H]([NH2+]C[C@H]1CCOC1)c1cccc(S(N)(=O)=O)c1	ZINC000096501606	529621983	/nfs/dbraw/zinc/62/19/83/529621983.db2.gz	LWKUHQOBWQGQBP-RISCZKNCSA-N	1	0	298.408	1.411	50	0		CDAARO
Cc1nccn1[C@H](C)C[NH+]1CCN(c2ncccn2)CC1	ZINC000019300822	282217485	/nfs/dbraw/zinc/21/74/85/282217485.db2.gz	MGFPDTDMOQJPHB-CYBMUJFWSA-N	1	0	286.383	1.365	50	0		CDAARO
CCCCNC(=O)[C@@H](C)N1CC[N@H+](C)[C@@H](C(C)(C)C)C1	ZINC000585116451	362044953	/nfs/dbraw/zinc/04/49/53/362044953.db2.gz	WMWCWEWXKATMGF-ZIAGYGMSSA-N	1	0	283.460	1.953	50	0		CDAARO
Cc1noc([C@H]2CN(Cc3ccncc3F)CCN2C)n1	ZINC000585116753	362045266	/nfs/dbraw/zinc/04/52/66/362045266.db2.gz	HIJLCSLWFHDIEX-CYBMUJFWSA-N	1	0	291.330	1.401	50	0		CDAARO
c1cnnc(N2CC[NH+](C[C@@H]3CC=CCC3)CC2)c1	ZINC000127929872	136386685	/nfs/dbraw/zinc/38/66/85/136386685.db2.gz	LARLXSXRBCLXIW-CQSZACIVSA-N	1	0	258.369	1.955	50	0		CDAARO
CC(C)[N@H+](C)CCNC(=O)c1ccc2c(c1)OCCO2	ZINC000084575498	362266004	/nfs/dbraw/zinc/26/60/04/362266004.db2.gz	YFSAMSYCYPWVJU-UHFFFAOYSA-N	1	0	278.352	1.528	50	0		CDAARO
Cc1[nH]ccc1C(=O)NCCCC[NH+]1C[C@@H](C)O[C@H](C)C1	ZINC000084028692	362259601	/nfs/dbraw/zinc/25/96/01/362259601.db2.gz	BVSYZHMKGKYRGH-CHWSQXEVSA-N	1	0	293.411	1.942	50	0		CDAARO
CN(C)S(=O)(=O)CCC[N@@H+]1CCC[C@H]1c1ccccn1	ZINC000252482732	362385442	/nfs/dbraw/zinc/38/54/42/362385442.db2.gz	DMOCCPXKGGHSLM-AWEZNQCLSA-N	1	0	297.424	1.500	50	0		CDAARO
Cn1cc(C[N@H+](CCn2cc(Cl)cn2)C2CC2)cn1	ZINC000252507742	362390488	/nfs/dbraw/zinc/39/04/88/362390488.db2.gz	WTJKLDATPNZYFX-UHFFFAOYSA-N	1	0	279.775	1.935	50	0		CDAARO
CC[N@H+](CCn1cc[nH]c1=O)C[C@@H]1CCCCO1	ZINC000252505781	362390505	/nfs/dbraw/zinc/39/05/05/362390505.db2.gz	VTRSUKGIKFJZCT-LBPRGKRZSA-N	1	0	253.346	1.067	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)C1	ZINC000191353841	362421072	/nfs/dbraw/zinc/42/10/72/362421072.db2.gz	BSVFJLWAJKHTJY-GFCCVEGCSA-N	1	0	288.326	1.779	50	0		CDAARO
Cc1c[nH]c(CN2CC[N@@H+]3CCC[C@H]3C2)c(C)c1=O	ZINC000253536650	362434895	/nfs/dbraw/zinc/43/48/95/362434895.db2.gz	ZUCIMPZMJRJPNV-ZDUSSCGKSA-N	1	0	261.369	1.684	50	0		CDAARO
CC[NH+](CC)CCn1nc(C(F)(F)F)ccc1=O	ZINC000097236393	185570767	/nfs/dbraw/zinc/57/07/67/185570767.db2.gz	DKBLYXVCLUAHDI-UHFFFAOYSA-N	1	0	263.263	1.604	50	0		CDAARO
COCc1cccc(C(=O)N2[C@@H]3CC[C@H]2C[NH2+]CC3)c1	ZINC000097334203	185586383	/nfs/dbraw/zinc/58/63/83/185586383.db2.gz	DNFHFLJSXOOVCK-CABCVRRESA-N	1	0	274.364	1.800	50	0		CDAARO
Cc1ccc(CN2CCN([C@@H]3CC[NH2+]C3)C2=O)cc1	ZINC000085347885	179029166	/nfs/dbraw/zinc/02/91/66/179029166.db2.gz	QUHOIOJLDRSVSC-CQSZACIVSA-N	1	0	259.353	1.595	50	0		CDAARO
Cn1cc([C@H]2OCC[C@@H]2C[NH2+]C2CCSCC2)cn1	ZINC000089755281	347612536	/nfs/dbraw/zinc/61/25/36/347612536.db2.gz	CDPJRLBBJYIPRA-RISCZKNCSA-N	1	0	281.425	1.983	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@@H]1CNC(=O)c1cncn1C	ZINC000584886187	349343740	/nfs/dbraw/zinc/34/37/40/349343740.db2.gz	KJDVOXUDLWZHET-LLVKDONJSA-N	1	0	250.346	1.023	50	0		CDAARO
O=C(C[NH+]1CCCCCCC1)N1CC[C@H](CO)C1	ZINC000584896723	349358310	/nfs/dbraw/zinc/35/83/10/349358310.db2.gz	ZAIZJCHOUZACQH-ZDUSSCGKSA-N	1	0	254.374	1.093	50	0		CDAARO
C[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1[nH]nc2ccccc21	ZINC000584889468	349347940	/nfs/dbraw/zinc/34/79/40/349347940.db2.gz	KBCORJPAOYMENC-OLZOCXBDSA-N	1	0	298.390	1.801	50	0		CDAARO
C[N@@H+]1CC[C@H](Cn2cnc3cccc(F)c3c2=O)C1	ZINC000584889179	349348102	/nfs/dbraw/zinc/34/81/02/349348102.db2.gz	FVCAVHJQTDTRAH-JTQLQIEISA-N	1	0	261.300	1.487	50	0		CDAARO
O=c1ccc(-c2ccccc2)nn1CC[NH2+][C@@H]1CCOC1	ZINC000584890974	349349461	/nfs/dbraw/zinc/34/94/61/349349461.db2.gz	YYBGYVPRBVTNTF-CQSZACIVSA-N	1	0	285.347	1.289	50	0		CDAARO
Cc1ccc(O)cc1C(=O)NCC[N@@H+]1CCC[C@H](CO)C1	ZINC000584894300	349354191	/nfs/dbraw/zinc/35/41/91/349354191.db2.gz	KDWKBROPCVXBQJ-ZDUSSCGKSA-N	1	0	292.379	1.135	50	0		CDAARO
C[C@H]([NH2+]C1CSCCSC1)c1cnn(C)c1	ZINC000584895120	349354944	/nfs/dbraw/zinc/35/49/44/349354944.db2.gz	QAQYIBCFTWMHDL-VIFPVBQESA-N	1	0	257.428	1.919	50	0		CDAARO
CN(CC[N@H+](C)C1CCCC1)C(=O)c1nccn1C	ZINC000584898937	349360892	/nfs/dbraw/zinc/36/08/92/349360892.db2.gz	YFXCXPIGQHMISR-UHFFFAOYSA-N	1	0	264.373	1.367	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(C(=O)[C@@H]2Cc3ccccc3N2)C1	ZINC000091392902	180145584	/nfs/dbraw/zinc/14/55/84/180145584.db2.gz	HQTNOAYCBIOICA-HIFRSBDPSA-N	1	0	273.380	1.576	50	0		CDAARO
COCC[C@]1(CO)CCC[N@H+](Cc2cccnc2N)C1	ZINC000091664795	180220815	/nfs/dbraw/zinc/22/08/15/180220815.db2.gz	IDCCHDGTOHSHSC-OAHLLOKOSA-N	1	0	279.384	1.275	50	0		CDAARO
C[NH+](C)C[C@@H]1CN(C(=O)c2ccccc2Cl)C[C@@H]1CO	ZINC000091706863	180230387	/nfs/dbraw/zinc/23/03/87/180230387.db2.gz	WBZRRCXEHVUIBF-VXGBXAGGSA-N	1	0	296.798	1.582	50	0		CDAARO
C[C@@H]1C[N@@H+](C[C@@H](O)COCc2ccccc2F)C[C@H](C)O1	ZINC000105699656	186069129	/nfs/dbraw/zinc/06/91/29/186069129.db2.gz	RFLIBMKXDGIBSK-VNHYZAJKSA-N	1	0	297.370	1.812	50	0		CDAARO
C[N@@H+]1CCN(Cc2c(F)cccc2Cl)C[C@H]1CCO	ZINC000106735848	186133547	/nfs/dbraw/zinc/13/35/47/186133547.db2.gz	GBHHQVIOMSAFEW-LLVKDONJSA-N	1	0	286.778	1.978	50	0		CDAARO
OC[C@@H]1CCC[N@@H+]1C[C@H](O)c1ccc(F)c(F)c1	ZINC000106772589	186135279	/nfs/dbraw/zinc/13/52/79/186135279.db2.gz	LPONBCAXIWMQAR-GWCFXTLKSA-N	1	0	257.280	1.455	50	0		CDAARO
CC1(C)C(=O)NCCN1C(=O)CC[C@H]([NH3+])c1ccccc1	ZINC000110665770	186311548	/nfs/dbraw/zinc/31/15/48/186311548.db2.gz	BNSQGJXAROFQDL-ZDUSSCGKSA-N	1	0	289.379	1.204	50	0		CDAARO
CC[C@H]1CCCC[C@@H]1C[NH+]1CCC2(CC1)NC(=O)NC2=O	ZINC000583650796	366007150	/nfs/dbraw/zinc/00/71/50/366007150.db2.gz	BIAFTEHYGYSCCT-QWHCGFSZSA-N	1	0	293.411	1.877	50	0		CDAARO
O=C(NCc1ccccc1)[C@]1(C(F)(F)F)CC[NH2+]C1	ZINC000111242879	186374287	/nfs/dbraw/zinc/37/42/87/186374287.db2.gz	GQBYOMATPDFAEX-LBPRGKRZSA-N	1	0	272.270	1.845	50	0		CDAARO
[NH3+]C[C@@H]1CCCN1S(=O)(=O)c1cc(F)ccc1Cl	ZINC000123946748	187115734	/nfs/dbraw/zinc/11/57/34/187115734.db2.gz	NHENOVVXOQTHDV-VIFPVBQESA-N	1	0	292.763	1.591	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1cc(Cl)ccn1	ZINC000036804829	363163639	/nfs/dbraw/zinc/16/36/39/363163639.db2.gz	WFLBKDWKBBBRFK-NSHDSACASA-N	1	0	267.760	1.949	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)N[C@H]1C[N@@H+](C)C[C@@H]1C	ZINC000076058269	538376951	/nfs/dbraw/zinc/37/69/51/538376951.db2.gz	FKGJHZJSEDWKHW-JQWIXIFHSA-N	1	0	286.372	1.363	50	0		CDAARO
COc1cc(C[NH2+]C[C@@H]2CCCO2)cc(OC)c1OC	ZINC000000874268	355923491	/nfs/dbraw/zinc/92/34/91/355923491.db2.gz	PLDISMFHHKDCEL-LBPRGKRZSA-N	1	0	281.352	1.981	50	0		CDAARO
Cc1cc(N2CCN(c3ccc(F)cc3)CC2)nc(N)[nH+]1	ZINC000002562058	355975165	/nfs/dbraw/zinc/97/51/65/355975165.db2.gz	YRROOFFSKFANIU-UHFFFAOYSA-N	1	0	287.342	1.833	50	0		CDAARO
Cc1ncc(/C=C\C(=O)N2CCC[C@H]([NH3+])C2)s1	ZINC000255126307	355996959	/nfs/dbraw/zinc/99/69/59/355996959.db2.gz	QFMJSUVPTKROBE-LWTINBJPSA-N	1	0	251.355	1.414	50	0		CDAARO
OCC[NH2+]C[C@@H](O)Cn1c2ccccc2c2ccccc21	ZINC000001806034	355952350	/nfs/dbraw/zinc/95/23/50/355952350.db2.gz	QZUDLONPOLSENE-CYBMUJFWSA-N	1	0	284.359	1.737	50	0		CDAARO
COC(=O)[C@@H](CC(C)C)NC(=O)[C@@H]([NH3+])CC(C)C	ZINC000004556761	356036137	/nfs/dbraw/zinc/03/61/37/356036137.db2.gz	AJMOLNFDYWTVQW-WDEREUQCSA-N	1	0	258.362	1.064	50	0		CDAARO
[NH3+]C[C@@H](O)c1ccccc1I	ZINC000008699507	356148800	/nfs/dbraw/zinc/14/88/00/356148800.db2.gz	CWLIBAOBIAUKPM-MRVPVSSYSA-N	1	0	263.078	1.283	50	0		CDAARO
COc1ccc(OC)c(NC(=O)[C@@H]2CCC[NH2+]2)c1	ZINC000011754447	356278202	/nfs/dbraw/zinc/27/82/02/356278202.db2.gz	CRAOEJRGFZMOPP-JTQLQIEISA-N	1	0	250.298	1.394	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)COc2ccc(F)cc2F)C1	ZINC000299740003	356285900	/nfs/dbraw/zinc/28/59/00/356285900.db2.gz	UPQBRZUAWOJWCK-GHMZBOCLSA-N	1	0	298.333	1.929	50	0		CDAARO
CNC(=O)COC1CC[NH+](Cc2ccccc2)CC1	ZINC000012359673	356294896	/nfs/dbraw/zinc/29/48/96/356294896.db2.gz	NLSUNMMALQJSIP-UHFFFAOYSA-N	1	0	262.353	1.414	50	0		CDAARO
C[NH+](C)CCNS(=O)(=O)Cc1ccccc1Cl	ZINC000013668464	356353319	/nfs/dbraw/zinc/35/33/19/356353319.db2.gz	JIFBMZDMFNYQDR-UHFFFAOYSA-N	1	0	276.789	1.321	50	0		CDAARO
C[C@@H]1CN(c2ccc(S(C)(=O)=O)cc2Cl)CC[NH2+]1	ZINC000015443299	356416497	/nfs/dbraw/zinc/41/64/97/356416497.db2.gz	ALKSWEZGUJBUAN-SECBINFHSA-N	1	0	288.800	1.542	50	0		CDAARO
CC(C)CC1C(=O)N=C(SCC[NH+](C)C)N=C1[O-]	ZINC000018059803	356466402	/nfs/dbraw/zinc/46/64/02/356466402.db2.gz	DJKCRBANAJKJNW-UHFFFAOYSA-N	1	0	271.386	1.328	50	0		CDAARO
Cc1ccc(C)c(OCCOCCN2CC[NH+](C)CC2)c1	ZINC000019792455	356504310	/nfs/dbraw/zinc/50/43/10/356504310.db2.gz	VAGYNGQMHDVXLX-UHFFFAOYSA-N	1	0	292.423	1.946	50	0		CDAARO
Cc1ccc(CN2CCC[N@H+](CCC(N)=O)CC2)cc1	ZINC000025306222	356672064	/nfs/dbraw/zinc/67/20/64/356672064.db2.gz	YXHMGIIONHASNE-UHFFFAOYSA-N	1	0	275.396	1.378	50	0		CDAARO
C[C@H]([NH2+]C[C@H]1CCCN1S(C)(=O)=O)c1ccsc1	ZINC000090799505	356833286	/nfs/dbraw/zinc/83/32/86/356833286.db2.gz	RWZLQSGYQIDCRH-CMPLNLGQSA-N	1	0	288.438	1.823	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCOC23CC[NH2+]CC3)cc1	ZINC000034936171	356824648	/nfs/dbraw/zinc/82/46/48/356824648.db2.gz	ZCXHOAINPWAZFG-UHFFFAOYSA-N	1	0	296.392	1.096	50	0		CDAARO
Cc1noc(C)c1S(=O)(=O)NC[C@@H]([NH3+])c1ccccc1	ZINC000036297697	356869451	/nfs/dbraw/zinc/86/94/51/356869451.db2.gz	AJHREXXPHYIMHG-GFCCVEGCSA-N	1	0	295.364	1.270	50	0		CDAARO
CC(C)CNC(=O)NC(=O)[C@H](C)[N@H+](C)Cc1ccccc1	ZINC000011127623	357249155	/nfs/dbraw/zinc/24/91/55/357249155.db2.gz	NYMZNJJVRJEJGY-ZDUSSCGKSA-N	1	0	291.395	1.989	50	0		CDAARO
O=c1[nH]c(CC[NH2+][C@@H]2CCSC2)nc2ccccc21	ZINC000065371444	357532357	/nfs/dbraw/zinc/53/23/57/357532357.db2.gz	ZKKUWLNLEWZHPN-SNVBAGLBSA-N	1	0	275.377	1.561	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](c2nc3c([nH]2)C(=O)NCCC3)C1	ZINC000065399284	357537945	/nfs/dbraw/zinc/53/79/45/357537945.db2.gz	OTJILPAKOHHGHX-NSHDSACASA-N	1	0	276.384	1.675	50	0		CDAARO
CCCc1nc(C)cc(N[C@H]2C[N@@H+](C(C)C)C[C@@H]2O)n1	ZINC000065417525	357540403	/nfs/dbraw/zinc/54/04/03/357540403.db2.gz	HVHLGBKBFKVPHY-STQMWFEESA-N	1	0	278.400	1.603	50	0		CDAARO
C/C(=C/C(=O)N(C)CC[N@H+](C)C1CC1)c1cnccn1	ZINC000408519612	357544831	/nfs/dbraw/zinc/54/48/31/357544831.db2.gz	FXMZDKPLPZQDQU-BENRWUELSA-N	1	0	274.368	1.433	50	0		CDAARO
Cn1cc(CC(=O)NC[C@@H]2CC[N@H+](C)C2)c2ccccc21	ZINC000067489615	357610410	/nfs/dbraw/zinc/61/04/10/357610410.db2.gz	YJQMJWXUPBFFTC-ZDUSSCGKSA-N	1	0	285.391	1.789	50	0		CDAARO
CCC[NH+]1CCC(Cc2noc([C@H]3CCC(=O)N3)n2)CC1	ZINC000067604998	357614607	/nfs/dbraw/zinc/61/46/07/357614607.db2.gz	WLXVXPMPSFFNRA-GFCCVEGCSA-N	1	0	292.383	1.685	50	0		CDAARO
CC(C)[C@H](Nc1ncnc2c1CC[NH2+]C2)c1nccn1C	ZINC000067841658	357631482	/nfs/dbraw/zinc/63/14/82/357631482.db2.gz	UDIDDDNTFLXOSG-ZDUSSCGKSA-N	1	0	286.383	1.665	50	0		CDAARO
Cc1cc(C)n(CC(=O)NC[C@H]2CCC[N@@H+](C(C)C)C2)n1	ZINC000067878924	357635382	/nfs/dbraw/zinc/63/53/82/357635382.db2.gz	OTGSOTUQPHBTMR-OAHLLOKOSA-N	1	0	292.427	1.737	50	0		CDAARO
CC(C)CO[C@@H]1CCN(C(=O)[C@@H]2CCC[C@H]2[NH3+])C1	ZINC000299740281	357700168	/nfs/dbraw/zinc/70/01/68/357700168.db2.gz	XZLKCXJEBZHBMP-JHJVBQTASA-N	1	0	254.374	1.387	50	0		CDAARO
O=C(C[C@H]1C[NH2+]CCO1)N1CCC[C@H]1c1ccccc1	ZINC000091299514	357709300	/nfs/dbraw/zinc/70/93/00/357709300.db2.gz	WMYVKKFCIFSXOQ-GJZGRUSLSA-N	1	0	274.364	1.729	50	0		CDAARO
NC(=O)CN1C[C@H]2CC[C@@H]1C[N@H+](Cc1ccc(F)cc1)C2	ZINC000091519334	283289484	/nfs/dbraw/zinc/28/94/84/283289484.db2.gz	OWPADMRJUGGQBP-DZGCQCFKSA-N	1	0	291.370	1.207	50	0		CDAARO
Cc1nn(C)c2ncnc(N3CC[C@@H]4CC[C@H](C3)[N@@H+]4C)c12	ZINC000072429032	357835117	/nfs/dbraw/zinc/83/51/17/357835117.db2.gz	PUBIJTWLQBEUHE-NWDGAFQWSA-N	1	0	286.383	1.345	50	0		CDAARO
Cc1ccc(N2CC[N@H+](C3CCCC3)[C@H](CCO)C2)nn1	ZINC000072476190	357837755	/nfs/dbraw/zinc/83/77/55/357837755.db2.gz	KLWMANAZZIRAIP-OAHLLOKOSA-N	1	0	290.411	1.601	50	0		CDAARO
COC(=O)C(C)(C)C[NH2+]C1CCN(c2ccccn2)CC1	ZINC000097081550	357944804	/nfs/dbraw/zinc/94/48/04/357944804.db2.gz	NEUHPIXGGWZFIZ-UHFFFAOYSA-N	1	0	291.395	1.839	50	0		CDAARO
Cc1nnc([C@@H](C)N[C@@H](CC(N)=O)C2CCCCC2)o1	ZINC000097111048	357987079	/nfs/dbraw/zinc/98/70/79/357987079.db2.gz	TYLRWECEAZAHFL-SKDRFNHKSA-N	1	0	280.372	1.853	50	0		CDAARO
COCc1cccc(S(=O)(=O)N[C@@H]2CCC[NH2+][C@H]2C)c1	ZINC000193455647	358295576	/nfs/dbraw/zinc/29/55/76/358295576.db2.gz	SWRZQDYROQAWKE-SMDDNHRTSA-N	1	0	298.408	1.252	50	0		CDAARO
CC(=O)N[C@@H]1C[N@@H+](C2CCOCC2)C[C@H]1c1ccc(C)o1	ZINC000091444841	358513836	/nfs/dbraw/zinc/51/38/36/358513836.db2.gz	BSNZQTWIYHJNBX-HUUCEWRRSA-N	1	0	292.379	1.671	50	0		CDAARO
[NH3+]C[C@@H](NS(=O)(=O)CCCF)C1CCCCC1	ZINC000195544534	358559811	/nfs/dbraw/zinc/55/98/11/358559811.db2.gz	XIYLYUSFXRLTHX-LLVKDONJSA-N	1	0	266.382	1.173	50	0		CDAARO
COC[C@H](C)C(=O)N[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C	ZINC000195564722	358565428	/nfs/dbraw/zinc/56/54/28/358565428.db2.gz	BKLKMICMVIKKGQ-OFQRWUPVSA-N	1	0	290.407	1.906	50	0		CDAARO
O=C(CCC[NH+]1CCCCC1)NCCn1cccc1	ZINC000095370559	358687579	/nfs/dbraw/zinc/68/75/79/358687579.db2.gz	ATTSCRGCRPTYES-UHFFFAOYSA-N	1	0	263.385	1.870	50	0		CDAARO
CCCc1nnc(N2CCC(OCC[NH+](C)C)CC2)o1	ZINC000095388288	358691335	/nfs/dbraw/zinc/69/13/35/358691335.db2.gz	KPJJXSUSRIIKGS-UHFFFAOYSA-N	1	0	282.388	1.569	50	0		CDAARO
COCc1cccc(C(=O)N(C)C2CC[NH2+]CC2)n1	ZINC000097076463	358750555	/nfs/dbraw/zinc/75/05/55/358750555.db2.gz	YBCKKCKNNDRCQO-UHFFFAOYSA-N	1	0	263.341	1.052	50	0		CDAARO
CCN(CC[NH+](C)C)C(=O)CCCc1cn[nH]c1	ZINC000096166558	358713330	/nfs/dbraw/zinc/71/33/30/358713330.db2.gz	OVKDEXSPVLCKAL-UHFFFAOYSA-N	1	0	252.362	1.143	50	0		CDAARO
O=C1c2ccccc2C(=O)N1CCC1=CC[NH2+]CC1	ZINC000098210217	358816457	/nfs/dbraw/zinc/81/64/57/358816457.db2.gz	SLRRBTDXLLXOKJ-UHFFFAOYSA-N	1	0	256.305	1.592	50	0		CDAARO
CC1(C)Cc2cc(CN3CC[NH2+]C[C@@H](O)C3)ccc2O1	ZINC000097394223	358772847	/nfs/dbraw/zinc/77/28/47/358772847.db2.gz	LTPXIQPFXNFCGD-CQSZACIVSA-N	1	0	276.380	1.166	50	0		CDAARO
Cn1c(C[N@@H+]2CCC[C@@](O)(CO)CC2)cc2ccccc21	ZINC000097505441	358781378	/nfs/dbraw/zinc/78/13/78/358781378.db2.gz	VRVDPTFCPXCLFC-KRWDZBQOSA-N	1	0	288.391	1.888	50	0		CDAARO
Cc1nc(C(=O)NCC[C@@H]2CCC[N@H+]2C)c(C)s1	ZINC000097553213	358785148	/nfs/dbraw/zinc/78/51/48/358785148.db2.gz	XEHYSTAGOFWNEF-NSHDSACASA-N	1	0	267.398	1.974	50	0		CDAARO
Cc1nc(C(=O)N2CCCC[C@@H]2C[NH3+])c(C)s1	ZINC000097784819	358798420	/nfs/dbraw/zinc/79/84/20/358798420.db2.gz	HEWJWKMHNUPWQI-SNVBAGLBSA-N	1	0	253.371	1.713	50	0		CDAARO
O=C([C@H]1C[NH2+]CCO1)N1CCC[C@H]1c1ccc(Cl)cc1	ZINC000178404634	366485994	/nfs/dbraw/zinc/48/59/94/366485994.db2.gz	KHDDSKBTMNXGNQ-UONOGXRCSA-N	1	0	294.782	1.992	50	0		CDAARO
[NH2+]=C1Nc2nc3ccccc3n2[C@H](c2ccco2)N1	ZINC000004702787	283409805	/nfs/dbraw/zinc/40/98/05/283409805.db2.gz	SZVHEKCVJYJHNS-LLVKDONJSA-N	1	0	253.265	1.916	50	0		CDAARO
CCCc1nc(C)c(CNC(=O)[C@@H]([NH3+])CC)s1	ZINC000219116103	359078265	/nfs/dbraw/zinc/07/82/65/359078265.db2.gz	SFTUTTXEOIGCJF-VIFPVBQESA-N	1	0	255.387	1.758	50	0		CDAARO
CCOC(=O)[C@@]12CC[NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)C2	ZINC000261250126	359276116	/nfs/dbraw/zinc/27/61/16/359276116.db2.gz	ZMLGCFGHQXSXAH-IAQYHMDHSA-N	1	0	298.383	1.539	50	0		CDAARO
Nc1cccc(C(=O)N2CCC[C@H](C[NH+]3CCCC3)C2)n1	ZINC000223334492	359417102	/nfs/dbraw/zinc/41/71/02/359417102.db2.gz	WDTHFYKAHQHYDQ-CYBMUJFWSA-N	1	0	288.395	1.612	50	0		CDAARO
O=C(CC[NH+]1CCN(c2ccccc2)CC1)NC1CC1	ZINC000026808319	359452083	/nfs/dbraw/zinc/45/20/83/359452083.db2.gz	SIIYSZGMTAUVOK-UHFFFAOYSA-N	1	0	273.380	1.477	50	0		CDAARO
Cn1cc(C[N@@H+]2C[C@@H](CO)[C@H](c3ccccn3)C2)cn1	ZINC000257187093	359528458	/nfs/dbraw/zinc/52/84/58/359528458.db2.gz	LHPJUMJLGNUXCL-UONOGXRCSA-N	1	0	272.352	1.023	50	0		CDAARO
COCCn1c(C)cnc1CO[C@@H]1CCC[N@H+](C)C1	ZINC000257191943	359589010	/nfs/dbraw/zinc/58/90/10/359589010.db2.gz	RWKXWOPYIGOYGJ-CYBMUJFWSA-N	1	0	267.373	1.449	50	0		CDAARO
Cc1ccc(OC[C@H](O)C[NH2+]C2CCOCC2)c(C)c1	ZINC000032529880	359686348	/nfs/dbraw/zinc/68/63/48/359686348.db2.gz	QQILRJJNEYPFJZ-OAHLLOKOSA-N	1	0	279.380	1.812	50	0		CDAARO
[NH3+]C[C@@H]1CCCN1C(=O)COc1cccc(F)c1	ZINC000178274593	283470718	/nfs/dbraw/zinc/47/07/18/283470718.db2.gz	TVZPMGZQUIGFAI-NSHDSACASA-N	1	0	252.289	1.154	50	0		CDAARO
C[C@H]1C[C@@H](C(=O)N[C@@H]2CCCC[C@H]2CO)CC[NH2+]1	ZINC000262333626	360056856	/nfs/dbraw/zinc/05/68/56/360056856.db2.gz	FHIPHDWPCNDWSZ-ZDEQEGDKSA-N	1	0	254.374	1.042	50	0		CDAARO
C[C@@H]1CN(C(=O)Cc2cn3ccsc3n2)C[C@@H]1[NH+](C)C	ZINC000089937162	360197477	/nfs/dbraw/zinc/19/74/77/360197477.db2.gz	VWPJXNHSOYSCFF-PWSUYJOCSA-N	1	0	292.408	1.347	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@H]1CCN(C(=O)c2cn(C)nc2C)C1	ZINC000409421107	360230142	/nfs/dbraw/zinc/23/01/42/360230142.db2.gz	IMIQUHIKCNKZBZ-ZDUSSCGKSA-N	1	0	287.367	1.629	50	0		CDAARO
COc1cc2ncnc(NCC[NH+](C)C)c2cc1OC	ZINC000011990252	360484986	/nfs/dbraw/zinc/48/49/86/360484986.db2.gz	YYAINWMZKWTMGT-UHFFFAOYSA-N	1	0	276.340	1.621	50	0		CDAARO
CCC[NH2+]C[C@@]1(O)CCCN(Cc2ccc(F)cc2)C1=O	ZINC000011953069	360465402	/nfs/dbraw/zinc/46/54/02/360465402.db2.gz	DTRGLHZMHSGOIU-INIZCTEOSA-N	1	0	294.370	1.679	50	0		CDAARO
C[C@@H](NC(=O)N(CCO)CC[NH+](C)C)c1ccc(F)cc1	ZINC000426658283	360693237	/nfs/dbraw/zinc/69/32/37/360693237.db2.gz	HKHVJAUAJUHULO-GFCCVEGCSA-N	1	0	297.374	1.452	50	0		CDAARO
Cc1nc(CNC(=O)CC[C@@H](C)[NH+]2CCCC2)n(C)c1C	ZINC000426419986	360668310	/nfs/dbraw/zinc/66/83/10/360668310.db2.gz	DDWQMNLRDLMFJN-GFCCVEGCSA-N	1	0	292.427	1.918	50	0		CDAARO
O=C(Cn1ccc([C@H]2CCC[NH2+]C2)n1)NCC(F)(F)F	ZINC000426465108	360672889	/nfs/dbraw/zinc/67/28/89/360672889.db2.gz	FTKRVOBSQULSOG-VIFPVBQESA-N	1	0	290.289	1.029	50	0		CDAARO
COc1ccccc1/C(C)=C/C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178571553	189127550	/nfs/dbraw/zinc/12/75/50/189127550.db2.gz	PNFYAMCHDYOILI-SRXBQZRASA-N	1	0	274.364	1.906	50	0		CDAARO
CC[C@H](Oc1ccccc1C)C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178592141	189129234	/nfs/dbraw/zinc/12/92/34/189129234.db2.gz	BSLCTCMLORBGTD-KGLIPLIRSA-N	1	0	276.380	1.960	50	0		CDAARO
CCCN(C(=O)Cc1ccc2c(c1)OCO2)[C@@H]1CC[NH2+]C1	ZINC000178903382	189153526	/nfs/dbraw/zinc/15/35/26/189153526.db2.gz	JWBIJBCASHUXLR-CYBMUJFWSA-N	1	0	290.363	1.558	50	0		CDAARO
CN(C(=O)c1cccc(Oc2cnccn2)c1)[C@H]1CC[NH2+]C1	ZINC000179083928	189167795	/nfs/dbraw/zinc/16/77/95/189167795.db2.gz	KXXUWSKTWJODHZ-ZDUSSCGKSA-N	1	0	298.346	1.703	50	0		CDAARO
COCC[N@@H+](Cc1cccn1C)C[C@H](O)COCC(C)C	ZINC000036098071	360909235	/nfs/dbraw/zinc/90/92/35/360909235.db2.gz	HBZHLUQLKHCZIQ-INIZCTEOSA-N	1	0	298.427	1.507	50	0		CDAARO
Cc1cccc(C)c1NC(=O)NC[C@@]1(O)CC[NH2+]C1	ZINC000299757709	200860396	/nfs/dbraw/zinc/86/03/96/200860396.db2.gz	AMNUCNACKJZTKD-CQSZACIVSA-N	1	0	263.341	1.149	50	0		CDAARO
Cc1ncn(C)c1C(=O)NCc1cccc(C[NH+](C)C)c1	ZINC000299796344	200878957	/nfs/dbraw/zinc/87/89/57/200878957.db2.gz	QUTHELPZINGFPA-UHFFFAOYSA-N	1	0	286.379	1.720	50	0		CDAARO
O[C@@H](Cn1ccc(C(F)(F)F)n1)C[NH+]1CCCC1	ZINC000000117335	364091691	/nfs/dbraw/zinc/09/16/91/364091691.db2.gz	BITXQCCVUCXHRC-SECBINFHSA-N	1	0	263.263	1.359	50	0		CDAARO
CN(CC1CC[NH+](C)CC1)C(=O)CCc1cn[nH]c1	ZINC000629956862	364256131	/nfs/dbraw/zinc/25/61/31/364256131.db2.gz	CHMNLXVZTJXJCD-UHFFFAOYSA-N	1	0	264.373	1.143	50	0		CDAARO
CCOC(=O)[C@@]1(C(C)C)CC[N@H+](C[C@@H](O)C(F)(F)F)C1	ZINC000248742626	364442051	/nfs/dbraw/zinc/44/20/51/364442051.db2.gz	QPHCDQWMHLTTEK-PWSUYJOCSA-N	1	0	297.317	1.821	50	0		CDAARO
C[NH+](C)CCN(Cc1ccco1)C(=O)c1cscn1	ZINC000088230618	364560596	/nfs/dbraw/zinc/56/05/96/364560596.db2.gz	KWQGODGLNAHFNH-UHFFFAOYSA-N	1	0	279.365	1.940	50	0		CDAARO
COc1cc(I)c(C[NH3+])cc1F	ZINC000169800942	365049298	/nfs/dbraw/zinc/04/92/98/365049298.db2.gz	JTQZEEHFEIMKJG-UHFFFAOYSA-N	1	0	281.068	1.898	50	0		CDAARO
Cc1cc(CCNC(=O)C[NH+](C)C)cc(C)c1O	ZINC000188719051	365374888	/nfs/dbraw/zinc/37/48/88/365374888.db2.gz	HRXPOMUEQRZEGO-UHFFFAOYSA-N	1	0	250.342	1.229	50	0		CDAARO
O=C(CN1CCC[C@H]([NH+]2CCCCCC2)C1)NCC1CC1	ZINC000089818983	366940989	/nfs/dbraw/zinc/94/09/89/366940989.db2.gz	YKEKDIBQOIVTKH-INIZCTEOSA-N	1	0	293.455	1.853	50	0		CDAARO
CCN(Cc1ccc2c(c1)OCO2)C(=O)C[C@@H]1CC[NH2+]C1	ZINC000089744008	366926012	/nfs/dbraw/zinc/92/60/12/366926012.db2.gz	NFDZJEQQIRUFQR-LBPRGKRZSA-N	1	0	290.363	1.763	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@H]1[NH2+]Cc1cscn1	ZINC000089949177	366978774	/nfs/dbraw/zinc/97/87/74/366978774.db2.gz	FTKPJGUTMOHVCY-DGCLKSJQSA-N	1	0	267.398	1.880	50	0		CDAARO
CC(C)(C)n1cc(C[N@@H+]2CC[C@]3(CNC(=O)C3)C2)cn1	ZINC000279492841	367015193	/nfs/dbraw/zinc/01/51/93/367015193.db2.gz	UZPMJWUSMOVRGV-HNNXBMFYSA-N	1	0	276.384	1.350	50	0		CDAARO
C[C@H]1CN(C(=O)c2cc(C(F)F)n[nH]2)[C@@H](C)CN1C	ZINC000630076998	367312055	/nfs/dbraw/zinc/31/20/55/367312055.db2.gz	MENKYRKQXDRTIL-YUMQZZPRSA-N	1	0	272.299	1.512	50	0		CDAARO
Cc1c[nH+]c(C)n1CCNC(=O)Cc1ccccc1	ZINC000575556139	369133887	/nfs/dbraw/zinc/13/38/87/369133887.db2.gz	VKDYNCUZDBVTOB-UHFFFAOYSA-N	1	0	257.337	1.859	50	0		CDAARO
C[C@H]1CCC[N@H+](Cc2cc(=O)n3ccsc3n2)C1	ZINC000003564868	370225197	/nfs/dbraw/zinc/22/51/97/370225197.db2.gz	CCDJRWIOKZIJLB-JTQLQIEISA-N	1	0	263.366	1.988	50	0		CDAARO
CC(C)CCN1C(=O)N(C(C)C)C(=O)C12CC[NH2+]CC2	ZINC000299797510	372768571	/nfs/dbraw/zinc/76/85/71/372768571.db2.gz	OHFNNDNEKKWJDK-UHFFFAOYSA-N	1	0	281.400	1.827	50	0		CDAARO
CC[C@@H](O)C[N@@H+]1CCC[C@@H]([C@H](C)NC(=O)NC(C)(C)C)C1	ZINC000108090723	412810719	/nfs/dbraw/zinc/81/07/19/412810719.db2.gz	QTHAVYDBXVPANQ-BFHYXJOUSA-N	1	0	299.459	1.956	50	0		CDAARO
Cc1cc([C@@H]2CCCN2CC(=O)NC[C@H]2CCOC2)on1	ZINC000108182580	412813555	/nfs/dbraw/zinc/81/35/55/412813555.db2.gz	JGXRIWCDWYIRFD-OLZOCXBDSA-N	1	0	293.367	1.273	50	0		CDAARO
C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=S)NC1CC1	ZINC000106864218	373787616	/nfs/dbraw/zinc/78/76/16/373787616.db2.gz	UXIQPNVNKTXCBP-TUAOUCFPSA-N	1	0	269.458	1.979	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CCCNc1ccc2nnnn2n1	ZINC000013002071	374087780	/nfs/dbraw/zinc/08/77/80/374087780.db2.gz	SEEQCYRCWVZUAE-LLVKDONJSA-N	1	0	275.360	1.196	50	0		CDAARO
CO[C@H]1C=CC2=CC[N@@H+]3CC[C@H]4COC(=O)C=C4[C@]23C1	ZINC000019864719	374383511	/nfs/dbraw/zinc/38/35/11/374383511.db2.gz	IXPDLJKEPLTCOU-RBOXIYTFSA-N	1	0	273.332	1.445	50	0		CDAARO
C[N@@H+]1CCC2(C1)CCN(C(=O)C[C@H]1CCOC1)CC2	ZINC000670460157	483042005	/nfs/dbraw/zinc/04/20/05/483042005.db2.gz	AYYSFVSVAVCRDX-CYBMUJFWSA-N	1	0	266.385	1.357	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@@H]2COc3ccccc32)C[C@@H]1[NH+](C)C	ZINC000089948373	541983100	/nfs/dbraw/zinc/98/31/00/541983100.db2.gz	JYZXTYZNUKKJFX-YUELXQCFSA-N	1	0	288.391	1.961	50	0		CDAARO
C1=CC[C@H](C[NH+]2CCN(C[C@H]3CCOC3)CC2)CC1	ZINC000093817403	374785556	/nfs/dbraw/zinc/78/55/56/374785556.db2.gz	KWJQEXKWAWKWLI-JKSUJKDBSA-N	1	0	264.413	1.997	50	0		CDAARO
CCSC[C@@H](C)[N@H+](C)CCN1C(=O)CCC1=O	ZINC000095432223	374932137	/nfs/dbraw/zinc/93/21/37/374932137.db2.gz	YUWAZULPTDRDRV-SNVBAGLBSA-N	1	0	258.387	1.209	50	0		CDAARO
CO[C@H](C)CC(=O)OCCC[N@@H+]1CCOC[C@@H]1C	ZINC000095467924	374963409	/nfs/dbraw/zinc/96/34/09/374963409.db2.gz	VEIFANOOLNSDJY-NWDGAFQWSA-N	1	0	259.346	1.065	50	0		CDAARO
c1cc(N2CCCC2)ncc1C[NH2+][C@H]1CCCOC1	ZINC000095412238	374914538	/nfs/dbraw/zinc/91/45/38/374914538.db2.gz	FMVYQZJAZCTFHS-AWEZNQCLSA-N	1	0	261.369	1.950	50	0		CDAARO
CCc1cc(C)nc(N2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)n1	ZINC000096011568	375050958	/nfs/dbraw/zinc/05/09/58/375050958.db2.gz	JGFNZULREWEKLQ-CHWSQXEVSA-N	1	0	278.400	1.239	50	0		CDAARO
C(C[NH+]1CCCCC1)c1nc([C@H]2CCOC2)no1	ZINC000096162800	375059869	/nfs/dbraw/zinc/05/98/69/375059869.db2.gz	DSGKJFPNPMVKKI-NSHDSACASA-N	1	0	251.330	1.602	50	0		CDAARO
COC(=O)CN1CCC[N@@H+]([C@H](C)Cc2ccsc2)CC1	ZINC000097084306	375144467	/nfs/dbraw/zinc/14/44/67/375144467.db2.gz	FOYYKPUSROVCKR-CYBMUJFWSA-N	1	0	296.436	1.860	50	0		CDAARO
Cc1cccc(CN2CCN(C(=O)[C@@H]3CC[NH2+]C3)CC2)c1	ZINC000055415133	375166908	/nfs/dbraw/zinc/16/69/08/375166908.db2.gz	GBLUMOVOXVKQPT-MRXNPFEDSA-N	1	0	287.407	1.249	50	0		CDAARO
COc1ccc(Cl)cc1CN(C)C(=O)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000299748963	375207638	/nfs/dbraw/zinc/20/76/38/375207638.db2.gz	IRYDWOKEBBARMR-RYUDHWBXSA-N	1	0	298.770	1.030	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1CC(=O)NCc1ccc2c(c1)OCO2	ZINC000002633434	375278287	/nfs/dbraw/zinc/27/82/87/375278287.db2.gz	JJYZSKBGDRSDGJ-GFCCVEGCSA-N	1	0	290.363	1.906	50	0		CDAARO
OC1C2(c3ccccc3)CNCC1(c1ccccc1)C[NH2+]C2	ZINC000057173102	375402850	/nfs/dbraw/zinc/40/28/50/375402850.db2.gz	AMBSFNUCUNMURE-UHFFFAOYSA-N	1	0	294.398	1.430	50	0		CDAARO
CC(=O)NCC[NH2+]C[C@@H](O)COc1ccccc1C(C)C	ZINC000003441427	375700846	/nfs/dbraw/zinc/70/08/46/375700846.db2.gz	CFMFMJXYYKQHIS-CQSZACIVSA-N	1	0	294.395	1.275	50	0		CDAARO
C[NH+](C)CC(C)(C)NS(=O)(=O)/C=C\c1ccccc1	ZINC000606444369	375825013	/nfs/dbraw/zinc/82/50/13/375825013.db2.gz	KXKKHRJXFPUYQI-KHPPLWFESA-N	1	0	282.409	1.917	50	0		CDAARO
Cc1ccc(C2(O)CC[NH+](Cc3cccnc3N)CC2)nc1	ZINC000067673872	377201326	/nfs/dbraw/zinc/20/13/26/377201326.db2.gz	SYVORVKVFDEYSU-UHFFFAOYSA-N	1	0	298.390	1.851	50	0		CDAARO
CCC(CC)[C@@H](CNc1ccc2nnnn2n1)[NH+](C)C	ZINC000012734865	377538264	/nfs/dbraw/zinc/53/82/64/377538264.db2.gz	NZDUCCPPILIBAE-LLVKDONJSA-N	1	0	277.376	1.298	50	0		CDAARO
COC(=O)[C@@]1(C)CCN(C(=O)[C@H](C)[NH+]2CCCCCC2)C1	ZINC000089420054	291673442	/nfs/dbraw/zinc/67/34/42/291673442.db2.gz	JGBGDARDYKHYAG-BBRMVZONSA-N	1	0	296.411	1.663	50	0		CDAARO
OC[C@@]1([NH2+]CCc2ccncc2)CCOc2ccccc21	ZINC000289363201	197312785	/nfs/dbraw/zinc/31/27/85/197312785.db2.gz	JBEGJYSONTVJTC-KRWDZBQOSA-N	1	0	284.359	1.884	50	0		CDAARO
Cc1cnc(C)c(N2CCC([N@@H+]3CCC[C@H](O)C3)CC2)n1	ZINC000077354300	390810124	/nfs/dbraw/zinc/81/01/24/390810124.db2.gz	NOQJCTHOWJTYAB-HNNXBMFYSA-N	1	0	290.411	1.519	50	0		CDAARO
O=C(CC[N@H+]1CC[C@@](O)(CO)C1)Nc1cccc(Cl)c1	ZINC000244794844	391044129	/nfs/dbraw/zinc/04/41/29/391044129.db2.gz	QUZBDJNMHZTXMN-AWEZNQCLSA-N	1	0	298.770	1.098	50	0		CDAARO
O=C(NCc1ccncc1)c1csc2c1CC[NH2+]C2	ZINC000526055989	391172087	/nfs/dbraw/zinc/17/20/87/391172087.db2.gz	HSJWTGGXBIRFMU-UHFFFAOYSA-N	1	0	273.361	1.719	50	0		CDAARO
CC(C)(C)OC(=O)NC(C)(C)C[NH2+]Cc1cc[nH]n1	ZINC000083475250	391482162	/nfs/dbraw/zinc/48/21/62/391482162.db2.gz	OUIWUEZEXGAGKI-UHFFFAOYSA-N	1	0	268.361	1.803	50	0		CDAARO
CC(C)(C)OC(=O)NC(C)(C)C[NH2+]Cc1ncc[nH]1	ZINC000083475172	391482226	/nfs/dbraw/zinc/48/22/26/391482226.db2.gz	BAKKZQFPYICIDS-UHFFFAOYSA-N	1	0	268.361	1.803	50	0		CDAARO
C=CC(=O)N(CCC)CCN1CC[NH+](CC)CC1	ZINC000521396827	391668999	/nfs/dbraw/zinc/66/89/99/391668999.db2.gz	VYKNPGUEZYILQA-UHFFFAOYSA-N	1	0	253.390	1.049	50	0		CDAARO
CO[C@H](C)C(=O)N[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C	ZINC000248812847	131117435	/nfs/dbraw/zinc/11/74/35/131117435.db2.gz	KQORFPAOOVBLEK-UMVBOHGHSA-N	1	0	276.380	1.658	50	0		CDAARO
CC[C@H]1CN(C)c2ccccc2C[N@@H+]1C[C@@H](O)COC	ZINC000107588826	392737949	/nfs/dbraw/zinc/73/79/49/392737949.db2.gz	KKWUYLCGNDRLEO-LSDHHAIUSA-N	1	0	278.396	1.724	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1CNC(=O)[C@H](c1ccccc1)n1cccn1	ZINC000106178388	392721798	/nfs/dbraw/zinc/72/17/98/392721798.db2.gz	LMVNSBYFCOIXAQ-CVEARBPZSA-N	1	0	298.390	1.683	50	0		CDAARO
CC(C)[N@H+](C)CCNC(=O)N1C[C@@H](C)S[C@H](C)C1	ZINC000096439886	393186506	/nfs/dbraw/zinc/18/65/06/393186506.db2.gz	OFPZJJYOJOKUEN-VXGBXAGGSA-N	1	0	273.446	1.862	50	0		CDAARO
CC1=CCC[C@H](C)[C@H]1C[N@H+](C)CC(=O)N1CCC(O)CC1	ZINC000195575805	393304842	/nfs/dbraw/zinc/30/48/42/393304842.db2.gz	AEZPCKCAXRYNGG-HOCLYGCPSA-N	1	0	294.439	1.894	50	0		CDAARO
Cc1ccc(C)c(N2CCN(C(=O)[C@@H]3CCC[NH2+]3)CC2)c1	ZINC000072328587	134984896	/nfs/dbraw/zinc/98/48/96/134984896.db2.gz	ZATJVFGLVJILFW-HNNXBMFYSA-N	1	0	287.407	1.704	50	0		CDAARO
COC[C@@H]([NH2+][C@@H](C)c1nccn1C)C1CCOCC1	ZINC000658098355	413195257	/nfs/dbraw/zinc/19/52/57/413195257.db2.gz	YCSMOQPPJVASBF-WCQYABFASA-N	1	0	267.373	1.512	50	0		CDAARO
C[NH2+]C1CCN(C(=O)Cc2ccc(F)cc2F)CC1	ZINC000095062377	147111519	/nfs/dbraw/zinc/11/15/19/147111519.db2.gz	AMKXKRDPHHPNRQ-UHFFFAOYSA-N	1	0	268.307	1.718	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCC[C@@H]2C[NH3+])cc1F	ZINC000089091768	292184480	/nfs/dbraw/zinc/18/44/80/292184480.db2.gz	BJEIJVRQPLEWIP-MFKMUULPSA-N	1	0	286.372	1.540	50	0		CDAARO
C[C@H]1CCCCN1S(=O)(=O)c1ccc(CC[NH3+])cc1	ZINC000000053767	299768882	/nfs/dbraw/zinc/76/88/82/299768882.db2.gz	AKNMFKYHSBWRLH-LBPRGKRZSA-N	1	0	282.409	1.751	50	0		CDAARO
C[NH+](C)Cc1ccc(C(=O)N[C@@H]2CCc3c[nH]nc3C2)cc1	ZINC000371956777	160064463	/nfs/dbraw/zinc/06/44/63/160064463.db2.gz	JSWHKOLMHAMDTO-OAHLLOKOSA-N	1	0	298.390	1.759	50	0		CDAARO
CCc1ccc(OCC(=O)NCC[NH+](C)C)cc1	ZINC000002968031	169846218	/nfs/dbraw/zinc/84/62/18/169846218.db2.gz	XMALEYOFHXHURV-UHFFFAOYSA-N	1	0	250.342	1.306	50	0		CDAARO
Cn1nccc1C(=O)NC1CC[NH+](Cc2ccccc2)CC1	ZINC000006729166	170234305	/nfs/dbraw/zinc/23/43/05/170234305.db2.gz	AQNHFPLJVRFLTF-UHFFFAOYSA-N	1	0	298.390	1.815	50	0		CDAARO
C[NH+]1CCC(NC(=O)COc2ccccc2Cl)CC1	ZINC000020220072	171081764	/nfs/dbraw/zinc/08/17/64/171081764.db2.gz	CXQPETBJOOQQDR-UHFFFAOYSA-N	1	0	282.771	1.929	50	0		CDAARO
O=C(NCCc1cccc(Cl)c1)[C@H]1CCC[NH2+]C1	ZINC000020269802	171125616	/nfs/dbraw/zinc/12/56/16/171125616.db2.gz	HJOFCPWSPYXDEC-LBPRGKRZSA-N	1	0	266.772	1.998	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNS(=O)(=O)c1cccc(N)c1	ZINC000020284713	171133635	/nfs/dbraw/zinc/13/36/35/171133635.db2.gz	WPGZGXDBDJDQQY-GFCCVEGCSA-N	1	0	283.397	1.031	50	0		CDAARO
COc1ccc(O[C@H](C)C(=O)NC2CC[NH+](C)CC2)cc1	ZINC000020312002	171144547	/nfs/dbraw/zinc/14/45/47/171144547.db2.gz	NGAMTWVEMZJFET-GFCCVEGCSA-N	1	0	292.379	1.673	50	0		CDAARO
[NH3+][C@H]1CCCN(S(=O)(=O)c2ccccc2Cl)C1	ZINC000020473808	171218098	/nfs/dbraw/zinc/21/80/98/171218098.db2.gz	BJZWQBLHZGUIES-VIFPVBQESA-N	1	0	274.773	1.452	50	0		CDAARO
CC[NH+]1CCN(C[C@@H](O)COc2ccccc2C)CC1	ZINC000020513017	171231488	/nfs/dbraw/zinc/23/14/88/171231488.db2.gz	MXCCUVAEFMDTRW-OAHLLOKOSA-N	1	0	278.396	1.372	50	0		CDAARO
CC(=O)CCc1ccc(OCCN2CC[NH+](C)CC2)cc1	ZINC000020652913	171269102	/nfs/dbraw/zinc/26/91/02/171269102.db2.gz	OJSIOSUEFIMNET-UHFFFAOYSA-N	1	0	290.407	1.834	50	0		CDAARO
CC[NH+]1CCN([C@@H](C)C(=O)Nc2ccccc2OC)CC1	ZINC000022785815	171398792	/nfs/dbraw/zinc/39/87/92/171398792.db2.gz	ONLNXPPFLPRQMT-ZDUSSCGKSA-N	1	0	291.395	1.660	50	0		CDAARO
O=S1(=O)CC[C@H](C[NH2+]C2CC(c3ccccc3)C2)C1	ZINC000038083279	174092728	/nfs/dbraw/zinc/09/27/28/174092728.db2.gz	OBGIGIJXXRYFOB-LRVUVFPRSA-N	1	0	279.405	1.957	50	0		CDAARO
C[NH+](C)CCN1CCN(C(=O)COC2CCCCC2)CC1	ZINC000044362563	175167150	/nfs/dbraw/zinc/16/71/50/175167150.db2.gz	QJQJXAJPJGBMJO-UHFFFAOYSA-N	1	0	297.443	1.042	50	0		CDAARO
CN(C(=O)OC(C)(C)C)[C@H](C[NH3+])C[C@H]1CCCOC1	ZINC000059085264	175630751	/nfs/dbraw/zinc/63/07/51/175630751.db2.gz	MXNWARAWBOJCJF-NEPJUHHUSA-N	1	0	272.389	1.997	50	0		CDAARO
COCC[NH+]1CCC(c2nccn2[C@@H](C)CO)CC1	ZINC000071497722	176191731	/nfs/dbraw/zinc/19/17/31/176191731.db2.gz	IOTKGXPRGVGMLR-LBPRGKRZSA-N	1	0	267.373	1.262	50	0		CDAARO
CCCn1nc([C@@H]2CCC[NH2+]C2)n(-c2ccccc2)c1=O	ZINC000071748413	176259035	/nfs/dbraw/zinc/25/90/35/176259035.db2.gz	ZKJMBXPTUBJFSB-CYBMUJFWSA-N	1	0	286.379	1.911	50	0		CDAARO
O=C(CCCn1ccnc1)N1CCC2(CC[NH2+]CC2)CC1	ZINC000071751457	176260074	/nfs/dbraw/zinc/26/00/74/176260074.db2.gz	GGJLLBRNOIKMNA-UHFFFAOYSA-N	1	0	290.411	1.656	50	0		CDAARO
Cc1nc2c(cnn2C)c(N(C)C[C@H]2CCCC[N@@H+]2C)n1	ZINC000072135631	176322182	/nfs/dbraw/zinc/32/21/82/176322182.db2.gz	WEOQPKLZESFVKB-GFCCVEGCSA-N	1	0	288.399	1.592	50	0		CDAARO
CC(C)c1nc(N2CCC[C@@](O)(C[NH+](C)C)CC2)no1	ZINC000072143246	176324318	/nfs/dbraw/zinc/32/43/18/176324318.db2.gz	JTELDSFXBJLINZ-AWEZNQCLSA-N	1	0	282.388	1.476	50	0		CDAARO
CC1(C)Cc2cccc(C[N@@H+]3CCC[C@](O)(CO)C3)c2O1	ZINC000072153481	176327953	/nfs/dbraw/zinc/32/79/53/176327953.db2.gz	NOHVGJDNQJWVQT-QGZVFWFLSA-N	1	0	291.391	1.719	50	0		CDAARO
O[C@H](CNc1ncnc2c1CC[NH2+]CC2)c1ccccc1	ZINC000072435521	176403238	/nfs/dbraw/zinc/40/32/38/176403238.db2.gz	RRYQCJCMTVHWNI-OAHLLOKOSA-N	1	0	284.363	1.310	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+][C@@H]1CCOC2(CCOCC2)C1	ZINC000077356641	177256833	/nfs/dbraw/zinc/25/68/33/177256833.db2.gz	OYPJOLBKMLHTRS-CYBMUJFWSA-N	1	0	279.384	1.844	50	0		CDAARO
C/C=C/C[C@H](CO)[NH2+]C1CCN([C@@H]2CCOC2)CC1	ZINC000655757670	424446886	/nfs/dbraw/zinc/44/68/86/424446886.db2.gz	WRSPHRZEUDJINT-SWVJOTTGSA-N	1	0	268.401	1.156	50	0		CDAARO
O=C(OCc1ccccc1)N1CC([NH2+]C2CCOCC2)C1	ZINC000397347613	270349041	/nfs/dbraw/zinc/34/90/41/270349041.db2.gz	HCXMBKFMBXHPAM-UHFFFAOYSA-N	1	0	290.363	1.776	50	0		CDAARO
Cc1ccc(CC(=O)N2CCC[C@H](C)[C@H]2C[NH3+])cn1	ZINC000429139023	274739006	/nfs/dbraw/zinc/73/90/06/274739006.db2.gz	WWWKSUIDENSBJO-SMDDNHRTSA-N	1	0	261.369	1.518	50	0		CDAARO
OCC[NH+]1CCN(Cc2ccccc2C(F)(F)F)CC1	ZINC000019607070	275046908	/nfs/dbraw/zinc/04/69/08/275046908.db2.gz	USNMRCVTCPLBLZ-UHFFFAOYSA-N	1	0	288.313	1.815	50	0		CDAARO
CC(C)NC(=O)C[C@@H](C)[NH2+]Cc1cccc2c[nH]nc21	ZINC000084048414	275654672	/nfs/dbraw/zinc/65/46/72/275654672.db2.gz	LXGXZUOQWUUOOT-LLVKDONJSA-N	1	0	274.368	1.956	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1Cn1c(N)c2ccccc2nc1=O	ZINC000009576505	276175490	/nfs/dbraw/zinc/17/54/90/276175490.db2.gz	SARPHHGOECHQAD-LLVKDONJSA-N	1	0	272.352	1.293	50	0		CDAARO
CC[C@H](CNC(=O)Nc1nncs1)[NH+]1CCCC1	ZINC000089943426	276626121	/nfs/dbraw/zinc/62/61/21/276626121.db2.gz	DMWNXNJVCSUKSK-SECBINFHSA-N	1	0	269.374	1.534	50	0		CDAARO
CCc1cc(N[C@@H]2C[NH2+]CC[C@H]2O)n2nc(C)c(C)c2n1	ZINC000072411956	276685577	/nfs/dbraw/zinc/68/55/77/276685577.db2.gz	JLVMEDQOOJHTIS-CHWSQXEVSA-N	1	0	289.383	1.043	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCCN(CC2CCCCC2)C1=O	ZINC000012437454	276770798	/nfs/dbraw/zinc/77/07/98/276770798.db2.gz	UAHPLFAFJDBOCK-OAHLLOKOSA-N	1	0	268.401	1.482	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)[C@H]2CSc3ccccc3O2)C1	ZINC000299739002	277286279	/nfs/dbraw/zinc/28/62/79/277286279.db2.gz	JJVOGNINPXWDHL-DGCLKSJQSA-N	1	0	292.404	1.608	50	0		CDAARO
CC(C)(C)[NH2+]C[C@@H](O)c1ccc(O)c(NC(N)=O)c1	ZINC000000000124	278370344	/nfs/dbraw/zinc/37/03/44/278370344.db2.gz	KEMXXQOFIRIICG-LLVKDONJSA-N	1	0	267.329	1.304	50	0	in-man	CDAARO
OCc1ccc(C[NH2+]C[C@@H]2CCCn3ccnc32)o1	ZINC000084436746	279248187	/nfs/dbraw/zinc/24/81/87/279248187.db2.gz	MMCZJTTYHNCDDX-NSHDSACASA-N	1	0	261.325	1.636	50	0		CDAARO
CCOC(=O)c1nn(CC(C)C)c2c1C[NH2+]CC2	ZINC000065381435	279645332	/nfs/dbraw/zinc/64/53/32/279645332.db2.gz	YUCUIGQAGAIHAS-UHFFFAOYSA-N	1	0	251.330	1.362	50	0		CDAARO
Cn1ncc(N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)c(Cl)c1=O	ZINC000095971013	290240715	/nfs/dbraw/zinc/24/07/15/290240715.db2.gz	GOSLKXUZXCPFKA-QWRGUYRKSA-N	1	0	296.802	1.354	50	0		CDAARO
CO[C@H](C)CS(=O)(=O)N[C@H](C)C[NH+]1CCCCCC1	ZINC000195459986	294297498	/nfs/dbraw/zinc/29/74/98/294297498.db2.gz	WPUIUKMKEUJBBT-CHWSQXEVSA-N	1	0	292.445	1.205	50	0		CDAARO
Cc1cc(F)ccc1C(=O)N1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1	ZINC000241157325	301310995	/nfs/dbraw/zinc/31/09/95/301310995.db2.gz	JWVBMWDVCFRWJD-LEWSCRJBSA-N	1	0	262.328	1.943	50	0		CDAARO
OC[C@]1([NH2+]CCc2ccncc2)CCOc2ccccc21	ZINC000289363202	304832419	/nfs/dbraw/zinc/83/24/19/304832419.db2.gz	JBEGJYSONTVJTC-QGZVFWFLSA-N	1	0	284.359	1.884	50	0		CDAARO
CC[C@H](NC(=O)C[NH+]1CCCCCC1)c1ncnn1CC	ZINC000534592849	328318995	/nfs/dbraw/zinc/31/89/95/328318995.db2.gz	UBBGLCFXMIZPKO-ZDUSSCGKSA-N	1	0	293.415	1.741	50	0		CDAARO
O=C(NCc1csc2c1CCCC2)[C@H]1C=CC[NH2+]1	ZINC000534642931	328328985	/nfs/dbraw/zinc/32/89/85/328328985.db2.gz	GXJJDMDJLVQPTJ-GFCCVEGCSA-N	1	0	262.378	1.771	50	0		CDAARO
CC[N@@H+]1CCC[C@@H](Nc2cc(-n3cccn3)ncn2)C1	ZINC000534646467	328329406	/nfs/dbraw/zinc/32/94/06/328329406.db2.gz	DKXFMDZUNRAEDX-GFCCVEGCSA-N	1	0	272.356	1.559	50	0		CDAARO
Cc1nn[nH]c1C(=O)N[C@H](CC[NH+](C)C)c1ccccc1	ZINC000534644086	328329789	/nfs/dbraw/zinc/32/97/89/328329789.db2.gz	IVQVYICGTFATFH-CYBMUJFWSA-N	1	0	287.367	1.536	50	0		CDAARO
O=C(NCCN1CCCc2ccccc21)[C@H]1C=CC[NH2+]1	ZINC000534637901	328334485	/nfs/dbraw/zinc/33/44/85/328334485.db2.gz	NVSPGLKYXIHWKP-CQSZACIVSA-N	1	0	271.364	1.083	50	0		CDAARO
O=S(=O)(c1ccc(Cl)s1)N1C[C@@H]2CC[NH2+][C@@H]2C1	ZINC000534638327	328334691	/nfs/dbraw/zinc/33/46/91/328334691.db2.gz	CETKMLFLPKNPFI-JGVFFNPUSA-N	1	0	292.813	1.384	50	0		CDAARO
Cc1ccoc1C(=O)N[C@H]1COC[C@@H]1[NH+]1CCCCC1	ZINC000534672296	328347990	/nfs/dbraw/zinc/34/79/90/328347990.db2.gz	OSEPBKWZVASEMA-STQMWFEESA-N	1	0	278.352	1.571	50	0		CDAARO
C[NH+]1CCC(OCCCNc2cccc(C(N)=O)n2)CC1	ZINC000534675277	328349078	/nfs/dbraw/zinc/34/90/78/328349078.db2.gz	LTYXNOVJSMXEJF-UHFFFAOYSA-N	1	0	292.383	1.093	50	0		CDAARO
C[C@H](NC(=O)C[NH2+][C@@H]1CCC(C)(C)C[C@H]1C)C(=O)N(C)C	ZINC000097099869	323207463	/nfs/dbraw/zinc/20/74/63/323207463.db2.gz	UFBRVSPVLCKVAZ-FRRDWIJNSA-N	1	0	297.443	1.384	50	0		CDAARO
CC(C)(C)OC(=O)NCCC(=O)NC[C@H]1CCCC[NH2+]1	ZINC000095882073	327203430	/nfs/dbraw/zinc/20/34/30/327203430.db2.gz	CYFGCIDOJKBKNC-LLVKDONJSA-N	1	0	285.388	1.160	50	0		CDAARO
C[C@H](C[NH+]1CCCC1)Nc1ncc(F)c(N(C)C)n1	ZINC001772703856	1159439140	/nfs/dbraw/zinc/43/91/40/1159439140.db2.gz	JRYKWTYSYUNESE-SNVBAGLBSA-N	1	0	267.352	1.578	50	0		CDAARO
OC[C@@]12C[N@@H+](C3CSCCSC3)C[C@@H]1COCC2	ZINC001772706686	1159441089	/nfs/dbraw/zinc/44/10/89/1159441089.db2.gz	XDTIFQKPBFJHDL-DGCLKSJQSA-N	1	0	289.466	1.166	50	0		CDAARO
NCc1nnc(NC[C@@H]2CC[N@@H+](C3CCCCC3)C2)o1	ZINC001772708184	1159442600	/nfs/dbraw/zinc/44/26/00/1159442600.db2.gz	FACGUEIEIYNNIL-NSHDSACASA-N	1	0	279.388	1.595	50	0		CDAARO
O=C(C[N@@H+]1C[C@@H]2[C@H](O)C[C@@H]2C1)NC1CCCCCCC1	ZINC001772712596	1159446841	/nfs/dbraw/zinc/44/68/41/1159446841.db2.gz	UJMXPDOYYDSNDX-VHDGCEQUSA-N	1	0	280.412	1.528	50	0		CDAARO
O=C(Cc1ccc(O)cc1)N1CC[C@@]2(CC[NH2+]C2)C1	ZINC000033426441	482518548	/nfs/dbraw/zinc/51/85/48/482518548.db2.gz	QLGBKHRBXZSXQT-OAHLLOKOSA-N	1	0	260.337	1.147	50	0		CDAARO
Cc1nccn1C[C@H](C)[NH2+]Cc1cnc2cnccn12	ZINC000670426613	482953328	/nfs/dbraw/zinc/95/33/28/482953328.db2.gz	IGDMEWXWKIGXBD-NSHDSACASA-N	1	0	270.340	1.413	50	0		CDAARO
Cn1c(CO)nnc1C1CC[NH+](C[C@H]2CC=CCC2)CC1	ZINC000670444964	482994412	/nfs/dbraw/zinc/99/44/12/482994412.db2.gz	CSEYSHDZJGQUBC-ZDUSSCGKSA-N	1	0	290.411	1.843	50	0		CDAARO
Cc1nn(CCC[NH2+][C@@H](C)CS(C)(=O)=O)c(C)c1C	ZINC000670447842	483002229	/nfs/dbraw/zinc/00/22/29/483002229.db2.gz	OXOBOBZFIYRTEI-JTQLQIEISA-N	1	0	287.429	1.221	50	0		CDAARO
CC(C)=CC[NH+]1CCC2(CC1)CC(=O)NC(=O)C2	ZINC000670454084	483024913	/nfs/dbraw/zinc/02/49/13/483024913.db2.gz	IUXHTDGXLDLZOS-UHFFFAOYSA-N	1	0	250.342	1.471	50	0		CDAARO
C[N@@H+]1CC[C@@](C)(C(=O)NC2(C(N)=O)CCCCCC2)C1	ZINC000670472792	483081637	/nfs/dbraw/zinc/08/16/37/483081637.db2.gz	UUHCUFPQWBUVQA-CQSZACIVSA-N	1	0	281.400	1.023	50	0		CDAARO
Cn1ccnc1SCCNC(=O)C(C)(C)[NH+]1CCCC1	ZINC000426399382	534795850	/nfs/dbraw/zinc/79/58/50/534795850.db2.gz	JJLDENHAIUFFOA-UHFFFAOYSA-N	1	0	296.440	1.503	50	0		CDAARO
Cc1nn(C)c(C)c1C(=O)NCCNc1cc[nH+]cc1C	ZINC000223710578	527609624	/nfs/dbraw/zinc/60/96/24/527609624.db2.gz	WJKTWDQTUPINQC-UHFFFAOYSA-N	1	0	287.367	1.582	50	0		CDAARO
CCNC(=O)N1CCC([NH2+]C[C@@](C)(O)[C@H](C)CC)CC1	ZINC000096492710	528126224	/nfs/dbraw/zinc/12/62/24/528126224.db2.gz	NRCVVNFRXIFIPG-IUODEOHRSA-N	1	0	285.432	1.567	50	0		CDAARO
COc1ccc(C[C@H](C)[NH2+]C2CCN(C)CC2)cn1	ZINC000414058011	536523320	/nfs/dbraw/zinc/52/33/20/536523320.db2.gz	GOCRLGKKPPKBML-LBPRGKRZSA-N	1	0	263.385	1.705	50	0		CDAARO
CCOc1ccc(C[NH2+]CCc2nnc[nH]2)cc1OCC	ZINC000119129588	538162219	/nfs/dbraw/zinc/16/22/19/538162219.db2.gz	WWFVMFBBQISBBU-UHFFFAOYSA-N	1	0	290.367	1.934	50	0		CDAARO
CO[C@@H]1C=CC2=CC[N@@H+]3CCC4=C(CC(=O)OC4)[C@]23C1	ZINC000071782775	567902203	/nfs/dbraw/zinc/90/22/03/567902203.db2.gz	PXWINCSLFXUWBZ-CJNGLKHVSA-N	1	0	273.332	1.589	50	0		CDAARO
Cc1[nH+]c2ccccc2c(N2CCO[C@H](C(N)=O)C2)c1C	ZINC000097085938	567904129	/nfs/dbraw/zinc/90/41/29/567904129.db2.gz	VVSLGZRDYCUMQZ-AWEZNQCLSA-N	1	0	285.347	1.542	50	0		CDAARO
COCCNC(=O)C12CC(C1)C[N@@H+]2Cc1ccccc1	ZINC000097124397	567904721	/nfs/dbraw/zinc/90/47/21/567904721.db2.gz	PYDOHJRNGUXFGP-UHFFFAOYSA-N	1	0	274.364	1.414	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@](O)([C@@H]([NH3+])C2CC2)C1	ZINC000958528543	613980879	/nfs/dbraw/zinc/98/08/79/613980879.db2.gz	QEBFZINDPCOVGI-GXFFZTMASA-N	1	0	256.346	1.096	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](CNC(=O)C2CCCC2)C1	ZINC000952966931	616349067	/nfs/dbraw/zinc/34/90/67/616349067.db2.gz	XPAPQEJYLNWHBE-CYBMUJFWSA-N	1	0	268.401	1.651	50	0		CDAARO
CNC(=O)CCc1ccccc1NC(=O)C1([NH3+])CCCC1	ZINC000952979421	616588215	/nfs/dbraw/zinc/58/82/15/616588215.db2.gz	NUHKFRGYDBSVJW-UHFFFAOYSA-N	1	0	289.379	1.575	50	0		CDAARO
C[C@@H]1[NH2+]CCN(C(=O)C[C@H](O)c2ccccc2)[C@H]1C	ZINC000888096873	617760412	/nfs/dbraw/zinc/76/04/12/617760412.db2.gz	UXQMATVNQFZIBY-OBJOEFQTSA-N	1	0	262.353	1.319	50	0		CDAARO
CO[C@@H]1CCC[C@]12CCC[N@H+](CCS(C)(=O)=O)C2	ZINC001704313331	1177685474	/nfs/dbraw/zinc/68/54/74/1177685474.db2.gz	LIEQMBGUMKBSQF-CHWSQXEVSA-N	1	0	275.414	1.312	50	0		CDAARO
CC[C@@H]1CN(c2ccc(C(C)=O)cn2)CC[N@@H+]1C[C@H](C)O	ZINC000248122607	822702738	/nfs/dbraw/zinc/70/27/38/822702738.db2.gz	UPYWRZSLARMSRE-SWLSCSKDSA-N	1	0	291.395	1.566	50	0		CDAARO
Cc1cccc(CCSc2nnc(C[NH3+])n2C)n1	ZINC000399803055	824164034	/nfs/dbraw/zinc/16/40/34/824164034.db2.gz	WYLLRAAHNXNLSN-UHFFFAOYSA-N	1	0	263.370	1.312	50	0		CDAARO
C[N@@H+]1CCCN(Cc2coc3ccccc3c2=O)CC1	ZINC000019537201	824233798	/nfs/dbraw/zinc/23/37/98/824233798.db2.gz	HPUWJRMWLBSGIM-UHFFFAOYSA-N	1	0	272.348	1.931	50	0		CDAARO
COc1ncccc1CN(CC[NH+](C)C)C[C@@H]1CCCO1	ZINC000952975822	828683072	/nfs/dbraw/zinc/68/30/72/828683072.db2.gz	XOZZVHBLZMOOBZ-HNNXBMFYSA-N	1	0	293.411	1.633	50	0		CDAARO
CC(C)=CC(=O)NCC1(C[NH+]2CCN(C)CC2)CC1	ZINC000067803892	824798502	/nfs/dbraw/zinc/79/85/02/824798502.db2.gz	CIHNASXHCMMOHK-UHFFFAOYSA-N	1	0	265.401	1.096	50	0		CDAARO
CC[C@H]1CN(CCn2ccnc2C)CC[N@@H+]1C(C)C	ZINC000244796029	825943164	/nfs/dbraw/zinc/94/31/64/825943164.db2.gz	RRSHDOSXWAJZGY-HNNXBMFYSA-N	1	0	264.417	1.996	50	0		CDAARO
c1c(CN2CCc3ncccc3C2)nn2c1C[NH2+]CCC2	ZINC000072167048	826161961	/nfs/dbraw/zinc/16/19/61/826161961.db2.gz	MTWFNYGFOASYTG-UHFFFAOYSA-N	1	0	283.379	1.330	50	0		CDAARO
CC[NH+](CC)CCNc1nc2nonc2nc1NC1CC1	ZINC000012573138	826322766	/nfs/dbraw/zinc/32/27/66/826322766.db2.gz	VHVUUDZBAQJCSR-UHFFFAOYSA-N	1	0	291.359	1.341	50	0		CDAARO
Cc1cnc(NCCC[N@@H+]2CCC[C@@H](O)C2)nc1N(C)C	ZINC000952964593	826360061	/nfs/dbraw/zinc/36/00/61/826360061.db2.gz	MQEWJRIIXYHQEM-CYBMUJFWSA-N	1	0	293.415	1.110	50	0		CDAARO
CCc1cc(N[C@H]2CCNC2=O)nc(N2CCCCC2)[nH+]1	ZINC000065489145	826829194	/nfs/dbraw/zinc/82/91/94/826829194.db2.gz	SITFRTGUZYWUCV-LBPRGKRZSA-N	1	0	289.383	1.330	50	0		CDAARO
O=C(N1CCCC1)[C@]12CC[NH2+][C@H]1CO[C@@H]2c1ccccc1	ZINC001481525154	901068124	/nfs/dbraw/zinc/06/81/24/901068124.db2.gz	SRIYSQBDUVYQSO-ZMSDIMECSA-N	1	0	286.375	1.729	50	0		CDAARO
Cc1n[nH]c(CNCC[N@@H+]2CCC[C@@H](CO)C2)c1Cl	ZINC000952869619	910419951	/nfs/dbraw/zinc/41/99/51/910419951.db2.gz	KLBCUSNJFVFOQU-LLVKDONJSA-N	1	0	286.807	1.165	50	0		CDAARO
C[C@@H](Cn1ccnc1)[N@@H+]1CCCN(C(=O)C2CCC2)CC1	ZINC000821751103	925595716	/nfs/dbraw/zinc/59/57/16/925595716.db2.gz	FWFJNARUBLFHQD-AWEZNQCLSA-N	1	0	290.411	1.606	50	0		CDAARO
C[NH+]1CCC2(CC[N@H+](Cc3c[nH]nc3C(=O)[O-])C2)CC1	ZINC000823770053	925726456	/nfs/dbraw/zinc/72/64/56/925726456.db2.gz	JWUDIPVXMQBMKX-UHFFFAOYSA-N	1	0	278.356	1.026	50	0		CDAARO
COCCC1([NH+](C)C)CCN(C(=O)c2cnccn2)CC1	ZINC000581804883	927204272	/nfs/dbraw/zinc/20/42/72/927204272.db2.gz	LIRSLHRWAXUUHU-UHFFFAOYSA-N	1	0	292.383	1.050	50	0		CDAARO
CCNC(=O)OC[C@H]1CCCC[N@@H+]1Cc1c[nH]nc1C	ZINC000585084504	930875330	/nfs/dbraw/zinc/87/53/30/930875330.db2.gz	JINLMYDIWWUTQS-CYBMUJFWSA-N	1	0	280.372	1.819	50	0		CDAARO
O[C@H]1C[NH2+]CCN(Cc2ccccc2-c2ccco2)C1	ZINC000219615030	930897204	/nfs/dbraw/zinc/89/72/04/930897204.db2.gz	NOXXAYCNEQBRNJ-AWEZNQCLSA-N	1	0	272.348	1.713	50	0		CDAARO
C[C@@H]1NC(=O)[C@H](C)N(CCO[C@@H]2CCCCO2)[C@H]1C	ZINC000585116153	930968251	/nfs/dbraw/zinc/96/82/51/930968251.db2.gz	JEKDMRYBXRSVPJ-ZDEQEGDKSA-N	1	0	270.373	1.127	50	0		CDAARO
CC(C)(C(=O)N1CC[C@@H](CCO)C1)[NH+]1CCCCC1	ZINC000585129302	931014549	/nfs/dbraw/zinc/01/45/49/931014549.db2.gz	FDPWHICCCYXJSG-ZDUSSCGKSA-N	1	0	268.401	1.482	50	0		CDAARO
Cc1cc(C[C@@H]2C[N@H+](Cc3cccnc3)C[C@@H]2O)on1	ZINC001529184993	969006996	/nfs/dbraw/zinc/00/69/96/969006996.db2.gz	HGOSHYDGPDBMNR-HIFRSBDPSA-N	1	0	273.336	1.413	50	0		CDAARO
CC(C)Sc1nnc(NC(=O)[C@H]2CCC[NH2+]C2)s1	ZINC001506421444	975158116	/nfs/dbraw/zinc/15/81/16/975158116.db2.gz	PQZCATVBZPCDMT-QMMMGPOBSA-N	1	0	286.426	1.977	50	0		CDAARO
CN(C)c1ccnc(N[C@H]2CCC[C@@H](CO)C2)n1	ZINC001506422095	975158139	/nfs/dbraw/zinc/15/81/39/975158139.db2.gz	OMPAPMAJPNCHIK-MNOVXSKESA-N	1	0	250.346	1.506	50	0		CDAARO
O=C(NCCC[N@H+]1CCC[C@@H]1CO)C1CCCC1	ZINC000096461789	230378059	/nfs/dbraw/zinc/37/80/59/230378059.db2.gz	YJTJXSONTLXKCD-CYBMUJFWSA-N	1	0	254.374	1.140	50	0		CDAARO
Cc1cccc(CCNC(=O)[C@@H](C)[NH+]2CCCC2)n1	ZINC000223890329	230399256	/nfs/dbraw/zinc/39/92/56/230399256.db2.gz	VDIARWKACCJSTJ-CYBMUJFWSA-N	1	0	261.369	1.533	50	0		CDAARO
Cn1c(SCC[C@@H]2CCOC2)nnc1C1CC[NH2+]CC1	ZINC000426633869	230425102	/nfs/dbraw/zinc/42/51/02/230425102.db2.gz	JYDKIGNQKFANMN-NSHDSACASA-N	1	0	296.440	1.801	50	0		CDAARO
CC(C)[C@@H]1C[N@H+](C)CCN1Cc1cnc2ncccn12	ZINC000097376900	342002985	/nfs/dbraw/zinc/00/29/85/342002985.db2.gz	FEPVCUHERZUJSU-AWEZNQCLSA-N	1	0	273.384	1.501	50	0		CDAARO
CC[C@H]([NH2+]C1CCSCC1)C(=O)N1CCOCC1	ZINC000095969090	185048138	/nfs/dbraw/zinc/04/81/38/185048138.db2.gz	FNGJREIJKMWTDC-LBPRGKRZSA-N	1	0	272.414	1.109	50	0		CDAARO
CCC[N@H+](CC(N)=O)[C@@H](C)CC(=O)Nc1ccccc1	ZINC000241923323	361754804	/nfs/dbraw/zinc/75/48/04/361754804.db2.gz	UEZUUSDLBFYWFH-LBPRGKRZSA-N	1	0	277.368	1.601	50	0		CDAARO
COc1ccccc1CCNC(=O)C[C@H]1CC[NH2+]C1	ZINC000127801044	187333487	/nfs/dbraw/zinc/33/34/87/187333487.db2.gz	QRGGWZCUPAYKCJ-GFCCVEGCSA-N	1	0	262.353	1.354	50	0		CDAARO
COc1ccc(-c2cc(N3CC[NH2+]CC3)n[nH]2)cc1	ZINC000062669899	365614090	/nfs/dbraw/zinc/61/40/90/365614090.db2.gz	SKUHJRQOSZXXJW-UHFFFAOYSA-N	1	0	258.325	1.495	50	0		CDAARO
CCOCC(C)(C)NC(=O)[C@@H]1CC12CC[NH2+]CC2	ZINC000386201077	342090024	/nfs/dbraw/zinc/09/00/24/342090024.db2.gz	UYKKYLUBZMPDIO-NSHDSACASA-N	1	0	254.374	1.307	50	0		CDAARO
CC(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2CO)cc1	ZINC000004948369	342089067	/nfs/dbraw/zinc/08/90/67/342089067.db2.gz	AJAAWXFYHFPWRQ-OAHLLOKOSA-N	1	0	262.353	1.992	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1cc(F)c(C)cc1F	ZINC000195544653	342626709	/nfs/dbraw/zinc/62/67/09/342626709.db2.gz	ABXJEZYJCCFDJU-SECBINFHSA-N	1	0	292.351	1.679	50	0		CDAARO
O=C1C[C@H]([NH2+]C2CCOCC2)CN1c1ccccc1	ZINC000095421060	539087963	/nfs/dbraw/zinc/08/79/63/539087963.db2.gz	OILBZHAAFSYPDS-ZDUSSCGKSA-N	1	0	260.337	1.561	50	0		CDAARO
C[C@H](C(=O)Nc1ccccn1)[N@H+](C)CC1(CO)CCCC1	ZINC000244724540	361860767	/nfs/dbraw/zinc/86/07/67/361860767.db2.gz	MWAYNGZMQJJLSL-CYBMUJFWSA-N	1	0	291.395	1.893	50	0		CDAARO
NC(=O)NC(=O)CC[N@@H+]1CCC[C@@H]1/C=C/c1ccccc1	ZINC000253425910	361938578	/nfs/dbraw/zinc/93/85/78/361938578.db2.gz	ULNHNVOVNWBCEQ-MYSGNRETSA-N	1	0	287.363	1.749	50	0		CDAARO
CC(C)[N@@H+]1CC[C@H](CNC(=O)N(C)CC2CCOCC2)C1	ZINC000097032339	185156227	/nfs/dbraw/zinc/15/62/27/185156227.db2.gz	IILQQJWNQRGIMR-OAHLLOKOSA-N	1	0	297.443	1.785	50	0		CDAARO
CCC1(CC)[C@H](NC(=O)Cn2ccnc2)[C@H](C)[C@@H]1OC	ZINC000092769682	361972338	/nfs/dbraw/zinc/97/23/38/361972338.db2.gz	FEEMKSHXMUKGFH-YUTCNCBUSA-N	1	0	279.384	1.839	50	0		CDAARO
C[C@@H]1CC[NH2+][C@@H](C)[C@@H]1NC(=O)c1cccc(CO)c1	ZINC000585136454	342216046	/nfs/dbraw/zinc/21/60/46/342216046.db2.gz	GZXMHUZKWHCYIN-UHIISALHSA-N	1	0	262.353	1.295	50	0		CDAARO
CC1(C)CNC(=O)[C@H]1[NH2+]C[C@H](c1ccco1)N1CCCC1	ZINC000585134640	342215579	/nfs/dbraw/zinc/21/55/79/342215579.db2.gz	DFVZVXRBZFVQHQ-TZMCWYRMSA-N	1	0	291.395	1.531	50	0		CDAARO
CCCS(=O)(=O)N1C[C@@H]2[C@H]3CCCC[N@H+]3C[C@H]2C1	ZINC000249695591	539069300	/nfs/dbraw/zinc/06/93/00/539069300.db2.gz	RFNYQIDRRWCEMC-RWMBFGLXSA-N	1	0	272.414	1.142	50	0		CDAARO
Cc1cc[nH+]c(NC[C@@H]2CCN([C@H]3CCOC3=O)C2)c1	ZINC000247838090	342241720	/nfs/dbraw/zinc/24/17/20/342241720.db2.gz	ODBBIHYUFPAAHP-STQMWFEESA-N	1	0	275.352	1.439	50	0		CDAARO
C[NH+](C)C1(CNS(=O)(=O)N2CCCC2)CCCCC1	ZINC000078722261	342339982	/nfs/dbraw/zinc/33/99/82/342339982.db2.gz	IEYIONVFSNTRJY-UHFFFAOYSA-N	1	0	289.445	1.181	50	0		CDAARO
CC(C)N(C)C(=O)[C@H](C)[NH2+][C@@H]1CCCC[C@H]1CO	ZINC000252585328	342385744	/nfs/dbraw/zinc/38/57/44/342385744.db2.gz	HTSJNNVPSBIAJK-RWMBFGLXSA-N	1	0	256.390	1.382	50	0		CDAARO
C[C@@H](CNC(=O)[C@H](C)[NH+]1CCCCCC1)C[C@H](C)O	ZINC000110652160	342432594	/nfs/dbraw/zinc/43/25/94/342432594.db2.gz	UCPWUTNGQFGRQB-RDBSUJKOSA-N	1	0	270.417	1.774	50	0		CDAARO
CC[C@@H](C)c1cc(C(=O)N2CC[C@@H](C[NH3+])C2)on1	ZINC000178532403	362245081	/nfs/dbraw/zinc/24/50/81/362245081.db2.gz	GOXNRPXVIBQZBE-ZJUUUORDSA-N	1	0	251.330	1.609	50	0		CDAARO
O=C(N[C@@H]1C[NH2+]C[C@@H](F)C1)OCc1ccccc1	ZINC000110915986	343762182	/nfs/dbraw/zinc/76/21/82/343762182.db2.gz	ABEYDAZZAVWOEL-RYUDHWBXSA-N	1	0	252.289	1.613	50	0		CDAARO
Cc1ccc(OCC(=O)N(C)[C@H]2CC[NH2+]C2)c(C)c1	ZINC000179097443	362253307	/nfs/dbraw/zinc/25/33/07/362253307.db2.gz	HUOFNQVXHBTXQU-ZDUSSCGKSA-N	1	0	262.353	1.503	50	0		CDAARO
C[C@@H]1CN(C(=O)COc2cccc(F)c2)C[C@H](C)[NH2+]1	ZINC000179163490	362253857	/nfs/dbraw/zinc/25/38/57/362253857.db2.gz	AXWHKRUYDLJJCE-PHIMTYICSA-N	1	0	266.316	1.413	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)Cc1ccccc1Br	ZINC000084719041	362270962	/nfs/dbraw/zinc/27/09/62/362270962.db2.gz	DNCLZWJPAOAYQB-JTQLQIEISA-N	1	0	297.196	1.812	50	0		CDAARO
C[C@H]1CN(C(=O)c2cc(F)c(F)c(F)c2)CC[NH2+]1	ZINC000088059200	362302400	/nfs/dbraw/zinc/30/24/00/362302400.db2.gz	JZSFDFYMBKVXBD-ZETCQYMHSA-N	1	0	258.243	1.538	50	0		CDAARO
CCn1ccc(CN2CCC[C@@H](c3n[nH]c(C)n3)C2)n1	ZINC000252478185	362383257	/nfs/dbraw/zinc/38/32/57/362383257.db2.gz	AFGUAJYEVZQTNW-GFCCVEGCSA-N	1	0	274.372	1.709	50	0		CDAARO
Cn1ccc(NC(=O)C[NH+]2CCCCCCC2)n1	ZINC000252482163	362384510	/nfs/dbraw/zinc/38/45/10/362384510.db2.gz	CZVMAAYMFFQFMM-UHFFFAOYSA-N	1	0	250.346	1.625	50	0		CDAARO
Cc1cccnc1CN(C)c1cc([C@H]2C[C@@H]([NH3+])C2)nc(N)n1	ZINC000252537342	362391757	/nfs/dbraw/zinc/39/17/57/362391757.db2.gz	KYSSPKQNHDUYDR-TXEJJXNPSA-N	1	0	298.394	1.603	50	0		CDAARO
CCn1c(CN(C)Cc2ccon2)nnc1[C@H]1C[C@@H]([NH3+])C1	ZINC000252527623	362391834	/nfs/dbraw/zinc/39/18/34/362391834.db2.gz	DADQFQKTZRMHIR-PHIMTYICSA-N	1	0	290.371	1.123	50	0		CDAARO
NC(=O)C1(C[NH2+]Cc2ccc(Cl)cc2)CCOCC1	ZINC000086250482	179255780	/nfs/dbraw/zinc/25/57/80/179255780.db2.gz	KWYWHSCDEIDVBS-UHFFFAOYSA-N	1	0	282.771	1.712	50	0		CDAARO
COC(C)(C)CCNC(=O)[C@@H]1CCCN1C1CC[NH2+]CC1	ZINC000584886886	349345348	/nfs/dbraw/zinc/34/53/48/349345348.db2.gz	AHVFVRAFNKQYLB-AWEZNQCLSA-N	1	0	297.443	1.134	50	0		CDAARO
O=C(NCC1([NH+]2CCCCC2)CCCC1)c1cn[nH]n1	ZINC000584893831	349353350	/nfs/dbraw/zinc/35/33/50/349353350.db2.gz	UJOCLVLROQMPQO-UHFFFAOYSA-N	1	0	277.372	1.333	50	0		CDAARO
C[C@H](NC1CC[NH+](Cc2ccco2)CC1)c1ncnn1C	ZINC000584895482	349356096	/nfs/dbraw/zinc/35/60/96/349356096.db2.gz	KLEJXGREYUTABD-LBPRGKRZSA-N	1	0	289.383	1.723	50	0		CDAARO
CC1(C)CCC[C@@H]1[NH2+]CCNS(=O)(=O)c1cccnc1	ZINC000090585092	180009258	/nfs/dbraw/zinc/00/92/58/180009258.db2.gz	KBQOSOVUPFQHBN-ZDUSSCGKSA-N	1	0	297.424	1.528	50	0		CDAARO
CCCn1ncc(C(=O)N(C)CCC[NH+](C)C)c1C	ZINC000091351221	180137840	/nfs/dbraw/zinc/13/78/40/180137840.db2.gz	HUBXMVMUPWNAOU-UHFFFAOYSA-N	1	0	266.389	1.625	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@@H]1NC(=O)c1cc(F)ccc1F	ZINC000091496491	180171743	/nfs/dbraw/zinc/17/17/43/180171743.db2.gz	MKIJMIQMGVEXRM-UFBFGSQYSA-N	1	0	254.280	1.835	50	0		CDAARO
CCn1nc(CC(C)C)cc1C(=O)NC[C@@H]1C[C@H](F)C[NH2+]1	ZINC000091551257	180188750	/nfs/dbraw/zinc/18/87/50/180188750.db2.gz	ITDIGRUYFAGJCJ-AAEUAGOBSA-N	1	0	296.390	1.531	50	0		CDAARO
O=C1N(C2CCCC2)CCC[C@]12CC[N@@H+](CCCO)C2	ZINC000091649685	180216265	/nfs/dbraw/zinc/21/62/65/180216265.db2.gz	POJHEXKAIMKVTR-MRXNPFEDSA-N	1	0	280.412	1.626	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)c2cnn(-c3ccccc3)c2)C[C@@H]1C1CC1	ZINC000091663205	180219637	/nfs/dbraw/zinc/21/96/37/180219637.db2.gz	SDZZWFKDSWOCBD-CVEARBPZSA-N	1	0	296.374	1.682	50	0		CDAARO
Cc1ncsc1CN1CCC[C@H]1C[N@@H+]1CCC[C@H]1CO	ZINC000110702380	350281701	/nfs/dbraw/zinc/28/17/01/350281701.db2.gz	JKENYPXAEQBNHO-KBPBESRZSA-N	1	0	295.452	1.873	50	0		CDAARO
CN(C)c1ccc(CN2C[C@H]([NH+](C)C)[C@@H](C3CC3)C2)cn1	ZINC000091809076	180261135	/nfs/dbraw/zinc/26/11/35/180261135.db2.gz	GEAAVOOVCYXCHV-CVEARBPZSA-N	1	0	288.439	1.920	50	0		CDAARO
Cc1n[nH]c(CCNc2cc(C(C)C)[nH+]c(N)n2)n1	ZINC000091997793	180302908	/nfs/dbraw/zinc/30/29/08/180302908.db2.gz	RMGCXDZXULPMFO-UHFFFAOYSA-N	1	0	261.333	1.263	50	0		CDAARO
C[C@@H](C(=O)NCC[N@@H+]1CCC[C@H](C)C1)n1cccn1	ZINC000106563363	186127395	/nfs/dbraw/zinc/12/73/95/186127395.db2.gz	STCXRFWUHRZVNB-STQMWFEESA-N	1	0	264.373	1.292	50	0		CDAARO
C[C@H](C(=O)N1CCC[C@H](C(N)=O)C1)[N@@H+]1CCC[C@@H](C)CC1	ZINC000106834370	186139267	/nfs/dbraw/zinc/13/92/67/186139267.db2.gz	MNQIBZMAQPZHJO-MCIONIFRSA-N	1	0	295.427	1.221	50	0		CDAARO
CC[N@H+](CCNC(=O)N1CC[C@H]([C@H](C)O)C1)C(C)C	ZINC000108468672	186218503	/nfs/dbraw/zinc/21/85/03/186218503.db2.gz	ZRGZCBUHMRVFJE-STQMWFEESA-N	1	0	271.405	1.129	50	0		CDAARO
C[C@@H](NC(=O)CCc1ccncc1)[C@@H]1CCCC[NH2+]1	ZINC000583651209	366008769	/nfs/dbraw/zinc/00/87/69/366008769.db2.gz	GYXDMLQLCVANAD-OCCSQVGLSA-N	1	0	261.369	1.661	50	0		CDAARO
C[C@@H]1C[C@H](CNC(=O)NC[C@H]2CCCC[N@H+](C)C2)[C@H](C)O1	ZINC000624207762	351481247	/nfs/dbraw/zinc/48/12/47/351481247.db2.gz	PXGYLTIJZICRKH-LXTVHRRPSA-N	1	0	297.443	1.831	50	0		CDAARO
[NH3+]C[C@@H]1CCCN1C(=O)Cc1cccc(Cl)c1	ZINC000122332326	187027021	/nfs/dbraw/zinc/02/70/21/187027021.db2.gz	VEEJZMGUTOTBQC-LBPRGKRZSA-N	1	0	252.745	1.832	50	0		CDAARO
[NH3+]C[C@H]1CCCN1S(=O)(=O)c1cc(F)ccc1Cl	ZINC000123946533	187116090	/nfs/dbraw/zinc/11/60/90/187116090.db2.gz	NHENOVVXOQTHDV-SECBINFHSA-N	1	0	292.763	1.591	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](NC(=O)N(C)Cc2cscn2)C1	ZINC000265502436	363331945	/nfs/dbraw/zinc/33/19/45/363331945.db2.gz	DIKGDYNCNQQDHX-LLVKDONJSA-N	1	0	298.412	1.005	50	0		CDAARO
COc1cc(CSC2=[NH+]CCN2)cc(OC)c1OC	ZINC000000137632	355890747	/nfs/dbraw/zinc/89/07/47/355890747.db2.gz	LCIOWLQROFJBRK-UHFFFAOYSA-N	1	0	282.365	1.905	50	0		CDAARO
COCC[NH2+][C@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000001529143	355939252	/nfs/dbraw/zinc/93/92/52/355939252.db2.gz	PXCLVBLJRPLSEC-SNVBAGLBSA-N	1	0	257.355	1.387	50	0		CDAARO
CC(C)c1cccc(OCCOCC[NH2+]CCO)c1	ZINC000002980654	355990207	/nfs/dbraw/zinc/99/02/07/355990207.db2.gz	WQSDZZOUNHRFLC-UHFFFAOYSA-N	1	0	267.369	1.787	50	0		CDAARO
Cc1c(C)n(C[C@@H](O)C[NH2+]CCCO)c2ccccc12	ZINC000003904539	356012664	/nfs/dbraw/zinc/01/26/64/356012664.db2.gz	GDVLDDOMEVYIQI-AWEZNQCLSA-N	1	0	276.380	1.591	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)/C=C\c2c(F)cccc2F)C1	ZINC000255207695	356017999	/nfs/dbraw/zinc/01/79/99/356017999.db2.gz	ALAQADWFNWHIKY-GFVADAIESA-N	1	0	266.291	1.928	50	0		CDAARO
C[C@H]([NH2+][C@@H](C)[C@@H]1CCCO1)c1nnnn1-c1ccccc1	ZINC000097373262	356093633	/nfs/dbraw/zinc/09/36/33/356093633.db2.gz	WFTZHWHSWLCKDZ-OBJOEFQTSA-N	1	0	287.367	1.880	50	0		CDAARO
CC[C@H]([NH2+]Cc1cccnc1)C(=O)Nc1cc(C)on1	ZINC000097495044	356176952	/nfs/dbraw/zinc/17/69/52/356176952.db2.gz	LKQSBEKDGWNDFJ-LBPRGKRZSA-N	1	0	274.324	1.885	50	0		CDAARO
CCn1cnnc1[C@H](C)Nc1cc(C)[nH+]c(N(C)C)n1	ZINC000032547834	356230735	/nfs/dbraw/zinc/23/07/35/356230735.db2.gz	DFESDCMFPOXLFP-JTQLQIEISA-N	1	0	275.360	1.636	50	0		CDAARO
C[C@H]1C[C@H](C)C[NH+](CC(=O)N(C)CC(=O)NC(C)(C)C)C1	ZINC000012797018	356325387	/nfs/dbraw/zinc/32/53/87/356325387.db2.gz	ACBPUPVYUOZDKA-STQMWFEESA-N	1	0	297.443	1.337	50	0		CDAARO
CN(C)C(=O)COC1CC[NH+](Cc2ccccc2)CC1	ZINC000012359786	356294958	/nfs/dbraw/zinc/29/49/58/356294958.db2.gz	WYGXZOIPPPSCFH-UHFFFAOYSA-N	1	0	276.380	1.756	50	0		CDAARO
COCCC[NH2+]Cc1ccc2c(c1)n(C)c(=O)n2C	ZINC000013718136	356354651	/nfs/dbraw/zinc/35/46/51/356354651.db2.gz	OBSRFJOSVCPZJH-UHFFFAOYSA-N	1	0	263.341	1.003	50	0		CDAARO
C[C@H](C(N)=O)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000032652207	356330158	/nfs/dbraw/zinc/33/01/58/356330158.db2.gz	SUSHMTQXTFULRW-LHRNQBEKSA-N	1	0	273.380	1.191	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](n2cc(C(=O)NC(C)C)nn2)C1	ZINC000014988867	356403382	/nfs/dbraw/zinc/40/33/82/356403382.db2.gz	MJTWUURVUAVADU-LBPRGKRZSA-N	1	0	279.388	1.463	50	0		CDAARO
COc1ccc(CN2CC[NH2+]C[C@H]2CCO)c(C)c1C	ZINC000019367995	356482985	/nfs/dbraw/zinc/48/29/85/356482985.db2.gz	SSWVGAQGUIIKGK-OAHLLOKOSA-N	1	0	278.396	1.468	50	0		CDAARO
C[NH+](C)/C=C/C=C1\CC(=O)N(c2ccccc2)C1=O	ZINC000018060977	356466475	/nfs/dbraw/zinc/46/64/75/356466475.db2.gz	SNADLNWTQWDSFM-QXZILWSFSA-N	1	0	256.305	1.952	50	0		CDAARO
C[C@H](CC[NH+]1CCN(CCO)CC1)c1ccccc1	ZINC000019633350	356494394	/nfs/dbraw/zinc/49/43/94/356494394.db2.gz	OAESXBMHRFBBKS-OAHLLOKOSA-N	1	0	262.397	1.790	50	0		CDAARO
CN(C)CC[NH2+]Cc1cccc(Oc2ncccn2)c1	ZINC000022937309	356625227	/nfs/dbraw/zinc/62/52/27/356625227.db2.gz	ZCGJRSFBALILDU-UHFFFAOYSA-N	1	0	272.352	1.920	50	0		CDAARO
Cc1cccc(C[NH+]2CCN(CCOCCO)CC2)c1	ZINC000023114732	356628882	/nfs/dbraw/zinc/62/88/82/356628882.db2.gz	AGDXHQNGMMMGAD-UHFFFAOYSA-N	1	0	278.396	1.122	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)C1	ZINC000247129448	356668878	/nfs/dbraw/zinc/66/88/78/356668878.db2.gz	NMCQEBHVPJQZPZ-XHVZSJERSA-N	1	0	280.318	1.876	50	0		CDAARO
Nc1cc(Cl)ccc1N1CC[NH+](CCO)CC1	ZINC000025778684	356682732	/nfs/dbraw/zinc/68/27/32/356682732.db2.gz	PHNNTQSQURBDKC-UHFFFAOYSA-N	1	0	255.749	1.037	50	0		CDAARO
COc1cccc(C[NH2+]C2CCN(C(C)=O)CC2)c1	ZINC000034995965	356825780	/nfs/dbraw/zinc/82/57/80/356825780.db2.gz	LRZPXTARPWDRLR-UHFFFAOYSA-N	1	0	262.353	1.796	50	0		CDAARO
C[C@H]1Oc2ccc(C(=O)C3CC[NH2+]CC3)cc2N(C)C1=O	ZINC000036244096	356867085	/nfs/dbraw/zinc/86/70/85/356867085.db2.gz	CNGLSGOXRQPNJH-SNVBAGLBSA-N	1	0	288.347	1.613	50	0		CDAARO
COc1cc(S(=O)(=O)N2CCN(C)CC2)c(C)cc1C	ZINC000035993526	356854129	/nfs/dbraw/zinc/85/41/29/356854129.db2.gz	XZPHFVMVZXMMPY-UHFFFAOYSA-N	1	0	298.408	1.248	50	0		CDAARO
C[C@@H](C[NH2+]CC1(C(N)=O)CCOCC1)c1ccccc1	ZINC000194204805	358512974	/nfs/dbraw/zinc/51/29/74/358512974.db2.gz	RDOPRXDDJUGELO-ZDUSSCGKSA-N	1	0	276.380	1.662	50	0		CDAARO
O=C(OC[C@H]1CCC[NH2+]C1)C(Cl)(Cl)Cl	ZINC000042768656	357079789	/nfs/dbraw/zinc/07/97/89/357079789.db2.gz	FBTYVGIYSPRIPD-LURJTMIESA-N	1	0	260.548	1.899	50	0		CDAARO
COCCN(Cc1cccs1)C(=O)[C@H]1CC[NH2+]C1	ZINC000055384341	357333459	/nfs/dbraw/zinc/33/34/59/357333459.db2.gz	CMVKVZRHOCKVLC-NSHDSACASA-N	1	0	268.382	1.333	50	0		CDAARO
CS[C@H]1CC[C@@H]([N@H+](C)CCS(C)(=O)=O)C1	ZINC000096441614	357473528	/nfs/dbraw/zinc/47/35/28/357473528.db2.gz	BGHRXVUIZYPYNM-ZJUUUORDSA-N	1	0	251.417	1.247	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)NCCNc1cccnc1	ZINC000065405848	357539270	/nfs/dbraw/zinc/53/92/70/357539270.db2.gz	LBJUHQFJSHWLMH-UHFFFAOYSA-N	1	0	276.384	1.486	50	0		CDAARO
CCc1nccn1CCC[NH2+][C@@H]1CCCN(CC)C1	ZINC000065461407	357543753	/nfs/dbraw/zinc/54/37/53/357543753.db2.gz	TTXJGRNDBFSAAU-CQSZACIVSA-N	1	0	264.417	1.910	50	0		CDAARO
CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1Cc1ccc(OC)nn1	ZINC000283223917	357545320	/nfs/dbraw/zinc/54/53/20/357545320.db2.gz	SYDUPZFXXHTSPL-UONOGXRCSA-N	1	0	276.384	1.544	50	0		CDAARO
CC[C@H]1C[N@@H+]2CCC[C@H]2CN1Cc1ccc(OC)nn1	ZINC000283223911	357546019	/nfs/dbraw/zinc/54/60/19/357546019.db2.gz	SYDUPZFXXHTSPL-KBPBESRZSA-N	1	0	276.384	1.544	50	0		CDAARO
CCN(Cc1ccccc1)C(=O)CC[N@@H+]1CCC[C@H]1CO	ZINC000065508838	357547114	/nfs/dbraw/zinc/54/71/14/357547114.db2.gz	DLAWNETUWKSZPU-INIZCTEOSA-N	1	0	290.407	1.882	50	0		CDAARO
C=Cc1cccc(C[N@H+]2CCC[C@H](CNC(=O)CO)C2)c1	ZINC000067723511	357621533	/nfs/dbraw/zinc/62/15/33/357621533.db2.gz	KDQLKIQQZFHKEZ-MRXNPFEDSA-N	1	0	288.391	1.650	50	0		CDAARO
C[NH+]1CCC(CNC(=O)C(=O)NC2CCCCCC2)CC1	ZINC000022999050	357581704	/nfs/dbraw/zinc/58/17/04/357581704.db2.gz	VGRRNXQRFADDNG-UHFFFAOYSA-N	1	0	295.427	1.283	50	0		CDAARO
Cc1cc(F)cc(S(=O)(=O)NC(C)(C)C[NH3+])c1	ZINC000097229439	358043651	/nfs/dbraw/zinc/04/36/51/358043651.db2.gz	FIKGXYNYLMCRQI-UHFFFAOYSA-N	1	0	260.334	1.150	50	0		CDAARO
[NH3+][C@@H]1CCCN(C(=O)[C@H]2COc3ccc(Cl)cc3C2)C1	ZINC000191350346	358128471	/nfs/dbraw/zinc/12/84/71/358128471.db2.gz	QPHJJVDCHBTVBD-DGCLKSJQSA-N	1	0	294.782	1.841	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1OC	ZINC000024865241	283365647	/nfs/dbraw/zinc/36/56/47/283365647.db2.gz	IKPIKVIWHDZQKS-QWRGUYRKSA-N	1	0	293.367	1.498	50	0		CDAARO
COc1ccc(C(=O)N2CCC[N@H+](C)CC2)c(F)c1	ZINC000089382461	358405866	/nfs/dbraw/zinc/40/58/66/358405866.db2.gz	CAVNBQSCZHNDFP-UHFFFAOYSA-N	1	0	266.316	1.612	50	0		CDAARO
c1cc(C[N@@H+]2CCS[C@@H]3COCC[C@@H]32)ccn1	ZINC000089884959	358442978	/nfs/dbraw/zinc/44/29/78/358442978.db2.gz	HDVUHCFWUIJPGR-QWHCGFSZSA-N	1	0	250.367	1.788	50	0		CDAARO
NC(=O)C[C@]1(O)CCC[N@H+](Cc2ccccc2C2CC2)C1	ZINC000643746767	358547195	/nfs/dbraw/zinc/54/71/95/358547195.db2.gz	UNLSNDRDJPPETO-QGZVFWFLSA-N	1	0	288.391	1.766	50	0		CDAARO
C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NC1CC1	ZINC000195617206	358563497	/nfs/dbraw/zinc/56/34/97/358563497.db2.gz	VRFZWMGHVPDFPF-TUAOUCFPSA-N	1	0	253.390	1.814	50	0		CDAARO
Cc1nc(C)c(C)c(N2CC[C@@]3(CC[N@@H+](C)C3)C2)n1	ZINC000095360271	358684278	/nfs/dbraw/zinc/68/42/78/358684278.db2.gz	PVSSIRAMKSKHEQ-OAHLLOKOSA-N	1	0	260.385	1.934	50	0		CDAARO
CN(C)[C@@H](C(=O)NCCCCC[NH3+])c1ccccc1F	ZINC000095360880	358685503	/nfs/dbraw/zinc/68/55/03/358685503.db2.gz	SSDWRHDJEYCKED-CQSZACIVSA-N	1	0	281.375	1.674	50	0		CDAARO
c1c[nH]c(CN2C[C@H]3CC[C@@H]2C[N@H+](Cc2ccccn2)C3)n1	ZINC000095372417	358688538	/nfs/dbraw/zinc/68/85/38/358688538.db2.gz	LCKKGZYRIFRGIT-GOEBONIOSA-N	1	0	297.406	1.901	50	0		CDAARO
CCO[C@H]1C[N@H+](C)C[C@@H]1Nc1nc(C)nc2ncccc21	ZINC000095378988	358689522	/nfs/dbraw/zinc/68/95/22/358689522.db2.gz	IIRKPTYSIFOXSO-STQMWFEESA-N	1	0	287.367	1.464	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)NCCn2cccc2)CC1	ZINC000095384463	358690655	/nfs/dbraw/zinc/69/06/55/358690655.db2.gz	LEQRYYJWJBXYGL-UHFFFAOYSA-N	1	0	263.385	1.725	50	0		CDAARO
CCc1cc(N2CCOC[C@H](C[NH+](C)C)C2)ncn1	ZINC000095385333	358691314	/nfs/dbraw/zinc/69/13/14/358691314.db2.gz	YQKZENUWLGAVMX-GFCCVEGCSA-N	1	0	264.373	1.053	50	0		CDAARO
CCn1cncc1CNC(=O)CC[C@H]1CCCC[N@@H+]1C	ZINC000095388505	358692072	/nfs/dbraw/zinc/69/20/72/358692072.db2.gz	ZUKJHAAQTLBBLI-CYBMUJFWSA-N	1	0	278.400	1.784	50	0		CDAARO
COCCc1noc([C@@H]2CCC[N@@H+](C3CCOCC3)C2)n1	ZINC000096153326	358710194	/nfs/dbraw/zinc/71/01/94/358710194.db2.gz	MTYINVDYTKWKKU-GFCCVEGCSA-N	1	0	295.383	1.617	50	0		CDAARO
CCn1ccnc1C1CCN(C(=O)[C@@H]2CC[N@H+](C)C2)CC1	ZINC000097775451	358797954	/nfs/dbraw/zinc/79/79/54/358797954.db2.gz	GSFXEYFTSOGJQV-CQSZACIVSA-N	1	0	290.411	1.561	50	0		CDAARO
COC(=O)CC1(NCc2cccnc2)CC[NH+](C)CC1	ZINC000088744349	366495241	/nfs/dbraw/zinc/49/52/41/366495241.db2.gz	SCVCODIWPRUNTL-UHFFFAOYSA-N	1	0	277.368	1.199	50	0		CDAARO
CCC(=O)NCCNC(=O)c1cccc(-c2ncc[nH]2)c1	ZINC000215520900	358893176	/nfs/dbraw/zinc/89/31/76/358893176.db2.gz	NACLCOBFASQONN-UHFFFAOYSA-N	1	0	286.335	1.333	50	0		CDAARO
C[C@@]1(O)CCC[N@H+](Cc2cccc(OCC(N)=O)c2)CC1	ZINC000215546678	358894367	/nfs/dbraw/zinc/89/43/67/358894367.db2.gz	DKZCGCGSTLSQIK-MRXNPFEDSA-N	1	0	292.379	1.288	50	0		CDAARO
CCc1nccc(CN(C)C[C@H]2CC[N@H+](CCOC)C2)n1	ZINC000215775202	358903421	/nfs/dbraw/zinc/90/34/21/358903421.db2.gz	RVMSPCPBOFJBNQ-CQSZACIVSA-N	1	0	292.427	1.439	50	0		CDAARO
COc1ccc2[nH]c3c(ncn(CC[NH+](C)C)c3=O)c2c1	ZINC000000525513	366522226	/nfs/dbraw/zinc/52/22/26/366522226.db2.gz	XIUNXJMOUNIEEM-UHFFFAOYSA-N	1	0	286.335	1.448	50	0	biogenic	CDAARO
Cc1c[nH+]ccc1N1CCN(C(=O)c2cc[nH]n2)CC1	ZINC000221279734	359225762	/nfs/dbraw/zinc/22/57/62/359225762.db2.gz	DHEXSSFXODWXMA-UHFFFAOYSA-N	1	0	271.324	1.076	50	0		CDAARO
Cc1nc2cc(CNC(=O)CC[NH+]3CCCC3)ccc2[nH]1	ZINC000221448500	359248827	/nfs/dbraw/zinc/24/88/27/359248827.db2.gz	XKOWAADRXFNHGV-UHFFFAOYSA-N	1	0	286.379	1.973	50	0		CDAARO
COc1ccc(C[C@@H](C)[NH2+]CCN2CCOCC2)cc1	ZINC000023283338	359223336	/nfs/dbraw/zinc/22/33/36/359223336.db2.gz	BZAUUIFCGIRSNS-CQSZACIVSA-N	1	0	278.396	1.548	50	0		CDAARO
c1ccc2c(c1)CC[C@H]([NH2+]CCN1CCOCC1)C2	ZINC000023283415	359223926	/nfs/dbraw/zinc/22/39/26/359223926.db2.gz	ZCEHTMVINZHCQB-INIZCTEOSA-N	1	0	260.381	1.466	50	0		CDAARO
O=C1CC[N@@H+](Cc2ccncc2)CCC[C@H](CO)CCN1	ZINC000257186052	359518940	/nfs/dbraw/zinc/51/89/40/359518940.db2.gz	YGJGUXBLCXZBPW-HNNXBMFYSA-N	1	0	291.395	1.182	50	0		CDAARO
COC[C@@H]1C[N@H+](Cc2ccoc2)C[C@H]1c1nc(C)no1	ZINC000257186138	359522152	/nfs/dbraw/zinc/52/21/52/359522152.db2.gz	KCYFSBMWPPXJTD-QWHCGFSZSA-N	1	0	277.324	1.833	50	0		CDAARO
COc1ccc(C[NH2+]C2CCN(S(C)(=O)=O)CC2)cc1	ZINC000030656152	359616639	/nfs/dbraw/zinc/61/66/39/359616639.db2.gz	AAZFWPUHLVYSOD-UHFFFAOYSA-N	1	0	298.408	1.209	50	0		CDAARO
Cn1c(C(=O)NCC[NH+](C)C)cc2sccc21	ZINC000040809016	359646660	/nfs/dbraw/zinc/64/66/60/359646660.db2.gz	ZCVULWRVWHBBFF-UHFFFAOYSA-N	1	0	251.355	1.531	50	0		CDAARO
CC(C)CCO[C@@H]1CCN(C(=O)[C@H]2CCC[C@H]2[NH3+])C1	ZINC000408519283	359911659	/nfs/dbraw/zinc/91/16/59/359911659.db2.gz	KOYCFHLOCZCNMO-HZSPNIEDSA-N	1	0	268.401	1.777	50	0		CDAARO
C[N@H+](CCCOc1ccccc1)C[C@@H]1COC(=O)N1	ZINC000408524205	359933601	/nfs/dbraw/zinc/93/36/01/359933601.db2.gz	REEIPXPCTQJGQI-GFCCVEGCSA-N	1	0	264.325	1.496	50	0		CDAARO
NC(=O)COc1ccc(C[NH+]2CCCC2)c(Cl)c1	ZINC000408525157	359934746	/nfs/dbraw/zinc/93/47/46/359934746.db2.gz	NQEBAGQEDZAQKO-UHFFFAOYSA-N	1	0	268.744	1.800	50	0		CDAARO
CCC(=O)N1CCC[C@@H]1[C@@H]1CCCN1[C@H]1CCOC1=O	ZINC000257365301	359943865	/nfs/dbraw/zinc/94/38/65/359943865.db2.gz	FWSWBDBIQGSYPF-XQQFMLRXSA-N	1	0	280.368	1.167	50	0		CDAARO
C[C@@H]([NH2+]C[C@H](O)CN1CCCC1=O)c1ccc(F)cc1F	ZINC000089515113	360095435	/nfs/dbraw/zinc/09/54/35/360095435.db2.gz	SGBIGUQYMHCUNR-PWSUYJOCSA-N	1	0	298.333	1.599	50	0		CDAARO
COC[C@@H]1[C@H](C(=O)N2CCC(C)CC2)CCC[N@@H+]1C	ZINC000409419814	360227256	/nfs/dbraw/zinc/22/72/56/360227256.db2.gz	RTWPKHCTNIOAPH-ZIAGYGMSSA-N	1	0	268.401	1.602	50	0		CDAARO
O=C(NCC(F)(F)F)N[C@H]1CC[N@@H+]2CCC[C@@H]2C1	ZINC000095950730	360323264	/nfs/dbraw/zinc/32/32/64/360323264.db2.gz	BRKOMTFIDAWSSG-DTWKUNHWSA-N	1	0	265.279	1.475	50	0		CDAARO
CC(C)(C)n1cc(C(=O)N2CC[C@@H](C[NH3+])C2)cn1	ZINC000178517842	189123506	/nfs/dbraw/zinc/12/35/06/189123506.db2.gz	DSDOBFQKRUKZAX-JTQLQIEISA-N	1	0	250.346	1.059	50	0		CDAARO
C[C@@H](c1ccc(-c2n[nH]c(C(=O)N(C)C)n2)cc1)[NH+](C)C	ZINC000426440452	360670702	/nfs/dbraw/zinc/67/07/02/360670702.db2.gz	YWAAUPVAUPIKQD-JTQLQIEISA-N	1	0	287.367	1.796	50	0		CDAARO
O=C(NCCOCc1ccccc1)[C@@H]1CC12CC[NH2+]CC2	ZINC000096162930	360718063	/nfs/dbraw/zinc/71/80/63/360718063.db2.gz	AFMPXQBANRBHBP-HNNXBMFYSA-N	1	0	288.391	1.709	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2ccc(COC)cc2)C1	ZINC000179011787	189161484	/nfs/dbraw/zinc/16/14/84/189161484.db2.gz	WQSCGDNXEPGKFO-CYBMUJFWSA-N	1	0	262.353	1.515	50	0		CDAARO
Cn1c(CC[NH3+])nnc1SCCOc1ccccc1	ZINC000426537472	360997908	/nfs/dbraw/zinc/99/79/08/360997908.db2.gz	KKADUZSNOMUTTA-UHFFFAOYSA-N	1	0	278.381	1.487	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)c2ccc3c(c2)CCC(=O)N3)C1	ZINC000084663763	283625645	/nfs/dbraw/zinc/62/56/45/283625645.db2.gz	BFIMXHMNYQIFNL-LBPRGKRZSA-N	1	0	273.336	1.135	50	0		CDAARO
C[NH2+][C@H](C)c1ccccc1N1CCCS1(=O)=O	ZINC000036880975	283678429	/nfs/dbraw/zinc/67/84/29/283678429.db2.gz	LMHWTQLDJHLWMX-SNVBAGLBSA-N	1	0	254.355	1.507	50	0		CDAARO
CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1CCCN1CCOCC1	ZINC000175037627	364618313	/nfs/dbraw/zinc/61/83/13/364618313.db2.gz	WGQBRMVSMXMOIC-HZPDHXFCSA-N	1	0	281.444	1.267	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CC[NH2+][C@@H](C)C2)cc1F	ZINC000606441670	366869479	/nfs/dbraw/zinc/86/94/79/366869479.db2.gz	KIWSBWNAOZKURM-QZPNVGJNSA-N	1	0	278.327	1.668	50	0		CDAARO
CCCC[NH2+][C@@H]1CS(=O)(=O)C[C@@H]1N1CCCCC1	ZINC000089954768	366982081	/nfs/dbraw/zinc/98/20/81/366982081.db2.gz	BQAZSENWMDYWCG-OLZOCXBDSA-N	1	0	274.430	1.028	50	0		CDAARO
CC(C)CC[N@@H+]1CCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H]2C1	ZINC000014747510	367007474	/nfs/dbraw/zinc/00/74/74/367007474.db2.gz	FXFSYSCEXJFKIM-UONOGXRCSA-N	1	0	295.427	1.090	50	0		CDAARO
CCc1nn(C)cc1CNC(=O)N1CC[C@H](C[NH+](C)C)C1	ZINC000130517438	367246243	/nfs/dbraw/zinc/24/62/43/367246243.db2.gz	YKDYIENQOFGUGO-GFCCVEGCSA-N	1	0	293.415	1.076	50	0		CDAARO
O=C(CNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2[NH2+]1)N1CCCCC1	ZINC000252487398	367577032	/nfs/dbraw/zinc/57/70/32/367577032.db2.gz	WLNFUCYBFSGRBD-MJBXVCDLSA-N	1	0	293.411	1.036	50	0		CDAARO
COC(=O)CC[N@H+](C)[C@@H](C)C(=O)NCc1ccccc1C	ZINC000252508515	367657356	/nfs/dbraw/zinc/65/73/56/367657356.db2.gz	XOLINZKHCRZHBW-ZDUSSCGKSA-N	1	0	292.379	1.495	50	0		CDAARO
c1coc(-c2nc([C@H]3C[N@@H+]4CCC[C@@H]4CO3)no2)c1	ZINC000252537422	367797858	/nfs/dbraw/zinc/79/78/58/367797858.db2.gz	LDJMKGFQWLSYNA-MWLCHTKSSA-N	1	0	261.281	1.865	50	0		CDAARO
Nc1nc(-n2cccn2)cc(NCc2ccncc2)[nH+]1	ZINC000130633979	368058565	/nfs/dbraw/zinc/05/85/65/368058565.db2.gz	QUBAMFQYSKXRSE-UHFFFAOYSA-N	1	0	267.296	1.252	50	0		CDAARO
Cc1nc2c(c(NCCCn3ccnc3)n1)CC[NH2+]CC2	ZINC000063868315	370908630	/nfs/dbraw/zinc/90/86/30/370908630.db2.gz	HQNMWMKXKIGBDA-UHFFFAOYSA-N	1	0	286.383	1.172	50	0		CDAARO
C[C@H]1CN(C(=O)N[C@H]2CC[N@H+](CC3CCCC3)C2)CCO1	ZINC000076088323	369493289	/nfs/dbraw/zinc/49/32/89/369493289.db2.gz	DBSHYGAXSQOWOI-ZFWWWQNUSA-N	1	0	295.427	1.681	50	0		CDAARO
O=C1NCCCC[C@@H]1[NH+]1CCC(C(F)(F)F)CC1	ZINC000120827001	370458344	/nfs/dbraw/zinc/45/83/44/370458344.db2.gz	RTRVRRHXNFLZNS-JTQLQIEISA-N	1	0	264.291	1.929	50	0		CDAARO
Cc1ncn(C)c1C(=O)N[C@@H]1CCC[N@@H+](C2CCCC2)C1	ZINC000299798570	372768982	/nfs/dbraw/zinc/76/89/82/372768982.db2.gz	SZJUFPVZEVKHIK-CYBMUJFWSA-N	1	0	290.411	1.865	50	0		CDAARO
C[NH+](C)CCCn1nnc2c1c1ccccc1oc2=O	ZINC000000198780	373466100	/nfs/dbraw/zinc/46/61/00/373466100.db2.gz	SJOYOFRLZWWACK-UHFFFAOYSA-N	1	0	272.308	1.489	50	0	biogenic	CDAARO
CSCC[C@H](C)[N@H+](C)C[C@@H]1CCCS(=O)(=O)C1	ZINC000253416409	373725477	/nfs/dbraw/zinc/72/54/77/373725477.db2.gz	VAOQNVHZUJWKBJ-RYUDHWBXSA-N	1	0	279.471	1.885	50	0		CDAARO
CCOC(CN1CC[C@H]2CC[N@H+](C)C[C@@H]21)OCC	ZINC000253417102	373725493	/nfs/dbraw/zinc/72/54/93/373725493.db2.gz	QBFKFYOKDYAHRC-OLZOCXBDSA-N	1	0	256.390	1.412	50	0		CDAARO
C[NH2+]C[C@@H](C)CNS(=O)(=O)c1ccc(C)nc1Cl	ZINC000253415912	373726031	/nfs/dbraw/zinc/72/60/31/373726031.db2.gz	BXXFUSZHFFBNLS-MRVPVSSYSA-N	1	0	291.804	1.177	50	0		CDAARO
c1ccc(Nc2ccc(N3CC[NH2+]CC3)nn2)nc1	ZINC000206578890	374177968	/nfs/dbraw/zinc/17/79/68/374177968.db2.gz	NFLQKXPALRVZPE-UHFFFAOYSA-N	1	0	256.313	1.025	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+][C@H](C)Cn2cncn2)C12CCCC2	ZINC000108329843	412824356	/nfs/dbraw/zinc/82/43/56/412824356.db2.gz	YFSPACUHLLVHFM-HZSPNIEDSA-N	1	0	278.400	1.994	50	0		CDAARO
CCCCCC[NH2+]CCn1cnc2c1ncnc2N	ZINC000002442851	374500180	/nfs/dbraw/zinc/50/01/80/374500180.db2.gz	DZZFRYGFJUTNHR-UHFFFAOYSA-N	1	0	262.361	1.578	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(c2ncnc(N)c2Cl)CC1	ZINC000277751950	374809858	/nfs/dbraw/zinc/80/98/58/374809858.db2.gz	JXEQVHOQMIRRSI-VIFPVBQESA-N	1	0	269.780	1.633	50	0		CDAARO
Cn1ncc(N[C@H]2CC[N@@H+](C3CCCC3)C2)c(Cl)c1=O	ZINC000095389614	374899826	/nfs/dbraw/zinc/89/98/26/374899826.db2.gz	WBNHNEVTXRMWOX-JTQLQIEISA-N	1	0	296.802	1.863	50	0		CDAARO
CCO[C@H]1C[C@@H]([NH2+]C2CCN(C(N)=O)CC2)C12CCCC2	ZINC000095423475	374924006	/nfs/dbraw/zinc/92/40/06/374924006.db2.gz	MYZFJXVJBHFYIW-KGLIPLIRSA-N	1	0	295.427	1.857	50	0		CDAARO
COc1ccc(Cl)cc1NC(=O)CN1CC([NH+](C)C)C1	ZINC000095462488	374960180	/nfs/dbraw/zinc/96/01/80/374960180.db2.gz	BOXMWJULOAARNG-UHFFFAOYSA-N	1	0	297.786	1.533	50	0		CDAARO
Cc1c(C(=O)OCCn2ccccc2=O)ccc2c[nH+]cn21	ZINC000095467992	374963673	/nfs/dbraw/zinc/96/36/73/374963673.db2.gz	PJVDXITWYKDWGF-UHFFFAOYSA-N	1	0	297.314	1.661	50	0		CDAARO
O=C(NCC1CC1)[C@@H]1CCC[N@@H+]([C@@H]2CCOC2)C1	ZINC000095410378	374912904	/nfs/dbraw/zinc/91/29/04/374912904.db2.gz	HWBVEDWMDFFTOQ-CHWSQXEVSA-N	1	0	252.358	1.014	50	0		CDAARO
COc1ccccc1-c1ncnc(N2CC[NH+](C)CC2)c1N	ZINC000096282135	375074214	/nfs/dbraw/zinc/07/42/14/375074214.db2.gz	QFJNRJZGNVDUCA-UHFFFAOYSA-N	1	0	299.378	1.486	50	0		CDAARO
Cc1cc(Br)ccc1C[NH+](CCO)CCO	ZINC000097047137	375140527	/nfs/dbraw/zinc/14/05/27/375140527.db2.gz	MXMXFODNBNOZMD-UHFFFAOYSA-N	1	0	288.185	1.544	50	0		CDAARO
COc1cccc([C@@H]2C[NH2+]C[C@H]2C(=O)NC(C)C)c1	ZINC000035847950	542014321	/nfs/dbraw/zinc/01/43/21/542014321.db2.gz	CYLJKHHBRBRCRL-UONOGXRCSA-N	1	0	262.353	1.523	50	0		CDAARO
O=C(C[NH2+]CCO)NCCc1ccc(Cl)cc1Cl	ZINC000003339010	375654185	/nfs/dbraw/zinc/65/41/85/375654185.db2.gz	TYSXNBJGWYSIBR-UHFFFAOYSA-N	1	0	291.178	1.234	50	0		CDAARO
Clc1ccc(-n2nnnc2CN2CCCC2)cc1	ZINC000004130436	375805188	/nfs/dbraw/zinc/80/51/88/375805188.db2.gz	XXVLFQVLMTUGNV-UHFFFAOYSA-N	1	0	263.732	1.912	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCCN1C(=O)/C=C\c1ccccn1	ZINC000606442107	375823259	/nfs/dbraw/zinc/82/32/59/375823259.db2.gz	QZGWRFQKVMBVSQ-BVUBYJHWSA-N	1	0	259.353	1.823	50	0		CDAARO
Cc1ccc(CC(=O)N2CCC[C@@H](C)[C@@H]2C[NH3+])cn1	ZINC000429139020	247422953	/nfs/dbraw/zinc/42/29/53/247422953.db2.gz	WWWKSUIDENSBJO-RISCZKNCSA-N	1	0	261.369	1.518	50	0		CDAARO
C[C@@H](CN1C[C@@H](C)O[C@@H](C)C1)C[NH+]1C[C@H](C)O[C@@H](C)C1	ZINC000241884821	376019211	/nfs/dbraw/zinc/01/92/11/376019211.db2.gz	SYBPFBQJBJGVKB-QMHWVQJVSA-N	1	0	284.444	1.841	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCCN(CCCc2ccccc2)C1=O	ZINC000012715738	377013256	/nfs/dbraw/zinc/01/32/56/377013256.db2.gz	UDECBOZZCIOMAN-QGZVFWFLSA-N	1	0	290.407	1.534	50	0		CDAARO
COc1ncc(C[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)cn1	ZINC000067786112	377238610	/nfs/dbraw/zinc/23/86/10/377238610.db2.gz	LQQOPQPSZVNYFG-GFCCVEGCSA-N	1	0	273.340	1.588	50	0		CDAARO
CCc1ccc(C[N@@H+]2CC[C@@H](CNC(C)=O)C2)nc1	ZINC000067804821	377240498	/nfs/dbraw/zinc/24/04/98/377240498.db2.gz	JNIKSZJXEVYCCE-AWEZNQCLSA-N	1	0	261.369	1.602	50	0		CDAARO
Cc1nc2sccn2c1CN1CC[N@@H+](C)[C@H](CCO)C1	ZINC000039412708	377520837	/nfs/dbraw/zinc/52/08/37/377520837.db2.gz	VSQXXEXWWVJIPA-GFCCVEGCSA-N	1	0	294.424	1.203	50	0		CDAARO
CC[NH+]1CCC(NC(=O)COc2cc(F)cc(F)c2)CC1	ZINC000289465506	197361087	/nfs/dbraw/zinc/36/10/87/197361087.db2.gz	WJGDKSJMIOFYBQ-UHFFFAOYSA-N	1	0	298.333	1.944	50	0		CDAARO
OC[C@H]1CN(c2nncs2)C[C@H]1C[NH+]1CCCCC1	ZINC000091986050	285293035	/nfs/dbraw/zinc/29/30/35/285293035.db2.gz	WDBOHGZCFIASOQ-VXGBXAGGSA-N	1	0	282.413	1.069	50	0		CDAARO
COc1ccc2c(c1OC)OC1(CC[NH2+]CC1)CC2=O	ZINC000011849211	390201444	/nfs/dbraw/zinc/20/14/44/390201444.db2.gz	JPSWFVKUKJJJHW-UHFFFAOYSA-N	1	0	277.320	1.791	50	0		CDAARO
CC12CN3CC(C)(CN(C1)C3c1cccs1)C2[NH3+]	ZINC000019331009	390226124	/nfs/dbraw/zinc/22/61/24/390226124.db2.gz	CSIGALDALAPVJI-UHFFFAOYSA-N	1	0	263.410	1.731	50	0		CDAARO
CCCCNC(=O)C[N@H+](C)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C	ZINC000096419629	390513144	/nfs/dbraw/zinc/51/31/44/390513144.db2.gz	BIBJTIVMFSUSRC-YUTCNCBUSA-N	1	0	268.401	1.648	50	0		CDAARO
Cc1nc(N(C)C)nc(N2CC[C@@H]([NH+](C)C)C2)c1C	ZINC000065458138	390552219	/nfs/dbraw/zinc/55/22/19/390552219.db2.gz	YENCGHQMGQEYTK-GFCCVEGCSA-N	1	0	263.389	1.300	50	0		CDAARO
Cc1n[nH]cc1C[NH2+]CCNC(=O)c1cccs1	ZINC000097159616	390801079	/nfs/dbraw/zinc/80/10/79/390801079.db2.gz	XUQCOTTVFSLMTG-UHFFFAOYSA-N	1	0	264.354	1.299	50	0		CDAARO
COCC[N@@H+]1CC[C@@H](CN(C)Cc2nc(C)c[nH]2)C1	ZINC000097785189	390918392	/nfs/dbraw/zinc/91/83/92/390918392.db2.gz	GBBVMBLLFKBNST-ZDUSSCGKSA-N	1	0	266.389	1.118	50	0		CDAARO
O=c1[nH]ccn1CC[N@@H+]1CCCC[C@H]1c1ccccn1	ZINC000299757995	391721661	/nfs/dbraw/zinc/72/16/61/391721661.db2.gz	JJDRDYRMEWSAGK-AWEZNQCLSA-N	1	0	272.352	1.799	50	0		CDAARO
CC[C@@H](C)[N@H+](C)CCNC(=O)[C@H]1COc2ccccc2O1	ZINC000248220565	131112450	/nfs/dbraw/zinc/11/24/50/131112450.db2.gz	HTBQDJJBNWYZOG-IUODEOHRSA-N	1	0	292.379	1.673	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CCCN(C(=O)COc2ccc(F)cc2)C1	ZINC000253433326	131143067	/nfs/dbraw/zinc/14/30/67/131143067.db2.gz	VUDUCYRUMQPPRO-NEPJUHHUSA-N	1	0	280.343	1.790	50	0		CDAARO
COC(=O)[C@]1(C)CCN(C(=O)[C@@H](C)[NH+]2CCCCCC2)C1	ZINC000089420053	392728222	/nfs/dbraw/zinc/72/82/22/392728222.db2.gz	JGBGDARDYKHYAG-CZUORRHYSA-N	1	0	296.411	1.663	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2cnn(-c3ccccc3C)c2)C1	ZINC000269172489	132124597	/nfs/dbraw/zinc/12/45/97/132124597.db2.gz	JTVOKRKDTZCFBX-AWEZNQCLSA-N	1	0	298.390	1.862	50	0		CDAARO
COc1cccc(C[NH2+][C@H]2CC(=O)N(C)C2)c1OC	ZINC000096403301	393177892	/nfs/dbraw/zinc/17/78/92/393177892.db2.gz	FHOBXFYYABXFHL-NSHDSACASA-N	1	0	264.325	1.024	50	0		CDAARO
CC[N@H+](C[C@@H](O)COC)[C@@H]1CCN(c2ccccc2)C1=O	ZINC000096409696	393182042	/nfs/dbraw/zinc/18/20/42/393182042.db2.gz	ZMDFTMCWVHVLQY-HUUCEWRRSA-N	1	0	292.379	1.121	50	0		CDAARO
CC(C)N1CC[C@H](N2CC[NH+]([C@H]3CCSC3)CC2)C1=O	ZINC000095413186	393148569	/nfs/dbraw/zinc/14/85/69/393148569.db2.gz	UEFYFJSKNHXYFR-KBPBESRZSA-N	1	0	297.468	1.119	50	0		CDAARO
C[C@@H](O)C1CC[NH+](CC(=O)N2CCCC[C@@H]2C)CC1	ZINC000095395335	147114064	/nfs/dbraw/zinc/11/40/64/147114064.db2.gz	BOHGLRUBKNUXRI-QWHCGFSZSA-N	1	0	268.401	1.480	50	0		CDAARO
O=C(NCC1CCOCC1)[C@]12C[NH2+]C[C@@H]1CCCC2	ZINC000262207597	149035157	/nfs/dbraw/zinc/03/51/57/149035157.db2.gz	NSTHCAALQPEFCE-DZGCQCFKSA-N	1	0	266.385	1.309	50	0		CDAARO
[NH3+]Cc1ccc(C(=O)N[C@H]2CCc3c[nH]nc3C2)cc1	ZINC000364033179	159366586	/nfs/dbraw/zinc/36/65/86/159366586.db2.gz	UDXJEEZFMQMVBB-ZDUSSCGKSA-N	1	0	270.336	1.156	50	0		CDAARO
C[NH+](C)CCCOC(=O)COc1ccc(F)cc1	ZINC000001867834	169761744	/nfs/dbraw/zinc/76/17/44/169761744.db2.gz	DQTRGEHUFSMODO-UHFFFAOYSA-N	1	0	255.289	1.699	50	0		CDAARO
CC(=O)CCc1ccc(OCC[NH2+]C[C@H](C)O)cc1	ZINC000002879640	169840124	/nfs/dbraw/zinc/84/01/24/169840124.db2.gz	FKSROGUMHIKTCL-ZDUSSCGKSA-N	1	0	265.353	1.557	50	0		CDAARO
C[NH+]1CCC(NC(=O)CSc2ccccc2)CC1	ZINC000004805314	170020069	/nfs/dbraw/zinc/02/00/69/170020069.db2.gz	IPKGDCKKGVXFTP-UHFFFAOYSA-N	1	0	264.394	1.989	50	0		CDAARO
CCOc1ccc(NC(=S)NCC[NH+](C)C)cc1	ZINC000005041657	170059719	/nfs/dbraw/zinc/05/97/19/170059719.db2.gz	CDWXJXQFQFTMJR-UHFFFAOYSA-N	1	0	267.398	1.933	50	0		CDAARO
COc1ccc2[nH]c(C(=O)NCC[NH+](C)C)c(C)c2c1	ZINC000005307517	170084777	/nfs/dbraw/zinc/08/47/77/170084777.db2.gz	UKGCZQUQTRVTEO-UHFFFAOYSA-N	1	0	275.352	1.776	50	0		CDAARO
Cc1c(C=O)c2ccccc2n1C[C@@H](O)C[NH+](C)C	ZINC000006678112	170225198	/nfs/dbraw/zinc/22/51/98/170225198.db2.gz	ZOEFLNBBNQFDDX-LBPRGKRZSA-N	1	0	260.337	1.685	50	0		CDAARO
COc1ccc(CC[NH2+]CC(=O)NCc2ccco2)cc1	ZINC000006785411	170243538	/nfs/dbraw/zinc/24/35/38/170243538.db2.gz	IHAKTWDYXSEQOY-UHFFFAOYSA-N	1	0	288.347	1.737	50	0		CDAARO
COc1ccc([C@H]2[NH2+]CCc3nc[nH]c32)cc1OC	ZINC000008733355	170351815	/nfs/dbraw/zinc/35/18/15/170351815.db2.gz	BSQOBDOISMSIDT-CYBMUJFWSA-N	1	0	259.309	1.662	50	0	biogenic	CDAARO
CCC[NH+]1CCN(C(=O)Cc2ccccc2OC)CC1	ZINC000020410709	171183286	/nfs/dbraw/zinc/18/32/86/171183286.db2.gz	IUOGYPKRBGFXRN-UHFFFAOYSA-N	1	0	276.380	1.792	50	0		CDAARO
COc1cc2nc(CSCC[NH3+])[nH]c(=O)c2cc1OC	ZINC000031775848	171647085	/nfs/dbraw/zinc/64/70/85/171647085.db2.gz	NYHKDSVYFMGWOW-UHFFFAOYSA-N	1	0	295.364	1.132	50	0		CDAARO
CCn1nc(C[NH2+]C[C@@H](C)O)c(-c2ccccc2)n1	ZINC000035287288	172104960	/nfs/dbraw/zinc/10/49/60/172104960.db2.gz	WIXVIZCYDMCFNB-LLVKDONJSA-N	1	0	260.341	1.435	50	0		CDAARO
CCOC(=O)[C@H](C[NH3+])c1cc(OC)cc(OC)c1	ZINC000035287634	172105969	/nfs/dbraw/zinc/10/59/69/172105969.db2.gz	ZDONKCSFWYYZKE-GFCCVEGCSA-N	1	0	253.298	1.309	50	0		CDAARO
CC[C@@H](Nc1cccc(OC)c1)C(=O)NCCC[NH3+]	ZINC000065493741	175743989	/nfs/dbraw/zinc/74/39/89/175743989.db2.gz	BQEWAAUSNKYUFR-CYBMUJFWSA-N	1	0	265.357	1.351	50	0		CDAARO
OCC[C@@H]1C[NH2+]CCN1CCc1c(F)cccc1Cl	ZINC000066275281	175756305	/nfs/dbraw/zinc/75/63/05/175756305.db2.gz	MMEUVVAXXZVWNA-LLVKDONJSA-N	1	0	286.778	1.678	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1CCNS(=O)(=O)NCc1ccccc1	ZINC000071749466	176259532	/nfs/dbraw/zinc/25/95/32/176259532.db2.gz	IDMDWRLQTBWAAY-CQSZACIVSA-N	1	0	297.424	1.095	50	0		CDAARO
O=C(C[NH+]1CCCCCCC1)N1CCn2cncc2C1	ZINC000072148474	176325473	/nfs/dbraw/zinc/32/54/73/176325473.db2.gz	UJOUWESPIZSZLZ-UHFFFAOYSA-N	1	0	276.384	1.491	50	0		CDAARO
CCCc1cc(C(=O)N2CCC[C@H]([NH3+])CC2)no1	ZINC000072153366	176327961	/nfs/dbraw/zinc/32/79/61/176327961.db2.gz	DNTXCEZEKYNEIY-JTQLQIEISA-N	1	0	251.330	1.581	50	0		CDAARO
O[C@H]1COCC[N@H+](Cc2cccc(-n3cccn3)c2)C1	ZINC000077407243	177264046	/nfs/dbraw/zinc/26/40/46/177264046.db2.gz	WYCDOIKTTPJVQX-OAHLLOKOSA-N	1	0	273.336	1.065	50	0		CDAARO
C/C=C\C[C@H](CO)[NH2+]C1CCN([C@H]2CCOC2)CC1	ZINC000655757671	424446235	/nfs/dbraw/zinc/44/62/35/424446235.db2.gz	WRSPHRZEUDJINT-VIOGHGGCSA-N	1	0	268.401	1.156	50	0		CDAARO
CCc1ccc(S(=O)(=O)N[C@@H]2CCC[C@H]2C[NH3+])cc1	ZINC000089092064	276689754	/nfs/dbraw/zinc/68/97/54/276689754.db2.gz	MEFXCPYLYLUFTH-GXTWGEPZSA-N	1	0	282.409	1.655	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)c1ccc(=O)[nH]c1)Cc1ccccc1	ZINC000022682069	276863703	/nfs/dbraw/zinc/86/37/03/276863703.db2.gz	HHSCNYKWYLCFRK-HNNXBMFYSA-N	1	0	299.374	1.278	50	0		CDAARO
C[NH+]1CCC(NC(=O)c2ccc(Br)o2)CC1	ZINC000016580094	277030715	/nfs/dbraw/zinc/03/07/15/277030715.db2.gz	DLMZDSJCBVYTHG-UHFFFAOYSA-N	1	0	287.157	1.866	50	0		CDAARO
C[N@@H+]1CC[C@@]23c4c5c(O)ccc4C[C@@H]1[C@@H]2CCC(=O)[C@@H]3O5	ZINC000000402954	277161368	/nfs/dbraw/zinc/16/13/68/277161368.db2.gz	WVLOADHCBXTIJK-YNHQPCIGSA-N	1	0	285.343	1.630	50	0	fda	CDAARO
COC[C@H]([NH2+]CC(=O)N1C[C@H](C)C[C@@H](C)C1)C1CC1	ZINC000097049018	277262045	/nfs/dbraw/zinc/26/20/45/277262045.db2.gz	RCSPZVRGNMXCIU-BZPMIXESSA-N	1	0	268.401	1.506	50	0		CDAARO
COCCC[NH+]1CCC2(CC1)Nc1ccccc1NC2=O	ZINC000082121923	277495355	/nfs/dbraw/zinc/49/53/55/277495355.db2.gz	MEHSSCWRAQDRCG-UHFFFAOYSA-N	1	0	289.379	1.922	50	0		CDAARO
CC(C)N1CC[C@H]([NH2+][C@@H]2CCC[C@@H]3OCC[C@@H]32)C1=O	ZINC000245771051	277630084	/nfs/dbraw/zinc/63/00/84/277630084.db2.gz	MKHNSZDPYAELGA-MQYQWHSLSA-N	1	0	266.385	1.543	50	0		CDAARO
C[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(C2)C[NH2+]CCOC3)CC1	ZINC000244794636	278380541	/nfs/dbraw/zinc/38/05/41/278380541.db2.gz	QQTVXKYWUUDKIW-IIAWOOMASA-N	1	0	296.411	1.030	50	0		CDAARO
CC(C)(C)OC(=O)NC1CCN([C@@H]2CC[NH2+]C2)CC1	ZINC000022014989	278425672	/nfs/dbraw/zinc/42/56/72/278425672.db2.gz	RYEDWVUQVIEGNA-GFCCVEGCSA-N	1	0	269.389	1.337	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@H]1NC(=O)c1cccc(F)c1F	ZINC000091496328	278512599	/nfs/dbraw/zinc/51/25/99/278512599.db2.gz	HLXHBEOZAOBXQR-LDYMZIIASA-N	1	0	254.280	1.835	50	0		CDAARO
CC(C)N1CC[C@H]([N@@H+]2CCC[C@H]([C@H](C)O)C2)C1=O	ZINC000245338717	280203297	/nfs/dbraw/zinc/20/32/97/280203297.db2.gz	OAGOMHUBNQAPDY-AVGNSLFASA-N	1	0	254.374	1.089	50	0		CDAARO
Cc1cc(N2Cc3cnc(C(C)(C)C)nc3C2)nc(N)[nH+]1	ZINC000067725628	280589952	/nfs/dbraw/zinc/58/99/52/280589952.db2.gz	ZTJYGIGOPGFZDY-UHFFFAOYSA-N	1	0	284.367	1.975	50	0		CDAARO
CC1(C)CCC[C@@H]1[NH2+]CC1(CS(C)(=O)=O)CC1	ZINC000090183745	281033815	/nfs/dbraw/zinc/03/38/15/281033815.db2.gz	NLVGGKZBAXFDBM-NSHDSACASA-N	1	0	259.415	1.980	50	0		CDAARO
C[NH2+][C@H]1CCCN(C(=O)/C=C\c2ccc(C(N)=O)cc2)C1	ZINC000255276908	289363435	/nfs/dbraw/zinc/36/34/35/289363435.db2.gz	XAIMRXQGVTWCNW-PIZKADEWSA-N	1	0	287.363	1.009	50	0		CDAARO
CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc(C(N)=O)cc2)[C@@H](C)C1	ZINC000562697304	293177271	/nfs/dbraw/zinc/17/72/71/293177271.db2.gz	VBVZNCOLCQGKRD-TXEJJXNPSA-N	1	0	289.379	1.340	50	0		CDAARO
Cc1ncc(C(=O)N2C[C@@H](C)[NH2+][C@H](C)C2)c(C(C)C)n1	ZINC000179162220	293576886	/nfs/dbraw/zinc/57/68/86/293576886.db2.gz	KBTJNVCMDVOYFG-GHMZBOCLSA-N	1	0	276.384	1.731	50	0		CDAARO
CCCc1nc(C)cc(N[C@@H]2CC=CC[C@H]2C(N)=O)n1	ZINC000534585994	328315230	/nfs/dbraw/zinc/31/52/30/328315230.db2.gz	HPZARWOEPGKUFW-VXGBXAGGSA-N	1	0	274.368	1.391	50	0		CDAARO
COc1cccc2c1OCCCN(C(=O)[C@@H]1C=CC[NH2+]1)C2	ZINC000534643571	328329418	/nfs/dbraw/zinc/32/94/18/328329418.db2.gz	SVHHEHSURSMXKK-ZDUSSCGKSA-N	1	0	288.347	1.334	50	0		CDAARO
CC[N@H+](C)[C@@H](C)C(=O)NCc1nn(C)c2ccc(C)cc12	ZINC000534633680	328332892	/nfs/dbraw/zinc/33/28/92/328332892.db2.gz	QXJFVVIGNIAQDT-LBPRGKRZSA-N	1	0	288.395	1.838	50	0		CDAARO
COCC(C)(C)CNC(=O)CC[C@H](C)[NH+]1CCN(C)CC1	ZINC000534649974	328336609	/nfs/dbraw/zinc/33/66/09/328336609.db2.gz	ALUXVEPPHCBEPU-AWEZNQCLSA-N	1	0	299.459	1.191	50	0		CDAARO
CCCn1ccnc1CNC(=O)[C@H](C)C[NH+]1CCCC1	ZINC000534660391	328342424	/nfs/dbraw/zinc/34/24/24/328342424.db2.gz	PGGAPSXLXCBBHC-CYBMUJFWSA-N	1	0	278.400	1.641	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1C(=O)NCC1(COC)CCCC1	ZINC000534665395	328344618	/nfs/dbraw/zinc/34/46/18/328344618.db2.gz	SNSCTSLKTOVIKJ-ZDUSSCGKSA-N	1	0	268.401	1.794	50	0		CDAARO
Nc1ncccc1CNC(=O)C[NH+]1CCCCCCC1	ZINC000534661821	328349439	/nfs/dbraw/zinc/34/94/39/328349439.db2.gz	FTYLNQSNLRDHPB-UHFFFAOYSA-N	1	0	276.384	1.546	50	0		CDAARO
Cn1c(C[NH3+])nnc1Sc1cc(C(F)(F)F)ccn1	ZINC000534673118	328348833	/nfs/dbraw/zinc/34/88/33/328348833.db2.gz	WSFISHBKNVXXIV-UHFFFAOYSA-N	1	0	289.286	1.839	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCCC2	ZINC000097373408	323207911	/nfs/dbraw/zinc/20/79/11/323207911.db2.gz	MPZYGQRISHGQGJ-UPJWGTAASA-N	1	0	280.412	1.696	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+]C[C@@]2(O)CCSC2)C1(C)C	ZINC000195550644	323571896	/nfs/dbraw/zinc/57/18/96/323571896.db2.gz	SBTKSQKGXAZLJR-LOWVWBTDSA-N	1	0	259.415	1.648	50	0		CDAARO
c1ccc(-n2c(CN3CC[NH2+]CC3)nc3cccnc32)cc1	ZINC000032918690	326898314	/nfs/dbraw/zinc/89/83/14/326898314.db2.gz	HAGQWDWUAKAKCE-UHFFFAOYSA-N	1	0	293.374	1.826	50	0		CDAARO
CC(C)C[N@@H+]1CCCC[C@@H]1CCNc1nnc(CN)o1	ZINC001772710005	1159444207	/nfs/dbraw/zinc/44/42/07/1159444207.db2.gz	UCTYVCNECHWMMF-GFCCVEGCSA-N	1	0	281.404	1.841	50	0		CDAARO
Cc1ccc(F)cc1C[N@@H+]1C[C@@H]2COCC[C@]2(CO)C1	ZINC001772710345	1159444310	/nfs/dbraw/zinc/44/43/10/1159444310.db2.gz	QEBNZKRNWWYHQN-GDBMZVCRSA-N	1	0	279.355	1.965	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]CCN1CCC[C@H](C)C1	ZINC000097159195	482459007	/nfs/dbraw/zinc/45/90/07/482459007.db2.gz	CCMHQKKIFCGGNX-NSHDSACASA-N	1	0	250.390	1.848	50	0		CDAARO
O=C(NC[C@@H](c1ccccc1)[NH+]1CCCC1)c1cn[nH]n1	ZINC000108285653	482683784	/nfs/dbraw/zinc/68/37/84/482683784.db2.gz	PTCLWKFIHPZKKQ-AWEZNQCLSA-N	1	0	285.351	1.372	50	0		CDAARO
O=C(c1ccoc1)N1CCC[N@@H+]([C@@H]2CCSC2)CC1	ZINC000670460752	483045981	/nfs/dbraw/zinc/04/59/81/483045981.db2.gz	GMEAWQYAJVFYAA-CYBMUJFWSA-N	1	0	280.393	1.933	50	0		CDAARO
Cn1cc([C@@H]2OCC[C@@H]2C[NH2+]Cc2ccc(CO)o2)cn1	ZINC000084317508	483272156	/nfs/dbraw/zinc/27/21/56/483272156.db2.gz	DWIFMEYFSMBMHX-IAQYHMDHSA-N	1	0	291.351	1.373	50	0		CDAARO
C[C@@H](CNC(=O)[C@H](C)[NH+]1CCCCCC1)Cn1ccnc1	ZINC000096446804	534019479	/nfs/dbraw/zinc/01/94/79/534019479.db2.gz	HBFKEXVBNRJNAD-GJZGRUSLSA-N	1	0	292.427	1.900	50	0		CDAARO
COC[C@@H](O)C[N@H+](C)[C@H]1CCCN(c2ccccc2)C1=O	ZINC000182310310	522395984	/nfs/dbraw/zinc/39/59/84/522395984.db2.gz	POXWKYDMCKRORJ-GJZGRUSLSA-N	1	0	292.379	1.121	50	0		CDAARO
C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1C[C@H](O)CN1CCCC1=O	ZINC000241383271	525354489	/nfs/dbraw/zinc/35/44/89/525354489.db2.gz	MTUXCMHLUFKJEL-LXTVHRRPSA-N	1	0	280.412	1.623	50	0		CDAARO
CC[C@H](C(=O)Nc1ccc(-c2ncn(C)n2)cc1)[NH+](C)C	ZINC000097140518	538437726	/nfs/dbraw/zinc/43/77/26/538437726.db2.gz	BOPKWZYEVDODRB-CYBMUJFWSA-N	1	0	287.367	1.761	50	0		CDAARO
CS(=O)(=O)NC1CCC([NH+]2CCCCC2)CC1	ZINC000080283420	538869277	/nfs/dbraw/zinc/86/92/77/538869277.db2.gz	FNKDXHWXJQAQIU-UHFFFAOYSA-N	1	0	260.403	1.333	50	0		CDAARO
CC(=O)N1CC([NH2+][C@@H](C)c2ccc(C(F)F)nc2)C1	ZINC000888101186	617764077	/nfs/dbraw/zinc/76/40/77/617764077.db2.gz	NWRZSVSIDFKPSO-QMMMGPOBSA-N	1	0	269.295	1.901	50	0		CDAARO
Cn1nn[n+]2c3c(cnc12)CC/C3=C/c1ccccc1	ZINC000032690856	631899837	/nfs/dbraw/zinc/89/98/37/631899837.db2.gz	HQBKUTWLKJYSIA-XFXZXTDPSA-N	1	0	264.312	1.436	50	0		CDAARO
Cc1nn(C)c(C)c1CCC(=O)N1C[C@H]2CC[C@@H](C1)[C@H]2[NH3+]	ZINC000952982582	833362543	/nfs/dbraw/zinc/36/25/43/833362543.db2.gz	PMBXJEYBCSOSMJ-VIKVFOODSA-N	1	0	290.411	1.165	50	0		CDAARO
CCCC[NH2+]C[C@@H](O)COc1cccc(OC)c1	ZINC000002465959	829376695	/nfs/dbraw/zinc/37/66/95/829376695.db2.gz	BRZBEIPHKZABTC-GFCCVEGCSA-N	1	0	253.342	1.825	50	0		CDAARO
CN(Cc1cc(C(C)(C)C)n[nH]1)[C@H]1CCC[NH2+]C1	ZINC000067649931	829464757	/nfs/dbraw/zinc/46/47/57/829464757.db2.gz	OVBZOABYDHQFIS-LBPRGKRZSA-N	1	0	250.390	1.891	50	0		CDAARO
Cc1nc(CCCNC(=O)[C@@H](C)[NH+](C)C)sc1C	ZINC000426389274	830453062	/nfs/dbraw/zinc/45/30/62/830453062.db2.gz	PPCSDHFRJRDWJM-SNVBAGLBSA-N	1	0	269.414	1.759	50	0		CDAARO
Cc1ccc(N2CCC([N@@H+]3CCC[C@@H](O)C3)CC2)nn1	ZINC000032603568	834023270	/nfs/dbraw/zinc/02/32/70/834023270.db2.gz	HZUXOEJABVGSHK-CQSZACIVSA-N	1	0	276.384	1.211	50	0		CDAARO
Cc1nc(CN2CC([N@H+]3CCCC[C@H]3C)C2)no1	ZINC000244899882	835007805	/nfs/dbraw/zinc/00/78/05/835007805.db2.gz	ZSFJEQGYCDOLCM-SNVBAGLBSA-N	1	0	250.346	1.437	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](CN(C)c2cc(=O)[nH]cn2)C1	ZINC000821246013	925574168	/nfs/dbraw/zinc/57/41/68/925574168.db2.gz	GWZGANPOVZPNQK-GFCCVEGCSA-N	1	0	264.373	1.596	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](NC(=O)c2cnc(N)s2)C1	ZINC000822922723	925657913	/nfs/dbraw/zinc/65/79/13/925657913.db2.gz	MUIHZJNGWCMXCN-SECBINFHSA-N	1	0	268.386	1.330	50	0		CDAARO
O=C(N1CCCCC1)N1CCC([NH2+][C@@H]2CCCOC2)CC1	ZINC000827937590	926005662	/nfs/dbraw/zinc/00/56/62/926005662.db2.gz	JYCWTENYFDGJID-OAHLLOKOSA-N	1	0	295.427	1.825	50	0		CDAARO
CCc1nc([C@H]([NH3+])CO)n(-c2ccc3ccccc3c2)n1	ZINC000828799096	926196012	/nfs/dbraw/zinc/19/60/12/926196012.db2.gz	LPEZDUFMNNQQGZ-CQSZACIVSA-N	1	0	282.347	1.975	50	0		CDAARO
C[C@@H]1CN(C(=O)C[N@H+](C)CCC[C@H]2CCCO2)C[C@H](C)O1	ZINC001529195905	969011628	/nfs/dbraw/zinc/01/16/28/969011628.db2.gz	PZSRGGHRNQSOQS-ZNMIVQPWSA-N	1	0	298.427	1.513	50	0		CDAARO
Cn1ccc(CNC(=O)N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)c1	ZINC000096499809	230384385	/nfs/dbraw/zinc/38/43/85/230384385.db2.gz	KCNMLPRRRITDLH-GJZGRUSLSA-N	1	0	290.411	1.651	50	0		CDAARO
Cc1nn(C)c2nc(NCC3(O)CC[NH+](C)CC3)sc12	ZINC000095517944	185002577	/nfs/dbraw/zinc/00/25/77/185002577.db2.gz	AVRLGUUPKRGEPK-UHFFFAOYSA-N	1	0	295.412	1.207	50	0		CDAARO
CCCCn1ccnc1C1CCN(C(=O)C[NH2+]C)CC1	ZINC000095530870	185004622	/nfs/dbraw/zinc/00/46/22/185004622.db2.gz	WZASLVLXLLGERC-UHFFFAOYSA-N	1	0	278.400	1.609	50	0		CDAARO
[NH3+][C@@H]1CN(Cc2[nH]c3ccccc3c2Cl)C[C@H]1O	ZINC000426734283	230428008	/nfs/dbraw/zinc/42/80/08/230428008.db2.gz	KFWYWLRCKIHHSR-BXKDBHETSA-N	1	0	265.744	1.325	50	0		CDAARO
Cc1nc(C)c(C[C@H](O)C[NH2+]C(C)(C)C)nc1C	ZINC000095918122	185031049	/nfs/dbraw/zinc/03/10/49/185031049.db2.gz	JGVUWDNANGTVQW-LBPRGKRZSA-N	1	0	251.374	1.693	50	0		CDAARO
c1cnc(N2CC[C@H](OCC[NH+]3CCCCC3)C2)nc1	ZINC000095974191	185050257	/nfs/dbraw/zinc/05/02/57/185050257.db2.gz	OJWRUQUSLZWRHO-AWEZNQCLSA-N	1	0	276.384	1.558	50	0		CDAARO
CC[NH+](CC)C[C@@H](O)COc1cccc(OC)c1	ZINC000015799115	342088621	/nfs/dbraw/zinc/08/86/21/342088621.db2.gz	LFZQQYKLMPZFSH-GFCCVEGCSA-N	1	0	253.342	1.777	50	0		CDAARO
C[NH+](C)C[C@H](O)COc1ccccc1Br	ZINC000004819474	342089048	/nfs/dbraw/zinc/08/90/48/342089048.db2.gz	ZKQUXALFXFYAGB-VIFPVBQESA-N	1	0	274.158	1.750	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N1CC[C@H]2OCCC[C@H]2C1	ZINC000195554473	342625889	/nfs/dbraw/zinc/62/58/89/342625889.db2.gz	HYTXABJPLACYMJ-SDDRHHMPSA-N	1	0	272.414	1.094	50	0		CDAARO
Cn1ccc([C@@H](NC(=O)C[NH2+]C2CC2)C(F)(F)F)c1	ZINC000195554660	342626152	/nfs/dbraw/zinc/62/61/52/342626152.db2.gz	AIZZRNVWIGKSSL-LLVKDONJSA-N	1	0	275.274	1.497	50	0		CDAARO
C[C@]1(O)CC[N@H+](Cc2cc3ccccc3o2)C[C@@H]1O	ZINC000096149124	185107513	/nfs/dbraw/zinc/10/75/13/185107513.db2.gz	IOOUCLVAGGDUJY-GJZGRUSLSA-N	1	0	261.321	1.750	50	0		CDAARO
Cc1noc(-c2ccccc2C(=O)N[C@H]2CC[NH2+]C2)n1	ZINC000127156242	342168012	/nfs/dbraw/zinc/16/80/12/342168012.db2.gz	SEUGRGZZAKJRFZ-JTQLQIEISA-N	1	0	272.308	1.137	50	0		CDAARO
CC(C)(C)OC(=O)N1CCN([C@H]2CCCC[C@H]2[NH3+])CC1	ZINC000409438465	342169570	/nfs/dbraw/zinc/16/95/70/342169570.db2.gz	CTIHUAFFLVLLSJ-OLZOCXBDSA-N	1	0	283.416	1.809	50	0		CDAARO
[NH3+]CCN1CCC[C@H](c2cc(C(F)(F)F)n[nH]2)C1	ZINC000263011067	361904611	/nfs/dbraw/zinc/90/46/11/361904611.db2.gz	PTKUGAPBOQLJGB-QMMMGPOBSA-N	1	0	262.279	1.567	50	0		CDAARO
COc1ccc(C[NH2+]Cc2c(CO)cnc(C)c2O)cc1	ZINC000157410275	342202665	/nfs/dbraw/zinc/20/26/65/342202665.db2.gz	WPHPARQRZASKRG-UHFFFAOYSA-N	1	0	288.347	1.886	50	0		CDAARO
O=C(NC1(c2ccccc2)CCC1)[C@@]1(F)CC[NH2+]C1	ZINC000253432206	361943544	/nfs/dbraw/zinc/94/35/44/361943544.db2.gz	JEUMUEQRSPYCAZ-CQSZACIVSA-N	1	0	262.328	1.884	50	0		CDAARO
C[C@@H](O)C1CCN(C(=O)C2([NH3+])Cc3ccccc3C2)CC1	ZINC000097019815	185152784	/nfs/dbraw/zinc/15/27/84/185152784.db2.gz	BRZKYZVFFLCGLY-GFCCVEGCSA-N	1	0	288.391	1.102	50	0		CDAARO
CN(C[C@@H]1CCC[N@H+](C)C1)c1nccc2nc[nH]c21	ZINC000585135087	342215935	/nfs/dbraw/zinc/21/59/35/342215935.db2.gz	WXKOJZVMIQLPKC-LLVKDONJSA-N	1	0	259.357	1.736	50	0		CDAARO
C[NH+](C)CC1CN(C(=O)Nc2cccc(F)c2)C1	ZINC000585141142	342219389	/nfs/dbraw/zinc/21/93/89/342219389.db2.gz	PZPLTSZGKGXKOR-UHFFFAOYSA-N	1	0	251.305	1.851	50	0		CDAARO
C[C@H](c1ccccn1)[NH+]1CCC(c2ncc(C(N)=O)[nH]2)CC1	ZINC000685941228	539045894	/nfs/dbraw/zinc/04/58/94/539045894.db2.gz	VJIHONJXNUVEQC-LLVKDONJSA-N	1	0	299.378	1.844	50	0		CDAARO
CCCc1noc(-c2ccn3c(c2)nnc3C[NH3+])n1	ZINC000409444235	539071824	/nfs/dbraw/zinc/07/18/24/539071824.db2.gz	WZPAJZNVTHGGFP-UHFFFAOYSA-N	1	0	258.285	1.191	50	0		CDAARO
CC(C)=CC[N@H+]1CC[C@@]2(C1)NC(=O)N(C(C)C)C2=O	ZINC000084597336	342265327	/nfs/dbraw/zinc/26/53/27/342265327.db2.gz	WLRDWYGJCXLPTP-AWEZNQCLSA-N	1	0	265.357	1.357	50	0		CDAARO
C[C@@H](NCc1ncnn1C)[C@H](c1ccccc1)[NH+](C)C	ZINC000585117756	362046546	/nfs/dbraw/zinc/04/65/46/362046546.db2.gz	VVLIFFBBSFKVTK-IUODEOHRSA-N	1	0	273.384	1.596	50	0		CDAARO
C[C@@H]1C[N@@H+](CCCNC(=O)c2ccncc2)C[C@H](C)O1	ZINC000036391936	362048411	/nfs/dbraw/zinc/04/84/11/362048411.db2.gz	PGIRNMBDMYXKDG-BETUJISGSA-N	1	0	277.368	1.311	50	0		CDAARO
CCOC(=O)c1sc(N2CCC([NH3+])CC2)nc1C	ZINC000142650830	362107958	/nfs/dbraw/zinc/10/79/58/362107958.db2.gz	IHASGUKNMZSMIU-UHFFFAOYSA-N	1	0	269.370	1.556	50	0		CDAARO
C[C@@H]1CC[N@H+](CC2CCN(C(=O)C(C)(C)C)CC2)C[C@H]1O	ZINC000253369532	342416082	/nfs/dbraw/zinc/41/60/82/342416082.db2.gz	DTGBUCMTQHLTFP-UKRRQHHQSA-N	1	0	296.455	1.974	50	0		CDAARO
COc1cccc([C@H](C)[N@@H+]2CCCN(C(N)=O)CC2)c1	ZINC000079756570	362181570	/nfs/dbraw/zinc/18/15/70/362181570.db2.gz	KZMZAJNWJXQFLZ-LBPRGKRZSA-N	1	0	277.368	1.843	50	0		CDAARO
COc1cc(C2(C(=O)N3CC[C@H](C[NH3+])C3)CC2)ccc1C	ZINC000178551962	362246681	/nfs/dbraw/zinc/24/66/81/362246681.db2.gz	VYNJEESDWYXQOX-CYBMUJFWSA-N	1	0	288.391	1.842	50	0		CDAARO
CN(C(=O)c1cccnc1N1CCCC1)[C@H]1CC[NH2+]C1	ZINC000179102175	362252162	/nfs/dbraw/zinc/25/21/62/362252162.db2.gz	DXCHLHCGDAUFQG-LBPRGKRZSA-N	1	0	274.368	1.116	50	0		CDAARO
O[C@H](COCc1ccccc1)C[N@@H+]1CCC[C@@H](O)C1	ZINC000084926163	362276765	/nfs/dbraw/zinc/27/67/65/362276765.db2.gz	LIMHTERJJLZADQ-CABCVRRESA-N	1	0	265.353	1.021	50	0		CDAARO
C[C@@H](c1nc2ccccc2c(=O)[nH]1)N1CC[NH2+][C@H](C)C1	ZINC000019927476	348746043	/nfs/dbraw/zinc/74/60/43/348746043.db2.gz	RSFRCTXPXJXUMD-MNOVXSKESA-N	1	0	272.352	1.278	50	0		CDAARO
CCc1csc(CC[NH2+][C@H](C)CN2CCOCC2)n1	ZINC000584896519	349358297	/nfs/dbraw/zinc/35/82/97/349358297.db2.gz	NXUYYOZVYSIHEN-GFCCVEGCSA-N	1	0	283.441	1.558	50	0		CDAARO
CCC[C@H]1C[C@H]1C(=O)N1CC[NH+](CCCCOC)CC1	ZINC000584889464	349348111	/nfs/dbraw/zinc/34/81/11/349348111.db2.gz	BRAAJBCEXDJABJ-LSDHHAIUSA-N	1	0	282.428	1.993	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1Cn1cnc2cnccc2c1=O	ZINC000584895006	349355161	/nfs/dbraw/zinc/35/51/61/349355161.db2.gz	ZWYILHDIBMUWRU-NSHDSACASA-N	1	0	258.325	1.276	50	0		CDAARO
Cc1ccc(F)c(S(=O)(=O)N2CCC([NH3+])CC2)c1	ZINC000036753752	362945943	/nfs/dbraw/zinc/94/59/43/362945943.db2.gz	XIIKWGNXNDBNQS-UHFFFAOYSA-N	1	0	272.345	1.246	50	0		CDAARO
NC(=O)NC1CC[NH+](Cc2ccc3c(c2)CCC3)CC1	ZINC000089806962	179869402	/nfs/dbraw/zinc/86/94/02/179869402.db2.gz	CHYKEWBIHZRTOT-UHFFFAOYSA-N	1	0	273.380	1.808	50	0		CDAARO
CN(CC1(CO)CCCC1)C(=O)C[C@@H]1CCCC[N@@H+]1C	ZINC000584897474	349358999	/nfs/dbraw/zinc/35/89/99/349358999.db2.gz	XAPGSEXJTJSPHJ-AWEZNQCLSA-N	1	0	282.428	1.872	50	0		CDAARO
CC[C@H](C(=O)NCC[NH+]1CCCC1)n1cccn1	ZINC000091755862	180246732	/nfs/dbraw/zinc/24/67/32/180246732.db2.gz	CRRKXZWNCZCFMO-GFCCVEGCSA-N	1	0	250.346	1.046	50	0		CDAARO
Cc1cnn(CCC(=O)N2CCC([C@H](C)[NH+](C)C)CC2)c1	ZINC000091860412	180275642	/nfs/dbraw/zinc/27/56/42/180275642.db2.gz	MZEANHWQIBINMZ-AWEZNQCLSA-N	1	0	292.427	1.770	50	0		CDAARO
Cc1cc(NCCc2nc3ccccc3n2C)nc(N)[nH+]1	ZINC000092028040	180309431	/nfs/dbraw/zinc/30/94/31/180309431.db2.gz	IPIBJTQFENUXOZ-UHFFFAOYSA-N	1	0	282.351	1.909	50	0		CDAARO
Cc1noc(C)c1C[NH2+]C[C@H]1CN(C2CC2)CCO1	ZINC000106379511	186111882	/nfs/dbraw/zinc/11/18/82/186111882.db2.gz	PWHKVVAQUITDGB-ZDUSSCGKSA-N	1	0	265.357	1.244	50	0		CDAARO
CC[C@@H]1CN(Cc2cnc(C)cn2)CC[N@@H+]1C[C@H](C)O	ZINC000106906943	186150361	/nfs/dbraw/zinc/15/03/61/186150361.db2.gz	RBSVBWYRPGFAMU-DZGCQCFKSA-N	1	0	278.400	1.062	50	0		CDAARO
C1=C[C@@H]2[C@H](C[C@@H]2[NH2+]CCc2nnc3ccccn32)C1	ZINC000107082964	186159621	/nfs/dbraw/zinc/15/96/21/186159621.db2.gz	GXMVTAFHYUDMKT-XQQFMLRXSA-N	1	0	254.337	1.826	50	0		CDAARO
CC[C@H]1CCCC[C@H]1C[NH+]1CCC2(CC1)NC(=O)NC2=O	ZINC000583650797	366007706	/nfs/dbraw/zinc/00/77/06/366007706.db2.gz	BIAFTEHYGYSCCT-STQMWFEESA-N	1	0	293.411	1.877	50	0		CDAARO
CCC[C@H]1NC(=[NH2+])NC(=N)N1c1cccc(Cl)c1	ZINC000096026641	351475530	/nfs/dbraw/zinc/47/55/30/351475530.db2.gz	JZSCQRCFXATNGX-JTQLQIEISA-N	1	0	265.748	1.916	50	0		CDAARO
Cc1nc(C)c(C[NH2+]CC[C@@]2(O)CCCOC2)o1	ZINC000628325823	363160826	/nfs/dbraw/zinc/16/08/26/363160826.db2.gz	GLPSJXAUAYNCPP-ZDUSSCGKSA-N	1	0	254.330	1.313	50	0		CDAARO
C[NH2+]CC(=O)Nc1nc2c(s1)CCCCCC2	ZINC000152598668	188030859	/nfs/dbraw/zinc/03/08/59/188030859.db2.gz	XIIPJADZPKKTCV-UHFFFAOYSA-N	1	0	253.371	1.960	50	0		CDAARO
CC[NH+]1CCN(Cc2nnc(CCc3ccccc3)[nH]2)CC1	ZINC000065503336	363295413	/nfs/dbraw/zinc/29/54/13/363295413.db2.gz	FSLFYQZHJBKWEH-UHFFFAOYSA-N	1	0	299.422	1.727	50	0		CDAARO
Cn1nccc1CNC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000036901236	363289043	/nfs/dbraw/zinc/28/90/43/363289043.db2.gz	QDOUGZKGAREHFL-UHFFFAOYSA-N	1	0	250.390	1.819	50	0		CDAARO
C[C@@H]1CN(CCOc2ccc(CC[NH3+])cc2)C[C@H](C)O1	ZINC000037049818	363331131	/nfs/dbraw/zinc/33/11/31/363331131.db2.gz	QLIRRHFEZCKROH-OKILXGFUSA-N	1	0	278.396	1.676	50	0		CDAARO
CNS(=O)(=O)Cc1ccc2[nH]cc(CC[NH+](C)C)c2c1	ZINC000000014360	355879523	/nfs/dbraw/zinc/87/95/23/355879523.db2.gz	KQKPFRSPSRPDEB-UHFFFAOYSA-N	1	0	295.408	1.321	50	0	fda	CDAARO
CS(=O)(=O)c1ccc(NC2CC[NH2+]CC2)c(F)c1	ZINC000001529137	355939179	/nfs/dbraw/zinc/93/91/79/355939179.db2.gz	MULJUZGQWIPXND-UHFFFAOYSA-N	1	0	272.345	1.393	50	0		CDAARO
c1cc(C[NH2+]CCCN2CCOCC2)cc2c1OCO2	ZINC000002885390	355986414	/nfs/dbraw/zinc/98/64/14/355986414.db2.gz	AXRYWNYJKRSQHP-UHFFFAOYSA-N	1	0	278.352	1.227	50	0		CDAARO
COc1cccc(OC)c1OCCOCC[N@H+](C)CCO	ZINC000002981046	355989712	/nfs/dbraw/zinc/98/97/12/355989712.db2.gz	KFWDLSFCELILPR-UHFFFAOYSA-N	1	0	299.367	1.023	50	0		CDAARO
COCC[NH2+]CCOCCOc1ccc(OC)cc1	ZINC000002981027	355989758	/nfs/dbraw/zinc/98/97/58/355989758.db2.gz	LHLGKLBYBPOIKS-UHFFFAOYSA-N	1	0	269.341	1.327	50	0		CDAARO
OC[C@H]1CCCC[N@@H+]1C[C@H](O)COc1ccc(Cl)cc1	ZINC000003110269	355994424	/nfs/dbraw/zinc/99/44/24/355994424.db2.gz	WMTGSWKPLDSFKN-KGLIPLIRSA-N	1	0	299.798	1.927	50	0		CDAARO
O[C@H](CN1CCOCC1)C[N@@H+]1CCC[C@H]1c1ccccc1	ZINC000034863374	355999262	/nfs/dbraw/zinc/99/92/62/355999262.db2.gz	JYIQSMZPACXSFW-SJORKVTESA-N	1	0	290.407	1.517	50	0		CDAARO
CCOC(=O)C1=C(O)NC(N2CCCCC2)=[NH+][C@@H]1C(C)C	ZINC000002441151	355970034	/nfs/dbraw/zinc/97/00/34/355970034.db2.gz	QCAZAEYHWCNBBL-VXGBXAGGSA-N	1	0	295.383	1.162	50	0		CDAARO
C[C@@H]1C[C@H]([NH3+])CCN1C(=O)c1ccc2c(c1)CCO2	ZINC000124675093	356058403	/nfs/dbraw/zinc/05/84/03/356058403.db2.gz	UBXKCAHAEQIVCG-ZWNOBZJWSA-N	1	0	260.337	1.573	50	0		CDAARO
c1ccc(-n2nnnc2N2CC[NH+](C3CCCC3)CC2)cc1	ZINC000032779321	356368232	/nfs/dbraw/zinc/36/82/32/356368232.db2.gz	VLALPFNXDAWGIE-UHFFFAOYSA-N	1	0	298.394	1.727	50	0		CDAARO
Cc1ccccc1CS(=O)(=O)NCCC[NH+]1CCCC1	ZINC000013673689	356353035	/nfs/dbraw/zinc/35/30/35/356353035.db2.gz	JYXPSNOUMTXKGB-UHFFFAOYSA-N	1	0	296.436	1.900	50	0		CDAARO
CCOc1ccc(C[NH2+]CCNC(=O)c2ccncc2)cc1	ZINC000004498117	356369634	/nfs/dbraw/zinc/36/96/34/356369634.db2.gz	SJVZYRAFJAYLSP-UHFFFAOYSA-N	1	0	299.374	2.000	50	0		CDAARO
CC(C)(C)CN1CCC[C@](O)(C[N@@H+]2CCCOCC2)C1=O	ZINC000014981404	356402318	/nfs/dbraw/zinc/40/23/18/356402318.db2.gz	KHGFQFCKUVGJJM-INIZCTEOSA-N	1	0	298.427	1.108	50	0		CDAARO
C[N@H+](CCOc1ccccc1Cl)CCC(N)=O	ZINC000016422266	356439283	/nfs/dbraw/zinc/43/92/83/356439283.db2.gz	VMPCALYXCRQJLV-UHFFFAOYSA-N	1	0	256.733	1.526	50	0		CDAARO
O=C(C[NH+]1CCCC1)NC(=O)NCc1ccccc1	ZINC000016445150	356440115	/nfs/dbraw/zinc/44/01/15/356440115.db2.gz	RNNLKCJVKYYNFC-UHFFFAOYSA-N	1	0	261.325	1.108	50	0		CDAARO
CCOc1ccc(C(=O)NC2CC[NH+](C)CC2)cc1	ZINC000016602513	356443031	/nfs/dbraw/zinc/44/30/31/356443031.db2.gz	HEUWVFBADSPXHG-UHFFFAOYSA-N	1	0	262.353	1.909	50	0		CDAARO
c1cc(CC[NH+]2CCN(c3ncccn3)CC2)cs1	ZINC000020135345	356527191	/nfs/dbraw/zinc/52/71/91/356527191.db2.gz	YJSXLYVNJRHCQQ-UHFFFAOYSA-N	1	0	274.393	1.903	50	0		CDAARO
Cc1ccc(Nc2ccc(N3CC[NH2+]CC3)nn2)cc1	ZINC000026444432	356693403	/nfs/dbraw/zinc/69/34/03/356693403.db2.gz	YNLJUHXPRUKMKO-UHFFFAOYSA-N	1	0	269.352	1.938	50	0		CDAARO
CCn1ccnc1CN1CC[N@H+](CC(C)C)[C@H](CCO)C1	ZINC000036385686	356873085	/nfs/dbraw/zinc/87/30/85/356873085.db2.gz	QJDSGPARLBCLON-OAHLLOKOSA-N	1	0	294.443	1.428	50	0		CDAARO
CC(C)(C)OC(=O)N[C@H]1CCCN(C2COC2)C1	ZINC000067802911	356901700	/nfs/dbraw/zinc/90/17/00/356901700.db2.gz	YGLAKKRUEGJYMY-JTQLQIEISA-N	1	0	256.346	1.374	50	0		CDAARO
COC(=O)[C@H]1CN(CCc2ccccc2)CCC1=O	ZINC000049786394	357222854	/nfs/dbraw/zinc/22/28/54/357222854.db2.gz	URYCIMSKJIWGEO-ZDUSSCGKSA-N	1	0	261.321	1.293	50	0		CDAARO
[NH3+]C1CCN(S(=O)(=O)c2c(F)cc(F)cc2F)CC1	ZINC000037908870	357508019	/nfs/dbraw/zinc/50/80/19/357508019.db2.gz	ZSDZYZRYTUQZOW-UHFFFAOYSA-N	1	0	294.298	1.216	50	0		CDAARO
O=C(c1cccc(-n2cccn2)c1)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065383353	357534750	/nfs/dbraw/zinc/53/47/50/357534750.db2.gz	ZVSHJFHLRHVAJH-ZBFHGGJFSA-N	1	0	296.374	1.839	50	0		CDAARO
Cc1ccc([C@H](C)NC(=O)C[NH2+]CC(C)(C)CO)cc1	ZINC000065461169	357543311	/nfs/dbraw/zinc/54/33/11/357543311.db2.gz	YTYWLXYGPHVOKU-ZDUSSCGKSA-N	1	0	278.396	1.780	50	0		CDAARO
COC[C@H](C)[NH2+]CC(=O)Nc1ccc(F)cc1C	ZINC000065506310	357545747	/nfs/dbraw/zinc/54/57/47/357545747.db2.gz	OZEDYTYPFFTZHR-JTQLQIEISA-N	1	0	254.305	1.697	50	0		CDAARO
CC(C)[N@@H+](Cc1ccc(CO)o1)C[C@@H]1CCC(=O)N1	ZINC000065506429	357546079	/nfs/dbraw/zinc/54/60/79/357546079.db2.gz	BCXLPXLNZQMQQA-NSHDSACASA-N	1	0	266.341	1.261	50	0		CDAARO
Cc1nc(C[NH3+])cc(NCCc2n[nH]c3c2CCCC3)n1	ZINC000067758280	357624617	/nfs/dbraw/zinc/62/46/17/357624617.db2.gz	BPSITFJCHZTQMO-UHFFFAOYSA-N	1	0	286.383	1.500	50	0		CDAARO
CC(C)=CC(=O)N1CCC[N@H+](C)C2(CCN(C)CC2)C1	ZINC000067641857	357616271	/nfs/dbraw/zinc/61/62/71/357616271.db2.gz	BHWYMVAGOZMKRF-UHFFFAOYSA-N	1	0	279.428	1.581	50	0		CDAARO
[NH3+]C1(C(=O)N2CCC[C@H](c3nccn3CC3CC3)C2)CC1	ZINC000082106663	358147000	/nfs/dbraw/zinc/14/70/00/358147000.db2.gz	SVCMWNWSXJLIOY-ZDUSSCGKSA-N	1	0	288.395	1.490	50	0		CDAARO
[NH3+][C@H]1CCCCN(C(=O)c2ncc(F)cc2F)C1	ZINC000082127906	358148787	/nfs/dbraw/zinc/14/87/87/358148787.db2.gz	ONRJMGMJCCWMMV-VIFPVBQESA-N	1	0	255.268	1.313	50	0		CDAARO
CCNC(=O)c1ccc(NC(=O)C2(C[NH3+])CCCC2)cc1	ZINC000127957585	358251244	/nfs/dbraw/zinc/25/12/44/358251244.db2.gz	WPNNUPBNIINAGI-UHFFFAOYSA-N	1	0	289.379	1.894	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@@H]1C(=O)NC[C@@H](O)C1CCCC1	ZINC000195530804	358559271	/nfs/dbraw/zinc/55/92/71/358559271.db2.gz	JINBCWRTWVCLPR-HUUCEWRRSA-N	1	0	282.428	1.917	50	0		CDAARO
[NH3+][C@@H](Cc1ccccc1)CN1C(=O)c2ccccc2C1=O	ZINC000095080003	358675745	/nfs/dbraw/zinc/67/57/45/358675745.db2.gz	GNRNHWYDOMWBIJ-ZDUSSCGKSA-N	1	0	280.327	1.853	50	0		CDAARO
O=C(CCC[NH+]1CCCCC1)NCCc1cnccn1	ZINC000095362208	358685539	/nfs/dbraw/zinc/68/55/39/358685539.db2.gz	TVAGUUZAFPFAGV-UHFFFAOYSA-N	1	0	276.384	1.401	50	0		CDAARO
CC(C)[N@@H+]1CC[C@H](CN2C(=O)COc3cccnc32)C1	ZINC000095362824	358685566	/nfs/dbraw/zinc/68/55/66/358685566.db2.gz	CBYBBJVSHWDHMM-LBPRGKRZSA-N	1	0	275.352	1.537	50	0		CDAARO
CCc1nc(N)nc(N2C[C@@H]3CC[N@H+](C)[C@@H]3C2)c1C	ZINC000095379979	358689608	/nfs/dbraw/zinc/68/96/08/358689608.db2.gz	UZNSJSFETMGECW-CMPLNLGQSA-N	1	0	261.373	1.070	50	0		CDAARO
CCn1ncnc1[C@@H](C)NC(=O)CC1CC[NH+](CC)CC1	ZINC000095387853	358691193	/nfs/dbraw/zinc/69/11/93/358691193.db2.gz	IDRMNYVLFBSWSD-GFCCVEGCSA-N	1	0	293.415	1.597	50	0		CDAARO
Cc1noc([C@H]2CCC[N@@H+](C3CCOCC3)C2)n1	ZINC000095454198	358694239	/nfs/dbraw/zinc/69/42/39/358694239.db2.gz	DUQMXOJCAZWVKU-NSHDSACASA-N	1	0	251.330	1.736	50	0		CDAARO
Cc1cc(C(=O)NCC[C@H]2CCC[N@H+]2C)cc(C)n1	ZINC000097117016	358751978	/nfs/dbraw/zinc/75/19/78/358751978.db2.gz	QOYAUZQXGGHZMZ-CQSZACIVSA-N	1	0	261.369	1.913	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](OC(=O)[C@H](O)c1ccccc1)C2	ZINC000100016393	358818113	/nfs/dbraw/zinc/81/81/13/358818113.db2.gz	ZTVIKZXZYLEVOL-CBBWQLFWSA-N	1	0	275.348	1.888	50	0	world	CDAARO
O=C(C[C@@H]1COCC[NH2+]1)NCc1ccc2c(c1)CCCC2	ZINC000097694792	358794012	/nfs/dbraw/zinc/79/40/12/358794012.db2.gz	UFTNVDXTNLJFJG-MRXNPFEDSA-N	1	0	288.391	1.560	50	0		CDAARO
Cn1nc(C(F)(F)F)c(Cl)c1C(=O)N[C@@H]1CC[NH2+]C1	ZINC000097775925	358799026	/nfs/dbraw/zinc/79/90/26/358799026.db2.gz	ZERQEPUJZLWWCY-RXMQYKEDSA-N	1	0	296.680	1.184	50	0		CDAARO
CCN(CCNC(=O)[C@H]1[C@@H]2C[NH2+]C[C@@H]21)c1cccc(C)c1	ZINC000102675138	358886611	/nfs/dbraw/zinc/88/66/11/358886611.db2.gz	PGNPLWJGXKORMQ-ZSHCYNCHSA-N	1	0	287.407	1.403	50	0		CDAARO
CO[C@H](CNc1cc(-n2cccn2)nc(N)[nH+]1)C(C)(C)C	ZINC000092918579	358894745	/nfs/dbraw/zinc/89/47/45/358894745.db2.gz	IJRVANQARVXVFZ-SNVBAGLBSA-N	1	0	290.371	1.718	50	0		CDAARO
CCc1ccc(C[N@@H+](CC)[C@H]2COC[C@@H]2O)nc1	ZINC000215643607	358896780	/nfs/dbraw/zinc/89/67/80/358896780.db2.gz	TZHBQSIGBLSCHX-KBPBESRZSA-N	1	0	250.342	1.226	50	0		CDAARO
COC[C@H]1CC[N@H+](Cc2cnc(N3CCCCC3)nc2)C1	ZINC000215826868	358905672	/nfs/dbraw/zinc/90/56/72/358905672.db2.gz	HFNVDMDTULFQSQ-AWEZNQCLSA-N	1	0	290.411	1.935	50	0		CDAARO
c1ccc(-n2nnnc2NCC[NH+]2CCCC2)cc1	ZINC000014116209	366530450	/nfs/dbraw/zinc/53/04/50/366530450.db2.gz	MWRLNTHAPTZLTD-UHFFFAOYSA-N	1	0	258.329	1.170	50	0		CDAARO
Cc1noc(C)c1C[N@@H+]1CCC[C@H](c2nnc[nH]2)C1	ZINC000216439011	358944497	/nfs/dbraw/zinc/94/44/97/358944497.db2.gz	RUYUXPOGDQUICA-NSHDSACASA-N	1	0	261.329	1.789	50	0		CDAARO
Cc1c(C[NH+]2CCC3(CC2)OCCC[C@H]3O)cnn1C	ZINC000216432774	358945117	/nfs/dbraw/zinc/94/51/17/358945117.db2.gz	VUEGOUHXRJXKHL-CQSZACIVSA-N	1	0	279.384	1.234	50	0		CDAARO
CC(C)C(=O)N1C[C@@H]2C[N@@H+](C3CCCC3)CC[C@]2(CO)C1	ZINC000257176539	359074228	/nfs/dbraw/zinc/07/42/28/359074228.db2.gz	UBQVURYJWIKDGJ-WMLDXEAASA-N	1	0	294.439	1.728	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCNC(=O)c2ccc(F)c(O)c2)C1	ZINC000219314139	359088196	/nfs/dbraw/zinc/08/81/96/359088196.db2.gz	RQILGPGXGWIJJD-LLVKDONJSA-N	1	0	280.343	1.993	50	0		CDAARO
CCCOCCN1CCn2nc([C@@H](O)C3CC3)cc2C1	ZINC000219925441	359138884	/nfs/dbraw/zinc/13/88/84/359138884.db2.gz	KPOYCOGSKKDRHG-HNNXBMFYSA-N	1	0	279.384	1.569	50	0		CDAARO
CCN1CCN(C(=O)CCn2nc(C)c(Cl)c2C)CC1	ZINC000032611170	359234685	/nfs/dbraw/zinc/23/46/85/359234685.db2.gz	USVQNAGAULKLPQ-UHFFFAOYSA-N	1	0	298.818	1.708	50	0		CDAARO
Cc1cc(CN(C)C(=O)CSCC[NH+]2CCCC2)on1	ZINC000221221196	359218571	/nfs/dbraw/zinc/21/85/71/359218571.db2.gz	VKGZSHOFABGAOC-UHFFFAOYSA-N	1	0	297.424	1.770	50	0		CDAARO
CCOC(=O)Cn1c2c(c(=[NH2+])c3c1CCC3)CCC2	ZINC000000198621	359289753	/nfs/dbraw/zinc/28/97/53/359289753.db2.gz	LDDOMCOQCYQJHD-UHFFFAOYSA-N	1	0	260.337	1.508	50	0		CDAARO
CC(C)[NH+]1CCC(CNC(=O)C(=O)NC(C)(C)C)CC1	ZINC000011693583	359551924	/nfs/dbraw/zinc/55/19/24/359551924.db2.gz	SYKMCSISWCHFRR-UHFFFAOYSA-N	1	0	283.416	1.138	50	0		CDAARO
C[C@]1(O)CCOC2(CC[NH+](Cc3cccnc3)CC2)C1	ZINC000257191413	359586412	/nfs/dbraw/zinc/58/64/12/359586412.db2.gz	QFNPQFWWDPIZCU-HNNXBMFYSA-N	1	0	276.380	1.978	50	0		CDAARO
CCC[N@H+](C)C[C@H]1CCN(C(=O)CCc2ccncn2)C1	ZINC000191268023	359610670	/nfs/dbraw/zinc/61/06/70/359610670.db2.gz	QMKHZNDPTAHMHH-CQSZACIVSA-N	1	0	290.411	1.600	50	0		CDAARO
COc1cccc(C(=O)NC(C)(C)C[NH+](C)C)c1	ZINC000408520531	359907813	/nfs/dbraw/zinc/90/78/13/359907813.db2.gz	KLAPCPQQIWAROG-UHFFFAOYSA-N	1	0	250.342	1.765	50	0		CDAARO
CCS(=O)(=O)N1CC[C@@H](Cn2c(C)c[nH+]c2C)C1	ZINC000409420072	360228658	/nfs/dbraw/zinc/22/86/58/360228658.db2.gz	RRQWTNQGPBEOKD-GFCCVEGCSA-N	1	0	271.386	1.172	50	0		CDAARO
O=C(NCCc1ncc[nH]1)[C@@H]1CCC[N@@H+]2CCCC[C@H]12	ZINC000426490702	360574381	/nfs/dbraw/zinc/57/43/81/360574381.db2.gz	YVLNGUJEYNHUJO-CHWSQXEVSA-N	1	0	276.384	1.333	50	0		CDAARO
CC[N@H+](C)C1(CNC(=O)c2cncc(=O)[nH]2)CCCCC1	ZINC000426651384	360692407	/nfs/dbraw/zinc/69/24/07/360692407.db2.gz	UBGQMJLWXBILDO-UHFFFAOYSA-N	1	0	292.383	1.154	50	0		CDAARO
CC[C@@H](O)CSc1nnc(C[NH3+])n1-c1ccccc1C	ZINC000426359067	360658456	/nfs/dbraw/zinc/65/84/56/360658456.db2.gz	NHKLLZWQNDMPCS-LLVKDONJSA-N	1	0	292.408	1.897	50	0		CDAARO
Cc1ccc(OCCC(=O)N2CC[C@@H](C[NH3+])C2)c(C)c1	ZINC000178558496	189126490	/nfs/dbraw/zinc/12/64/90/189126490.db2.gz	CYOPXXLLBQXUGE-AWEZNQCLSA-N	1	0	276.380	1.880	50	0		CDAARO
CC[C@@H](Oc1ccccc1C)C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178592154	189129182	/nfs/dbraw/zinc/12/91/82/189129182.db2.gz	BSLCTCMLORBGTD-ZIAGYGMSSA-N	1	0	276.380	1.960	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)NC[C@H](O)c2c(F)cccc2F)C1	ZINC000299739000	200850739	/nfs/dbraw/zinc/85/07/39/200850739.db2.gz	JJOVYCXLAFKXDC-SBMIAAHKSA-N	1	0	284.306	1.242	50	0		CDAARO
CCC[C@@H](CCc1ccccc1)NC(=O)[C@H]1C[NH2+]CCO1	ZINC000187889397	189480442	/nfs/dbraw/zinc/48/04/42/189480442.db2.gz	QLBCFSIRLMEIKJ-JKSUJKDBSA-N	1	0	290.407	1.893	50	0		CDAARO
CC[NH+](CC)CCNc1c(=O)c(=O)c1-c1ccccc1	ZINC000101982152	364857081	/nfs/dbraw/zinc/85/70/81/364857081.db2.gz	OAQPXPJMQYPEAS-UHFFFAOYSA-N	1	0	272.348	1.703	50	0		CDAARO
C[C@@H](NC(=O)Cc1ccc(O)cc1)C1=CC[N@H+](C)CC1	ZINC000272742890	365375529	/nfs/dbraw/zinc/37/55/29/365375529.db2.gz	CYVQBLDXOULDIJ-GFCCVEGCSA-N	1	0	274.364	1.701	50	0		CDAARO
COc1ccc(CCC(=O)N2CC[NH2+][C@@H](C)C2)cc1F	ZINC000275784932	193127767	/nfs/dbraw/zinc/12/77/67/193127767.db2.gz	QNUNRFVBQSGMOC-NSHDSACASA-N	1	0	280.343	1.587	50	0		CDAARO
NC(=O)CC[N@@H+]1CCS[C@H](c2ccccc2)C1	ZINC000089828119	366941512	/nfs/dbraw/zinc/94/15/12/366941512.db2.gz	NTFCDVKEGMIURL-LBPRGKRZSA-N	1	0	250.367	1.652	50	0		CDAARO
O=C(N[C@@H]1CC12CC[NH2+]CC2)N1CCO[C@@H]2CCC[C@@H]21	ZINC000627119262	367489617	/nfs/dbraw/zinc/48/96/17/367489617.db2.gz	LPDYZNQJWBREGS-YNEHKIRRSA-N	1	0	279.384	1.091	50	0		CDAARO
CN(C)c1ccccc1C[NH2+][C@H](CS(C)(=O)=O)C1CC1	ZINC000252503502	367651458	/nfs/dbraw/zinc/65/14/58/367651458.db2.gz	VEAKITGJBUVXOE-CQSZACIVSA-N	1	0	296.436	1.665	50	0		CDAARO
O[C@H]1C[C@@H](c2cc(NCC34CCC[NH+]3CCC4)ncn2)C1	ZINC000240517126	189903216	/nfs/dbraw/zinc/90/32/16/189903216.db2.gz	NVIUSEFXQUEDJE-BETUJISGSA-N	1	0	288.395	1.755	50	0		CDAARO
C[N@H+](CCC[C@H]1CCCO1)CCn1cc[nH]c1=O	ZINC000244716033	189910007	/nfs/dbraw/zinc/91/00/07/189910007.db2.gz	LHBGIGBYORLEGA-LBPRGKRZSA-N	1	0	253.346	1.067	50	0		CDAARO
COc1cccc(C[NH+]2CCC3(CC2)C[C@@H](O)CCO3)n1	ZINC000253412196	373720654	/nfs/dbraw/zinc/72/06/54/373720654.db2.gz	QEKWCQPAZNNJKI-AWEZNQCLSA-N	1	0	292.379	1.596	50	0		CDAARO
CCOc1ccc(C[N@@H+]2C[C@@H](CO)[C@H](NC(C)=O)C2)cc1	ZINC000253397099	373686956	/nfs/dbraw/zinc/68/69/56/373686956.db2.gz	BJKSVKVHBWHLRY-GOEBONIOSA-N	1	0	292.379	1.014	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@@H]1NC(=O)Cc1c(F)cccc1F	ZINC000095048570	373694130	/nfs/dbraw/zinc/69/41/30/373694130.db2.gz	GXCZDYPQUCEUOH-ZANVPECISA-N	1	0	268.307	1.764	50	0		CDAARO
CCOC(=O)[C@@H]1CCC[C@@H]1[N@@H+]1CCC[C@H](NC(=O)CC)C1	ZINC000108157288	412814451	/nfs/dbraw/zinc/81/44/51/412814451.db2.gz	OHNDJQAWTSRJAO-MJBXVCDLSA-N	1	0	296.411	1.709	50	0		CDAARO
Cc1nnsc1C(=O)N(CC[NH+](C)C)C1CCOCC1	ZINC000206665689	374179543	/nfs/dbraw/zinc/17/95/43/374179543.db2.gz	VXBPJLVYSFPYAE-UHFFFAOYSA-N	1	0	298.412	1.029	50	0		CDAARO
O=C1CCCN1C[C@@H](O)C[N@@H+]1CCC[C@@H]1c1cccs1	ZINC000111682100	374199374	/nfs/dbraw/zinc/19/93/74/374199374.db2.gz	CSEQHERRWPUWGN-QWHCGFSZSA-N	1	0	294.420	1.868	50	0		CDAARO
COCC1CCN(C(=O)[C@H](C[NH3+])CC(C)C)CC1	ZINC000094700472	374446670	/nfs/dbraw/zinc/44/66/70/374446670.db2.gz	ULIRZTWDKHWVBZ-ZDUSSCGKSA-N	1	0	256.390	1.492	50	0		CDAARO
CC(C)[C@@H]([NH2+]CCc1ccc(S(N)(=O)=O)cc1)C1CC1	ZINC000095419862	374920957	/nfs/dbraw/zinc/92/09/57/374920957.db2.gz	YSEZTMJTZMRMRX-OAHLLOKOSA-N	1	0	296.436	1.901	50	0		CDAARO
CC(=O)c1cccc(NC(=O)C[NH2+]C(C)(C)C(C)(C)O)c1	ZINC000095459768	374957928	/nfs/dbraw/zinc/95/79/28/374957928.db2.gz	DMWOZALQGDXAPZ-UHFFFAOYSA-N	1	0	292.379	1.967	50	0		CDAARO
NC(=O)c1ccc(C[NH+]2CCC(c3cn[nH]c3)CC2)cc1	ZINC000097202937	375155940	/nfs/dbraw/zinc/15/59/40/375155940.db2.gz	WXDPTMVCZDOEEV-UHFFFAOYSA-N	1	0	284.363	1.888	50	0		CDAARO
Cc1nn(C)cc1C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000002781313	375326983	/nfs/dbraw/zinc/32/69/83/375326983.db2.gz	APAXGYWEUQYYTF-UHFFFAOYSA-N	1	0	278.400	1.768	50	0		CDAARO
CNC(=S)NC[C@H](c1ccco1)[NH+]1CCCCC1	ZINC000003335610	375652332	/nfs/dbraw/zinc/65/23/32/375652332.db2.gz	ATOXTUHGUVHLDY-LLVKDONJSA-N	1	0	267.398	1.901	50	0		CDAARO
CCC[C@H]([NH2+]CCCn1cc(CO)nn1)[C@H]1CC1(C)C	ZINC000417324562	375781724	/nfs/dbraw/zinc/78/17/24/375781724.db2.gz	ALXARJJPRNBFAO-KGLIPLIRSA-N	1	0	280.416	1.965	50	0		CDAARO
CC(=O)N1CCC([NH2+][C@H](C(C)C)[C@@H](CO)C(C)C)CC1	ZINC000449513615	375897818	/nfs/dbraw/zinc/89/78/18/375897818.db2.gz	TXVPNJBCEVWDGW-JKSUJKDBSA-N	1	0	284.444	1.876	50	0		CDAARO
CCCC[C@H]([NH2+][C@@H]1CCN(C(C)=O)C[C@H]1CC)C(N)=O	ZINC000239654141	376017039	/nfs/dbraw/zinc/01/70/39/376017039.db2.gz	BMPWBKARDJXSBE-MCIONIFRSA-N	1	0	283.416	1.267	50	0		CDAARO
OC[C@H]([NH2+][C@H]1Cc2ccccc2[C@H]1O)c1ccccc1	ZINC000241371402	376018379	/nfs/dbraw/zinc/01/83/79/376018379.db2.gz	MNGSIXOJRACXGG-YESZJQIVSA-N	1	0	269.344	1.968	50	0		CDAARO
CCn1cc(C[N@H+](C)[C@H]2Cc3ccccc3[C@H]2O)cn1	ZINC000241774132	376019887	/nfs/dbraw/zinc/01/98/87/376019887.db2.gz	RNHQKNQMJUQKCG-JKSUJKDBSA-N	1	0	271.364	1.993	50	0		CDAARO
Cn1ccnc1-c1cccc(NC(=O)[C@H]2CC(=O)N(C)C2)c1	ZINC000065152360	376031717	/nfs/dbraw/zinc/03/17/17/376031717.db2.gz	ZWKKSBSYZAQWAO-LBPRGKRZSA-N	1	0	298.346	1.504	50	0		CDAARO
CN(CCc1cn[nH]c1)C[C@]1(O)CCC[N@@H+]2CCCC[C@@H]21	ZINC000067790577	377237633	/nfs/dbraw/zinc/23/76/33/377237633.db2.gz	PEOVRKUYFQAZKB-HZPDHXFCSA-N	1	0	292.427	1.263	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N(C)[C@@H]1CCN(c2ccccc2F)C1=O	ZINC000129854124	377495004	/nfs/dbraw/zinc/49/50/04/377495004.db2.gz	KQOHZPRZBBBVNI-DGCLKSJQSA-N	1	0	293.342	1.127	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(C[NH3+])c2)C1	ZINC000381900527	379418123	/nfs/dbraw/zinc/41/81/23/379418123.db2.gz	WDMDCQRLSUZIMY-ZDUSSCGKSA-N	1	0	293.367	1.929	50	0		CDAARO
O=C1N(Cc2ccc(F)cc2)CCC[C@]12CC[NH2+]C2	ZINC000072143570	284853821	/nfs/dbraw/zinc/85/38/21/284853821.db2.gz	BEAFJVANWSQDDL-OAHLLOKOSA-N	1	0	262.328	1.928	50	0		CDAARO
NC(=[NH2+])NC[C@@H](O)CN(c1ccccc1)c1ccccc1	ZINC000000492769	169655680	/nfs/dbraw/zinc/65/56/80/169655680.db2.gz	MOBSQAWJINLGBZ-OAHLLOKOSA-N	1	0	284.363	1.669	50	0		CDAARO
CC[NH+]1CCC(CC(=O)N[C@@H](C)Cc2cnccn2)CC1	ZINC000095355884	184951513	/nfs/dbraw/zinc/95/15/13/184951513.db2.gz	NRTCGWNWUMRVLZ-ZDUSSCGKSA-N	1	0	290.411	1.646	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1C(=O)N1CCC(OCCOC)CC1	ZINC000096408533	390507897	/nfs/dbraw/zinc/50/78/97/390507897.db2.gz	ANEVWAROXGZGIE-OAHLLOKOSA-N	1	0	298.427	1.515	50	0		CDAARO
c1ccc(C[N@H+]2CCCC[C@@H]2CN2CCOCC2)nc1	ZINC000096424218	390516251	/nfs/dbraw/zinc/51/62/51/390516251.db2.gz	HZOXVRPWDPJBGA-MRXNPFEDSA-N	1	0	275.396	1.768	50	0		CDAARO
Cc1n[nH]c(C)c1C[NH2+]C[C@@H](O)c1ccccc1F	ZINC000097159481	390800970	/nfs/dbraw/zinc/80/09/70/390800970.db2.gz	KXNYUVDQKXXRES-CQSZACIVSA-N	1	0	263.316	1.989	50	0		CDAARO
C[C@@H](CNC(=O)N1CCCC1)[N@@H+]1CCC[C@H](C)C1	ZINC000079267674	390946411	/nfs/dbraw/zinc/94/64/11/390946411.db2.gz	KFQPFGNDVRAERH-STQMWFEESA-N	1	0	253.390	1.912	50	0		CDAARO
Nc1ccc(NC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3[NH2+]2)cn1	ZINC000237998122	390897421	/nfs/dbraw/zinc/89/74/21/390897421.db2.gz	RDCZMMMSVGSZQK-DLOVCJGASA-N	1	0	260.341	1.523	50	0		CDAARO
CC(C)[C@@H](O)C[NH2+][C@H](C)c1ccc(-n2cncn2)cc1	ZINC000123923330	390912511	/nfs/dbraw/zinc/91/25/11/390912511.db2.gz	PQFLYWSABRDLHG-DOMZBBRYSA-N	1	0	274.368	1.935	50	0		CDAARO
c1csc(C[N@@H+]2CC[C@H](N3CCOCC3)C2)c1	ZINC000121082280	391527175	/nfs/dbraw/zinc/52/71/75/391527175.db2.gz	FDIBAPLNHBYGAD-LBPRGKRZSA-N	1	0	252.383	1.655	50	0		CDAARO
CC(C)OCCCNC(=O)N1CCC[C@H]2C[N@H+](C)CC[C@H]21	ZINC000095996140	393157687	/nfs/dbraw/zinc/15/76/87/393157687.db2.gz	QHTCHXFIBBHPMS-LSDHHAIUSA-N	1	0	297.443	1.927	50	0		CDAARO
O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCOC1	ZINC000093064763	135078259	/nfs/dbraw/zinc/07/82/59/135078259.db2.gz	KMDYRUJXTXMZNH-CQSZACIVSA-N	1	0	289.379	1.451	50	0		CDAARO
COC(C)(C)C[C@@H](C)[NH2+]CCn1c(C)cc(C)nc1=O	ZINC000065381000	292066248	/nfs/dbraw/zinc/06/62/48/292066248.db2.gz	VTZNBEWOXYNAGR-GFCCVEGCSA-N	1	0	281.400	1.653	50	0		CDAARO
COC(=O)CN1CCC[N@H+](CCc2ccccc2F)CC1	ZINC000097162638	397981224	/nfs/dbraw/zinc/98/12/24/397981224.db2.gz	IUVAQMQAKMDDKG-UHFFFAOYSA-N	1	0	294.370	1.549	50	0		CDAARO
CCOC(=O)[C@@H]1C[NH2+]C[C@@]12CCN(C(=O)OC(C)(C)C)C2	ZINC000091303162	285885922	/nfs/dbraw/zinc/88/59/22/285885922.db2.gz	LKKYIMUKDUHHII-XHDPSFHLSA-N	1	0	298.383	1.396	50	0		CDAARO
Cc1nnc(C[N@@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)s1	ZINC000660691098	413377687	/nfs/dbraw/zinc/37/76/87/413377687.db2.gz	FWPVOWQPAXHOME-UTUOFQBUSA-N	1	0	267.398	1.972	50	0		CDAARO
C[NH+](C)[C@@H]1CCC[C@H]1Nc1cnc2ccccc2n1	ZINC000362676189	159211183	/nfs/dbraw/zinc/21/11/83/159211183.db2.gz	ULGGPJQQIRAJDG-ZIAGYGMSSA-N	1	0	256.353	1.946	50	0		CDAARO
C[C@@H]([NH2+]CC(C)(C)C(N)=O)c1ccccc1N(C)C	ZINC000097033748	287016127	/nfs/dbraw/zinc/01/61/27/287016127.db2.gz	HEUHSHDIBDDXSO-LLVKDONJSA-N	1	0	263.385	1.915	50	0		CDAARO
CC[C@@H]1CN(C(C)=O)CC[C@@H]1[NH2+][C@H](C)C(=O)NC(C)(C)C	ZINC000107584142	287179563	/nfs/dbraw/zinc/17/95/63/287179563.db2.gz	MELUQDGOIMVLSN-BNOWGMLFSA-N	1	0	297.443	1.526	50	0		CDAARO
[NH3+]CCS[C@H]1CC(=O)N(c2cccc(F)c2)C1=O	ZINC000002727639	169822786	/nfs/dbraw/zinc/82/27/86/169822786.db2.gz	CMOPJIJUGAPTQO-JTQLQIEISA-N	1	0	268.313	1.150	50	0		CDAARO
C[N@@H+]1CCCN(C(=S)NCCc2ccccc2)CC1	ZINC000007526354	170289166	/nfs/dbraw/zinc/28/91/66/170289166.db2.gz	ZHJMKTCNZMCLHW-UHFFFAOYSA-N	1	0	277.437	1.741	50	0		CDAARO
CC(=O)Nc1ccc(NC(=O)C[NH2+]C(C)(C)C)cc1	ZINC000009365582	170374147	/nfs/dbraw/zinc/37/41/47/170374147.db2.gz	NGOIFBBZXHEHOF-UHFFFAOYSA-N	1	0	263.341	1.972	50	0		CDAARO
C[NH+](C)CCNS(=O)(=O)Cc1ccc(Cl)cc1	ZINC000010111704	170397772	/nfs/dbraw/zinc/39/77/72/170397772.db2.gz	DQEAMWJKNZFPTL-UHFFFAOYSA-N	1	0	276.789	1.321	50	0		CDAARO
CCN(CC[NH3+])S(=O)(=O)c1ccc(Cl)s1	ZINC000020183155	171046782	/nfs/dbraw/zinc/04/67/82/171046782.db2.gz	KIXYXUPEZRAPBN-UHFFFAOYSA-N	1	0	268.791	1.371	50	0		CDAARO
CCOc1ccc(NC(=O)CN2CC[NH+](CC)CC2)cc1	ZINC000020608834	171267716	/nfs/dbraw/zinc/26/77/16/171267716.db2.gz	YDVUHHVBLNRSBE-UHFFFAOYSA-N	1	0	291.395	1.661	50	0		CDAARO
CCN(CCCC[NH3+])c1ccc2c(c1)c(=O)[nH][nH]c2=O	ZINC000020840621	171275518	/nfs/dbraw/zinc/27/55/18/171275518.db2.gz	LEOJISUPFSWNMA-UHFFFAOYSA-N	1	0	276.340	1.194	50	0		CDAARO
COc1ccc(CN2CCC[N@H+](C)CC2)cc1O	ZINC000022591530	171392974	/nfs/dbraw/zinc/39/29/74/171392974.db2.gz	YCCAREKYPDCRSY-UHFFFAOYSA-N	1	0	250.342	1.538	50	0		CDAARO
CC(=O)c1ccccc1OCC[NH+]1CCC(C(N)=O)CC1	ZINC000026467761	171486172	/nfs/dbraw/zinc/48/61/72/171486172.db2.gz	QMWZYEOZELTGIE-UHFFFAOYSA-N	1	0	290.363	1.465	50	0		CDAARO
COc1cccc(C(=O)N(C)[C@H]2CCC[NH2+]CC2)c1	ZINC000035605686	172292909	/nfs/dbraw/zinc/29/29/09/172292909.db2.gz	LRLFCVCWYSXXRP-ZDUSSCGKSA-N	1	0	262.353	1.909	50	0		CDAARO
[NH3+]CCOc1ccc2nnc(-c3cccc(Cl)c3)n2n1	ZINC000038478038	174142136	/nfs/dbraw/zinc/14/21/36/174142136.db2.gz	AEUDOZRPZQUDSO-UHFFFAOYSA-N	1	0	289.726	1.782	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2ccccc2Br)C1	ZINC000038538688	174145602	/nfs/dbraw/zinc/14/56/02/174145602.db2.gz	OSIMPZQGBAVRSX-SNVBAGLBSA-N	1	0	255.159	1.982	50	0		CDAARO
Cc1cc(C)c(C)c(C(=O)NC[C@H]2C[NH2+]C[C@@H]2CO)c1C	ZINC000055182897	175573489	/nfs/dbraw/zinc/57/34/89/175573489.db2.gz	FZSHZQIAZAQAEQ-HUUCEWRRSA-N	1	0	290.407	1.478	50	0		CDAARO
C[NH+]1CCC(CCNC(=O)COc2ccccc2)CC1	ZINC000071376389	176141474	/nfs/dbraw/zinc/14/14/74/176141474.db2.gz	TWVRCAPUPWIWLI-UHFFFAOYSA-N	1	0	276.380	1.914	50	0		CDAARO
[NH3+]C1(C(=O)N2CCC([C@@H](O)Cc3ccccc3)CC2)CC1	ZINC000071575593	176202939	/nfs/dbraw/zinc/20/29/39/176202939.db2.gz	PVSBTWNANGKYMP-HNNXBMFYSA-N	1	0	288.391	1.320	50	0		CDAARO
C[NH+](C)[C@H]1CCCN(C(=O)c2ccnc(N)c2)CC1	ZINC000072160952	176329920	/nfs/dbraw/zinc/32/99/20/176329920.db2.gz	FRJSEKVBRFLDNO-LBPRGKRZSA-N	1	0	262.357	1.220	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(c2nnc(C[NH3+])[nH]2)CC1	ZINC000072236514	176345556	/nfs/dbraw/zinc/34/55/56/176345556.db2.gz	GJQOUBFXUZYQCM-UHFFFAOYSA-N	1	0	281.360	1.378	50	0		CDAARO
CCc1nn(C)c(Cl)c1CN1CC[C@H]2C[NH2+]C[C@H]21	ZINC000077342089	177254533	/nfs/dbraw/zinc/25/45/33/177254533.db2.gz	JQMALAQEWJEKPQ-JOYOIKCWSA-N	1	0	268.792	1.430	50	0		CDAARO
[NH3+]CCNC(=O)CN(Cc1ccccc1)c1ccccc1	ZINC000012647682	260063373	/nfs/dbraw/zinc/06/33/73/260063373.db2.gz	LIMOMEWLCFTFCR-UHFFFAOYSA-N	1	0	283.375	1.768	50	0		CDAARO
CN(CC[NH+]1CCCCC1)c1ncnc2c1cnn2C	ZINC000521396633	260099444	/nfs/dbraw/zinc/09/94/44/260099444.db2.gz	IEYSPZKGEUPHII-UHFFFAOYSA-N	1	0	274.372	1.285	50	0		CDAARO
C[C@@H]1C[C@H](C(=O)N2CC[N@@H+]3C[C@H](O)C[C@H]3C2)CC(C)(C)C1	ZINC000655296009	424314683	/nfs/dbraw/zinc/31/46/83/424314683.db2.gz	KUDLAXRKMMEGNE-CBBWQLFWSA-N	1	0	294.439	1.726	50	0		CDAARO
C[C@@H]1C[N@@H+](C[C@H](O)COC2CCCC2)C[C@H](C)O1	ZINC000012419919	424377523	/nfs/dbraw/zinc/37/75/23/424377523.db2.gz	VKESFLWTZYJZIP-XQQFMLRXSA-N	1	0	257.374	1.416	50	0		CDAARO
C[C@@H]([NH3+])[C@@H]1CCCCN1C(=O)c1cccc(-n2cncn2)c1	ZINC000122217564	274238580	/nfs/dbraw/zinc/23/85/80/274238580.db2.gz	XZKPBWZSBCLWKJ-DOMZBBRYSA-N	1	0	299.378	1.609	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+]C[C@@H]2CN(C3CC3)CCO2)C1(C)C	ZINC000097034702	276345259	/nfs/dbraw/zinc/34/52/59/276345259.db2.gz	ANBIQRZGIHBNDM-RBSFLKMASA-N	1	0	282.428	1.643	50	0		CDAARO
CCOC(=O)N1CC[C@@](C)([NH+]2CCC(O)CC2)C1	ZINC000095081535	276433843	/nfs/dbraw/zinc/43/38/43/276433843.db2.gz	KAORKQKJTABAMV-CYBMUJFWSA-N	1	0	256.346	1.064	50	0		CDAARO
C[NH+](C)C[C@]1(O)CCCN(CCc2ccccc2)C1=O	ZINC000015080664	276809567	/nfs/dbraw/zinc/80/95/67/276809567.db2.gz	OCAFCNQTJJNZIJ-MRXNPFEDSA-N	1	0	276.380	1.144	50	0		CDAARO
C[NH+]1CCC2(CC1)OCCN2C(=O)c1cccs1	ZINC000013722675	276890115	/nfs/dbraw/zinc/89/01/15/276890115.db2.gz	QAEMIOIFYDKPGZ-UHFFFAOYSA-N	1	0	266.366	1.642	50	0		CDAARO
CNC(=O)[C@H]1C[N@H+](CC2CCCCCC2)CCO1	ZINC000182446968	277013902	/nfs/dbraw/zinc/01/39/02/277013902.db2.gz	VINWDIRPYWCAMA-CYBMUJFWSA-N	1	0	254.374	1.404	50	0		CDAARO
C[N@@H+]1CCCCC[C@@H]1C(=O)N1CCn2cccc2C1	ZINC000095382047	277042922	/nfs/dbraw/zinc/04/29/22/277042922.db2.gz	IFVOCRLMFKDYGK-CQSZACIVSA-N	1	0	261.369	1.705	50	0		CDAARO
CC(=O)Nc1ccc([C@H]2[NH2+]CCc3nc[nH]c32)cc1	ZINC000065399206	277084060	/nfs/dbraw/zinc/08/40/60/277084060.db2.gz	UQEIZESBGYJISQ-CYBMUJFWSA-N	1	0	256.309	1.603	50	0		CDAARO
COC[C@@H](C)[NH2+]CC1(Cn2nc(C)cc2C)CC1	ZINC000065374632	277562557	/nfs/dbraw/zinc/56/25/57/277562557.db2.gz	NGYRRMWRINPUAI-GFCCVEGCSA-N	1	0	251.374	1.905	50	0		CDAARO
CC[C@H](OC)C(=O)N1CC[C@@H]([NH+]2CCCC2)[C@H]1C	ZINC000253419893	288127998	/nfs/dbraw/zinc/12/79/98/288127998.db2.gz	DLHPMUBYESNPAV-UPJWGTAASA-N	1	0	254.374	1.497	50	0		CDAARO
Cn1cnc2cc(C(=O)N3C[C@H]([NH3+])[C@@H](C4CC4)C3)ccc21	ZINC000091390867	279388280	/nfs/dbraw/zinc/38/82/80/279388280.db2.gz	GZALSJPWUYUBDA-OLZOCXBDSA-N	1	0	284.363	1.383	50	0		CDAARO
CC(C)N1CC[C@H]([N@@H+]2CCC[C@@H]([C@H](C)O)C2)C1=O	ZINC000245338719	280203701	/nfs/dbraw/zinc/20/37/01/280203701.db2.gz	OAGOMHUBNQAPDY-XQQFMLRXSA-N	1	0	254.374	1.089	50	0		CDAARO
Cc1cc(C(=O)Nc2cc(N(C)C)cc[nH+]2)cc(=O)[nH]1	ZINC000097107800	280366992	/nfs/dbraw/zinc/36/69/92/280366992.db2.gz	TVAZONVVHWJHIG-UHFFFAOYSA-N	1	0	272.308	1.397	50	0		CDAARO
C[C@@H]1CC[N@H+](CC(=O)NCc2nc3cc(F)ccc3[nH]2)C1	ZINC000553497334	290122510	/nfs/dbraw/zinc/12/25/10/290122510.db2.gz	BUOJILJYPHZPDS-SNVBAGLBSA-N	1	0	290.342	1.660	50	0		CDAARO
CC[NH+](CC)CC[C@H](CO)NC(=O)c1c[nH]cc1C	ZINC000571194810	294386894	/nfs/dbraw/zinc/38/68/94/294386894.db2.gz	PYSRULZPXZTBOI-GFCCVEGCSA-N	1	0	267.373	1.146	50	0		CDAARO
COc1ccc(C2N3CC4(C)CN2CC(C)(C3)C4[NH3+])cc1	ZINC000019331571	295115135	/nfs/dbraw/zinc/11/51/35/295115135.db2.gz	PMIFDJNHYVOVRA-UHFFFAOYSA-N	1	0	287.407	1.679	50	0	biogenic	CDAARO
NC(N)S[C@@H](C[NH+]1CCCCC1)C(F)(F)F	ZINC000019323451	295200776	/nfs/dbraw/zinc/20/07/76/295200776.db2.gz	ZNFKQGOUOBQICP-ZETCQYMHSA-N	1	0	257.325	1.337	50	0		CDAARO
C[C@@H]1c2ccccc2O[C@@H]1C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179092443	297826770	/nfs/dbraw/zinc/82/67/70/297826770.db2.gz	BTSHEEACKOTCNJ-GYSYKLTISA-N	1	0	260.337	1.371	50	0		CDAARO
Cc1nc2cc(CC(=O)N3C[C@H]4CC[C@@H](C3)[C@H]4[NH3+])ccc2[nH]1	ZINC000534578244	328310906	/nfs/dbraw/zinc/31/09/06/328310906.db2.gz	ARBSDIYCANKBQX-LAQFHYBYSA-N	1	0	298.390	1.610	50	0		CDAARO
O=C([C@@H]1C=CC[NH2+]1)N1CCC(c2ccncc2)CC1	ZINC000534638592	328334791	/nfs/dbraw/zinc/33/47/91/328334791.db2.gz	PTGHJRPUTSRRAX-AWEZNQCLSA-N	1	0	257.337	1.316	50	0		CDAARO
CN(Cc1nccn1Cc1ccccc1)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000534652971	328338207	/nfs/dbraw/zinc/33/82/07/328338207.db2.gz	CLDXLTYUSQAGQW-HNNXBMFYSA-N	1	0	296.374	1.418	50	0		CDAARO
Cc1cc2cccc(C(=O)N[C@H]3C[NH2+]CC[C@H]3O)c2o1	ZINC000534674615	328349429	/nfs/dbraw/zinc/34/94/29/328349429.db2.gz	GSVPSJGAFUULEH-QWHCGFSZSA-N	1	0	274.320	1.194	50	0		CDAARO
Cn1nccc1CN(CCC[NH3+])c1ccccc1F	ZINC000097372949	323207998	/nfs/dbraw/zinc/20/79/98/323207998.db2.gz	VUDBHWPNKGMZPG-UHFFFAOYSA-N	1	0	262.332	1.915	50	0		CDAARO
Brc1ccc(C[NH2+]CCN2CCOCC2)cc1	ZINC000019872136	326857688	/nfs/dbraw/zinc/85/76/88/326857688.db2.gz	GYYNPAMRMGYNDP-UHFFFAOYSA-N	1	0	299.212	1.871	50	0		CDAARO
Cc1cnc(NC[C@H](O)C[NH+]2CCCCC2)nc1	ZINC000095352462	327202540	/nfs/dbraw/zinc/20/25/40/327202540.db2.gz	ZSNULFDDRAGXTR-LBPRGKRZSA-N	1	0	250.346	1.044	50	0		CDAARO
CCn1cnnc1CCNC(=O)[C@H](C)[NH+]1CCCCCC1	ZINC000096436403	329526288	/nfs/dbraw/zinc/52/62/88/329526288.db2.gz	HBXARWUFXNVPPF-ZDUSSCGKSA-N	1	0	293.415	1.221	50	0		CDAARO
Cc1nnc([C@H](C)Nc2cc(C(C)C)[nH+]c(N)n2)[nH]1	ZINC000091871314	482588288	/nfs/dbraw/zinc/58/82/88/482588288.db2.gz	ASKUIHLLPXBSSF-ZETCQYMHSA-N	1	0	261.333	1.782	50	0		CDAARO
C[C@H](Cc1ccccc1)[NH2+]Cc1cc(=O)[nH]c(=O)[nH]1	ZINC000670419694	482938586	/nfs/dbraw/zinc/93/85/86/482938586.db2.gz	PKYQXAKQVRETGF-SNVBAGLBSA-N	1	0	259.309	1.609	50	0		CDAARO
COCC[C@@H]1C[N@@H+](C2CSCCSC2)CCO1	ZINC000670441756	482987429	/nfs/dbraw/zinc/98/74/29/482987429.db2.gz	XRWNMAHRYJPQLJ-GFCCVEGCSA-N	1	0	277.455	1.572	50	0		CDAARO
COc1nc(NCCC[N@@H+]2CCCC[C@H]2CO)ncc1F	ZINC000670446173	482996337	/nfs/dbraw/zinc/99/63/37/482996337.db2.gz	GBRVASMVZMIXNL-NSHDSACASA-N	1	0	298.362	1.273	50	0		CDAARO
OC[C@@H]1CCC[N@H+](CCNc2ncc(Cl)cn2)C1	ZINC000670452039	483015329	/nfs/dbraw/zinc/01/53/29/483015329.db2.gz	XBDNBIJQMGIINO-SNVBAGLBSA-N	1	0	270.764	1.246	50	0		CDAARO
COc1ccc(/C(C)=C/C(=O)N2CC[C@H](C[NH3+])C2)cc1	ZINC000178544475	523360666	/nfs/dbraw/zinc/36/06/66/523360666.db2.gz	YTUXGPMBHSTNHM-CNELAYHGSA-N	1	0	274.364	1.906	50	0		CDAARO
CS[C@H](C)CNC(=O)C[C@@H](C)[C@H]1CCC[NH2+]C1	ZINC000248729680	525874432	/nfs/dbraw/zinc/87/44/32/525874432.db2.gz	ODEQEDMBMIFSCU-UTUOFQBUSA-N	1	0	258.431	1.880	50	0		CDAARO
CC[C@@](C)(O)C[NH+]1CCN(c2nccs2)CC1	ZINC000119394140	538170051	/nfs/dbraw/zinc/17/00/51/538170051.db2.gz	PWBDEMNTSKLBHK-GFCCVEGCSA-N	1	0	255.387	1.426	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@@H]([NH3+])C2CCCCC2)C1	ZINC000958528897	613973443	/nfs/dbraw/zinc/97/34/43/613973443.db2.gz	YDLJQAIWESJSCG-LBPRGKRZSA-N	1	0	284.400	1.876	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC(O)([C@@H]([NH3+])C2CC2)CC1	ZINC000958528806	613974643	/nfs/dbraw/zinc/97/46/43/613974643.db2.gz	VUHZGJOGXOBFSU-NSHDSACASA-N	1	0	270.373	1.486	50	0		CDAARO
CCn1ccc(C[NH2+][C@@H]2CCCN(C(=O)C(C)C)C2)n1	ZINC000952966316	616031832	/nfs/dbraw/zinc/03/18/32/616031832.db2.gz	IAFSEGSXDLTAHB-CQSZACIVSA-N	1	0	278.400	1.640	50	0		CDAARO
COc1nc(N(C)CC[NH+]2CCCC2)ncc1F	ZINC001704303690	1177680378	/nfs/dbraw/zinc/68/03/78/1177680378.db2.gz	AWKRNGXWGBSJDZ-UHFFFAOYSA-N	1	0	254.309	1.156	50	0		CDAARO
NC(=O)C1CC[NH+](C2CSCCSC2)CC1	ZINC001506428483	975161670	/nfs/dbraw/zinc/16/16/70/975161670.db2.gz	PBWBOETXFTYKHE-UHFFFAOYSA-N	1	0	260.428	1.032	50	0		CDAARO
C[NH+](C)CC[C@H]1CN(C(=O)Cc2ccc(F)cc2)CCO1	ZINC000012703263	837430507	/nfs/dbraw/zinc/43/05/07/837430507.db2.gz	WQRYPUJREVPUBT-HNNXBMFYSA-N	1	0	294.370	1.547	50	0		CDAARO
Cc1[nH+]c(N(C)C)nc(NCCc2nnc(N)s2)c1C	ZINC000065370634	836396984	/nfs/dbraw/zinc/39/69/84/836396984.db2.gz	AZZKFQUCNJZXIR-UHFFFAOYSA-N	1	0	293.400	1.248	50	0		CDAARO
CCCCn1nc(C)nc1CC[C@@H](C)[NH+]1CCN(C)CC1	ZINC000096163299	836494284	/nfs/dbraw/zinc/49/42/84/836494284.db2.gz	RBZPNHSUHGESKT-CQSZACIVSA-N	1	0	293.459	1.955	50	0		CDAARO
Cc1n[nH]c(C)c1CNC(=O)CC[C@@H](C)[NH+]1CCCC1	ZINC000426383840	836688067	/nfs/dbraw/zinc/68/80/67/836688067.db2.gz	MYCAQMVCISCUFN-LLVKDONJSA-N	1	0	278.400	1.907	50	0		CDAARO
CCc1cnc(N)nc1N[C@@H]1CCCN(c2ncccn2)C1	ZINC000095358031	842671673	/nfs/dbraw/zinc/67/16/73/842671673.db2.gz	MMQKPUILTZWBES-GFCCVEGCSA-N	1	0	299.382	1.492	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)NCc2cccc(F)c2F)C1	ZINC000426394737	842851244	/nfs/dbraw/zinc/85/12/44/842851244.db2.gz	SNMNYCBCMOKFTB-JTQLQIEISA-N	1	0	269.295	1.598	50	0		CDAARO
Cn1ccnc1C(=O)NCC1(C[NH+]2CCCC2)CC1	ZINC000952860690	910412720	/nfs/dbraw/zinc/41/27/20/910412720.db2.gz	RQGFCAFRXNDLJR-UHFFFAOYSA-N	1	0	262.357	1.026	50	0		CDAARO
Cc1n[nH]c(CNCC[N@@H+]2CCC[C@H](CO)C2)c1Cl	ZINC000952869623	910420696	/nfs/dbraw/zinc/42/06/96/910420696.db2.gz	KLBCUSNJFVFOQU-NSHDSACASA-N	1	0	286.807	1.165	50	0		CDAARO
Cc1ccc(C[NH2+]CCN2CCC3(C2)OCCO3)cc1C	ZINC000952884374	910458566	/nfs/dbraw/zinc/45/85/66/910458566.db2.gz	ZKAYONDHOWQKND-UHFFFAOYSA-N	1	0	290.407	1.842	50	0		CDAARO
C[N@@H+]1CCC[C@@H](Nc2ncccc2C(=O)N2CCCC2)C1	ZINC000823771466	925727299	/nfs/dbraw/zinc/72/72/99/925727299.db2.gz	OINDYGNZFCRATG-CYBMUJFWSA-N	1	0	288.395	1.824	50	0		CDAARO
C[N@@H+]1CCC[C@H](Nc2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000823771494	925727613	/nfs/dbraw/zinc/72/76/13/925727613.db2.gz	WAGCXABTVIAPSG-AWEZNQCLSA-N	1	0	288.395	1.824	50	0		CDAARO
CS(=O)(=O)NC[C@@H]1CC[N@@H+](C2CCCCC2)C1	ZINC000824864409	925838768	/nfs/dbraw/zinc/83/87/68/925838768.db2.gz	BCKMWBMRVTVNFF-NSHDSACASA-N	1	0	260.403	1.190	50	0		CDAARO
Cc1nccn1C[C@@H](C)[NH2+]CCc1nc(C)cc(=O)[nH]1	ZINC000825264401	925859315	/nfs/dbraw/zinc/85/93/15/925859315.db2.gz	BNFCTSRFFWQELD-LLVKDONJSA-N	1	0	275.356	1.216	50	0		CDAARO
O=C(NCC1CC[NH+](CC2CCC2)CC1)c1ccon1	ZINC000828196022	926064756	/nfs/dbraw/zinc/06/47/56/926064756.db2.gz	FRUYDNUBTXGXPN-UHFFFAOYSA-N	1	0	277.368	1.917	50	0		CDAARO
CO[C@H](C[N@@H+]1CCN(C)[C@@H](c2nc(C)no2)C1)C(C)C	ZINC000585089069	930913250	/nfs/dbraw/zinc/91/32/50/930913250.db2.gz	APIITUJQVSOVPJ-CHWSQXEVSA-N	1	0	282.388	1.338	50	0		CDAARO
CC(C)[NH+]1CCN(c2nnnn2Cc2ccccc2)CC1	ZINC000585133016	931028193	/nfs/dbraw/zinc/02/81/93/931028193.db2.gz	MYAGXTGXVPQYDQ-UHFFFAOYSA-N	1	0	286.383	1.252	50	0		CDAARO
O[C@H]1C[N@H+](Cc2ccncc2)C[C@H]1Cc1ccncc1	ZINC001529144271	968992946	/nfs/dbraw/zinc/99/29/46/968992946.db2.gz	VSZXDSJWKIIKJO-CVEARBPZSA-N	1	0	269.348	1.512	50	0		CDAARO
Cc1nc(CN2CC[N@@H+](CC(C)C)[C@H](CCO)C2)cs1	ZINC001529146914	968994358	/nfs/dbraw/zinc/99/43/58/968994358.db2.gz	QWCTVUFDRZEVEZ-OAHLLOKOSA-N	1	0	297.468	1.976	50	0		CDAARO
COCC(=O)Nc1ccc(NC(=O)[C@@H]([NH3+])C(C)C)cc1C	ZINC001506419617	975157199	/nfs/dbraw/zinc/15/71/99/975157199.db2.gz	GSZQGTOFYDKKTK-AWEZNQCLSA-N	1	0	293.367	1.502	50	0		CDAARO
Cc1cnc(C)c(N2CC[N@@H+](CC(C)C)[C@H](CCO)C2)n1	ZINC001506426370	975160771	/nfs/dbraw/zinc/16/07/71/975160771.db2.gz	OEFVWLUUMLLZPA-OAHLLOKOSA-N	1	0	292.427	1.622	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1cccc(Nc2cnccn2)c1	ZINC000124457742	187138322	/nfs/dbraw/zinc/13/83/22/187138322.db2.gz	XJXPFXONVFQBKB-GFCCVEGCSA-N	1	0	297.362	1.654	50	0		CDAARO
CCNC(=O)NC(=O)[C@H](C)[N@H+](C)[C@H](C)Cc1ccsc1	ZINC000107531113	398152539	/nfs/dbraw/zinc/15/25/39/398152539.db2.gz	PVLMFJZZDGRMOY-MNOVXSKESA-N	1	0	297.424	1.845	50	0		CDAARO
CN1CCC([NH2+]Cc2ccc(N3CCOC3=O)cc2)CC1	ZINC000127023326	342007216	/nfs/dbraw/zinc/00/72/16/342007216.db2.gz	YKEYDFGRTQEEMT-UHFFFAOYSA-N	1	0	289.379	1.827	50	0		CDAARO
CNS(=O)(=O)CCC[NH2+][C@H](C)c1cccc(C)c1C	ZINC000095985240	185055568	/nfs/dbraw/zinc/05/55/68/185055568.db2.gz	WOXNTSBCLAVGHW-CYBMUJFWSA-N	1	0	284.425	1.893	50	0		CDAARO
COC(=O)C1CCN(C(=O)C[C@H](C)[NH2+]C2CCCC2)CC1	ZINC000096008822	185063713	/nfs/dbraw/zinc/06/37/13/185063713.db2.gz	OQORAZCHLMESKJ-LBPRGKRZSA-N	1	0	296.411	1.709	50	0		CDAARO
CSCCN(C)c1cc(N2CCSCC2)ncn1	ZINC000239653705	361747070	/nfs/dbraw/zinc/74/70/70/361747070.db2.gz	BKVBXYAERYUUBF-UHFFFAOYSA-N	1	0	284.454	1.829	50	0		CDAARO
CC(C)C[C@H]([NH3+])C(=O)N1CC[C@H](Oc2ccncc2)C1	ZINC000195554339	342625906	/nfs/dbraw/zinc/62/59/06/342625906.db2.gz	APQYKKFLZLHAJE-KBPBESRZSA-N	1	0	277.368	1.435	50	0		CDAARO
CCC(=O)N1CC[C@H]([NH2+]C2Cc3ccccc3C2)C1	ZINC000095423900	539087971	/nfs/dbraw/zinc/08/79/71/539087971.db2.gz	AYSLHYMUDHPSKN-AWEZNQCLSA-N	1	0	258.365	1.754	50	0		CDAARO
O[C@@H]1CCCOC12CC[NH+](Cc1cncn1C1CC1)CC2	ZINC000244659755	361854887	/nfs/dbraw/zinc/85/48/87/361854887.db2.gz	HICLBSOGCZZZSO-OAHLLOKOSA-N	1	0	291.395	1.724	50	0		CDAARO
Cc1ccn(CC[N@@H+](C)[C@@H](C)Cc2cnccn2)n1	ZINC000244685567	361857404	/nfs/dbraw/zinc/85/74/04/361857404.db2.gz	ISMUEWMXHMOUJD-ZDUSSCGKSA-N	1	0	259.357	1.545	50	0		CDAARO
COC(=O)CCN(C(=O)C1CC[NH+](C2CC2)CC1)C(C)C	ZINC000252481644	361842535	/nfs/dbraw/zinc/84/25/35/361842535.db2.gz	CPVYJBMUEKNPEO-UHFFFAOYSA-N	1	0	296.411	1.661	50	0		CDAARO
COc1ccccc1CNC(=O)C[N@H+](C)CC1(C)COC1	ZINC000244795508	361864961	/nfs/dbraw/zinc/86/49/61/361864961.db2.gz	RHPUHRZHBLCXMM-UHFFFAOYSA-N	1	0	292.379	1.280	50	0		CDAARO
CCC[C@H]([NH3+])CNS(=O)(=O)c1cc(F)ccc1Cl	ZINC000097229380	342204918	/nfs/dbraw/zinc/20/49/18/342204918.db2.gz	LZXDNXIQJHKPAB-VIFPVBQESA-N	1	0	294.779	1.885	50	0		CDAARO
Cc1ccc(C[NH2+]CC2(CO)CCOCC2)s1	ZINC000097020491	185152654	/nfs/dbraw/zinc/15/26/54/185152654.db2.gz	RJWPXBXDMZMXPX-UHFFFAOYSA-N	1	0	255.383	1.935	50	0		CDAARO
Cc1c(C(=O)N2CCC[N@@H+](C)CC2)cnn1-c1ccccc1	ZINC000096991999	185148974	/nfs/dbraw/zinc/14/89/74/185148974.db2.gz	QAWSRBZEXKJHKG-UHFFFAOYSA-N	1	0	298.390	1.958	50	0		CDAARO
NC(=O)[C@H]1CC[N@H+](C[C@H]2CCN(c3ccccc3)C2)C1	ZINC000585141358	342219018	/nfs/dbraw/zinc/21/90/18/342219018.db2.gz	ULHGKWXZOONNPH-KGLIPLIRSA-N	1	0	273.380	1.320	50	0		CDAARO
Cc1ccccc1[C@H](O)CNC(=O)[C@H](C)[C@H](C)[NH3+]	ZINC000249090440	539066866	/nfs/dbraw/zinc/06/68/66/539066866.db2.gz	SPRVIHKWFOFDIB-NTZNESFSSA-N	1	0	250.342	1.128	50	0		CDAARO
Cc1nc(-c2cccc(C(=O)N3CC[NH2+]C[C@@H]3C)c2)n[nH]1	ZINC000125590325	187192177	/nfs/dbraw/zinc/19/21/77/187192177.db2.gz	OZQRAHZOMWJPOQ-JTQLQIEISA-N	1	0	285.351	1.214	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1cccc(Nc2cnccn2)c1	ZINC000125563222	187191068	/nfs/dbraw/zinc/19/10/68/187191068.db2.gz	XJXPFXONVFQBKB-LBPRGKRZSA-N	1	0	297.362	1.654	50	0		CDAARO
CC(C)=CC[N@H+]1CC[C@]2(C1)NC(=O)N(C(C)C)C2=O	ZINC000084597337	342265253	/nfs/dbraw/zinc/26/52/53/342265253.db2.gz	WLRDWYGJCXLPTP-CQSZACIVSA-N	1	0	265.357	1.357	50	0		CDAARO
CC(C)N1C(=O)N[C@@]2(CC[N@H+](CC3CCCCC3)C2)C1=O	ZINC000084597331	342265284	/nfs/dbraw/zinc/26/52/84/342265284.db2.gz	PAWDPUAHERXSBD-MRXNPFEDSA-N	1	0	293.411	1.971	50	0		CDAARO
CCN1C[C@H](C[N@H+](C)Cc2[nH]cc(C)c(=O)c2C)CC1=O	ZINC000670446893	539114268	/nfs/dbraw/zinc/11/42/68/539114268.db2.gz	IQJSEUVOFNWXEK-ZDUSSCGKSA-N	1	0	291.395	1.292	50	0		CDAARO
C[NH+](C)CCCn1cnc2nc3c(cc2c1=O)CCCC3	ZINC000033267623	539135939	/nfs/dbraw/zinc/13/59/39/539135939.db2.gz	DGODKILFUFPNDM-UHFFFAOYSA-N	1	0	286.379	1.622	50	0		CDAARO
Cc1cccc2[nH]c(CCC(=O)N3CC[NH2+]C[C@@H]3C)nc21	ZINC000125963356	187207520	/nfs/dbraw/zinc/20/75/20/187207520.db2.gz	ZVMFIVJDXKGNLM-LBPRGKRZSA-N	1	0	286.379	1.624	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CN(C)C(=O)c1cnccc1N	ZINC000128118840	187352989	/nfs/dbraw/zinc/35/29/89/187352989.db2.gz	REFZYKRGGMUCCK-NSHDSACASA-N	1	0	262.357	1.220	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cc(OC)c(OC)cc2C)C1	ZINC000179010140	362251317	/nfs/dbraw/zinc/25/13/17/362251317.db2.gz	RDOSLYGEZAXDMR-GFCCVEGCSA-N	1	0	292.379	1.694	50	0		CDAARO
CCO[C@H]1C[C@H]([N@H+](C)CCC(=O)N2CCOCC2)C1(C)C	ZINC000084800720	362274654	/nfs/dbraw/zinc/27/46/54/362274654.db2.gz	SHVFYLOFFRRNDC-KBPBESRZSA-N	1	0	298.427	1.371	50	0		CDAARO
C[C@@H]1CN(C(=O)c2nccc3ccccc32)CC[NH2+]1	ZINC000088059245	362302487	/nfs/dbraw/zinc/30/24/87/362302487.db2.gz	FIRPHFQMRVRWKI-LLVKDONJSA-N	1	0	255.321	1.669	50	0		CDAARO
OC[C@]1(O)CCC[N@H+](CCOc2ccccc2)CC1	ZINC000252486907	362387480	/nfs/dbraw/zinc/38/74/80/362387480.db2.gz	HQJMIRZDGAHWKT-HNNXBMFYSA-N	1	0	265.353	1.275	50	0		CDAARO
CN(Cc1cc2ccccc2n(C)c1=O)[C@H]1CC[N@H+](C)C1	ZINC000219851698	529980766	/nfs/dbraw/zinc/98/07/66/529980766.db2.gz	NUDHSDPGOYZOIO-HNNXBMFYSA-N	1	0	285.391	1.674	50	0		CDAARO
CC1(CNS(=O)(=O)c2cccc(F)c2)CC[NH2+]CC1	ZINC000129252365	362548159	/nfs/dbraw/zinc/54/81/59/362548159.db2.gz	SJEUSIPPDWXGDI-UHFFFAOYSA-N	1	0	286.372	1.494	50	0		CDAARO
CC[C@@H]([NH2+]CC(=O)NC(=O)NC)c1ccc(Cl)cc1	ZINC000085433828	179060903	/nfs/dbraw/zinc/06/09/03/179060903.db2.gz	SWZKCYDCPHNGSI-LLVKDONJSA-N	1	0	283.759	1.836	50	0		CDAARO
O[C@@H](C[NH+]1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000085436855	179063089	/nfs/dbraw/zinc/06/30/89/179063089.db2.gz	MKRHJWXRSNTBKF-INIZCTEOSA-N	1	0	260.381	1.575	50	0		CDAARO
CN1CCN(c2cc(O)ccc2Br)CC1	ZINC000218753773	348755189	/nfs/dbraw/zinc/75/51/89/348755189.db2.gz	GBVJNMFYHQMFLJ-UHFFFAOYSA-N	1	0	271.158	1.907	50	0		CDAARO
COCc1nc2n(n1)CCC[C@@H]2[NH2+]C1CCSCC1	ZINC000089420437	179784700	/nfs/dbraw/zinc/78/47/00/179784700.db2.gz	RKPHJWIBOZWZJO-NSHDSACASA-N	1	0	282.413	1.745	50	0		CDAARO
O=C(NCCC[NH+]1CCC(O)CC1)[C@@H]1CC12CCC2	ZINC000584896006	349357374	/nfs/dbraw/zinc/35/73/74/349357374.db2.gz	RMUJRJJRJVSHCJ-ZDUSSCGKSA-N	1	0	266.385	1.140	50	0		CDAARO
Cc1nonc1CNC(=O)[C@@H](C)[NH+]1CCCCCC1	ZINC000584896607	349358401	/nfs/dbraw/zinc/35/84/01/349358401.db2.gz	CWCVSNMHUQLTAZ-LLVKDONJSA-N	1	0	266.345	1.259	50	0		CDAARO
CNC(=O)[C@H]([NH2+]C1CSCCSC1)c1ccccc1	ZINC000584895312	349355840	/nfs/dbraw/zinc/35/58/40/349355840.db2.gz	HXTQEUNRCYCWEH-CYBMUJFWSA-N	1	0	296.461	1.912	50	0		CDAARO
CO[C@H]1[C@@H]2CC[C@H]1CN(C(=O)[C@@H]1CCC[C@H]([NH3+])C1)C2	ZINC000584895399	349355878	/nfs/dbraw/zinc/35/58/78/349355878.db2.gz	MVUDBCBZNWESQI-DGTMBMJNSA-N	1	0	266.385	1.387	50	0		CDAARO
Cc1ncc2c(c1CNc1ccncn1)CC[NH2+]C2	ZINC000091444944	180156404	/nfs/dbraw/zinc/15/64/04/180156404.db2.gz	BDJSLZPLEZHISC-UHFFFAOYSA-N	1	0	255.325	1.438	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CCC[NH2+][C@@H]2C)cc1C	ZINC000091496972	180172793	/nfs/dbraw/zinc/17/27/93/180172793.db2.gz	WDDOTLZLDGROTP-TZMCWYRMSA-N	1	0	282.409	1.722	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)NCCc1cnccn1	ZINC000091416673	180149643	/nfs/dbraw/zinc/14/96/43/180149643.db2.gz	DBERROPOMWRLDO-ZDUSSCGKSA-N	1	0	262.357	1.010	50	0		CDAARO
Cc1ccc2[nH]c(C[NH+]3CCC(C(N)=O)CC3)cc(=O)c2c1	ZINC000091713655	180231072	/nfs/dbraw/zinc/23/10/72/180231072.db2.gz	YFLFIPSDNUHRPL-UHFFFAOYSA-N	1	0	299.374	1.534	50	0		CDAARO
O=c1cc(C[NH2+]C[C@H]2CCOC2)[nH]c2c(F)cccc12	ZINC000091769895	180249493	/nfs/dbraw/zinc/24/94/93/180249493.db2.gz	YFAAPKMRVXJMFA-SNVBAGLBSA-N	1	0	276.311	1.793	50	0		CDAARO
CN1CCO[C@@H](C[NH2+]Cc2cccc(Br)c2)C1	ZINC000105472113	186058806	/nfs/dbraw/zinc/05/88/06/186058806.db2.gz	ORUUODBZPIXQPW-ZDUSSCGKSA-N	1	0	299.212	1.869	50	0		CDAARO
CC(C)CCN1C(=O)C[C@H]([N@@H+]2CC[C@@]3(CCOC3)C2)C1=O	ZINC000110677808	186311945	/nfs/dbraw/zinc/31/19/45/186311945.db2.gz	LWTYVPAICCMJPD-XJKSGUPXSA-N	1	0	294.395	1.272	50	0		CDAARO
c1cnnc(NC[C@H]2CN(C[C@H]3CCCCO3)CCO2)c1	ZINC000257366032	350964676	/nfs/dbraw/zinc/96/46/76/350964676.db2.gz	GSEDGNDYILBWOJ-KGLIPLIRSA-N	1	0	292.383	1.158	50	0		CDAARO
C[NH+](C)C[C@@H]1CCN(C(=O)c2n[nH]c3c2CCCC3)C1	ZINC000095959276	351457825	/nfs/dbraw/zinc/45/78/25/351457825.db2.gz	LPITWHQDKZZQME-NSHDSACASA-N	1	0	276.384	1.312	50	0		CDAARO
Cc1nc(-c2cccc(C(=O)N[C@H]3CC[NH2+]C3)c2)no1	ZINC000126561959	351594751	/nfs/dbraw/zinc/59/47/51/351594751.db2.gz	AOKKVFAGLASDAO-LBPRGKRZSA-N	1	0	272.308	1.137	50	0		CDAARO
O=C(CNCCC[NH+]1CCCC1)NCc1ccccc1F	ZINC000065417534	363211075	/nfs/dbraw/zinc/21/10/75/363211075.db2.gz	QZCUTPBCFFYLEZ-UHFFFAOYSA-N	1	0	293.386	1.517	50	0		CDAARO
S=C1N(CN2CCCCC2)CCN1C[NH+]1CCCCC1	ZINC000000027631	355879443	/nfs/dbraw/zinc/87/94/43/355879443.db2.gz	CCMPHOBVVMUPII-UHFFFAOYSA-N	1	0	296.484	1.776	50	0		CDAARO
O=C1C[C@H](N2CCSCC2)C(=O)N1c1ccc(F)cc1	ZINC000000063621	355883638	/nfs/dbraw/zinc/88/36/38/355883638.db2.gz	LLMKTDQDFYIJMW-LBPRGKRZSA-N	1	0	294.351	1.506	50	0		CDAARO
COc1ccccc1CC(=O)NC1C[C@H]2CC[C@@H](C1)[N@H+]2C	ZINC000000132892	355889447	/nfs/dbraw/zinc/88/94/47/355889447.db2.gz	WTHJXUUFWSZIQW-GOOCMWNKSA-N	1	0	288.391	1.979	50	0		CDAARO
Cc1ccc(SCC(=O)NCC[NH+](C)C)cc1	ZINC000002866786	355985678	/nfs/dbraw/zinc/98/56/78/355985678.db2.gz	OOQHZNPVUALYCZ-UHFFFAOYSA-N	1	0	252.383	1.765	50	0		CDAARO
CC[NH+](CC)CCOC(=O)c1ccc(OC)c(O)c1	ZINC000002903328	355987354	/nfs/dbraw/zinc/98/73/54/355987354.db2.gz	QLCKEYDPDVELQP-UHFFFAOYSA-N	1	0	267.325	1.899	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](CN(C)C(=O)CSC)C1	ZINC000584901736	355956239	/nfs/dbraw/zinc/95/62/39/355956239.db2.gz	KJSUJYKCCRMSOB-GFCCVEGCSA-N	1	0	274.430	1.166	50	0		CDAARO
COc1ccc(/C(C)=C\C(=O)N2CC[C@@H]([NH3+])C2)cc1	ZINC000255297615	356037161	/nfs/dbraw/zinc/03/71/61/356037161.db2.gz	RJXXZIVZWFZZMT-PRWOLLLXSA-N	1	0	260.337	1.658	50	0		CDAARO
CNC(=O)C(C)(C)C[NH2+][C@H](C)c1cnn(C(C)C)c1	ZINC000097373426	356094622	/nfs/dbraw/zinc/09/46/22/356094622.db2.gz	RECDDTWIAFILCQ-LLVKDONJSA-N	1	0	266.389	1.887	50	0		CDAARO
CCn1nc(C(C)C)cc1C(=O)N1CC[C@H](C[NH3+])C1	ZINC000299738875	356263464	/nfs/dbraw/zinc/26/34/64/356263464.db2.gz	HOSJSIKZPUQBTF-LLVKDONJSA-N	1	0	264.373	1.447	50	0		CDAARO
Cc1nn(C)c2nc(N3CC[NH2+]CC3)cc(C(F)(F)F)c12	ZINC000011567795	356275564	/nfs/dbraw/zinc/27/55/64/356275564.db2.gz	VMFACPLZZIHSCY-UHFFFAOYSA-N	1	0	299.300	1.705	50	0		CDAARO
COc1cc2c(cc1OC)CN(C(=O)CCC[NH3+])CC2	ZINC000011755439	356278739	/nfs/dbraw/zinc/27/87/39/356278739.db2.gz	GFAHWMONVLNMBJ-UHFFFAOYSA-N	1	0	278.352	1.327	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1CC(OC(=O)[C@@H](CO)c1ccccc1)C2	ZINC000012358661	356294891	/nfs/dbraw/zinc/29/48/91/356294891.db2.gz	RKUNBYITZUJHSG-QXULXFAOSA-N	1	0	289.375	1.931	50	0	biogenic,in-man	CDAARO
C[NH+]1CCC(Cn2cnc3cnccc3c2=O)CC1	ZINC000032590402	356306921	/nfs/dbraw/zinc/30/69/21/356306921.db2.gz	ZFYUSAKWIZVXBP-UHFFFAOYSA-N	1	0	258.325	1.133	50	0		CDAARO
[NH2+]=C1S[C@H]2CS(=O)(=O)C[C@@H]2N1CCc1ccccc1	ZINC000013688161	356352817	/nfs/dbraw/zinc/35/28/17/356352817.db2.gz	SGQUNMIYQVOSKO-RYUDHWBXSA-N	1	0	296.417	1.378	50	0		CDAARO
OCCOc1ccc(C[NH2+]C[C@H]2CCCO2)cc1	ZINC000013731002	356354982	/nfs/dbraw/zinc/35/49/82/356354982.db2.gz	XUNRLURNFSLDIN-CQSZACIVSA-N	1	0	251.326	1.326	50	0		CDAARO
CN(C)c1ccc(CNS(=O)(=O)c2cccs2)cn1	ZINC000032825796	356383269	/nfs/dbraw/zinc/38/32/69/356383269.db2.gz	UBDXRIHRDLUDFD-UHFFFAOYSA-N	1	0	297.405	1.688	50	0		CDAARO
O=C(NCc1ccco1)[C@H]1Cc2ccccc2C[NH2+]1	ZINC000034754833	356390315	/nfs/dbraw/zinc/39/03/15/356390315.db2.gz	XIJYOFKTTSJBSQ-CQSZACIVSA-N	1	0	256.305	1.610	50	0		CDAARO
Nc1ccccc1C[NH+]1CCN(c2ccccn2)CC1	ZINC000019405465	356483897	/nfs/dbraw/zinc/48/38/97/356483897.db2.gz	FUCBCWSVCXPHEM-UHFFFAOYSA-N	1	0	268.364	1.986	50	0		CDAARO
O=C(Cc1ccc(Cl)cc1)N1CCC[NH2+]CC1	ZINC000019434074	356485333	/nfs/dbraw/zinc/48/53/33/356485333.db2.gz	OPJIKEXTTDKAQC-UHFFFAOYSA-N	1	0	252.745	1.704	50	0		CDAARO
COc1ccc(OC)c(C[NH2+]CCN2CCOCC2)c1	ZINC000019551717	356491566	/nfs/dbraw/zinc/49/15/66/356491566.db2.gz	RKLNMSOXXDGWNG-UHFFFAOYSA-N	1	0	280.368	1.126	50	0		CDAARO
[NH3+]CCN1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000022920585	356623973	/nfs/dbraw/zinc/62/39/73/356623973.db2.gz	YDJUKXZGPAOCSN-UHFFFAOYSA-N	1	0	273.302	1.786	50	0		CDAARO
Cc1cc(NC(=O)[C@H](C)N(C)Cc2cnn(C)c2)on1	ZINC000022911382	356624613	/nfs/dbraw/zinc/62/46/13/356624613.db2.gz	SWPHOEJDBXBPTQ-JTQLQIEISA-N	1	0	277.328	1.176	50	0		CDAARO
COc1ccc(C[C@@H](C)[NH+]2CCN(CCO)CC2)cc1	ZINC000023283105	356638689	/nfs/dbraw/zinc/63/86/89/356638689.db2.gz	ZMAIFPQBFJMZHM-CQSZACIVSA-N	1	0	278.396	1.236	50	0		CDAARO
CNC(=O)NC(=O)[C@H](C)[NH2+]C1C2CC3CC(C2)CC1C3	ZINC000009483607	290498926	/nfs/dbraw/zinc/49/89/26/290498926.db2.gz	YYOONUBDHUDIFS-DDNJXNFVSA-N	1	0	279.384	1.245	50	0		CDAARO
Cc1cccc(N2CCN(c3cc[nH+]c(NN)n3)CC2)c1C	ZINC000032951459	356695974	/nfs/dbraw/zinc/69/59/74/356695974.db2.gz	XYDYLOGQNOOAFY-UHFFFAOYSA-N	1	0	298.394	1.706	50	0		CDAARO
COCCC[NH2+][C@@H]1CC(=O)N(c2ccc(C)cc2)C1=O	ZINC000028632637	356723521	/nfs/dbraw/zinc/72/35/21/356723521.db2.gz	IHVICQPNMCCYCX-CYBMUJFWSA-N	1	0	276.336	1.253	50	0		CDAARO
COc1ccc(C[N@@H+]2CCCN(C(C)=O)CC2)cc1	ZINC000032860222	356788520	/nfs/dbraw/zinc/78/85/20/356788520.db2.gz	KHPXZISGDOIWNR-UHFFFAOYSA-N	1	0	262.353	1.749	50	0		CDAARO
O=C1NCCN1C1CC[NH+](CCc2cccs2)CC1	ZINC000069974409	356834050	/nfs/dbraw/zinc/83/40/50/356834050.db2.gz	XNHAMMJQJFZSFT-UHFFFAOYSA-N	1	0	279.409	1.780	50	0		CDAARO
Cc1nn(C)cc1CN1CC[N@@H+](CC(C)C)[C@H](CCO)C1	ZINC000039430132	356973548	/nfs/dbraw/zinc/97/35/48/356973548.db2.gz	VKIZFUQOLCLIOO-MRXNPFEDSA-N	1	0	294.443	1.253	50	0		CDAARO
CC(=O)N1CCC[N@H+](C[C@H](O)c2ccccc2)CC1	ZINC000049932687	363571696	/nfs/dbraw/zinc/57/16/96/363571696.db2.gz	XHXDXNKNKOANAB-HNNXBMFYSA-N	1	0	262.353	1.274	50	0		CDAARO
CCS(=O)(=O)N1CC[NH+](C[C@H]2CC=CCC2)CC1	ZINC000049573754	357219810	/nfs/dbraw/zinc/21/98/10/357219810.db2.gz	POBOSHPECWVQDW-ZDUSSCGKSA-N	1	0	272.414	1.310	50	0		CDAARO
Cc1ccc(O[C@@H](C)C(=O)N2CC[NH2+]CC2)c(Cl)c1	ZINC000054351340	357318882	/nfs/dbraw/zinc/31/88/82/357318882.db2.gz	PRBDSCTYSBRFOE-NSHDSACASA-N	1	0	282.771	1.848	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)COc1cccc(C)c1	ZINC000057159637	357352667	/nfs/dbraw/zinc/35/26/67/357352667.db2.gz	ZVCSOCKHAJGREX-CQSZACIVSA-N	1	0	276.380	1.974	50	0		CDAARO
COc1cccc(CNCCC[NH+](C)C)c1OC	ZINC000057234775	357353330	/nfs/dbraw/zinc/35/33/30/357353330.db2.gz	JUTCZTNZSSFDGQ-UHFFFAOYSA-N	1	0	252.358	1.745	50	0		CDAARO
C[NH2+]Cc1n[nH]c(=O)n1-c1cc(Cl)ccc1C	ZINC000065393664	357535771	/nfs/dbraw/zinc/53/57/71/357535771.db2.gz	FYUBHUYJISQDKI-UHFFFAOYSA-N	1	0	252.705	1.242	50	0		CDAARO
CC(=O)N1CCC([N@H+](CCN(C)C)C[C@@H]2CCCO2)CC1	ZINC000065467270	357543667	/nfs/dbraw/zinc/54/36/67/357543667.db2.gz	YNASXABFAISIMP-INIZCTEOSA-N	1	0	297.443	1.040	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@@H]([NH3+])CN1Cc1cccc2cnccc21	ZINC000067727212	357621620	/nfs/dbraw/zinc/62/16/20/357621620.db2.gz	OEXDBNMNZCGFMF-ZBFHGGJFSA-N	1	0	298.390	1.273	50	0		CDAARO
CCC[N@H+](CCS(C)(=O)=O)[C@H]1C[C@@H](OCC)C1(C)C	ZINC000106931421	283267201	/nfs/dbraw/zinc/26/72/01/283267201.db2.gz	SIIXLNPVAHEELN-QWHCGFSZSA-N	1	0	291.457	1.947	50	0		CDAARO
CSc1n[nH]c(-c2cc(F)cc3c2O[C@H](C[NH3+])C3)n1	ZINC000067588726	357612375	/nfs/dbraw/zinc/61/23/75/357612375.db2.gz	QJTRWRHEMZIKLO-QMMMGPOBSA-N	1	0	280.328	1.595	50	0		CDAARO
COc1nc(C)c(C(=O)NCC[C@H]2CCC[N@H+](C)C2)s1	ZINC000067559560	357612505	/nfs/dbraw/zinc/61/25/05/357612505.db2.gz	DTKUEECRBLZUEO-LLVKDONJSA-N	1	0	297.424	1.922	50	0		CDAARO
O=C(Nc1cnc2n1CCCC2)[C@H]1CC12CC[NH2+]CC2	ZINC000067654569	357616936	/nfs/dbraw/zinc/61/69/36/357616936.db2.gz	WPASLITXQFWLTB-LLVKDONJSA-N	1	0	274.368	1.548	50	0		CDAARO
C[C@@H]1CN(C(=O)CCc2cc(F)ccc2F)CC[NH2+]1	ZINC000188386329	357647148	/nfs/dbraw/zinc/64/71/48/357647148.db2.gz	ZZAZNWMDRJMOSN-SNVBAGLBSA-N	1	0	268.307	1.718	50	0		CDAARO
CCn1ccnc1CN1CC[C@@H](CNC(=O)C=C(C)C)C1	ZINC000067885002	357634948	/nfs/dbraw/zinc/63/49/48/357634948.db2.gz	ODTZHXYZFGHZAY-AWEZNQCLSA-N	1	0	290.411	1.807	50	0		CDAARO
[NH3+]C1CCN(C(=O)c2c[nH]nc2-c2ccccc2)CC1	ZINC000070451523	357724778	/nfs/dbraw/zinc/72/47/78/357724778.db2.gz	VWJKFUNCJNXRQJ-UHFFFAOYSA-N	1	0	270.336	1.640	50	0		CDAARO
COc1cccc(Cl)c1C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188459833	357691678	/nfs/dbraw/zinc/69/16/78/357691678.db2.gz	ZISXMXMVXWLCBO-SECBINFHSA-N	1	0	268.744	1.783	50	0		CDAARO
COc1ccc(C[N@@H+]2CCC[C@@H]2CN2CCOCC2)cc1	ZINC000092218179	357896660	/nfs/dbraw/zinc/89/66/60/357896660.db2.gz	SICXMWLZKCRXRD-MRXNPFEDSA-N	1	0	290.407	1.992	50	0		CDAARO
Cc1ocnc1C(=O)Nc1ccc2c(c1)C[NH2+]CC2	ZINC000097019666	357913523	/nfs/dbraw/zinc/91/35/23/357913523.db2.gz	SRFCNIMDZAQDKS-UHFFFAOYSA-N	1	0	257.293	1.881	50	0		CDAARO
C[C@@H]([NH2+]CCNC(=O)c1ccn[nH]1)c1cccs1	ZINC000097236296	358048940	/nfs/dbraw/zinc/04/89/40/358048940.db2.gz	KEDHLAOOGZCRRY-SECBINFHSA-N	1	0	264.354	1.552	50	0		CDAARO
[NH3+][C@@H]1CCN(Cc2cc(C(F)(F)F)ccc2F)C[C@H]1O	ZINC000082115014	358147478	/nfs/dbraw/zinc/14/74/78/358147478.db2.gz	PYOITKMNJPNHFL-VXGBXAGGSA-N	1	0	292.276	1.738	50	0		CDAARO
CCOC(=O)[C@@]1(C(C)C)CC[N@H+](Cc2cnn(C)c2)C1	ZINC000194857092	358543187	/nfs/dbraw/zinc/54/31/87/358543187.db2.gz	NYHPTNGKROYZQK-HNNXBMFYSA-N	1	0	279.384	1.831	50	0		CDAARO
COc1nc(C)nc(NCC2([NH+](C)C)CCOCC2)c1C	ZINC000195567322	358566488	/nfs/dbraw/zinc/56/64/88/358566488.db2.gz	WOGKBWGGIFRWQT-UHFFFAOYSA-N	1	0	294.399	1.625	50	0		CDAARO
COCC[N@@H+]1C[C@H]2CC[C@@H]1CN(Cc1csc(C)n1)C2	ZINC000095391670	358692277	/nfs/dbraw/zinc/69/22/77/358692277.db2.gz	JJANNDWDNHPIAF-DZGCQCFKSA-N	1	0	295.452	1.994	50	0		CDAARO
c1cnn(CCC2CC[NH+](Cc3cnc[nH]3)CC2)c1	ZINC000097514340	358781400	/nfs/dbraw/zinc/78/14/00/358781400.db2.gz	GOOWTZSQTCTHNZ-UHFFFAOYSA-N	1	0	259.357	1.909	50	0		CDAARO
COCC1(C(=O)N2CCN[C@@H](c3ccccc3)C2)CC1	ZINC000097568864	358784952	/nfs/dbraw/zinc/78/49/52/358784952.db2.gz	RUSVNUIJEKBZEZ-CQSZACIVSA-N	1	0	274.364	1.586	50	0		CDAARO
CC[N@H+](Cc1ccc(OC)c(COC)c1)[C@H]1COC[C@@H]1O	ZINC000097713569	358794738	/nfs/dbraw/zinc/79/47/38/358794738.db2.gz	MZSHIGDDAPCZGO-GJZGRUSLSA-N	1	0	295.379	1.423	50	0		CDAARO
Cc1ccccc1N1CCCN(C(=O)[C@H]2[C@@H]3C[NH2+]C[C@@H]32)CC1	ZINC000101969440	358866961	/nfs/dbraw/zinc/86/69/61/358866961.db2.gz	NASJABOYUDCQEX-QLPKVWCKSA-N	1	0	299.418	1.499	50	0		CDAARO
Cc1nonc1CC(=O)NCC1([NH+](C)C)CCCCC1	ZINC000215292446	358881892	/nfs/dbraw/zinc/88/18/92/358881892.db2.gz	CJKTYBJQMPASGQ-UHFFFAOYSA-N	1	0	280.372	1.301	50	0		CDAARO
O=C(C[NH2+]C1CC1)NC[C@H]1CCc2ccccc2O1	ZINC000215385685	358887320	/nfs/dbraw/zinc/88/73/20/358887320.db2.gz	SJNBVYPBEOQNEZ-CYBMUJFWSA-N	1	0	260.337	1.248	50	0		CDAARO
COc1ccc(C[N@H+](C)C[C@H]2COCCO2)cc1F	ZINC000215421029	358888571	/nfs/dbraw/zinc/88/85/71/358888571.db2.gz	OSYLWSRRVVDBOL-LBPRGKRZSA-N	1	0	269.316	1.682	50	0		CDAARO
Cn1ncc(Cl)c1C(=O)N1C[C@H]2CC[C@@H]1C[N@H+](C)C2	ZINC000216022430	358918219	/nfs/dbraw/zinc/91/82/19/358918219.db2.gz	TYUXRUZTCQFURI-VHSXEESVSA-N	1	0	282.775	1.240	50	0		CDAARO
CCc1nccc(C[N@H+](C)[C@H](C)Cc2cnccn2)n1	ZINC000215624692	358896185	/nfs/dbraw/zinc/89/61/85/358896185.db2.gz	QGQVEUXRWUTYTD-GFCCVEGCSA-N	1	0	271.368	1.892	50	0		CDAARO
CCn1cc(C(=O)N2C[C@H]3CC[C@@H]2C[N@H+](C)C3)c(C)n1	ZINC000215642981	358897160	/nfs/dbraw/zinc/89/71/60/358897160.db2.gz	ZDHJBRCUCMMVPO-QWHCGFSZSA-N	1	0	276.384	1.378	50	0		CDAARO
COC[C@@H]1CC[N@H+](Cc2cnc(N3CCCCC3)nc2)C1	ZINC000215826826	358904945	/nfs/dbraw/zinc/90/49/45/358904945.db2.gz	HFNVDMDTULFQSQ-CQSZACIVSA-N	1	0	290.411	1.935	50	0		CDAARO
Cc1nnc([C@@H](C)NC(=O)C2([NH+]3CCCC3)CCCC2)[nH]1	ZINC000215940256	358910884	/nfs/dbraw/zinc/91/08/84/358910884.db2.gz	LTKWIIKBMDXKSB-LLVKDONJSA-N	1	0	291.399	1.699	50	0		CDAARO
CCCn1ncc(CN2CC[NH+](CCOC)CC2)c1C	ZINC000216511042	358948230	/nfs/dbraw/zinc/94/82/30/358948230.db2.gz	RCSMKWANLVZVDZ-UHFFFAOYSA-N	1	0	280.416	1.366	50	0		CDAARO
CC(C)(C)[C@H]([NH3+])C(=O)NCc1ccccc1-n1cncn1	ZINC000219145761	359079943	/nfs/dbraw/zinc/07/99/43/359079943.db2.gz	ZJTODJVIMOQCJS-CYBMUJFWSA-N	1	0	287.367	1.257	50	0		CDAARO
COc1ccc(CC[C@H](C)[NH2+]CCN2CCOCC2)cc1	ZINC000022916982	359142955	/nfs/dbraw/zinc/14/29/55/359142955.db2.gz	WNJANOHTAAFPEC-HNNXBMFYSA-N	1	0	292.423	1.938	50	0		CDAARO
O[C@H](c1cc2n(n1)CCN(Cc1ccncc1)C2)C1CC1	ZINC000221443382	359249521	/nfs/dbraw/zinc/24/95/21/359249521.db2.gz	WAVVOGFHKHQZDI-INIZCTEOSA-N	1	0	284.363	1.737	50	0		CDAARO
CCc1ccc(C(=O)N2C[C@H]3CC[C@@H](C2)[N@H+](C)C3)[nH]1	ZINC000221451398	359249774	/nfs/dbraw/zinc/24/97/74/359249774.db2.gz	BJUZYUGIFONSNZ-AAEUAGOBSA-N	1	0	261.369	1.743	50	0		CDAARO
[NH3+]C1CC(c2cc(NCCc3cn[nH]c3)ncn2)C1	ZINC000222318211	359334044	/nfs/dbraw/zinc/33/40/44/359334044.db2.gz	BDNUWQJKWPOJJW-UHFFFAOYSA-N	1	0	258.329	1.059	50	0		CDAARO
CN(C)c1nc2c(c(=O)[nH]1)CC[N@H+](Cc1ccncc1)CC2	ZINC000257182102	359442330	/nfs/dbraw/zinc/44/23/30/359442330.db2.gz	OOKNWLNZGUYEAP-UHFFFAOYSA-N	1	0	299.378	1.244	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@@H](CO)N(C(=O)CCc2ccc(F)cc2)C1	ZINC000223714981	359450103	/nfs/dbraw/zinc/45/01/03/359450103.db2.gz	DZAUSUNKIMCKNK-CABCVRRESA-N	1	0	294.370	1.282	50	0		CDAARO
c1ccc2[nH]c(SCCN3CC[NH2+]CC3)nc2c1	ZINC000034049517	359765403	/nfs/dbraw/zinc/76/54/03/359765403.db2.gz	HLCJWHPFHPEXMI-UHFFFAOYSA-N	1	0	262.382	1.560	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OC[C@@H]1CCCOC1	ZINC000408525691	359935455	/nfs/dbraw/zinc/93/54/55/359935455.db2.gz	UFMMJAYUTVQJBJ-OLZOCXBDSA-N	1	0	257.374	1.967	50	0		CDAARO
CC1=CCC[C@H](C)[C@@H]1C[N@H+](C)C[C@H](O)CN1CCOCC1	ZINC000191076333	360073943	/nfs/dbraw/zinc/07/39/43/360073943.db2.gz	SLFDQKPTHQTVGG-YESZJQIVSA-N	1	0	296.455	1.604	50	0		CDAARO
C[NH+](C)C1(CC2CC2)CCN(C(=O)c2cnccn2)CC1	ZINC000409420195	360223272	/nfs/dbraw/zinc/22/32/72/360223272.db2.gz	LPISMNFWMSVEJN-UHFFFAOYSA-N	1	0	288.395	1.813	50	0		CDAARO
Cc1nnc2n1CC[C@@H]([N@H+](C)Cc1ccncc1)CC2	ZINC000409421257	360230302	/nfs/dbraw/zinc/23/03/02/360230302.db2.gz	YBRCJVGKIVFPQI-AWEZNQCLSA-N	1	0	271.368	1.818	50	0		CDAARO
CC(C)(C)c1ccc(C(=O)N2CCO[C@@H](C[NH3+])C2)cc1	ZINC000011887259	360400972	/nfs/dbraw/zinc/40/09/72/360400972.db2.gz	PGSCWYDDORSOEK-AWEZNQCLSA-N	1	0	276.380	1.784	50	0		CDAARO
COc1ccc(OCCC[NH3+])c(C(=O)N(C)C)c1	ZINC000426438882	360531775	/nfs/dbraw/zinc/53/17/75/360531775.db2.gz	NXAHNUWAYBILGC-UHFFFAOYSA-N	1	0	252.314	1.125	50	0		CDAARO
OCCn1ccc([C@@H]2CCC[N@@H+](C3CCOCC3)C2)n1	ZINC000426606678	360687963	/nfs/dbraw/zinc/68/79/63/360687963.db2.gz	BZVIWULBHJUKRG-CYBMUJFWSA-N	1	0	279.384	1.234	50	0		CDAARO
COc1cc(C(=O)N2CC[C@H](C[NH3+])C2)ccc1OC(C)C	ZINC000178574852	189128085	/nfs/dbraw/zinc/12/80/85/189128085.db2.gz	STDSPEUZMYIZBH-GFCCVEGCSA-N	1	0	292.379	1.903	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)c2cccnc2NC(C)C)C1	ZINC000178975126	189158997	/nfs/dbraw/zinc/15/89/97/189158997.db2.gz	OQHOFWZQJARHSM-GFCCVEGCSA-N	1	0	276.384	1.583	50	0		CDAARO
CCc1noc2ncc(C(=O)N3CC[C@H](C[NH2+]C)C3)cc12	ZINC000178966573	189157609	/nfs/dbraw/zinc/15/76/09/189157609.db2.gz	NUKBOCHCRKFVFO-SNVBAGLBSA-N	1	0	288.351	1.467	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)c1cnc(-c2ccncc2)s1	ZINC000179122932	189171492	/nfs/dbraw/zinc/17/14/92/189171492.db2.gz	WMJUKDQVYQEDQN-JTQLQIEISA-N	1	0	288.376	1.639	50	0		CDAARO
c1ccc(COCCC2(CNC3=[NH+]CCN3)CC2)cc1	ZINC000184597132	189390353	/nfs/dbraw/zinc/39/03/53/189390353.db2.gz	BMHLKVHQXVQDPK-UHFFFAOYSA-N	1	0	273.380	1.922	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNC(=O)c1cc2c([nH]c1=O)CCC2	ZINC000049551359	364071822	/nfs/dbraw/zinc/07/18/22/364071822.db2.gz	KNNQNKNIRGWHPK-GFCCVEGCSA-N	1	0	289.379	1.078	50	0		CDAARO
CC[N@H+](C)C[C@H]1CCN(C(=O)N[C@@H](C)c2cn[nH]c2)C1	ZINC000270377593	364571978	/nfs/dbraw/zinc/57/19/78/364571978.db2.gz	VDQXQGUMPCRGIG-NWDGAFQWSA-N	1	0	279.388	1.454	50	0		CDAARO
Cc1cc(S(=O)(=O)N2CCC[C@H]2C[NH3+])sc1C	ZINC000195555304	189679834	/nfs/dbraw/zinc/67/98/34/189679834.db2.gz	AANMAUZSCIWZQN-JTQLQIEISA-N	1	0	274.411	1.477	50	0		CDAARO
C[C@@H]1CCCN(C(=O)COCc2ccccc2)[C@H]1C[NH3+]	ZINC000179224004	364988003	/nfs/dbraw/zinc/98/80/03/364988003.db2.gz	UHCUIRKGARCZSB-HIFRSBDPSA-N	1	0	276.380	1.789	50	0		CDAARO
O=S(=O)(CCC1CC1)N[C@@H]1CC[N@H+](CC2CC2)C1	ZINC000089598162	366881541	/nfs/dbraw/zinc/88/15/41/366881541.db2.gz	NJZZIWUWPZYNGB-CYBMUJFWSA-N	1	0	272.414	1.190	50	0		CDAARO
Cc1nc(N(C)C)sc1C[N@H+](C)CCN1CCCC1=O	ZINC000093320443	365374828	/nfs/dbraw/zinc/37/48/28/365374828.db2.gz	CDMUFBYBMCLNSH-UHFFFAOYSA-N	1	0	296.440	1.572	50	0		CDAARO
CC(C)[C@H]1C[N@H+](C)CCN1C(=O)NCCCC(C)(C)CO	ZINC000089802088	366938424	/nfs/dbraw/zinc/93/84/24/366938424.db2.gz	RULTUGPBEUXBAU-CQSZACIVSA-N	1	0	299.459	1.767	50	0		CDAARO
C[C@@]1(O)CC[N@@H+]([C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000089908121	366963440	/nfs/dbraw/zinc/96/34/40/366963440.db2.gz	WADUQEFWEPFWRH-NVXWUHKLSA-N	1	0	288.391	1.634	50	0		CDAARO
O=C(NC[C@]1(O)CCOC1)[C@H]1CCCC[N@@H+]1C1CCCC1	ZINC000252481728	367566049	/nfs/dbraw/zinc/56/60/49/367566049.db2.gz	CRAMCAPGZSYHPZ-GDBMZVCRSA-N	1	0	296.411	1.051	50	0		CDAARO
C[C@H](O)C1CCN(C(=O)[C@@H]2C[C@H]3CCCC[C@@H]3[NH2+]2)CC1	ZINC000252585391	368161064	/nfs/dbraw/zinc/16/10/64/368161064.db2.gz	IGHSFRYLJWTOAE-ATGSNQNLSA-N	1	0	280.412	1.527	50	0		CDAARO
Cc1ccc(CC23CN4CC(C[N@H+](C2)CC4)[C@H]3O)c(C)c1	ZINC000019361080	369703838	/nfs/dbraw/zinc/70/38/38/369703838.db2.gz	ZCEHQAIPDAYTJE-LXPRWKDFSA-N	1	0	286.419	1.454	50	0		CDAARO
CCC(=O)Nc1cccc(C(=O)NC2(C)CC[NH2+]CC2)c1	ZINC000193379356	370010498	/nfs/dbraw/zinc/01/04/98/370010498.db2.gz	AFTJJEBDPTXNHA-UHFFFAOYSA-N	1	0	289.379	1.907	50	0		CDAARO
Cc1ccccc1C(=O)N[C@H](C)c1nnc2n1CC[NH2+]CC2	ZINC000299755673	372745843	/nfs/dbraw/zinc/74/58/43/372745843.db2.gz	BMQIAISNELPTGF-GFCCVEGCSA-N	1	0	299.378	1.223	50	0		CDAARO
CCc1n[nH]cc1C(=O)NC[C@@H]1CC[N@@H+](C2CCCC2)C1	ZINC000299758402	372746430	/nfs/dbraw/zinc/74/64/30/372746430.db2.gz	MRZCMWYLPWLTAS-LBPRGKRZSA-N	1	0	290.411	1.966	50	0		CDAARO
CCNC(=O)[C@H](C)[N@H+](C)CCc1c(C)n[nH]c1C	ZINC000299782995	372759733	/nfs/dbraw/zinc/75/97/33/372759733.db2.gz	UMNPSNRZSJGPHD-NSHDSACASA-N	1	0	252.362	1.025	50	0		CDAARO
Cc1cccc2[nH]c(CNC(=O)[C@H]3CCC[NH2+]CC3)nc21	ZINC000299786943	372762132	/nfs/dbraw/zinc/76/21/32/372762132.db2.gz	RVYBJKSQNPXUIJ-LBPRGKRZSA-N	1	0	286.379	1.877	50	0		CDAARO
O=C(C[NH+]1CCCC1)N[C@H](c1ccccn1)[C@H]1C[C@H](O)C1	ZINC000244748548	189911085	/nfs/dbraw/zinc/91/10/85/189911085.db2.gz	OJNMGMPPAIJFRA-XEZPLFJOSA-N	1	0	289.379	1.106	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)Cc1ccc(F)cc1F	ZINC000095067610	373706420	/nfs/dbraw/zinc/70/64/20/373706420.db2.gz	VEZUAFQJLDNAGK-VIFPVBQESA-N	1	0	254.280	1.328	50	0		CDAARO
COC[C@@H]1CCCCN(Cc2ncnn2CCF)C1	ZINC000253429047	373736282	/nfs/dbraw/zinc/73/62/82/373736282.db2.gz	BYJRYCPYNISLPZ-GFCCVEGCSA-N	1	0	270.352	1.496	50	0		CDAARO
O=C1NCCN1C1CC[NH+](C[C@@H](O)c2ccccc2)CC1	ZINC000051449848	373849375	/nfs/dbraw/zinc/84/93/75/373849375.db2.gz	OXYPYJJUFOHWTD-OAHLLOKOSA-N	1	0	289.379	1.210	50	0		CDAARO
Cc1ccc(O)c(C[NH2+]C2CCN(C3CC3)CC2)n1	ZINC000103341394	373959733	/nfs/dbraw/zinc/95/97/33/373959733.db2.gz	QIHFIDZKODIWRJ-UHFFFAOYSA-N	1	0	261.369	1.812	50	0		CDAARO
COc1ccc(C[NH2+]CC2(O)CCOCC2)cc1F	ZINC000112717264	374226808	/nfs/dbraw/zinc/22/68/08/374226808.db2.gz	KYAIVWFSXHUZET-UHFFFAOYSA-N	1	0	269.316	1.465	50	0		CDAARO
C[C@@H]1C[N@H+](C[C@@H](O)COCc2ccccc2)[C@H](C)CO1	ZINC000114503577	374315704	/nfs/dbraw/zinc/31/57/04/374315704.db2.gz	WOHMRMXPSQKRFD-IIAWOOMASA-N	1	0	279.380	1.673	50	0		CDAARO
C[C@H](C(=O)NCC(F)(F)F)[N@H+](C)CC1CCC1	ZINC000095430674	374932587	/nfs/dbraw/zinc/93/25/87/374932587.db2.gz	XRESUCWFBPPJEL-MRVPVSSYSA-N	1	0	252.280	1.785	50	0		CDAARO
COc1ccccc1NC(=O)NCCOCC[NH+](C)C	ZINC000095467265	374961745	/nfs/dbraw/zinc/96/17/45/374961745.db2.gz	PAJPKDOSIIHIRG-UHFFFAOYSA-N	1	0	281.356	1.395	50	0		CDAARO
COC1(CNC(=O)NC2CCC(C[NH+](C)C)CC2)CCC1	ZINC000097055257	375143344	/nfs/dbraw/zinc/14/33/44/375143344.db2.gz	PHHGPUWPSKUEHX-UHFFFAOYSA-N	1	0	297.443	1.975	50	0		CDAARO
C[C@@H](C(=O)N1CC[C@@H]([NH3+])C1)c1ccc(F)c(F)c1	ZINC000299739784	375200277	/nfs/dbraw/zinc/20/02/77/375200277.db2.gz	RIHRUPADCIHTTK-PSASIEDQSA-N	1	0	254.280	1.628	50	0		CDAARO
CN(C)[C@@H]1CCC[C@H]2[C@H]1[NH2+]CCN2Cc1ccccc1	ZINC000261508874	190040433	/nfs/dbraw/zinc/04/04/33/190040433.db2.gz	XWESEHYQUMTBRP-IKGGRYGDSA-N	1	0	273.424	1.943	50	0		CDAARO
CCCc1noc([C@H](C)[NH2+][C@@H]2CCN(C(C)=O)C[C@H]2C)n1	ZINC000241969534	376020812	/nfs/dbraw/zinc/02/08/12/376020812.db2.gz	UXDFIYUWEUWTPH-NTZNESFSSA-N	1	0	294.399	1.930	50	0		CDAARO
O=C(NCC1CC1)c1ccc([C@H]2CCC[NH2+]C2)nc1	ZINC000242554687	376021692	/nfs/dbraw/zinc/02/16/92/376021692.db2.gz	MTNUKEQYBPWAQH-LBPRGKRZSA-N	1	0	259.353	1.688	50	0		CDAARO
C[C@H]1C[NH2+]CCN1C(=O)C[C@H]1OCCc2ccccc21	ZINC000125750954	376326707	/nfs/dbraw/zinc/32/67/07/376326707.db2.gz	IQAVOOPKGCYWIG-SWLSCSKDSA-N	1	0	274.364	1.511	50	0		CDAARO
CO[C@@H]1CC[C@H]2OCC[N@H+](CCc3ccncc3)[C@H]2C1	ZINC000246081119	376375554	/nfs/dbraw/zinc/37/55/54/376375554.db2.gz	BZQURKMTFLHUEX-OWCLPIDISA-N	1	0	276.380	1.892	50	0		CDAARO
C[NH+]1CCC(O)(CNC(=O)c2sccc2Cl)CC1	ZINC000286129877	377869234	/nfs/dbraw/zinc/86/92/34/377869234.db2.gz	NZAIQTAEJHRTCJ-UHFFFAOYSA-N	1	0	288.800	1.588	50	0		CDAARO
CC(C)[NH2+]C[C@@H](O)c1ccc(NS(C)(=O)=O)cc1	ZINC000000004166	169504313	/nfs/dbraw/zinc/50/43/13/169504313.db2.gz	ZBMZVLHSJCTVON-GFCCVEGCSA-N	1	0	272.370	1.090	50	0	fda	CDAARO
COc1cc(Br)c(CC[NH3+])cc1OC	ZINC000000336690	169610457	/nfs/dbraw/zinc/61/04/57/169610457.db2.gz	WGAFQMMKTNUYDH-UHFFFAOYSA-N	1	0	260.131	1.968	50	0		CDAARO
O=C1OC2(CN1c1ccc(F)cc1)CC[NH2+]CC2	ZINC000071788986	284946366	/nfs/dbraw/zinc/94/63/66/284946366.db2.gz	FQIMMUOGSMFIEY-UHFFFAOYSA-N	1	0	250.273	1.905	50	0		CDAARO
O=S1(=O)CCC([NH2+]C2Cc3ccccc3C2)CC1	ZINC000036331721	285052671	/nfs/dbraw/zinc/05/26/71/285052671.db2.gz	KYJIRSHFWWQWBQ-UHFFFAOYSA-N	1	0	265.378	1.321	50	0		CDAARO
COCC[NH2+][C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000016082597	285082548	/nfs/dbraw/zinc/08/25/48/285082548.db2.gz	KUBIWWTWZPYRIV-NSHDSACASA-N	1	0	258.362	1.622	50	0		CDAARO
C[C@H]1CC([NH2+]CC(C)(C)CCS(C)(=O)=O)C[C@H](C)O1	ZINC000095988343	256882611	/nfs/dbraw/zinc/88/26/11/256882611.db2.gz	NTWVVVQVZYZKAZ-RYUDHWBXSA-N	1	0	291.457	1.993	50	0		CDAARO
O[C@@H]1c2ccccc2C[C@H]1[N@@H+]1CCc2n[nH]cc2C1	ZINC000097034166	285340792	/nfs/dbraw/zinc/34/07/92/285340792.db2.gz	OLZWDSAQPFZIQJ-HUUCEWRRSA-N	1	0	255.321	1.426	50	0		CDAARO
CC(C)(C)CCS(=O)(=O)NC[C@@H]1CC[N@@H+](C2CC2)C1	ZINC000096427710	390517446	/nfs/dbraw/zinc/51/74/46/390517446.db2.gz	JLBBFLUANLSGPK-LBPRGKRZSA-N	1	0	288.457	1.826	50	0		CDAARO
C[C@H]([NH3+])[C@@H]1CCCCN1C(=O)c1ccnc(C2CC2)n1	ZINC000408519104	390849787	/nfs/dbraw/zinc/84/97/87/390849787.db2.gz	LJWJSOSXNMJTPQ-GWCFXTLKSA-N	1	0	274.368	1.696	50	0		CDAARO
COc1ccccc1[C@H]1CCCN1C(=O)[C@H]1C[NH2+]CCO1	ZINC000187656377	390895272	/nfs/dbraw/zinc/89/52/72/390895272.db2.gz	OHOPGQOATITGTK-UKRRQHHQSA-N	1	0	290.363	1.347	50	0		CDAARO
c1ccc(CC[N@@H+]2CC[C@@H](CN3CCOCC3)C2)nc1	ZINC000096424593	390957344	/nfs/dbraw/zinc/95/73/44/390957344.db2.gz	DFVMJSPZJMBIEE-OAHLLOKOSA-N	1	0	275.396	1.278	50	0		CDAARO
Cc1cc(C)nc(NC[C@H](O)C[NH+]2CCC(C)CC2)n1	ZINC000096456199	391484434	/nfs/dbraw/zinc/48/44/34/391484434.db2.gz	CTJVDORZWOTWMU-AWEZNQCLSA-N	1	0	278.400	1.598	50	0		CDAARO
CC(C)[N@@H+]1C[C@H](C)[C@H](NS(=O)(=O)c2ccccc2)C1	ZINC000246946899	391893518	/nfs/dbraw/zinc/89/35/18/391893518.db2.gz	KHBKFZCSRPVMAS-GXTWGEPZSA-N	1	0	282.409	1.694	50	0		CDAARO
CO[C@H]1C[N@H+](C)C[C@@H]1NC(=O)c1ccc2ccccc2n1	ZINC000223484951	391924901	/nfs/dbraw/zinc/92/49/01/391924901.db2.gz	XQSBICXEJNUNGD-GJZGRUSLSA-N	1	0	285.347	1.294	50	0		CDAARO
NC(=O)CCC1CC[NH+](CC[C@H]2CCOC2)CC1	ZINC000438125759	392536420	/nfs/dbraw/zinc/53/64/20/392536420.db2.gz	XCPKONRWZIOZAT-ZDUSSCGKSA-N	1	0	254.374	1.391	50	0		CDAARO
COc1ccsc1C(=O)NCC[NH2+]C(C)(C)C	ZINC000096418540	393181362	/nfs/dbraw/zinc/18/13/62/393181362.db2.gz	VQCURQFAOGQLAJ-UHFFFAOYSA-N	1	0	256.371	1.875	50	0		CDAARO
Oc1cccc(CN2CC[NH+](C[C@@H]3CCOC3)CC2)c1	ZINC000096452008	393187209	/nfs/dbraw/zinc/18/72/09/393187209.db2.gz	BPZHIFATNJZWGK-HNNXBMFYSA-N	1	0	276.380	1.546	50	0		CDAARO
CC1=CCC[C@@H](C)[C@@H]1C[N@H+](C)CC(=O)N1CCC(O)CC1	ZINC000195575800	393305312	/nfs/dbraw/zinc/30/53/12/393305312.db2.gz	AEZPCKCAXRYNGG-GDBMZVCRSA-N	1	0	294.439	1.894	50	0		CDAARO
COC(=O)c1ccc(OC[C@@H](O)C[NH2+]C(C)(C)C)cc1	ZINC000002827950	169835244	/nfs/dbraw/zinc/83/52/44/169835244.db2.gz	SZAYMQLNVXIKNC-LBPRGKRZSA-N	1	0	281.352	1.601	50	0		CDAARO
COCC[NH2+]Cc1ccc(OC)c(OC)c1OC	ZINC000004700310	170001218	/nfs/dbraw/zinc/00/12/18/170001218.db2.gz	GGAWHUCOPILUEE-UHFFFAOYSA-N	1	0	255.314	1.448	50	0		CDAARO
COc1ccc(C[C@H](C)[NH2+][C@@H]2CCCCNC2=O)cc1	ZINC000004989279	170049808	/nfs/dbraw/zinc/04/98/08/170049808.db2.gz	WWPLVGJTGXDBAY-SWLSCSKDSA-N	1	0	276.380	1.885	50	0		CDAARO
CC(C)(C)[C@H]([NH3+])CNC(=O)CC1=N[C@@H](C(C)(C)C)CO1	ZINC000005677060	170127186	/nfs/dbraw/zinc/12/71/86/170127186.db2.gz	HIQKYUPIBXOQFM-GHMZBOCLSA-N	1	0	283.416	1.710	50	0		CDAARO
C[NH2+]CCc1c[nH]c2ccc(C[C@H]3COC(=O)N3)cc12	ZINC000005996379	170165817	/nfs/dbraw/zinc/16/58/17/170165817.db2.gz	QGGCHSMZXKNGCK-LBPRGKRZSA-N	1	0	273.336	1.581	50	0	in-vitro	CDAARO
CCC(CC)[NH2+]CC(=O)NCc1ccc(C(=O)OC)cc1	ZINC000006940319	170256881	/nfs/dbraw/zinc/25/68/81/170256881.db2.gz	ZNHYTNQATBNOHS-UHFFFAOYSA-N	1	0	292.379	1.868	50	0		CDAARO
CC(C)[N@H+](CCOc1cccc(Cl)c1)CC(N)=O	ZINC000009363900	170373657	/nfs/dbraw/zinc/37/36/57/170373657.db2.gz	NWFWFHNSLZIUFS-UHFFFAOYSA-N	1	0	270.760	1.915	50	0		CDAARO
C[C@H](CCNc1noc(C2CC2)n1)[NH+]1CCN(C)CC1	ZINC000534665449	411829312	/nfs/dbraw/zinc/82/93/12/411829312.db2.gz	JOJYVZMSTZECDZ-LLVKDONJSA-N	1	0	279.388	1.385	50	0		CDAARO
[NH3+]C[C@H]1CC(=O)N(CCc2cccc(Cl)c2)C1	ZINC000019669450	170834891	/nfs/dbraw/zinc/83/48/91/170834891.db2.gz	QYVXNYUYXOTERU-LLVKDONJSA-N	1	0	252.745	1.690	50	0		CDAARO
COC(=O)c1ccc(CN2CCC[N@H+](C)CC2)cc1	ZINC000020302773	171139662	/nfs/dbraw/zinc/13/96/62/171139662.db2.gz	MHUFFPUFJUCRGZ-UHFFFAOYSA-N	1	0	262.353	1.611	50	0		CDAARO
COC(=O)CN1CC[NH+](Cc2ccccc2C)CC1	ZINC000020418607	171183789	/nfs/dbraw/zinc/18/37/89/171183789.db2.gz	WLGXGFFJLBZCBD-UHFFFAOYSA-N	1	0	262.353	1.286	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@H]2CCC[NH2+]C2)cc1C	ZINC000020432271	171196653	/nfs/dbraw/zinc/19/66/53/171196653.db2.gz	JZHOCYCESJMFOQ-LBPRGKRZSA-N	1	0	268.382	1.334	50	0		CDAARO
Cn1cc(CN2CC[N@H+](C)[C@@H](CCO)C2)c2ccccc21	ZINC000020920046	171280153	/nfs/dbraw/zinc/28/01/53/171280153.db2.gz	YDAZIVCXKDZRRN-HNNXBMFYSA-N	1	0	287.407	1.677	50	0		CDAARO
CC1CCN(S(=O)(=O)Cc2ccccc2C[NH3+])CC1	ZINC000021515915	171312215	/nfs/dbraw/zinc/31/22/15/171312215.db2.gz	ZZJJDHFECFIIRT-UHFFFAOYSA-N	1	0	282.409	1.707	50	0		CDAARO
C[NH+](C)[C@H](CNC(=O)c1ccc(=O)[nH]n1)c1cccs1	ZINC000022687698	171395798	/nfs/dbraw/zinc/39/57/98/171395798.db2.gz	OJRCFAWAXKBUOI-SNVBAGLBSA-N	1	0	292.364	1.276	50	0		CDAARO
c1cc2c(c(CNC[C@H]3CC[N@@H+](C4CC4)C3)c1)OCO2	ZINC000037409510	173185896	/nfs/dbraw/zinc/18/58/96/173185896.db2.gz	XAACTYPCVBJSLF-GFCCVEGCSA-N	1	0	274.364	1.989	50	0		CDAARO
Cc1cc(NC(=O)[C@@H]2CCC[NH2+]2)ccc1N1CCCC1=O	ZINC000040429437	174259316	/nfs/dbraw/zinc/25/93/16/174259316.db2.gz	FDNKXQNCYYMNFZ-ZDUSSCGKSA-N	1	0	287.363	1.812	50	0		CDAARO
NC(=O)COc1cccc(C[NH+]2CC(c3ccccn3)C2)c1	ZINC000072147350	176325676	/nfs/dbraw/zinc/32/56/76/176325676.db2.gz	YFGNKNFGWQAGFW-UHFFFAOYSA-N	1	0	297.358	1.545	50	0		CDAARO
C[C@@H]1CN(C)c2ccccc2N(C(=O)[C@H]2C[NH2+]CCO2)C1	ZINC000187452734	296970135	/nfs/dbraw/zinc/97/01/35/296970135.db2.gz	SYCKUWLRKNRUSW-IUODEOHRSA-N	1	0	289.379	1.094	50	0		CDAARO
[NH3+]C[C@H](CO)Cc1cc(F)cc(Br)c1	ZINC000086697042	260396533	/nfs/dbraw/zinc/39/65/33/260396533.db2.gz	GFBQXGJHHNWFEB-MRVPVSSYSA-N	1	0	262.122	1.698	50	0		CDAARO
Cc1sc2ncnc(N3CC[NH+](CCO)CC3)c2c1C	ZINC000019973492	274879579	/nfs/dbraw/zinc/87/95/79/274879579.db2.gz	DAXDZYRZRYGBPV-UHFFFAOYSA-N	1	0	292.408	1.422	50	0		CDAARO
CC(C)[C@H](O)C[N@@H+]1CC[C@H]2[C@@H](CCC(=O)N2C2CC2)C1	ZINC000366596188	276024497	/nfs/dbraw/zinc/02/44/97/276024497.db2.gz	JQFASDZYGMLPOI-AEGPPILISA-N	1	0	280.412	1.479	50	0		CDAARO
CCOc1cc(N2C[C@H]3CCC[N@@H+]3C[C@H]2C)ncn1	ZINC000252585949	276370951	/nfs/dbraw/zinc/37/09/51/276370951.db2.gz	MJZDZZNIWDKGKD-VXGBXAGGSA-N	1	0	262.357	1.548	50	0		CDAARO
COC(=O)c1cc2n(n1)CCC[N@@H+](C1CCOCC1)C2	ZINC000067694627	277153552	/nfs/dbraw/zinc/15/35/52/277153552.db2.gz	ZECISQBZOCHARA-UHFFFAOYSA-N	1	0	279.340	1.054	50	0		CDAARO
CNC(=O)[C@H](C[NH3+])Cc1ccc(C(F)(F)F)cc1	ZINC000050303852	277249860	/nfs/dbraw/zinc/24/98/60/277249860.db2.gz	ZHZQASDVLDLEKE-VIFPVBQESA-N	1	0	260.259	1.569	50	0		CDAARO
CC(C)n1nc(C2CCOCC2)nc1[C@@H]1C[C@H]([NH3+])CN1C	ZINC000097532692	278142011	/nfs/dbraw/zinc/14/20/11/278142011.db2.gz	AZPKYBNOERSPLT-STQMWFEESA-N	1	0	293.415	1.457	50	0		CDAARO
CC1(C)CCC[C@H]1[NH2+]CC1(CS(C)(=O)=O)CC1	ZINC000090183746	278248052	/nfs/dbraw/zinc/24/80/52/278248052.db2.gz	NLVGGKZBAXFDBM-LLVKDONJSA-N	1	0	259.415	1.980	50	0		CDAARO
C[C@H]([NH2+]CCOc1ccc2c(c1)OCO2)c1nccn1C	ZINC000096491591	279471776	/nfs/dbraw/zinc/47/17/76/279471776.db2.gz	NEGRFEZWOCOZLX-NSHDSACASA-N	1	0	289.335	1.878	50	0		CDAARO
O=C([C@@H]1[NH2+]Cc2ccccc21)N1C[C@@H]2[C@H]3CC[C@H](O3)[C@@H]2C1	ZINC000071751385	280119052	/nfs/dbraw/zinc/11/90/52/280119052.db2.gz	YITSFMJBJGVKPU-LYYZXLFJSA-N	1	0	284.359	1.467	50	0		CDAARO
O=C1CC[C@]2(CN1Cc1ccccc1)[NH2+]CCc1nc[nH]c12	ZINC000067840398	280261564	/nfs/dbraw/zinc/26/15/64/280261564.db2.gz	OACJTHOLJKIQCI-QGZVFWFLSA-N	1	0	296.374	1.573	50	0		CDAARO
C[NH+](C)CC(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000067802684	282059086	/nfs/dbraw/zinc/05/90/86/282059086.db2.gz	SOYNWULUYQZNKB-NSHDSACASA-N	1	0	285.388	1.064	50	0		CDAARO
C[C@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)N[C@H]1CCCC[C@H]1C	ZINC000241157320	290157095	/nfs/dbraw/zinc/15/70/95/290157095.db2.gz	JWTQRGCFTWKXTK-QPSCCSFWSA-N	1	0	282.428	1.917	50	0		CDAARO
COC[C@H]([NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCC2)C1CC1	ZINC000248701684	293162831	/nfs/dbraw/zinc/16/28/31/293162831.db2.gz	GHLLPYBTIIODOB-XJFOESAGSA-N	1	0	251.370	1.959	50	0		CDAARO
CCN(C(=O)c1cn(CC[NH3+])nn1)c1cccc(Cl)c1	ZINC000570584005	294268883	/nfs/dbraw/zinc/26/88/83/294268883.db2.gz	QBHZUMCYHSXFGE-UHFFFAOYSA-N	1	0	293.758	1.557	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)C1	ZINC000269152588	295258175	/nfs/dbraw/zinc/25/81/75/295258175.db2.gz	CCFXRXNBDGFPNN-ZLKJLUDKSA-N	1	0	262.328	1.736	50	0		CDAARO
CC1(C(=O)NCC2(C[NH+]3CCCC3)CC2)COC1	ZINC000534584146	328311109	/nfs/dbraw/zinc/31/11/09/328311109.db2.gz	QBYHMSIVVZMVIM-UHFFFAOYSA-N	1	0	252.358	1.015	50	0		CDAARO
CN(Cc1noc2c1CCCC2)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000534587865	328316192	/nfs/dbraw/zinc/31/61/92/328316192.db2.gz	KLOIEKYNSCXMNY-NSHDSACASA-N	1	0	261.325	1.040	50	0		CDAARO
O=C(N[C@H]1C[NH2+]CC[C@H]1O)c1csc2ccccc12	ZINC000534590755	328318152	/nfs/dbraw/zinc/31/81/52/328318152.db2.gz	HQPHZWVKJBLKCN-NWDGAFQWSA-N	1	0	276.361	1.354	50	0		CDAARO
CCc1ccc2c(c1)C(=O)N1C[C@H]([NH+](C)C)C[C@H]1C(=O)N2	ZINC000534592700	328318578	/nfs/dbraw/zinc/31/85/78/328318578.db2.gz	FTHWJKRKSILPRH-RISCZKNCSA-N	1	0	287.363	1.346	50	0		CDAARO
C[C@@H](Cn1cncn1)[NH2+]CCCc1nc2ccccc2n1C	ZINC000534642759	328329065	/nfs/dbraw/zinc/32/90/65/328329065.db2.gz	FIMBPDPPORDROO-ZDUSSCGKSA-N	1	0	298.394	1.776	50	0		CDAARO
[NH3+][C@H]1CCCN(Cc2nc(C(F)(F)F)no2)C1	ZINC000534646509	328329783	/nfs/dbraw/zinc/32/97/83/328329783.db2.gz	VDNGRARVRZUHAP-LURJTMIESA-N	1	0	250.224	1.012	50	0		CDAARO
Cc1ncc(C(=O)N2CCCC3(CC[NH2+]CC3)CC2)cn1	ZINC000534645507	328330807	/nfs/dbraw/zinc/33/08/07/328330807.db2.gz	RUYGFTFYSRJWIL-UHFFFAOYSA-N	1	0	288.395	1.781	50	0		CDAARO
Cc1c[nH]c(C[NH2+][C@H]2CCCSC2)c(C)c1=O	ZINC000534656868	328340753	/nfs/dbraw/zinc/34/07/53/328340753.db2.gz	FXMUIDUHFNDZIR-NSHDSACASA-N	1	0	252.383	1.977	50	0		CDAARO
COc1cccc(-n2cc(CNC(=O)[C@H]3C=CC[NH2+]3)cn2)c1	ZINC000534657558	328341133	/nfs/dbraw/zinc/34/11/33/328341133.db2.gz	DOBPCMOCYBNYFG-OAHLLOKOSA-N	1	0	298.346	1.025	50	0		CDAARO
CC1(C)C[C@@H]([NH2+]CC(=O)NC2CCOCC2)C(C)(C)O1	ZINC000097100436	323207388	/nfs/dbraw/zinc/20/73/88/323207388.db2.gz	YXGPCFOOJBMWPG-GFCCVEGCSA-N	1	0	284.400	1.217	50	0		CDAARO
Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2[NH2+]CCO)cc1	ZINC000184890047	323376906	/nfs/dbraw/zinc/37/69/06/323376906.db2.gz	ZCOCACMOFVUOKA-CABCVRRESA-N	1	0	297.420	1.662	50	0		CDAARO
O=C(NCC1(CO)CCCC1)[C@@H]1CC12CC[NH2+]CC2	ZINC000135100371	328449083	/nfs/dbraw/zinc/44/90/83/328449083.db2.gz	KPLIGRYWPGRHJB-LBPRGKRZSA-N	1	0	266.385	1.045	50	0		CDAARO
COc1ccccc1OCCC[N@H+]1C[C@@H]2[C@H](O)C[C@@H]2C1	ZINC001772711539	1159446297	/nfs/dbraw/zinc/44/62/97/1159446297.db2.gz	YTYMYXJXHXCUNE-HZSPNIEDSA-N	1	0	277.364	1.777	50	0		CDAARO
COC[C@](C)(O)C(=O)NC1CCC([NH+]2CCCCC2)CC1	ZINC000086591357	482738724	/nfs/dbraw/zinc/73/87/24/482738724.db2.gz	HMTLNGBXAKZYOT-XUJLQICISA-N	1	0	298.427	1.297	50	0		CDAARO
O=C(C1CCC1)N1CCC[N@H+](C[C@H]2CCCOC2)CC1	ZINC000670437758	482978150	/nfs/dbraw/zinc/97/81/50/482978150.db2.gz	WEUQJSKNXDRTFH-CQSZACIVSA-N	1	0	280.412	1.747	50	0		CDAARO
COc1ccc(C[N@@H+]2CC[C@@H](C(C)(C)O)C2)cc1O	ZINC000670445263	482996277	/nfs/dbraw/zinc/99/62/77/482996277.db2.gz	OGPICWMYBFGETD-GFCCVEGCSA-N	1	0	265.353	1.994	50	0		CDAARO
C[C@H](c1ncnn1CCc1ccccc1)N1CC[NH+](C)CC1	ZINC000670448758	483003829	/nfs/dbraw/zinc/00/38/29/483003829.db2.gz	OXIFYWJKDMLJHS-OAHLLOKOSA-N	1	0	299.422	1.829	50	0		CDAARO
OC[C@H]1CCC[N@H+](CCCNc2ncnc3[nH]ccc32)C1	ZINC000670461567	483045166	/nfs/dbraw/zinc/04/51/66/483045166.db2.gz	MUNKBOWPMYYTNF-LBPRGKRZSA-N	1	0	289.383	1.416	50	0		CDAARO
CCOC(=O)N1CC[C@H]([NH2+]CCc2nccs2)C1	ZINC000670462191	483047351	/nfs/dbraw/zinc/04/73/51/483047351.db2.gz	DIDXBIFIKJCDJT-JTQLQIEISA-N	1	0	269.370	1.506	50	0		CDAARO
Cc1nnc(CN(C)[C@H]2CC[N@H+](CC3CCCC3)C2)n1C	ZINC000084291174	483270314	/nfs/dbraw/zinc/27/03/14/483270314.db2.gz	FOOGFBRLFJSKKH-HNNXBMFYSA-N	1	0	291.443	1.820	50	0		CDAARO
Cn1cc([C@@H]2OCC[C@H]2C[NH2+]Cc2ccc(CO)o2)cn1	ZINC000084317502	483272017	/nfs/dbraw/zinc/27/20/17/483272017.db2.gz	DWIFMEYFSMBMHX-XHDPSFHLSA-N	1	0	291.351	1.373	50	0		CDAARO
Cc1ccsc1[C@@H](C)[NH2+]C[C@H]1CN2CCN1CC2	ZINC000090648931	483281860	/nfs/dbraw/zinc/28/18/60/483281860.db2.gz	PUANHGYPGMECAR-OLZOCXBDSA-N	1	0	265.426	1.707	50	0		CDAARO
O=C(C1CC[NH+](Cc2ccccn2)CC1)N1CCCC1	ZINC000004663314	526302706	/nfs/dbraw/zinc/30/27/06/526302706.db2.gz	PHAVFCNEAYDPJF-UHFFFAOYSA-N	1	0	273.380	1.916	50	0		CDAARO
CCCn1ccnc1CNc1cc(C2CC([NH3+])C2)ncn1	ZINC000222747683	528867510	/nfs/dbraw/zinc/86/75/10/528867510.db2.gz	HLQRPHPZFRGSQH-UHFFFAOYSA-N	1	0	286.383	1.900	50	0		CDAARO
C[C@@H](Cn1cccn1)[NH2+]C[C@@H]1CC(=O)Nc2ccccc21	ZINC000097162379	545522502	/nfs/dbraw/zinc/52/25/02/545522502.db2.gz	HPZXYKGDYQYPPC-STQMWFEESA-N	1	0	284.363	1.987	50	0		CDAARO
Cc1ccc([C@H](O)CN2CC[N@@H+](C)C[C@@H]2C)cc1C	ZINC000089643188	545567485	/nfs/dbraw/zinc/56/74/85/545567485.db2.gz	DIPUAHUTSUGSST-GOEBONIOSA-N	1	0	262.397	1.973	50	0		CDAARO
C[C@H]1C[NH2+]CC[C@H]1c1ccc(NS(C)(=O)=O)cc1	ZINC000757207499	577035940	/nfs/dbraw/zinc/03/59/40/577035940.db2.gz	BJGHMSCCGWMMEG-GXFFZTMASA-N	1	0	268.382	1.771	50	0		CDAARO
COc1cc(NC(=O)CC2CC[NH2+]CC2)ccc1O	ZINC000952990690	617200169	/nfs/dbraw/zinc/20/01/69/617200169.db2.gz	XNHDQXJYSYHYSI-UHFFFAOYSA-N	1	0	264.325	1.729	50	0		CDAARO
CC(C)Cc1nc([C@@H]([NH3+])Cc2ccccc2)n(CCO)n1	ZINC000952988413	614232785	/nfs/dbraw/zinc/23/27/85/614232785.db2.gz	DHCUXFDQYYTBGX-AWEZNQCLSA-N	1	0	288.395	1.711	50	0		CDAARO
CC(C)[N@@H+]1CCC[C@@H](C(=O)N(C)CC2(CO)CCC2)C1	ZINC000952972835	614334333	/nfs/dbraw/zinc/33/43/33/614334333.db2.gz	AFICKSZYQCQTDA-CQSZACIVSA-N	1	0	282.428	1.728	50	0		CDAARO
C[C@@H]1[NH2+]CCN(C(=O)C[C@H](O)c2cccc(F)c2)[C@H]1C	ZINC000888096332	617758418	/nfs/dbraw/zinc/75/84/18/617758418.db2.gz	AUXYOANJCDNZNL-MJVIPROJSA-N	1	0	280.343	1.458	50	0		CDAARO
CC(C)[C@@H](O)C[N@@H+]1CC[C@](CO)(c2cccc(F)c2)C1	ZINC000888101427	617766737	/nfs/dbraw/zinc/76/67/37/617766737.db2.gz	VJJSBVPODGPLCP-HOTGVXAUSA-N	1	0	281.371	1.778	50	0		CDAARO
CO[C@@H]1CCC[C@]12CCCN(C(=O)C[NH2+]C1CC1)C2	ZINC001704298968	1177678907	/nfs/dbraw/zinc/67/89/07/1177678907.db2.gz	LEYWZKXIIPQUEV-UKRRQHHQSA-N	1	0	266.385	1.546	50	0		CDAARO
Cc1ncccc1C[N@H+]1C[C@@H](Cc2cnccn2)[C@H](O)C1	ZINC001704328248	1177688879	/nfs/dbraw/zinc/68/88/79/1177688879.db2.gz	LRIUZGAIOVJNST-GDBMZVCRSA-N	1	0	284.363	1.215	50	0		CDAARO
CCCO[C@@H]1CCC[N@H+](CCn2cc[nH]c2=O)C1	ZINC001704352062	1177699268	/nfs/dbraw/zinc/69/92/68/1177699268.db2.gz	WQUUSKRYUJKZSY-GFCCVEGCSA-N	1	0	253.346	1.480	50	0		CDAARO
O=C(C=C1CC[NH2+]CC1)NCC[C@@H]1CCCCO1	ZINC000852884376	844743765	/nfs/dbraw/zinc/74/37/65/844743765.db2.gz	KBFPDLQMHMTGBE-ZDUSSCGKSA-N	1	0	252.358	1.372	50	0		CDAARO
CON(C)C(=O)CC[N@@H+]1CC[C@H](c2ccccn2)C1	ZINC000799189885	845195676	/nfs/dbraw/zinc/19/56/76/845195676.db2.gz	IEXOGDKCKOYUIW-LBPRGKRZSA-N	1	0	263.341	1.281	50	0		CDAARO
CC(C)[N@@H+]1CC[C@@H](C[NH+](C)CCn2cccn2)C1	ZINC000299766553	845870571	/nfs/dbraw/zinc/87/05/71/845870571.db2.gz	PAGGXAJGAPIEGD-AWEZNQCLSA-N	1	0	250.390	1.545	50	0		CDAARO
CCOCC[NH2+][C@@H](C)c1cccc(-n2cnnc2)c1	ZINC000863983318	846891690	/nfs/dbraw/zinc/89/16/90/846891690.db2.gz	FTMSPZBBSRTFCS-LBPRGKRZSA-N	1	0	260.341	1.954	50	0		CDAARO
C1CC1c1nc2c(c(O[C@H]3CCC[NH2+]C3)n1)CCOCC2	ZINC000675013539	899868405	/nfs/dbraw/zinc/86/84/05/899868405.db2.gz	HRPFIPGIMRFDPR-LBPRGKRZSA-N	1	0	289.379	1.600	50	0		CDAARO
Cc1nc(CO[C@H]2CCC[N@H+](Cc3ccccn3)C2)no1	ZINC000675018321	899870923	/nfs/dbraw/zinc/87/09/23/899870923.db2.gz	PPOFGWXAOHKCNU-AWEZNQCLSA-N	1	0	288.351	1.954	50	0		CDAARO
Cc1cccc(OCCN2CCOC[C@H]2C(C)(C)O)c1	ZINC000952883884	910458165	/nfs/dbraw/zinc/45/81/65/910458165.db2.gz	SOWJDTNYNPPYKB-HNNXBMFYSA-N	1	0	279.380	1.846	50	0		CDAARO
Cc1cnccc1C(=O)N1CCOC[C@H](C[NH+](C)C)C1	ZINC000823690246	925722710	/nfs/dbraw/zinc/72/27/10/925722710.db2.gz	SZHYYSMMFJURCG-CYBMUJFWSA-N	1	0	277.368	1.040	50	0		CDAARO
COc1ncc(C[N@H+](C)[C@H]2CCOC(C)(C)C2)cn1	ZINC000824852029	925839749	/nfs/dbraw/zinc/83/97/49/925839749.db2.gz	OEZPFQNLQHTAAQ-LBPRGKRZSA-N	1	0	265.357	1.875	50	0		CDAARO
O=C(Nc1ccccc1C[NH+]1CCCC1)[C@H]1CCC(=O)N1	ZINC000828275961	926094894	/nfs/dbraw/zinc/09/48/94/926094894.db2.gz	BGSLIHUXLBEEIA-CQSZACIVSA-N	1	0	287.363	1.500	50	0		CDAARO
O=C(NCC1CC[NH+](CCO)CC1)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000828759849	926186650	/nfs/dbraw/zinc/18/66/50/926186650.db2.gz	CXQVESSBMNFQAP-GUWHFVFCSA-N	1	0	292.423	1.099	50	0		CDAARO
C[C@@H](CCNCc1cccc2c1OCO2)[NH+](C)C	ZINC000585117161	930978559	/nfs/dbraw/zinc/97/85/59/930978559.db2.gz	SNRSXRITNHKIGZ-NSHDSACASA-N	1	0	250.342	1.845	50	0		CDAARO
C[NH+]1CCC2(CC1)CN(C(=O)c1ccns1)CCO2	ZINC001550825660	966226292	/nfs/dbraw/zinc/22/62/92/966226292.db2.gz	XVMMGXMKOXQPPA-UHFFFAOYSA-N	1	0	281.381	1.080	50	0		CDAARO
C[NH+]1CCC(n2nccc2NC(=O)[C@H]2CCCO2)CC1	ZINC001506398714	975149140	/nfs/dbraw/zinc/14/91/40/975149140.db2.gz	DVQAZJPVEXBAAF-GFCCVEGCSA-N	1	0	278.356	1.267	50	0		CDAARO
CCn1ccc(CN(C)C[C@H]2CC[N@H+](CCOC)C2)n1	ZINC001506403310	975150715	/nfs/dbraw/zinc/15/07/15/975150715.db2.gz	SXSBQZYENAOLLB-CQSZACIVSA-N	1	0	280.416	1.303	50	0		CDAARO
Cc1nc(N)nc(N2CC[C@@H](C[NH+](C)C)C2)c1Cl	ZINC001506406783	975152017	/nfs/dbraw/zinc/15/20/17/975152017.db2.gz	RQQLXLHNWUAELH-VIFPVBQESA-N	1	0	269.780	1.409	50	0		CDAARO
CN(C)C(=O)c1cccc(N2CC[C@@H](C[NH+](C)C)C2)n1	ZINC001506417488	975155567	/nfs/dbraw/zinc/15/55/67/975155567.db2.gz	KMPRLXXRMOOVMS-LBPRGKRZSA-N	1	0	276.384	1.171	50	0		CDAARO
C[NH2+][C@@H](C)c1nc2cc(Cl)ccc2c(=O)n1C	ZINC000000250230	341978617	/nfs/dbraw/zinc/97/86/17/341978617.db2.gz	FCQJNMKDJXOVSW-ZETCQYMHSA-N	1	0	251.717	1.867	50	0		CDAARO
C[C@@H]1CC(C)(C)C[C@@](CO)([NH2+]CCn2cncn2)C1	ZINC000096452927	230376352	/nfs/dbraw/zinc/37/63/52/230376352.db2.gz	YRPHQYGUKHQZEE-OCCSQVGLSA-N	1	0	266.389	1.445	50	0		CDAARO
CCOCCCNC(=O)[C@@H]([NH3+])Cc1ccccc1	ZINC000095920265	185031961	/nfs/dbraw/zinc/03/19/61/185031961.db2.gz	RNDUOAAKJVEZQY-ZDUSSCGKSA-N	1	0	250.342	1.099	50	0		CDAARO
C[C@H](C1CC1)N(C(=O)C[NH2+][C@H](CO)C1CC1)C1CC1	ZINC000095941350	185036379	/nfs/dbraw/zinc/03/63/79/185036379.db2.gz	AAOWXUJORDKYJQ-QMTHXVAHSA-N	1	0	266.385	1.136	50	0		CDAARO
Cn1cc(C(=O)NCc2ccccc2C[NH+](C)C)ccc1=O	ZINC000095949439	185038740	/nfs/dbraw/zinc/03/87/40/185038740.db2.gz	ROFNJKPTMPVVFW-UHFFFAOYSA-N	1	0	299.374	1.377	50	0		CDAARO
COC(=O)CNC(=O)[C@H](C)[N@@H+]1CC[C@@H](C)C[C@@H](C)C1	ZINC000127713007	187328422	/nfs/dbraw/zinc/32/84/22/187328422.db2.gz	QGCGQDCTDKFIJT-UTUOFQBUSA-N	1	0	270.373	1.032	50	0		CDAARO
CCn1cc(C(=O)NCc2ccc(C[NH2+]C)cc2)cn1	ZINC000095971626	185048834	/nfs/dbraw/zinc/04/88/34/185048834.db2.gz	YDEZYVIPUIQNKK-UHFFFAOYSA-N	1	0	272.352	1.552	50	0		CDAARO
O=c1[nH]c(C[NH2+][C@@H]2CCCSC2)nc2ccccc21	ZINC000136375359	342071496	/nfs/dbraw/zinc/07/14/96/342071496.db2.gz	OTHKIZHMRBCGBO-SNVBAGLBSA-N	1	0	275.377	1.908	50	0		CDAARO
COc1ccc(Cl)cc1CC(=O)N1CC[NH2+]C[C@H]1C	ZINC000125088770	187168758	/nfs/dbraw/zinc/16/87/58/187168758.db2.gz	ZUCSPJIXYBCJNE-SNVBAGLBSA-N	1	0	282.771	1.711	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCCN(CC2CCCCC2)C1=O	ZINC000012437453	282130944	/nfs/dbraw/zinc/13/09/44/282130944.db2.gz	UAHPLFAFJDBOCK-HNNXBMFYSA-N	1	0	268.401	1.482	50	0		CDAARO
CSCC[C@H]([NH3+])C(=O)N1CC[C@@H]2OCCC[C@H]2C1	ZINC000195554471	342625875	/nfs/dbraw/zinc/62/58/75/342625875.db2.gz	HYTXABJPLACYMJ-SRVKXCTJSA-N	1	0	272.414	1.094	50	0		CDAARO
CCC1=NO[C@@H](C[N@H+](C)CCCn2cccn2)C1	ZINC000244724404	361859645	/nfs/dbraw/zinc/85/96/45/361859645.db2.gz	MTGRIRCEVJSWJF-CYBMUJFWSA-N	1	0	250.346	1.760	50	0		CDAARO
Nc1nc(NCCc2ccncc2)cc([C@H]2C[C@@H]([NH3+])C2)n1	ZINC000244748605	361861808	/nfs/dbraw/zinc/86/18/08/361861808.db2.gz	OKVKCBASFGOZHH-TXEJJXNPSA-N	1	0	284.367	1.313	50	0		CDAARO
NC(=O)CC[N@@H+](Cc1ccccc1)C[C@@H]1CCCOC1	ZINC000244787721	361863800	/nfs/dbraw/zinc/86/38/00/361863800.db2.gz	QCLNHQZZDREZPL-HNNXBMFYSA-N	1	0	276.380	1.791	50	0		CDAARO
CS[C@@H](C)CNC(=O)C[C@@H](C)C1CC[NH2+]CC1	ZINC000125432655	187184844	/nfs/dbraw/zinc/18/48/44/187184844.db2.gz	ZPGCZKZWHYQHIT-MNOVXSKESA-N	1	0	258.431	1.880	50	0		CDAARO
Cc1nc(CN(C)c2ncnc3c2CN(C)CC3)cs1	ZINC000065465999	361907110	/nfs/dbraw/zinc/90/71/10/361907110.db2.gz	GKUWEPKSRQDPPO-UHFFFAOYSA-N	1	0	289.408	1.866	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+]C[C@@H]2CN(C3CC3)CCO2)C1(C)C	ZINC000097034700	185157468	/nfs/dbraw/zinc/15/74/68/185157468.db2.gz	ANBIQRZGIHBNDM-QLFBSQMISA-N	1	0	282.428	1.643	50	0		CDAARO
COc1ccc(CC(=O)N2CC[NH2+]C[C@@H]2C)cc1F	ZINC000125512601	187189099	/nfs/dbraw/zinc/18/90/99/187189099.db2.gz	BKWQZNDSKBYRND-JTQLQIEISA-N	1	0	266.316	1.197	50	0		CDAARO
C[C@H]1C[N@H+](C)CC[C@H]1N(C)C(=O)Nc1cccn(C)c1=O	ZINC000685939648	539045737	/nfs/dbraw/zinc/04/57/37/539045737.db2.gz	ATXFIQXNONHXKE-WCQYABFASA-N	1	0	292.383	1.189	50	0		CDAARO
Cc1cc(C)cc(C(=O)NC[C@H]2C[N@@H+]3CCC[C@H]3CO2)c1	ZINC000061650303	539051822	/nfs/dbraw/zinc/05/18/22/539051822.db2.gz	VXTUMJSMPBLLIC-HOTGVXAUSA-N	1	0	288.391	1.896	50	0		CDAARO
Cc1cc([C@H]2CCC[N@H+](C[C@@H](O)Cn3cccn3)C2)[nH]n1	ZINC000107143155	349664870	/nfs/dbraw/zinc/66/48/70/349664870.db2.gz	IBAVMZDCBZUZSR-UONOGXRCSA-N	1	0	289.383	1.155	50	0		CDAARO
C[NH+]1CCC2(CC1)CN(c1ccncc1F)CCO2	ZINC000641648856	365690310	/nfs/dbraw/zinc/69/03/10/365690310.db2.gz	RKVQVTUCMNXBSH-UHFFFAOYSA-N	1	0	265.332	1.522	50	0		CDAARO
C[NH+](C)CCCC(C)(C)NC(=O)c1cc(F)c[nH]c1=O	ZINC000585114213	362033395	/nfs/dbraw/zinc/03/33/95/362033395.db2.gz	LBIJOUUFVZWXFG-UHFFFAOYSA-N	1	0	283.347	1.777	50	0		CDAARO
CC[NH+]1CCN(CC(=O)N[C@H](C)Cc2ccsc2)CC1	ZINC000081284347	342366148	/nfs/dbraw/zinc/36/61/48/342366148.db2.gz	FABFKQLJNYENSH-CYBMUJFWSA-N	1	0	295.452	1.433	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCN(c2ccc(F)cc2Cl)CC1	ZINC000095996423	342431778	/nfs/dbraw/zinc/43/17/78/342431778.db2.gz	XRGCCKMAPUYXBU-LBPRGKRZSA-N	1	0	299.777	1.865	50	0		CDAARO
Fc1cc(CC[NH2+]C[C@@H]2CCOC2)c2c(c1)COCO2	ZINC000095966291	282959542	/nfs/dbraw/zinc/95/95/42/282959542.db2.gz	KDWSLNHXMXQWLG-NSHDSACASA-N	1	0	281.327	1.861	50	0		CDAARO
CCc1noc(CC)c1CC(=O)N1CC[C@H](C[NH3+])C1	ZINC000178532854	362245722	/nfs/dbraw/zinc/24/57/22/362245722.db2.gz	HYSSWHKUWSZVBA-SNVBAGLBSA-N	1	0	265.357	1.149	50	0		CDAARO
COc1cc(C)c(C[NH2+][C@@H]2CCN(C)C2=O)cc1OC	ZINC000083471275	362248593	/nfs/dbraw/zinc/24/85/93/362248593.db2.gz	IQRCHXMNUZKVOI-GFCCVEGCSA-N	1	0	278.352	1.333	50	0		CDAARO
C[NH2+]Cc1cc2nc(Cl)nc(N3CCOCC3)c2s1	ZINC000113280106	343770257	/nfs/dbraw/zinc/77/02/57/343770257.db2.gz	FGYOBHBOPXDZMF-UHFFFAOYSA-N	1	0	298.799	1.901	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)Cc1ccccc1Br	ZINC000084719040	362268856	/nfs/dbraw/zinc/26/88/56/362268856.db2.gz	DNCLZWJPAOAYQB-SNVBAGLBSA-N	1	0	297.196	1.812	50	0		CDAARO
Cc1ccc2[nH]c(CN3CC[C@H]([NH3+])C3)cc(=O)c2c1	ZINC000253537074	362435609	/nfs/dbraw/zinc/43/56/09/362435609.db2.gz	WLZZFAOODZBALR-NSHDSACASA-N	1	0	257.337	1.782	50	0		CDAARO
Cc1nccn1C[C@@H]1CCC[N@H+]1CCN1CCO[C@@H](C)C1	ZINC000249213681	362475812	/nfs/dbraw/zinc/47/58/12/362475812.db2.gz	DIEPXTVZOYWYCS-HOCLYGCPSA-N	1	0	292.427	1.377	50	0		CDAARO
C[N@@H+]1CCC[C@@H](CCNC(=O)c2ccc(O)cc2F)C1	ZINC000220507804	530054800	/nfs/dbraw/zinc/05/48/00/530054800.db2.gz	UXRYYWWNAJMOQC-NSHDSACASA-N	1	0	280.343	1.993	50	0		CDAARO
OCC1([NH2+]Cc2cccc(-n3cccn3)c2)CCOCC1	ZINC000084383380	178877827	/nfs/dbraw/zinc/87/78/27/178877827.db2.gz	ATBMZMWZZUTQAH-UHFFFAOYSA-N	1	0	287.363	1.503	50	0		CDAARO
CO[C@H](C)C(=O)NCCCC[NH+]1C[C@@H](C)O[C@H](C)C1	ZINC000085455797	179068150	/nfs/dbraw/zinc/06/81/50/179068150.db2.gz	CUBSDDODTHRBQN-JHJVBQTASA-N	1	0	272.389	1.027	50	0		CDAARO
CNC(=O)NC(=O)C[N@@H+]1CCC[C@@H]2CCC[C@H](C)[C@@H]21	ZINC000106516583	362724695	/nfs/dbraw/zinc/72/46/95/362724695.db2.gz	ZRFFHGCZOLJLGX-GVXVVHGQSA-N	1	0	267.373	1.343	50	0		CDAARO
O=C1NCC2(CC[NH+](C3Cc4ccccc4C3)CC2)O1	ZINC000584885457	349343189	/nfs/dbraw/zinc/34/31/89/349343189.db2.gz	OHLXETVMLANENH-UHFFFAOYSA-N	1	0	272.348	1.728	50	0		CDAARO
CC(C)[C@@H](O)C(=O)N(C)CC[N@H+](C)C1CCCC1	ZINC000584889133	349348062	/nfs/dbraw/zinc/34/80/62/349348062.db2.gz	SRPARWBTVABWST-CYBMUJFWSA-N	1	0	256.390	1.336	50	0		CDAARO
C[NH+](C)CC1(O)CCN(C(=O)[C@@H]2CC23CCC3)CC1	ZINC000584892953	349352776	/nfs/dbraw/zinc/35/27/76/349352776.db2.gz	FLJDJBDKQBMVKG-LBPRGKRZSA-N	1	0	266.385	1.092	50	0		CDAARO
C[N@@H+]1CCCN(CC(=O)NCCCC[C@@H]2CCCO2)CC1	ZINC000584899840	349361704	/nfs/dbraw/zinc/36/17/04/349361704.db2.gz	OBOXFFVECNZRTD-OAHLLOKOSA-N	1	0	297.443	1.089	50	0		CDAARO
Cc1ccc([C@H]2CN(CC(=O)N3CCCCC3)C[C@@H]2[NH3+])o1	ZINC000091440006	180156608	/nfs/dbraw/zinc/15/66/08/180156608.db2.gz	JCXBAWSLCLSYDQ-KBPBESRZSA-N	1	0	291.395	1.327	50	0		CDAARO
O=C(CC[NH+]1CCC2(CC1)OCCC[C@@H]2O)N1CCCC1	ZINC000091487047	180167723	/nfs/dbraw/zinc/16/77/23/180167723.db2.gz	AOQREXMEEASPAW-AWEZNQCLSA-N	1	0	296.411	1.005	50	0		CDAARO
C[N@@H+]1C[C@H]2CC[C@@H]1CN(C(=O)c1ccc3nccnc3c1)C2	ZINC000091410401	180148245	/nfs/dbraw/zinc/14/82/45/180148245.db2.gz	PGPMBVUCSQBKNM-TZMCWYRMSA-N	1	0	296.374	1.796	50	0		CDAARO
CCNc1ncc(C[N@@H+]2CCC[C@@](CC)(CO)C2)cn1	ZINC000091412204	180149117	/nfs/dbraw/zinc/14/91/17/180149117.db2.gz	KALOIUUUJUMZKS-OAHLLOKOSA-N	1	0	278.400	1.893	50	0		CDAARO
Cc1nnc(C[N@H+]2CC[C@@]3(C2)CCCN(C)C3=O)s1	ZINC000091416971	180149376	/nfs/dbraw/zinc/14/93/76/180149376.db2.gz	KXRQBMSDQISHQO-CYBMUJFWSA-N	1	0	280.397	1.291	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@@H](Cn2cc(-c3nccn3C)nn2)C1	ZINC000091563462	180192908	/nfs/dbraw/zinc/19/29/08/180192908.db2.gz	LXKKWUBHOZAMGC-CYBMUJFWSA-N	1	0	288.399	1.657	50	0		CDAARO
Cc1ncc(C(=O)N2C[C@H]([NH3+])[C@@H](C(C)C)C2)s1	ZINC000091505400	180175954	/nfs/dbraw/zinc/17/59/54/180175954.db2.gz	RKWMCAAQJWTNBW-ZJUUUORDSA-N	1	0	253.371	1.507	50	0		CDAARO
Cc1ncnc(NCC[N@@H+]2CCC[C@@H](CO)C2)c1C	ZINC000091657061	180217592	/nfs/dbraw/zinc/21/75/92/180217592.db2.gz	LKKXTIFACNRFFM-CYBMUJFWSA-N	1	0	264.373	1.210	50	0		CDAARO
CN(C)c1ccc(CC(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)cc1	ZINC000091690928	180227238	/nfs/dbraw/zinc/22/72/38/180227238.db2.gz	AAYBTBATRZIFFH-CVEARBPZSA-N	1	0	287.407	1.491	50	0		CDAARO
COc1cccc(OCC(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)c1	ZINC000091695144	180228608	/nfs/dbraw/zinc/22/86/08/180228608.db2.gz	LOZJIPFBBFQUQQ-CABCVRRESA-N	1	0	290.363	1.270	50	0		CDAARO
CO[C@@H]1CC[N@H+](Cc2cc(=O)c3cc(F)ccc3[nH]2)C1	ZINC000091820309	180263776	/nfs/dbraw/zinc/26/37/76/180263776.db2.gz	FOBNWYVEYJPPNM-GFCCVEGCSA-N	1	0	276.311	1.888	50	0		CDAARO
CCCc1nnc(N2C[C@H]([NH3+])[C@@H](C(C)C)C2)s1	ZINC000091943167	180290179	/nfs/dbraw/zinc/29/01/79/180290179.db2.gz	ZEXJBQOIPVMJPT-ZJUUUORDSA-N	1	0	254.403	1.910	50	0		CDAARO
O=C(c1ccsc1)N1C[C@H](CO)[C@H](C[NH+]2CCCC2)C1	ZINC000091906564	180283975	/nfs/dbraw/zinc/28/39/75/180283975.db2.gz	IVXMMNXAJAQKCC-ZIAGYGMSSA-N	1	0	294.420	1.524	50	0		CDAARO
C[NH+]1CCC(OCCCNc2ccncn2)CC1	ZINC000092004008	180304874	/nfs/dbraw/zinc/30/48/74/180304874.db2.gz	VFFQMKVZBKZBBS-UHFFFAOYSA-N	1	0	250.346	1.389	50	0		CDAARO
COCC[N@@H+]1C[C@H](NC(=O)c2cccs2)[C@@H](C2CC2)C1	ZINC000092028971	180309060	/nfs/dbraw/zinc/30/90/60/180309060.db2.gz	CQILHCDWTVIIDU-OLZOCXBDSA-N	1	0	294.420	1.835	50	0		CDAARO
CCCCNC(=O)[C@@H]1CC[C@H](C)[N@H+](Cc2cnc[nH]2)C1	ZINC000092400530	180377199	/nfs/dbraw/zinc/37/71/99/180377199.db2.gz	UIFUJGYWAHLGKQ-QWHCGFSZSA-N	1	0	278.400	1.927	50	0		CDAARO
CC[C@H]1CN(Cc2cc(C)no2)CC[N@@H+]1C[C@H](C)O	ZINC000106841075	186139589	/nfs/dbraw/zinc/13/95/89/186139589.db2.gz	ZVFBVLKKHKUFJP-STQMWFEESA-N	1	0	267.373	1.260	50	0		CDAARO
C[C@@H](Cn1cccn1)[NH2+][C@H]1CCN(CC(F)(F)F)C1=O	ZINC000111229652	186371378	/nfs/dbraw/zinc/37/13/78/186371378.db2.gz	CLAOWZILUPQXHT-UWVGGRQHSA-N	1	0	290.289	1.024	50	0		CDAARO
C[C@@H]([NH3+])[C@H]1CN(C(=O)c2ccc(F)cc2F)CCO1	ZINC000122853347	187055929	/nfs/dbraw/zinc/05/59/29/187055929.db2.gz	AESPSNCJCAWSAN-PRHODGIISA-N	1	0	270.279	1.153	50	0		CDAARO
C[C@H](O)CSc1nnc(CC[NH3+])n1-c1ccccc1F	ZINC000426369126	358477786	/nfs/dbraw/zinc/47/77/86/358477786.db2.gz	FXPPDJYGKVRVJV-VIFPVBQESA-N	1	0	296.371	1.381	50	0		CDAARO
C[C@@H](O)CN1CCN(Cc2cnc(Cl)s2)C[C@H]1C	ZINC000175431252	366096174	/nfs/dbraw/zinc/09/61/74/366096174.db2.gz	FHYBMTWJVZDPCN-NXEZZACHSA-N	1	0	289.832	1.683	50	0		CDAARO
O=c1sc2ccccc2n1C[C@H](O)C[n+]1ccccc1	ZINC000000405484	355909796	/nfs/dbraw/zinc/90/97/96/355909796.db2.gz	TXQNSZFBHHFFDY-GFCCVEGCSA-N	1	0	287.364	1.412	50	0		CDAARO
O=C(COc1ccccc1)O[C@H]1C[NH+]2CCC1CC2	ZINC000000108880	355886955	/nfs/dbraw/zinc/88/69/55/355886955.db2.gz	MEMGOYZHMQABFZ-AWEZNQCLSA-N	1	0	261.321	1.703	50	0		CDAARO
C[C@H](Cn1cccn1)[NH2+]CCCc1nnc2ccccn21	ZINC000584901541	355956600	/nfs/dbraw/zinc/95/66/00/355956600.db2.gz	SVUOUBXSTNOKMR-CYBMUJFWSA-N	1	0	284.367	1.537	50	0		CDAARO
Cn1nnnc1SCC[NH2+]Cc1ccsc1	ZINC000002219869	355964399	/nfs/dbraw/zinc/96/43/99/355964399.db2.gz	ZWYYDJFGRURIQX-UHFFFAOYSA-N	1	0	255.372	1.154	50	0		CDAARO
COc1cc(C[N@@H+]2CCC[C@H](O)C2)cc(OC)c1OC	ZINC000002490716	355971672	/nfs/dbraw/zinc/97/16/72/355971672.db2.gz	GGXNBMCMKMAKCH-LBPRGKRZSA-N	1	0	281.352	1.669	50	0		CDAARO
CC1(C)OC(=O)C(C[C@H]([NH3+])c2ccccc2)C(=O)O1	ZINC000255187870	356007883	/nfs/dbraw/zinc/00/78/83/356007883.db2.gz	HHALSYMJKXLKBU-NSHDSACASA-N	1	0	263.293	1.529	50	0		CDAARO
COC[C@H](C)C(=O)N[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C	ZINC000097378827	356106333	/nfs/dbraw/zinc/10/63/33/356106333.db2.gz	BKLKMICMVIKKGQ-YCPHGPKFSA-N	1	0	290.407	1.906	50	0		CDAARO
O=C(C[NH2+][C@@H]1CCCSC1)NCCc1ccccc1	ZINC000097371056	356089146	/nfs/dbraw/zinc/08/91/46/356089146.db2.gz	ZBWQHKUKVZQWGV-CQSZACIVSA-N	1	0	278.421	1.831	50	0		CDAARO
Cc1ccsc1C(=O)[C@H]1CCC[N@H+](CCO)C1	ZINC000012587892	356310135	/nfs/dbraw/zinc/31/01/35/356310135.db2.gz	RNZNFAQDQMEXNK-NSHDSACASA-N	1	0	253.367	1.944	50	0		CDAARO
CNC(=S)N1CCCC[C@H]1CC[NH+]1CCCC1	ZINC000013690954	356353948	/nfs/dbraw/zinc/35/39/48/356353948.db2.gz	GFNCVGPEPMUBNF-LBPRGKRZSA-N	1	0	255.431	1.831	50	0		CDAARO
C[C@@H]1C[C@@H](C)C[NH+](CC(=O)NCc2ccco2)C1	ZINC000014194569	356379436	/nfs/dbraw/zinc/37/94/36/356379436.db2.gz	FNBHEMCKPFVINB-VXGBXAGGSA-N	1	0	250.342	1.874	50	0		CDAARO
CSc1ccccc1C(=O)NC[C@@H](C)N1CCOCC1	ZINC000032817373	356380022	/nfs/dbraw/zinc/38/00/22/356380022.db2.gz	KHZXHNDUUDKVAC-GFCCVEGCSA-N	1	0	294.420	1.859	50	0		CDAARO
Cc1cccc(C(=O)N2CCN(C[C@@H](C)O)C[C@H]2C)c1F	ZINC000194030082	358503710	/nfs/dbraw/zinc/50/37/10/358503710.db2.gz	WOQWVHNICMRCRU-CHWSQXEVSA-N	1	0	294.370	1.661	50	0		CDAARO
O=C(Cc1ccc(F)cc1)NCC[NH+]1CCCCC1	ZINC000016604334	356442939	/nfs/dbraw/zinc/44/29/39/356442939.db2.gz	LUVPGBWNYRFKSK-UHFFFAOYSA-N	1	0	264.344	1.970	50	0		CDAARO
C[NH+]1CCN(Cc2c[nH]nc2-c2ccc(F)cc2)CC1	ZINC000019722630	356497097	/nfs/dbraw/zinc/49/70/97/356497097.db2.gz	RSDVXIAABWUOSJ-UHFFFAOYSA-N	1	0	274.343	1.963	50	0		CDAARO
O=C1[C@@H]2CC=C(Cl)C[C@H]2C(=O)N1CC[NH+]1CCCCC1	ZINC000019810523	356506801	/nfs/dbraw/zinc/50/68/01/356506801.db2.gz	SHZOHIJTDOCLRY-CHWSQXEVSA-N	1	0	296.798	1.990	50	0		CDAARO
Cc1ccnn1CCC[NH+]1CCN(c2ccccn2)CC1	ZINC000023478454	356644067	/nfs/dbraw/zinc/64/40/67/356644067.db2.gz	MDYSYYFTVONZGC-UHFFFAOYSA-N	1	0	285.395	1.799	50	0		CDAARO
CC(C)NC(=O)NC(=O)C[N@H+](C)[C@H](C)C(C)(C)C	ZINC000027133696	356704129	/nfs/dbraw/zinc/70/41/29/356704129.db2.gz	AVZCVFWHUXCWBR-SNVBAGLBSA-N	1	0	257.378	1.587	50	0		CDAARO
CC(C)c1cc(N[C@H]2CCC[C@H]2C(N)=O)nc(N)[nH+]1	ZINC000095374834	356705131	/nfs/dbraw/zinc/70/51/31/356705131.db2.gz	SRLXBYAZJSWNHK-BDAKNGLRSA-N	1	0	263.345	1.248	50	0		CDAARO
COc1ccc(C[C@@H](C)[NH2+][C@H]2CCCCNC2=O)cc1	ZINC000004022532	356735519	/nfs/dbraw/zinc/73/55/19/356735519.db2.gz	WWPLVGJTGXDBAY-DOMZBBRYSA-N	1	0	276.380	1.885	50	0		CDAARO
CCOC(=O)[C@@H]1CCCCN1C1CC[NH+](C)CC1	ZINC000000291709	356813940	/nfs/dbraw/zinc/81/39/40/356813940.db2.gz	OCOMZDWEJWQZBX-ZDUSSCGKSA-N	1	0	254.374	1.498	50	0		CDAARO
O=C(Nc1ccc(Br)cn1)[C@H]1CCC[NH2+]C1	ZINC000034939008	356824526	/nfs/dbraw/zinc/82/45/26/356824526.db2.gz	LURZDHQDKHLCGG-QMMMGPOBSA-N	1	0	284.157	1.782	50	0		CDAARO
CC1CCN(c2cc(N3CC[NH2+]CC3)ncn2)CC1	ZINC000038478083	356962091	/nfs/dbraw/zinc/96/20/91/356962091.db2.gz	XHWUYFZOALIEHI-UHFFFAOYSA-N	1	0	261.373	1.123	50	0		CDAARO
CC[NH+]1CCC(CCNC(=O)NC2(CO)CCCC2)CC1	ZINC000095416213	357298461	/nfs/dbraw/zinc/29/84/61/357298461.db2.gz	RNWWWVWHFJFUPE-UHFFFAOYSA-N	1	0	297.443	1.713	50	0		CDAARO
COc1ccc(CNCCC[NH+](C)C)c(OC)c1	ZINC000054979088	357327604	/nfs/dbraw/zinc/32/76/04/357327604.db2.gz	QFECSZWXESTQTG-UHFFFAOYSA-N	1	0	252.358	1.745	50	0		CDAARO
[NH3+][C@@H](C(=O)N1CCC(n2cncn2)CC1)c1ccccc1	ZINC000095426477	357355898	/nfs/dbraw/zinc/35/58/98/357355898.db2.gz	MKXCNXNDHINPMI-CQSZACIVSA-N	1	0	285.351	1.142	50	0		CDAARO
O=S(=O)([N-][C@H]1CCC[NH2+]C1)c1c(F)cc(F)cc1F	ZINC000037908915	357508198	/nfs/dbraw/zinc/50/81/98/357508198.db2.gz	JISQAOSCYBREHC-QMMMGPOBSA-N	1	0	294.298	1.134	50	0		CDAARO
CC(C)[N@H+](CCC(N)=O)Cc1ccc2c(c1)OCCO2	ZINC000065384538	357534719	/nfs/dbraw/zinc/53/47/19/357534719.db2.gz	UPEYSEPQDMZAHB-UHFFFAOYSA-N	1	0	278.352	1.544	50	0		CDAARO
Cc1c(C[N@H+](C)Cc2ccc(-n3cncn3)cc2)cnn1C	ZINC000065393753	357536045	/nfs/dbraw/zinc/53/60/45/357536045.db2.gz	AELUNFRNIYNVEY-UHFFFAOYSA-N	1	0	296.378	1.941	50	0		CDAARO
COC[C@H](C)[NH2+]CCC(=O)Nc1cc(F)ccc1F	ZINC000065399072	357538172	/nfs/dbraw/zinc/53/81/72/357538172.db2.gz	NLQADYVWJDMVGP-VIFPVBQESA-N	1	0	272.295	1.918	50	0		CDAARO
CCOCC[N@@H+]1CCC=C([C@@H](C)N(C)C(C)=O)C1	ZINC000065460096	357542116	/nfs/dbraw/zinc/54/21/16/357542116.db2.gz	HZEWZJSMXZJECA-GFCCVEGCSA-N	1	0	254.374	1.522	50	0		CDAARO
C[C@H](CCc1ccccc1)[NH2+]CCSc1nnnn1C	ZINC000065528383	357548357	/nfs/dbraw/zinc/54/83/57/357548357.db2.gz	RBOFTIHGTFBXMA-GFCCVEGCSA-N	1	0	291.424	1.913	50	0		CDAARO
c1cc(CN2CC[NH+]([C@@H]3CCSC3)CC2)no1	ZINC000098019315	538880029	/nfs/dbraw/zinc/88/00/29/538880029.db2.gz	CEZPGQOQQOKBFH-GFCCVEGCSA-N	1	0	253.371	1.298	50	0		CDAARO
COc1cccc(OCC(=O)NCC2CC[NH+](C)CC2)c1	ZINC000023013837	357646887	/nfs/dbraw/zinc/64/68/87/357646887.db2.gz	UEULGCQNWXZOBZ-UHFFFAOYSA-N	1	0	292.379	1.532	50	0		CDAARO
CN1C[C@@]2(CC[N@H+](Cc3cccc4nonc43)C2)OC1=O	ZINC000072478720	357838162	/nfs/dbraw/zinc/83/81/62/357838162.db2.gz	JFFKWNZBPFVCDL-CQSZACIVSA-N	1	0	288.307	1.249	50	0		CDAARO
Cc1nnc(CN2CCN(c3cccc(C)n3)CC2)[nH]1	ZINC000097163413	358004872	/nfs/dbraw/zinc/00/48/72/358004872.db2.gz	MCPWHUVVRIGTIQ-UHFFFAOYSA-N	1	0	272.356	1.139	50	0		CDAARO
COCCNC(=O)CC[NH2+]C1C[C@@H](C)C[C@H](C)C1	ZINC000097229301	358043252	/nfs/dbraw/zinc/04/32/52/358043252.db2.gz	LMTILIARBQGAJC-RYUDHWBXSA-N	1	0	256.390	1.553	50	0		CDAARO
[NH3+]C[C@@H](NS(=O)(=O)c1cc(F)c(F)c(F)c1)C1CC1	ZINC000097229417	358043364	/nfs/dbraw/zinc/04/33/64/358043364.db2.gz	XDWMYODVYFDGIG-SNVBAGLBSA-N	1	0	294.298	1.120	50	0		CDAARO
C[C@@H]1Cc2cc(S(=O)(=O)N[C@@H](C[NH3+])C3CC3)ccc2O1	ZINC000097229368	358043637	/nfs/dbraw/zinc/04/36/37/358043637.db2.gz	RIVZJDXJLOHCKN-RNCFNFMXSA-N	1	0	296.392	1.026	50	0		CDAARO
CCc1ccc(C[NH2+]C[C@H]2COC3(CCOCC3)O2)o1	ZINC000097231493	358048948	/nfs/dbraw/zinc/04/89/48/358048948.db2.gz	FWHUXSPBXDXEEK-AWEZNQCLSA-N	1	0	281.352	1.854	50	0		CDAARO
Cc1cc(S(=O)(=O)N(C)CC[C@H]([NH3+])C(C)C)c(C)o1	ZINC000097234925	358050534	/nfs/dbraw/zinc/05/05/34/358050534.db2.gz	ZTHLXSHMGRHWFJ-LBPRGKRZSA-N	1	0	288.413	1.890	50	0		CDAARO
Cn1cc(C[NH2+]Cc2cccc(N3CCCC3=O)c2)cn1	ZINC000097159099	358186923	/nfs/dbraw/zinc/18/69/23/358186923.db2.gz	MELMGWSVBQLKSU-UHFFFAOYSA-N	1	0	284.363	1.837	50	0		CDAARO
CCc1ccccc1S(=O)(=O)N[C@@H]1CCC[NH2+][C@H]1C	ZINC000193451010	358295067	/nfs/dbraw/zinc/29/50/67/358295067.db2.gz	AXVRYIMJJRHDGW-WCQYABFASA-N	1	0	282.409	1.668	50	0		CDAARO
CCNC(=O)C[NH2+]C[C@@H](c1cccc(OC)c1)N(C)C	ZINC000020070537	358321187	/nfs/dbraw/zinc/32/11/87/358321187.db2.gz	FVMPYCJJOZNSKZ-AWEZNQCLSA-N	1	0	279.384	1.024	50	0		CDAARO
CC1(C)SC(=O)N(CC[NH+]2CCCCC2)C1=O	ZINC000194404029	358519049	/nfs/dbraw/zinc/51/90/49/358519049.db2.gz	FKSOMVHWXNMYRA-UHFFFAOYSA-N	1	0	256.371	1.946	50	0		CDAARO
CCS(=O)(=O)N1CC(C[NH2+]C[C@H](C)c2ccccc2)C1	ZINC000194826688	358542522	/nfs/dbraw/zinc/54/25/22/358542522.db2.gz	OVHWUIVMLUEAOJ-ZDUSSCGKSA-N	1	0	296.436	1.661	50	0		CDAARO
Cc1ccc(N2CC[C@H]([N@@H+]3CC[C@@H](CCO)C3)C2=O)cc1	ZINC000195530842	358559020	/nfs/dbraw/zinc/55/90/20/358559020.db2.gz	HIDISNYLAILDFY-HOCLYGCPSA-N	1	0	288.391	1.805	50	0		CDAARO
CCn1cnnc1[C@H](C)NC(=O)CC1CC[NH+](CC)CC1	ZINC000095377915	358689265	/nfs/dbraw/zinc/68/92/65/358689265.db2.gz	YRFFDOHCJWSMPP-LBPRGKRZSA-N	1	0	293.415	1.597	50	0		CDAARO
CS[C@@H](CO)[C@H](C)NC(=O)C1CC[NH+](C(C)C)CC1	ZINC000095445643	358693933	/nfs/dbraw/zinc/69/39/33/358693933.db2.gz	FMWWRLULHVWRFJ-AAEUAGOBSA-N	1	0	288.457	1.335	50	0		CDAARO
C(Cc1nc([C@@H]2CCOC2)no1)C[NH+]1CCCC1	ZINC000096138063	358709530	/nfs/dbraw/zinc/70/95/30/358709530.db2.gz	GAJSZKZAFXJKGX-LLVKDONJSA-N	1	0	251.330	1.602	50	0		CDAARO
[NH3+]C[C@H]1CC[C@@H](C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2F)O1	ZINC000261998288	358726628	/nfs/dbraw/zinc/72/66/28/358726628.db2.gz	NGWPQOOVUIEPJD-PSJXJDHFSA-N	1	0	296.317	1.443	50	0		CDAARO
c1ccc2[nH]c(CN3C[C@H]4CC[C@@H](C3)[NH2+]C4)nc2c1	ZINC000097637928	358789677	/nfs/dbraw/zinc/78/96/77/358789677.db2.gz	XRENVSGRFMWSOU-RYUDHWBXSA-N	1	0	256.353	1.747	50	0		CDAARO
Cn1cncc1CN1CC[NH+](C2Cc3ccccc3C2)CC1	ZINC000214969708	358866333	/nfs/dbraw/zinc/86/63/33/358866333.db2.gz	SJVZNDNQQWLGFN-UHFFFAOYSA-N	1	0	296.418	1.705	50	0		CDAARO
CC[C@@H]1C[N@@H+]([C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)CCN1C[C@@H](C)O	ZINC000095457100	358870536	/nfs/dbraw/zinc/87/05/36/358870536.db2.gz	SBPKRZCDZFOEHU-LJIZCISZSA-N	1	0	296.455	1.577	50	0		CDAARO
Cc1cc(C)n(CCC[N@@H+](C)C[C@@H]2CCOC2)n1	ZINC000216001034	358916261	/nfs/dbraw/zinc/91/62/61/358916261.db2.gz	PXCYVNWVLWLFJF-AWEZNQCLSA-N	1	0	251.374	1.858	50	0		CDAARO
CC1=CC[N@H+](Cc2cccc(OCC(N)=O)c2)CC1	ZINC000216023055	358918166	/nfs/dbraw/zinc/91/81/66/358918166.db2.gz	UWXSLZFMPDPFHJ-UHFFFAOYSA-N	1	0	260.337	1.703	50	0		CDAARO
CNC(=O)C[C@@H](C)[N@H+](C)Cc1cncn1C(C)C	ZINC000216036878	358919379	/nfs/dbraw/zinc/91/93/79/358919379.db2.gz	JZLWRDDAELTXEK-LLVKDONJSA-N	1	0	252.362	1.420	50	0		CDAARO
CCn1ncnc1CN1CCC[C@@H](C[NH+]2CCCCC2)C1	ZINC000216199640	358930862	/nfs/dbraw/zinc/93/08/62/358930862.db2.gz	LZZNIWXQRWOCNR-HNNXBMFYSA-N	1	0	291.443	1.996	50	0		CDAARO
O=C(C[C@H]1CC[NH2+]C1)N1CCC(c2ncc[nH]2)CC1	ZINC000216269547	358934471	/nfs/dbraw/zinc/93/44/71/358934471.db2.gz	QXIFOOVJEWRTNK-LLVKDONJSA-N	1	0	262.357	1.115	50	0		CDAARO
COCC[N@@H+]1CCC[C@H](C(=O)Nc2ccccc2)C1	ZINC000012328140	358999059	/nfs/dbraw/zinc/99/90/59/358999059.db2.gz	FFETVKZOZKCNOY-ZDUSSCGKSA-N	1	0	262.353	1.984	50	0		CDAARO
CCC[C@@H](NC(=O)CC[NH+]1CCCC1)c1nccn1C	ZINC000218987781	359073764	/nfs/dbraw/zinc/07/37/64/359073764.db2.gz	GCGMWJYCOYOTON-CYBMUJFWSA-N	1	0	278.400	1.863	50	0		CDAARO
C[N@@H+]1CCC[C@@H](C(=O)NCCc2nc3ccccc3o2)C1	ZINC000218983252	359073943	/nfs/dbraw/zinc/07/39/43/359073943.db2.gz	HOCSMNBTEJCDJK-GFCCVEGCSA-N	1	0	287.363	1.828	50	0		CDAARO
COCC1(CNc2cc(C3CC([NH3+])C3)nc(N)n2)CC1	ZINC000222936956	359385114	/nfs/dbraw/zinc/38/51/14/359385114.db2.gz	XWBRKRKWKVMLDH-UHFFFAOYSA-N	1	0	277.372	1.102	50	0		CDAARO
CC[C@@H](NC(=O)CC[NH+]1CCCC1)c1nc(C)no1	ZINC000223154892	359404334	/nfs/dbraw/zinc/40/43/34/359404334.db2.gz	NCOVITFRTUOIHA-LLVKDONJSA-N	1	0	266.345	1.431	50	0		CDAARO
OCC[N@H+](CCCc1nnc(C(F)(F)F)o1)C1CCC1	ZINC000408525517	359935396	/nfs/dbraw/zinc/93/53/96/359935396.db2.gz	PTNBPQRHOQQQMZ-UHFFFAOYSA-N	1	0	293.289	1.868	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2n[nH]c3ccc(C)cc32)C1	ZINC000408525451	359935583	/nfs/dbraw/zinc/93/55/83/359935583.db2.gz	JJTAQOADZMHZDG-NSHDSACASA-N	1	0	272.352	1.553	50	0		CDAARO
COc1c([C@@H]2CCCN2[C@H]2CCOC2=O)c(C)nn1C	ZINC000257365311	359944087	/nfs/dbraw/zinc/94/40/87/359944087.db2.gz	IMTZCDWODAKUEZ-QWRGUYRKSA-N	1	0	279.340	1.190	50	0		CDAARO
CC(C)C(=O)N1CCC2(C[N@@H+](C3CCC3)C[C@@H]2CO)CC1	ZINC000409419605	360227337	/nfs/dbraw/zinc/22/73/37/360227337.db2.gz	ATOWWMAYAXDDKU-CQSZACIVSA-N	1	0	294.439	1.728	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@@H]1CCCN(C(=O)c2cnccn2)C1	ZINC000409421091	360230499	/nfs/dbraw/zinc/23/04/99/360230499.db2.gz	GUPBRWUKUZIAHG-CYBMUJFWSA-N	1	0	285.351	1.767	50	0		CDAARO
O=C(Cc1ccccc1)N1C[C@H](CO)C2(C1)CC[NH2+]CC2	ZINC000409421518	360231806	/nfs/dbraw/zinc/23/18/06/360231806.db2.gz	GWPIWXWSPMGGCW-OAHLLOKOSA-N	1	0	288.391	1.050	50	0		CDAARO
Cc1nc(CNC(=O)CC[C@H](C)[NH+]2CCCC2)n(C)c1C	ZINC000426419987	360668512	/nfs/dbraw/zinc/66/85/12/360668512.db2.gz	DDWQMNLRDLMFJN-LBPRGKRZSA-N	1	0	292.427	1.918	50	0		CDAARO
Cc1ccc(C)c(OCCC(=O)N2CC[C@H](C[NH3+])C2)c1	ZINC000178546362	189125965	/nfs/dbraw/zinc/12/59/65/189125965.db2.gz	XWLOUNUQTHGTNW-CQSZACIVSA-N	1	0	276.380	1.880	50	0		CDAARO
Cc1ncc(/C=C/C(=O)N2CC[C@@H](C[NH3+])C2)s1	ZINC000178531790	189124981	/nfs/dbraw/zinc/12/49/81/189124981.db2.gz	CMPFILFBWDFXPD-PBKGFPTLSA-N	1	0	251.355	1.272	50	0		CDAARO
Cc1ccc(CC(=O)N2CCC[C@@H](C)[C@H]2C[NH3+])cn1	ZINC000429139015	360763585	/nfs/dbraw/zinc/76/35/85/360763585.db2.gz	WWWKSUIDENSBJO-BXUZGUMPSA-N	1	0	261.369	1.518	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N1CCC[C@@H]1C[NH3+]	ZINC000104309908	360804021	/nfs/dbraw/zinc/80/40/21/360804021.db2.gz	AQUXTJZTGSIESX-LLVKDONJSA-N	1	0	272.345	1.246	50	0		CDAARO
C[C@](O)(C[N@@H+]1CCC[C@H]1Cn1cncn1)c1ccccc1	ZINC000248320894	361330405	/nfs/dbraw/zinc/33/04/05/361330405.db2.gz	SXWOUWINBAGOIO-HOTGVXAUSA-N	1	0	286.379	1.650	50	0		CDAARO
CC(C)(C)[NH2+]C[C@H](O)c1cc(Br)no1	ZINC000000000098	361438624	/nfs/dbraw/zinc/43/86/24/361438624.db2.gz	JBRBWHCVRGURBA-LURJTMIESA-N	1	0	263.135	1.859	50	0	in-man	CDAARO
CNC(=O)C(C)(C)C[NH2+][C@@H](C)c1cccc(CO)c1	ZINC000183835590	189369273	/nfs/dbraw/zinc/36/92/73/189369273.db2.gz	CROQFUDJIKZMML-NSHDSACASA-N	1	0	264.369	1.602	50	0		CDAARO
CCOC[C@@H]1CCCN([C@H](C)c2nnnn2C)C1	ZINC000249299238	364514498	/nfs/dbraw/zinc/51/44/98/364514498.db2.gz	NHIGJSDBPSHGCJ-GHMZBOCLSA-N	1	0	253.350	1.020	50	0		CDAARO
NC(=O)C[C@@H]1CCC[N@H+](C[C@H](O)CC2CCCC2)C1	ZINC000252538975	367811209	/nfs/dbraw/zinc/81/12/09/367811209.db2.gz	NOVHDYAIMOKXQK-UONOGXRCSA-N	1	0	268.401	1.515	50	0		CDAARO
COc1ccccc1S(=O)(=O)N[C@H]1CCC[C@@H]1C[NH3+]	ZINC000089091800	368833260	/nfs/dbraw/zinc/83/32/60/368833260.db2.gz	LGWWXCIFHKYCNG-MNOVXSKESA-N	1	0	284.381	1.101	50	0		CDAARO
CCCn1cnnc1[C@@H](C)NC(=O)C(C)(C)[NH+]1CCCC1	ZINC000426641537	284132478	/nfs/dbraw/zinc/13/24/78/284132478.db2.gz	NABRRZZFLZEHDN-GFCCVEGCSA-N	1	0	293.415	1.740	50	0		CDAARO
CC(C)OCC[NH+]1CCC(NC(=O)c2ccsn2)CC1	ZINC000295421671	371268367	/nfs/dbraw/zinc/26/83/67/371268367.db2.gz	VZAWZLMMXHYMPW-UHFFFAOYSA-N	1	0	297.424	1.762	50	0		CDAARO
c1cc(CN2CCOCC2)cc(OC2CC[NH2+]CC2)c1	ZINC000299756327	372744955	/nfs/dbraw/zinc/74/49/55/372744955.db2.gz	GVYVOGUFXXAIRO-UHFFFAOYSA-N	1	0	276.380	1.650	50	0		CDAARO
Cc1ccc2ccccc2c1NC(=O)N[C@@H]1CC[NH2+]C[C@H]1O	ZINC000299778693	372754131	/nfs/dbraw/zinc/75/41/31/372754131.db2.gz	HFKRJABZIJCEAH-HUUCEWRRSA-N	1	0	299.374	1.993	50	0		CDAARO
[NH3+]CCCOc1ccc(F)cc1C(=O)N1CCSCC1	ZINC000299782290	372760259	/nfs/dbraw/zinc/76/02/59/372760259.db2.gz	XCNIWIWPPJFIIT-UHFFFAOYSA-N	1	0	298.383	1.742	50	0		CDAARO
Cc1n[nH]nc1C(=O)N1C[C@H]2CC[C@H](C[N@H+]2CC2CC2)C1	ZINC000299801387	372771477	/nfs/dbraw/zinc/77/14/77/372771477.db2.gz	XKYVGWPQGKNLSM-CHWSQXEVSA-N	1	0	289.383	1.060	50	0		CDAARO
CC(C)(C)OC(=O)NCc1cn([C@H]2CCC[NH2+]C2)nn1	ZINC000299805454	372772695	/nfs/dbraw/zinc/77/26/95/372772695.db2.gz	OWIKJTPGPPMAEM-NSHDSACASA-N	1	0	281.360	1.227	50	0		CDAARO
Cc1[nH]c(C=O)cc1C(=O)NC1CC[NH+](C(C)C)CC1	ZINC000253406194	373696682	/nfs/dbraw/zinc/69/66/82/373696682.db2.gz	WONKJIISQAURGG-UHFFFAOYSA-N	1	0	277.368	1.738	50	0		CDAARO
CC[C@H]1CN(c2ncnc3c2CCC3)CC[N@@H+]1C[C@H](C)O	ZINC000106906112	373790071	/nfs/dbraw/zinc/79/00/71/373790071.db2.gz	IJOGUOUJZAOXKI-STQMWFEESA-N	1	0	290.411	1.247	50	0		CDAARO
Cc1cnn(C[C@@H]2CCCN2[C@H]2C[C@H](C)OC2=O)c1	ZINC000253603485	373938279	/nfs/dbraw/zinc/93/82/79/373938279.db2.gz	GFCRDEIAHUNAFV-AVGNSLFASA-N	1	0	263.341	1.360	50	0		CDAARO
O=C(N[C@@H]1CCC[NH2+]C1)c1ccc(F)c(F)c1F	ZINC000084609360	374061902	/nfs/dbraw/zinc/06/19/02/374061902.db2.gz	VGWKDULMXGMTPO-SSDOTTSWSA-N	1	0	258.243	1.586	50	0		CDAARO
Cc1n[nH]c(C)c1C[N@@H+]1CCCC[C@@H]1CN1CCOCC1	ZINC000130987174	374354783	/nfs/dbraw/zinc/35/47/83/374354783.db2.gz	HUEXYBZDXMJZEI-OAHLLOKOSA-N	1	0	292.427	1.713	50	0		CDAARO
CC(C)n1cc([C@H]2C[N@@H+]3CC[C@H]2C[C@@H]3CO)nn1	ZINC000070633536	374667912	/nfs/dbraw/zinc/66/79/12/374667912.db2.gz	IQADILDQHFSVCQ-TUAOUCFPSA-N	1	0	250.346	1.029	50	0	biogenic	CDAARO
CN1CCC([NH2+]C[C@@H](O)c2c(F)cccc2F)CC1	ZINC000037887407	374827445	/nfs/dbraw/zinc/82/74/45/374827445.db2.gz	MCGQRHQXJLVOIP-CYBMUJFWSA-N	1	0	270.323	1.682	50	0		CDAARO
CC[C@@H](O)CN1C(=O)CC[C@@H]1CC[NH2+]Cc1ccccc1	ZINC000299768948	375211371	/nfs/dbraw/zinc/21/13/71/375211371.db2.gz	HBXPXHXRUPXXLV-HZPDHXFCSA-N	1	0	290.407	1.928	50	0		CDAARO
C[C@@H]1C[C@H]([NH2+]Cc2nncn2-c2ccccc2)[C@H](C)O1	ZINC000296284607	375367494	/nfs/dbraw/zinc/36/74/94/375367494.db2.gz	FKHXGCFFTVXXMQ-DYEKYZERSA-N	1	0	272.352	1.923	50	0		CDAARO
O=C(Nc1cccc(C[NH+]2CCCC2)c1)[C@@H]1COCCO1	ZINC000031237684	375763842	/nfs/dbraw/zinc/76/38/42/375763842.db2.gz	BNWNCUKFFATSDS-HNNXBMFYSA-N	1	0	290.363	1.636	50	0		CDAARO
C[C@H](NCCC[NH+]1CCCC1)C(=O)NC1CCCC1	ZINC000058552779	375786823	/nfs/dbraw/zinc/78/68/23/375786823.db2.gz	PHXVKWMIDYPWTF-ZDUSSCGKSA-N	1	0	267.417	1.509	50	0		CDAARO
O=C(NC[C@@]1(O)CCCC[NH2+]C1)OCc1ccccc1	ZINC000261508384	190040315	/nfs/dbraw/zinc/04/03/15/190040315.db2.gz	RVYVRFJILMLBKA-OAHLLOKOSA-N	1	0	278.352	1.417	50	0		CDAARO
Cc1ncc(C[N@@H+]2CC[C@@H](CC(N)=O)C2)n1-c1ccccc1	ZINC000377852745	377106329	/nfs/dbraw/zinc/10/63/29/377106329.db2.gz	TVOJYHPGTKXBEL-AWEZNQCLSA-N	1	0	298.390	1.878	50	0		CDAARO
COCCN(Cc1cccs1)C(=O)C[C@H]1CC[NH2+]C1	ZINC000089744179	256862461	/nfs/dbraw/zinc/86/24/61/256862461.db2.gz	NNAIQQVSZFCJHA-GFCCVEGCSA-N	1	0	282.409	1.723	50	0		CDAARO
CCOC(=O)[C@H]1[C@@H]([NH+]2CCCC2)C(C)(C)[C@H]1C(=O)OCC	ZINC000005796525	390165216	/nfs/dbraw/zinc/16/52/16/390165216.db2.gz	RJAIFMNTFDYYIO-JHJVBQTASA-N	1	0	297.395	1.849	50	0		CDAARO
CC[N@@H+]1CC[C@H](N(C)S(=O)(=O)c2cccnc2)[C@H](C)C1	ZINC000096428229	390518474	/nfs/dbraw/zinc/51/84/74/390518474.db2.gz	GVTGNSHPRCJXKX-OCCSQVGLSA-N	1	0	297.424	1.432	50	0		CDAARO
Cc1cc(N2CC[C@@H](OCC[NH+]3CCCCC3)C2)ncn1	ZINC000096484310	390526911	/nfs/dbraw/zinc/52/69/11/390526911.db2.gz	MMDWLKXDLLYOKX-OAHLLOKOSA-N	1	0	290.411	1.866	50	0		CDAARO
Cn1nc(-c2nc(-c3cccc(F)c3)no2)c2c1CC[NH2+]C2	ZINC000070463095	390606483	/nfs/dbraw/zinc/60/64/83/390606483.db2.gz	ASHQTMDKHSFECF-UHFFFAOYSA-N	1	0	299.309	1.922	50	0		CDAARO
COc1cc(C[N@H+]2[C@H](C)C[C@@H](O)C[C@@H]2C)sn1	ZINC000521396513	391668449	/nfs/dbraw/zinc/66/84/49/391668449.db2.gz	ODRAUKOXYGCVIC-ILWJIGKKSA-N	1	0	256.371	1.885	50	0		CDAARO
O=S(=O)(c1ccc(Cl)cc1)C1CC[NH2+]CC1	ZINC000000154138	296467890	/nfs/dbraw/zinc/46/78/90/296467890.db2.gz	KZMZUOWQIRVCRK-UHFFFAOYSA-N	1	0	259.758	1.866	50	0		CDAARO
CC(C)=CCO[C@@H]1COCC[C@H]1NC(=O)C[N@@H+](C)C(C)C	ZINC000223062611	391920007	/nfs/dbraw/zinc/92/00/07/391920007.db2.gz	JGWUQXXDAPVHGN-HUUCEWRRSA-N	1	0	298.427	1.583	50	0		CDAARO
Cc1ccn2cc(CN3CC[N@@H+]4CCC[C@@H]4C3)nc2c1	ZINC000243892548	131083361	/nfs/dbraw/zinc/08/33/61/131083361.db2.gz	AIPBCIWEHWSCNH-OAHLLOKOSA-N	1	0	270.380	1.923	50	0		CDAARO
CC[C@H]1CN(CCc2ccncc2)CC[N@@H+]1C[C@H](C)O	ZINC000107320835	392737047	/nfs/dbraw/zinc/73/70/47/392737047.db2.gz	ZXJBIFXMLOIXHL-HOCLYGCPSA-N	1	0	277.412	1.401	50	0		CDAARO
[NH3+][C@@H]1CCN(C(=O)c2ccnc(OC3CCCCC3)c2)C1	ZINC000519707559	392847642	/nfs/dbraw/zinc/84/76/42/392847642.db2.gz	RVHNHWQFUPQHLU-CYBMUJFWSA-N	1	0	289.379	1.966	50	0		CDAARO
CCC[C@H]([NH3+])C(=O)N1CCOC[C@H]1c1ccccc1	ZINC000376789928	393051416	/nfs/dbraw/zinc/05/14/16/393051416.db2.gz	PIGFLTSUJGSXSV-KBPBESRZSA-N	1	0	262.353	1.714	50	0		CDAARO
CCOC[C@@H]1CCCN(C(=O)[C@H]2CCC[C@H]2[NH3+])C1	ZINC000299740225	393199952	/nfs/dbraw/zinc/19/99/52/393199952.db2.gz	XEFOJAJPPOJYQQ-FRRDWIJNSA-N	1	0	254.374	1.389	50	0		CDAARO
COc1ccc(Cl)cc1/C=C\C(=O)N1CC[NH2+]CC1	ZINC000493794872	393441806	/nfs/dbraw/zinc/44/18/06/393441806.db2.gz	UKBJGOAMQRZJHH-DJWKRKHSSA-N	1	0	280.755	1.794	50	0		CDAARO
CC(C)([NH3+])CC(=O)N1CCN(c2ccccc2)CC1	ZINC000084162584	135031819	/nfs/dbraw/zinc/03/18/19/135031819.db2.gz	XFOUGVMLCCBUHH-UHFFFAOYSA-N	1	0	261.369	1.463	50	0		CDAARO
c1ccc(NC[C@@H]2CC[N@H+](C[C@H]3CCOC3)C2)nc1	ZINC000241795550	140262990	/nfs/dbraw/zinc/26/29/90/140262990.db2.gz	SABUSLIXTPSIGI-UONOGXRCSA-N	1	0	261.369	1.852	50	0		CDAARO
CCOCCN(CC)C(=O)[C@@H]1CCCCC[C@@H]1[NH3+]	ZINC000094753870	286078796	/nfs/dbraw/zinc/07/87/96/286078796.db2.gz	IFNCCYJLTLHBSL-OLZOCXBDSA-N	1	0	256.390	1.779	50	0		CDAARO
NC(=O)COc1ccc(C[NH2+]C2CCCCC2)cc1	ZINC000004867219	170033237	/nfs/dbraw/zinc/03/32/37/170033237.db2.gz	CYXWOFMRAKGPIP-UHFFFAOYSA-N	1	0	262.353	1.973	50	0		CDAARO
COc1ccc(C(=O)N2CCC[N@H+](C)CC2)c(OC)c1	ZINC000006698471	170227830	/nfs/dbraw/zinc/22/78/30/170227830.db2.gz	ODRZYWRPKMJSKT-UHFFFAOYSA-N	1	0	278.352	1.482	50	0		CDAARO
C[C@H]1C[C@H](C)C[NH+](CC(=O)Nc2ccccc2C(N)=O)C1	ZINC000006725558	170232710	/nfs/dbraw/zinc/23/27/10/170232710.db2.gz	UEIASVUCIDAPRA-RYUDHWBXSA-N	1	0	289.379	1.702	50	0		CDAARO
Nc1cc(N)[nH+]c(SCC(=O)N2CCCCCCC2)n1	ZINC000007692791	170297724	/nfs/dbraw/zinc/29/77/24/170297724.db2.gz	ZCPPSPZXOZEXLO-UHFFFAOYSA-N	1	0	295.412	1.526	50	0		CDAARO
CC(C)[NH2+]C[C@@]1(O)CCCN(CCc2ccccc2)C1=O	ZINC000012440090	170488294	/nfs/dbraw/zinc/48/82/94/170488294.db2.gz	CAHNEAHMOQQDCD-KRWDZBQOSA-N	1	0	290.407	1.581	50	0		CDAARO
CCOc1ccc(CNCC[NH2+]C[C@H](C)O)cc1Cl	ZINC000020177144	171043051	/nfs/dbraw/zinc/04/30/51/171043051.db2.gz	AZYOJBWVEGJPNO-NSHDSACASA-N	1	0	286.803	1.799	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CCC[C@H]([NH3+])C2)c(C)c1	ZINC000020432125	171196635	/nfs/dbraw/zinc/19/66/35/171196635.db2.gz	DFCLLRATQLCLDR-LBPRGKRZSA-N	1	0	268.382	1.415	50	0		CDAARO
C[NH+]1CCN(CCCNC(=O)c2ccc(F)cc2)CC1	ZINC000020819345	171273466	/nfs/dbraw/zinc/27/34/66/171273466.db2.gz	UGRNPCAAVUUVTF-UHFFFAOYSA-N	1	0	279.359	1.193	50	0		CDAARO
Cc1ccccc1C(=O)NCCCN1CC[NH+](C)CC1	ZINC000020819358	171273728	/nfs/dbraw/zinc/27/37/28/171273728.db2.gz	MULQCALEFVTZRZ-UHFFFAOYSA-N	1	0	275.396	1.362	50	0		CDAARO
CS[C@@H](C)CC[NH+]1CCC(Cn2cc(CO)nn2)CC1	ZINC000020864198	171276703	/nfs/dbraw/zinc/27/67/03/171276703.db2.gz	ZOQWKNFUNCRNPN-LBPRGKRZSA-N	1	0	298.456	1.624	50	0		CDAARO
CCCCC[C@@H](C)NC(=O)C[NH+]1CCC(C(N)=O)CC1	ZINC000020940989	171281640	/nfs/dbraw/zinc/28/16/40/171281640.db2.gz	DDOKBSBNEKUPMJ-GFCCVEGCSA-N	1	0	283.416	1.269	50	0		CDAARO
CCOc1cc(CN2CCC[N@H+](C)CC2)ccc1O	ZINC000022454606	171388238	/nfs/dbraw/zinc/38/82/38/171388238.db2.gz	HJCVFFADNAPFJC-UHFFFAOYSA-N	1	0	264.369	1.928	50	0		CDAARO
O=C([C@H](c1ccccc1)[NH+]1CCC(O)CC1)N1CCCC1	ZINC000026858972	171501350	/nfs/dbraw/zinc/50/13/50/171501350.db2.gz	PMEYYYLCEGVIHQ-INIZCTEOSA-N	1	0	288.391	1.807	50	0		CDAARO
Cc1cc([C@H]2CCCN2C(=O)[C@@H]2CCC[NH2+]C2)on1	ZINC000037820267	173771899	/nfs/dbraw/zinc/77/18/99/173771899.db2.gz	IKWLZMPEZQXATI-VXGBXAGGSA-N	1	0	263.341	1.646	50	0		CDAARO
[NH3+][C@H]1CCC2(C[C@H]1OCc1ccccc1)OCCO2	ZINC000037981083	173940868	/nfs/dbraw/zinc/94/08/68/173940868.db2.gz	BJBTZUJRKVTZDI-UONOGXRCSA-N	1	0	263.337	1.826	50	0		CDAARO
CC(C)[N@@H+]1CCN(Cc2ccccc2)[C@H](CCO)C1	ZINC000039478998	174168938	/nfs/dbraw/zinc/16/89/38/174168938.db2.gz	HDOCWVLLUKBVGB-MRXNPFEDSA-N	1	0	262.397	1.964	50	0		CDAARO
O=C1N(Cc2ccc(F)cc2)CCN1C1CC[NH2+]CC1	ZINC000045796141	175384060	/nfs/dbraw/zinc/38/40/60/175384060.db2.gz	NZKBYMDQMAXAIK-UHFFFAOYSA-N	1	0	277.343	1.815	50	0		CDAARO
Cc1cc(C[C@@H](C)[NH2+]CCC(=O)Nc2nccs2)[nH]n1	ZINC000065371020	175722871	/nfs/dbraw/zinc/72/28/71/175722871.db2.gz	UVWLEZKATLFCQP-SECBINFHSA-N	1	0	293.396	1.724	50	0		CDAARO
C[NH2+]CC(=O)N1CCC[C@@H]1c1nc(-c2cccnc2)no1	ZINC000071761207	176261085	/nfs/dbraw/zinc/26/10/85/176261085.db2.gz	AGUKOZCFGREYIN-LLVKDONJSA-N	1	0	287.323	1.015	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1CCN(Cc1cn(-c3ccccc3)nn1)C2	ZINC000072134403	176322304	/nfs/dbraw/zinc/32/23/04/176322304.db2.gz	MLFYKEGLHUYKTQ-DOTOQJQBSA-N	1	0	297.406	1.936	50	0		CDAARO
Cn1ncc(C[N@@H+]2CCC[C@](O)(CO)CC2)c1C1CC1	ZINC000072162743	176330683	/nfs/dbraw/zinc/33/06/83/176330683.db2.gz	SVTNMUKUXNSWLM-OAHLLOKOSA-N	1	0	279.384	1.007	50	0		CDAARO
C[C@@H]1CCC[C@@H](NC(=O)NC(=O)C[NH+]2CCCC2)[C@@H]1C	ZINC000007813454	287405065	/nfs/dbraw/zinc/40/50/65/287405065.db2.gz	PGPHIJIVTGBTSX-JHJVBQTASA-N	1	0	281.400	1.733	50	0		CDAARO
Cc1cc(N[C@@H]2CS(=O)(=O)C[C@H]2O)c2ccccc2[nH+]1	ZINC000032513806	424340937	/nfs/dbraw/zinc/34/09/37/424340937.db2.gz	LYFJVTHQFPVNNM-ZIAGYGMSSA-N	1	0	292.360	1.113	50	0		CDAARO
C[NH+](C)[C@H]1Cc2ccccc2N(C(=O)c2cnsn2)C1	ZINC000109112530	273820548	/nfs/dbraw/zinc/82/05/48/273820548.db2.gz	FNWVHRVOEANVMS-NSHDSACASA-N	1	0	288.376	1.671	50	0		CDAARO
COc1ccc(-n2cccn2)c([C@H]2[NH2+]CCc3nc[nH]c32)c1	ZINC000065534462	274105405	/nfs/dbraw/zinc/10/54/05/274105405.db2.gz	QBCIUCANEFOKCX-OAHLLOKOSA-N	1	0	295.346	1.839	50	0		CDAARO
Cc1cc2c(c(-c3ccc(N(C)C)nn3)c1)O[C@@H](C[NH3+])C2	ZINC000067673620	274725483	/nfs/dbraw/zinc/72/54/83/274725483.db2.gz	QNGDRJITMUWNTL-GFCCVEGCSA-N	1	0	284.363	1.780	50	0		CDAARO
CC(=O)N1CC[NH+](C[C@H]2CCOc3ccccc3C2)CC1	ZINC000095522220	275461350	/nfs/dbraw/zinc/46/13/50/275461350.db2.gz	COSYVXTYONABNR-HNNXBMFYSA-N	1	0	288.391	1.792	50	0		CDAARO
CCC[NH+]1CCC(N[C@@H]2CCCCNC2=O)CC1	ZINC000003683634	276258101	/nfs/dbraw/zinc/25/81/01/276258101.db2.gz	SIAGKKVXHNAWGE-CYBMUJFWSA-N	1	0	253.390	1.119	50	0		CDAARO
CC[N@@H+]1CCC[C@H](N2CC[C@H](N(C)C(C)=O)C2)C1	ZINC000042926127	276374245	/nfs/dbraw/zinc/37/42/45/276374245.db2.gz	DJBJOHJIEJVGFU-KBPBESRZSA-N	1	0	253.390	1.023	50	0		CDAARO
C[NH+](C)[C@H]1CCN(c2ccc(Br)cn2)C1	ZINC000035898827	276874014	/nfs/dbraw/zinc/87/40/14/276874014.db2.gz	XTPJCCKHBQLBST-JTQLQIEISA-N	1	0	270.174	1.984	50	0		CDAARO
C[NH+]1CCN(c2ccnc(Br)c2)CC1	ZINC000044118689	277113488	/nfs/dbraw/zinc/11/34/88/277113488.db2.gz	CTJBLTGBCCXHDX-UHFFFAOYSA-N	1	0	256.147	1.596	50	0		CDAARO
CNC(=O)C[N@H+](C)C[C@H]1CCOc2ccccc2C1	ZINC000095529295	277228217	/nfs/dbraw/zinc/22/82/17/277228217.db2.gz	BPGRSNBIAKZDEA-LBPRGKRZSA-N	1	0	262.353	1.306	50	0		CDAARO
CC(C)(C)OC(=O)N1CCC[C@]2(C[NH2+]CCO2)C1	ZINC000072194300	278397128	/nfs/dbraw/zinc/39/71/28/278397128.db2.gz	KSLJZAAAQPGVRM-ZDUSSCGKSA-N	1	0	256.346	1.376	50	0		CDAARO
CCO[C@@H]1C[C@@H]([NH2+][C@@H]2CCN(C)C2=O)C1(CC)CC	ZINC000095408398	279820861	/nfs/dbraw/zinc/82/08/61/279820861.db2.gz	PUUCDHAYXHDYSL-JHJVBQTASA-N	1	0	268.401	1.791	50	0		CDAARO
CCS(=O)(=O)c1ccccc1N1CCC([NH3+])CC1	ZINC000035062007	280033319	/nfs/dbraw/zinc/03/33/19/280033319.db2.gz	RWHZGMSHDGVKGI-UHFFFAOYSA-N	1	0	268.382	1.408	50	0		CDAARO
Cc1cc(C(=O)N2CCC[C@@H]2C[NH+]2CCCC2)no1	ZINC000066944727	280326243	/nfs/dbraw/zinc/32/62/43/280326243.db2.gz	SWOSDVOLRPSLTO-GFCCVEGCSA-N	1	0	263.341	1.683	50	0		CDAARO
Cc1cc(C(=O)N2C[C@H]3CC[C@@H](C2)[N@H+](C)C3)c(C)n1C	ZINC000218973491	280344682	/nfs/dbraw/zinc/34/46/82/280344682.db2.gz	DNLRFWLTZZTXAN-KBPBESRZSA-N	1	0	275.396	1.808	50	0		CDAARO
Cc1ccc2c(c1)[C@H]1C[N@H+](C)CC[C@@H]1N2S(C)(=O)=O	ZINC000004020000	281128046	/nfs/dbraw/zinc/12/80/46/281128046.db2.gz	DGKGNEDJNWYORV-OCCSQVGLSA-N	1	0	280.393	1.562	50	0		CDAARO
CO[C@@H](C)C(=O)NC[C@H](C1CCCCC1)[NH+](C)C	ZINC000089478450	293402885	/nfs/dbraw/zinc/40/28/85/293402885.db2.gz	WHJNOKYBUFZXHM-WCQYABFASA-N	1	0	256.390	1.648	50	0		CDAARO
Cc1cc(C(=O)N[C@H](c2nccn2C)C2CC2)cc(=O)[nH]1	ZINC000534585013	328314863	/nfs/dbraw/zinc/31/48/63/328314863.db2.gz	ROEWVMSDMGELEM-ZDUSSCGKSA-N	1	0	286.335	1.710	50	0		CDAARO
COc1cccc2c1OCCCN(C(=O)[C@H]1C=CC[NH2+]1)C2	ZINC000534643570	328329491	/nfs/dbraw/zinc/32/94/91/328329491.db2.gz	SVHHEHSURSMXKK-CYBMUJFWSA-N	1	0	288.347	1.334	50	0		CDAARO
CC[N@@H+]1C[C@H](NC(=O)c2ccsc2)[C@@H](OC)C1	ZINC000534645961	328331923	/nfs/dbraw/zinc/33/19/23/328331923.db2.gz	CDAWFOUATUPWAD-QWRGUYRKSA-N	1	0	254.355	1.197	50	0		CDAARO
Clc1cnc(N2[C@@H]3CC[C@H]2[C@H]2C[NH2+]C[C@H]23)nc1	ZINC000534647960	328343170	/nfs/dbraw/zinc/34/31/70/328343170.db2.gz	FJXKRIOARBOZCB-DTIDVZRVSA-N	1	0	250.733	1.317	50	0		CDAARO
CCc1ccc(C(=O)NC[C@@H](C(C)C)[NH+](C)C)[nH]1	ZINC000534648287	328343368	/nfs/dbraw/zinc/34/33/68/328343368.db2.gz	XLPMJYONGLDBAE-ZDUSSCGKSA-N	1	0	251.374	1.893	50	0		CDAARO
C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]CCCN1C(=O)CNC1=O	ZINC000097099874	323207341	/nfs/dbraw/zinc/20/73/41/323207341.db2.gz	RXEPNIIWWBYGJN-NEPJUHHUSA-N	1	0	281.400	1.733	50	0		CDAARO
O=C(Nc1nc(-c2cccs2)ns1)[C@H]1CCC[NH2+]1	ZINC000183098236	323319524	/nfs/dbraw/zinc/31/95/24/323319524.db2.gz	GYQDAPZOCXPFED-SSDOTTSWSA-N	1	0	280.378	1.957	50	0		CDAARO
O=C1OC2(CN1c1cccc(F)c1)CC[NH2+]CC2	ZINC000071289240	482450241	/nfs/dbraw/zinc/45/02/41/482450241.db2.gz	CHJIZJMFNIVWLC-UHFFFAOYSA-N	1	0	250.273	1.905	50	0		CDAARO
C[N@@H+]1CC[C@@H](NS(=O)(=O)Cc2ccc(Cl)cc2)C1	ZINC000074864982	482774243	/nfs/dbraw/zinc/77/42/43/482774243.db2.gz	GXGBGFMMUFDQBI-GFCCVEGCSA-N	1	0	288.800	1.464	50	0		CDAARO
CN1CC[C@H]([NH2+]C[C@@]2(O)CCCOC2)[C@H]1c1ccccc1	ZINC000585094277	482828499	/nfs/dbraw/zinc/82/84/99/482828499.db2.gz	AFPQUXSEPKLJMZ-BBWFWOEESA-N	1	0	290.407	1.563	50	0		CDAARO
O=c1ccccn1CCC[NH2+]C1Cc2ccccc2C1	ZINC000670434427	482970392	/nfs/dbraw/zinc/97/03/92/482970392.db2.gz	LACDKUNMLIYKRC-UHFFFAOYSA-N	1	0	268.360	1.995	50	0		CDAARO
OC[C@H]1CCC[N@H+](CCNc2cnc3ccccc3n2)C1	ZINC000670439351	482983345	/nfs/dbraw/zinc/98/33/45/482983345.db2.gz	GTHNVFBVWKBFDQ-ZDUSSCGKSA-N	1	0	286.379	1.746	50	0		CDAARO
Cc1nccn1CC[C@H](C)[NH2+]Cc1cnc2cnccn12	ZINC000670443476	482988627	/nfs/dbraw/zinc/98/86/27/482988627.db2.gz	ZNRNJXRADNYCOZ-LBPRGKRZSA-N	1	0	284.367	1.803	50	0		CDAARO
O=C(c1ccoc1)N1CCC[N@H+](CC[C@H]2CCOC2)CC1	ZINC000670444588	482991785	/nfs/dbraw/zinc/99/17/85/482991785.db2.gz	YFYSCBCUPGBYHA-AWEZNQCLSA-N	1	0	292.379	1.854	50	0		CDAARO
CC(=O)N1CCC([N@@H+]2CC[C@H](O)CC(C)(C)C2)CC1	ZINC000670445210	482996105	/nfs/dbraw/zinc/99/61/05/482996105.db2.gz	QXQVSTSWEODCBT-AWEZNQCLSA-N	1	0	268.401	1.480	50	0		CDAARO
CO[C@@H]1CC[N@@H+](C2CCN(Cc3ccco3)CC2)C1	ZINC000670453313	483022151	/nfs/dbraw/zinc/02/21/51/483022151.db2.gz	UTNYKCKRUBVDOS-CQSZACIVSA-N	1	0	264.369	1.965	50	0		CDAARO
O=C(C1CCC1)N1CCC[N@H+](CC[C@H]2CCOC2)CC1	ZINC000670460663	483042109	/nfs/dbraw/zinc/04/21/09/483042109.db2.gz	OIYLKOASCYZGMQ-AWEZNQCLSA-N	1	0	280.412	1.747	50	0		CDAARO
O=C1CN(c2ncnc3[nH]ccc32)CCN1C1CCCCC1	ZINC000670459494	483042190	/nfs/dbraw/zinc/04/21/90/483042190.db2.gz	QPCOFLAPKIGYJE-UHFFFAOYSA-N	1	0	299.378	1.939	50	0		CDAARO
COc1ccccc1-n1cc(CNC(=O)[C@H]2C=CC[NH2+]2)cn1	ZINC000670463848	483054514	/nfs/dbraw/zinc/05/45/14/483054514.db2.gz	DWQKLTHPVFZVDD-CYBMUJFWSA-N	1	0	298.346	1.025	50	0		CDAARO
COc1cc2c(cc1CN[C@@H](C)CC[NH+](C)C)OCCO2	ZINC000670468127	483059445	/nfs/dbraw/zinc/05/94/45/483059445.db2.gz	CUUNBYKESIZGEX-LBPRGKRZSA-N	1	0	294.395	1.896	50	0		CDAARO
C[NH+](C)C[C@]1(CO)CCCN(C(=O)CC2CCCC2)C1	ZINC000670469210	483063498	/nfs/dbraw/zinc/06/34/98/483063498.db2.gz	DUGYVEPFZIBCMJ-MRXNPFEDSA-N	1	0	282.428	1.729	50	0		CDAARO
CCC(=O)N1CCC[C@H]1[C@@H]1CCC[N@@H+]1CCn1cccn1	ZINC000084718646	483317582	/nfs/dbraw/zinc/31/75/82/483317582.db2.gz	UIGPWOPFHNWAJL-GJZGRUSLSA-N	1	0	290.411	1.749	50	0		CDAARO
O=C(CCC1CCCC1)N1C[C@H](CO)C2(C1)CC[NH2+]CC2	ZINC000581800945	1161980675	/nfs/dbraw/zinc/98/06/75/1161980675.db2.gz	JQYAHLWPEUDOCA-OAHLLOKOSA-N	1	0	294.439	1.777	50	0		CDAARO
CS(=O)(=O)[C@@H]1CCCC[C@H]1[NH2+]Cc1ccoc1	ZINC000182555437	525233507	/nfs/dbraw/zinc/23/35/07/525233507.db2.gz	ZCHVZBWYEMJQRL-VXGBXAGGSA-N	1	0	257.355	1.725	50	0		CDAARO
O=C(NC[C@@H](O)c1ccccc1Cl)[C@]1(F)CC[NH2+]C1	ZINC000299739186	526489142	/nfs/dbraw/zinc/48/91/42/526489142.db2.gz	LQMIKYNNNXMUTA-YPMHNXCESA-N	1	0	286.734	1.191	50	0		CDAARO
CCCCOC[C@@H](O)C[NH+]1CCC(C2OCCO2)CC1	ZINC000195174416	528615483	/nfs/dbraw/zinc/61/54/83/528615483.db2.gz	WBORHAGVBIEDGK-AWEZNQCLSA-N	1	0	287.400	1.249	50	0		CDAARO
CC(C)[N@H+](C)CCNC(=O)N(C)CC1CCOCC1	ZINC000096488998	528819226	/nfs/dbraw/zinc/81/92/26/528819226.db2.gz	IBTZNEYRCKXFCW-UHFFFAOYSA-N	1	0	271.405	1.395	50	0		CDAARO
CCCCc1c(C)[nH+]c(N)nc1N1CCO[C@@H](CCO)C1	ZINC000091574485	535077443	/nfs/dbraw/zinc/07/74/43/535077443.db2.gz	MTWYXSGXZSIDPW-LBPRGKRZSA-N	1	0	294.399	1.297	50	0		CDAARO
CCc1c(C(=O)N2CCC([NH3+])CC2)cnn1C(C)(C)C	ZINC000269104896	536026949	/nfs/dbraw/zinc/02/69/49/536026949.db2.gz	CDWIYMMAPJZJAK-UHFFFAOYSA-N	1	0	278.400	1.764	50	0		CDAARO
C[C@@H]([NH2+]Cc1cnn(C)c1)c1ccc(-n2cncn2)cc1	ZINC000097123815	567904578	/nfs/dbraw/zinc/90/45/78/567904578.db2.gz	YQKRZDNGYLRFOF-GFCCVEGCSA-N	1	0	282.351	1.852	50	0		CDAARO
O=C(C1CC[NH+](C[C@@H](O)C(F)(F)F)CC1)N1CCCC1	ZINC000097141794	567904964	/nfs/dbraw/zinc/90/49/64/567904964.db2.gz	PJQXEKXILALOMI-LLVKDONJSA-N	1	0	294.317	1.244	50	0		CDAARO
Cn1cc(N2CC[C@@H]([NH2+]CCC(C)(C)C)C2=O)cn1	ZINC000097164469	567905490	/nfs/dbraw/zinc/90/54/90/567905490.db2.gz	KMASRMGMZMQLRL-GFCCVEGCSA-N	1	0	264.373	1.551	50	0		CDAARO
C[C@H]1[NH2+]CCC[C@H]1c1ccc(NS(C)(=O)=O)cc1	ZINC000757215132	577036392	/nfs/dbraw/zinc/03/63/92/577036392.db2.gz	VAGOQANJCNJSJX-ZWNOBZJWSA-N	1	0	268.382	1.914	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)([C@@H]([NH3+])c2ccccc2)C1	ZINC000958528574	613973336	/nfs/dbraw/zinc/97/33/36/613973336.db2.gz	QTIVACPRABCKEF-LBPRGKRZSA-N	1	0	278.352	1.668	50	0		CDAARO
CCC[N@@H+]1CCC[C@@H](NC(=O)/C=C/c2cnc(N)nc2)C1	ZINC000952965029	614659327	/nfs/dbraw/zinc/65/93/27/614659327.db2.gz	PQPWBWQFBVCREG-URWSZGRFSA-N	1	0	289.383	1.063	50	0		CDAARO
CCc1nc(C)c(C[NH2+]CCN2CCC[C@@H](CO)C2)[nH]1	ZINC000952982467	615737522	/nfs/dbraw/zinc/73/75/22/615737522.db2.gz	XGMDJLRKNIUQSF-CYBMUJFWSA-N	1	0	280.416	1.074	50	0		CDAARO
CC(=O)N1CCC[C@H](CNc2cc(C)[nH+]c(N)n2)C1	ZINC000032587054	631812224	/nfs/dbraw/zinc/81/22/24/631812224.db2.gz	CMGGRVFQHNMZRD-LLVKDONJSA-N	1	0	263.345	1.038	50	0		CDAARO
CSc1nc(N)cc(N[C@@H](C)c2nncn2C)n1	ZINC000132507987	1175793748	/nfs/dbraw/zinc/79/37/48/1175793748.db2.gz	CVYZVWAQPXGZFX-LURJTMIESA-N	1	0	265.346	1.082	50	0		CDAARO
CN(C)c1nccnc1N1CCC[C@@H]([NH+](C)C)CC1	ZINC001704344724	1177695011	/nfs/dbraw/zinc/69/50/11/1177695011.db2.gz	XJTLTIPBZRNLRO-GFCCVEGCSA-N	1	0	263.389	1.463	50	0		CDAARO
Cc1ccc(C[NH2+]CCN2CCCC[C@@H]2CO)o1	ZINC000952963432	698377523	/nfs/dbraw/zinc/37/75/23/698377523.db2.gz	JZEVYCDYUOXKMV-CYBMUJFWSA-N	1	0	252.358	1.524	50	0		CDAARO
[NH3+]C[C@@H]1CCCN(S(=O)(=O)CC2CCCC2)C1	ZINC000262028581	698661304	/nfs/dbraw/zinc/66/13/04/698661304.db2.gz	JKSXBZAWBLSXIF-LBPRGKRZSA-N	1	0	260.403	1.177	50	0		CDAARO
COc1cc(CN2CC[C@H]3CC[C@@H](C2)[NH2+]3)sn1	ZINC000399023927	705192205	/nfs/dbraw/zinc/19/22/05/705192205.db2.gz	GLYOJTVBHVGMNA-ZJUUUORDSA-N	1	0	253.371	1.478	50	0		CDAARO
CC(C)[C@H](CCO)NC(=O)C(C)(C)[NH+]1CCCCC1	ZINC000863948074	705241418	/nfs/dbraw/zinc/24/14/18/705241418.db2.gz	ALDIARZLFBPACJ-ZDUSSCGKSA-N	1	0	270.417	1.774	50	0		CDAARO
C[NH2+]CC(=O)Nc1ccccc1OC[C@H]1CCCO1	ZINC000066225826	848512605	/nfs/dbraw/zinc/51/26/05/848512605.db2.gz	HADDCQRXLFTHMF-LLVKDONJSA-N	1	0	264.325	1.402	50	0		CDAARO
Cc1cc(C)c2ncn([C@@H]3CCC[NH2+]C3)c(=O)c2c1	ZINC000757176119	848874659	/nfs/dbraw/zinc/87/46/59/848874659.db2.gz	AOFJXNMQRYWSHR-GFCCVEGCSA-N	1	0	257.337	1.938	50	0		CDAARO
c1nc(CC[NH2+][C@H]2CCN(c3ccccc3)C2)c[nH]1	ZINC000952969006	849135826	/nfs/dbraw/zinc/13/58/26/849135826.db2.gz	AHXNHDOZYSAQCN-AWEZNQCLSA-N	1	0	256.353	1.821	50	0		CDAARO
O=C(C[NH+]1CCCCCC1)N[C@H]1CCC[C@@H](CO)C1	ZINC000952980952	849417575	/nfs/dbraw/zinc/41/75/75/849417575.db2.gz	BDIVRQBQXISVFK-KGLIPLIRSA-N	1	0	268.401	1.530	50	0		CDAARO
O=C(C[C@H](O)c1cccc(F)c1)NC[C@H]1CCC[NH2+]1	ZINC000864092208	849661306	/nfs/dbraw/zinc/66/13/06/849661306.db2.gz	NFDSXKWCNRHJLN-OLZOCXBDSA-N	1	0	266.316	1.117	50	0		CDAARO
COc1ccccc1OCCCCC[NH2+]CCO	ZINC000002900832	896976275	/nfs/dbraw/zinc/97/62/75/896976275.db2.gz	SCSHQWBLMWRUFZ-UHFFFAOYSA-N	1	0	253.342	1.826	50	0		CDAARO
CCn1nccc1C(=O)N(CC[NH+](C)C)C1CCOCC1	ZINC000675022426	899879479	/nfs/dbraw/zinc/87/94/79/899879479.db2.gz	NZGUDZLPNLQBMW-UHFFFAOYSA-N	1	0	294.399	1.086	50	0		CDAARO
CCc1nccn1C[C@@H](C)N1CC[NH+](C(C)C)CC1	ZINC001506397410	908904016	/nfs/dbraw/zinc/90/40/16/908904016.db2.gz	UXQQBRDMODMDGE-CQSZACIVSA-N	1	0	264.417	1.860	50	0		CDAARO
C[NH2+]C[C@@H](O)[C@H](C)C(=O)NC1CC(C)(C)CC(C)(C)C1	ZINC000952882213	910448870	/nfs/dbraw/zinc/44/88/70/910448870.db2.gz	JGOXBLQGYMWEQQ-WCQYABFASA-N	1	0	284.444	1.924	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](NC(=O)Cc2sc(N)nc2C)C1	ZINC000822922775	925657725	/nfs/dbraw/zinc/65/77/25/925657725.db2.gz	UBZWZEPSMLZGAQ-NSHDSACASA-N	1	0	296.440	1.567	50	0		CDAARO
CNC(=O)C[C@H]1CC[N@H+](Cc2nc(C)cs2)C1	ZINC000823820919	925731215	/nfs/dbraw/zinc/73/12/15/925731215.db2.gz	FVJIMFZNKKIDPQ-SNVBAGLBSA-N	1	0	253.371	1.410	50	0		CDAARO
COc1ncc(C[N@H+](CCO)C2CCCCC2)cn1	ZINC000828757281	926186121	/nfs/dbraw/zinc/18/61/21/926186121.db2.gz	FFQJWMIAJNXUHI-UHFFFAOYSA-N	1	0	265.357	1.612	50	0		CDAARO
O[C@H]1C[N@@H+](C2CCCCCC2)C[C@@H]1N1CCOCC1	ZINC000828896799	926210080	/nfs/dbraw/zinc/21/00/80/926210080.db2.gz	SABHCOUCXYAKKU-GJZGRUSLSA-N	1	0	268.401	1.087	50	0		CDAARO
CO[C@@H](C[N@@H+]1CCN(C)[C@@H](c2nc(C)no2)C1)C(C)C	ZINC000585089070	930912868	/nfs/dbraw/zinc/91/28/68/930912868.db2.gz	APIITUJQVSOVPJ-OLZOCXBDSA-N	1	0	282.388	1.338	50	0		CDAARO
Cc1ncoc1CN1CC[N@@H+](CC(C)(C)O)C[C@H]1C	ZINC000585120870	930994349	/nfs/dbraw/zinc/99/43/49/930994349.db2.gz	RRWOJKKNUSCNLO-LLVKDONJSA-N	1	0	267.373	1.260	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)N[C@H]1C[C@@H]([NH+](C)C)C12CCC2	ZINC000585131308	931024340	/nfs/dbraw/zinc/02/43/40/931024340.db2.gz	RKBMJQCZPVQNFW-UONOGXRCSA-N	1	0	290.411	1.558	50	0		CDAARO
CCN(C(=O)N1CCC[C@H](C[N@@H+]2CC[C@@H](O)C2)C1)C(C)C	ZINC000585139412	931042929	/nfs/dbraw/zinc/04/29/29/931042929.db2.gz	WMPGBSNRVZNQOT-HUUCEWRRSA-N	1	0	297.443	1.615	50	0		CDAARO
Cc1nc(NCCN2CC[NH2+]CC2)ccc1Cl	ZINC001529109480	968984076	/nfs/dbraw/zinc/98/40/76/968984076.db2.gz	ADIKZQOJSPIMHU-UHFFFAOYSA-N	1	0	254.765	1.361	50	0		CDAARO
Cc1nc(=NC[C@H]2CCC[N@H+](Cc3ccco3)C2)n(C)[nH]1	ZINC001529124989	968988458	/nfs/dbraw/zinc/98/84/58/968988458.db2.gz	CUNSICRVHVRAOM-CYBMUJFWSA-N	1	0	289.383	1.463	50	0		CDAARO
Cc1nncn1CCN(C)Cc1nc(-c2ccncc2)no1	ZINC001529189793	969009724	/nfs/dbraw/zinc/00/97/24/969009724.db2.gz	YNSDXYFOOBKUNV-UHFFFAOYSA-N	1	0	299.338	1.164	50	0		CDAARO
NC(=O)C1([NH2+][C@H]2CCC(=O)N(CC3CC3)CC2)CCCC1	ZINC001506404220	975150408	/nfs/dbraw/zinc/15/04/08/975150408.db2.gz	SGQAGEHKCGHLIC-ZDUSSCGKSA-N	1	0	293.411	1.165	50	0		CDAARO
Cc1cccc(NC(=O)CC(=O)N2CC[C@H]([NH+](C)C)C2)c1	ZINC001506409761	975152834	/nfs/dbraw/zinc/15/28/34/975152834.db2.gz	SPDHNLUFHDGANZ-AWEZNQCLSA-N	1	0	289.379	1.486	50	0		CDAARO
Cc1nc(N)nc(N2CCC3(CC[N@@H+](C)C3)CC2)c1Cl	ZINC001506415373	975155338	/nfs/dbraw/zinc/15/53/38/975155338.db2.gz	XPQIGOFFTIQLGL-UHFFFAOYSA-N	1	0	295.818	1.943	50	0		CDAARO
CO[C@@H]1CCCN(C(=O)CCC[NH+]2CCCC2)C1	ZINC001506422805	975159456	/nfs/dbraw/zinc/15/94/56/975159456.db2.gz	DNUGQKGRVQHPCT-CYBMUJFWSA-N	1	0	254.374	1.500	50	0		CDAARO
c1cn(CCC[NH+]2CCC(Oc3ncccn3)CC2)cn1	ZINC001506427673	975160895	/nfs/dbraw/zinc/16/08/95/975160895.db2.gz	OVHIQWAOMHOMAG-UHFFFAOYSA-N	1	0	287.367	1.607	50	0		CDAARO
c1ncn(C[C@H]2CCC[N@@H+]2C[C@H]2CCCCO2)n1	ZINC000106664561	349446139	/nfs/dbraw/zinc/44/61/39/349446139.db2.gz	WZRQXOUFTGEWQR-CHWSQXEVSA-N	1	0	250.346	1.312	50	0		CDAARO
Cn1ccc(C(=O)NC[C@@H](c2ccccc2)[NH+](C)C)cc1=O	ZINC000095948425	185038885	/nfs/dbraw/zinc/03/88/85/185038885.db2.gz	XJQCDIPPUVWIKP-HNNXBMFYSA-N	1	0	299.374	1.418	50	0		CDAARO
CCOCC[NH2+][C@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000309737743	342024188	/nfs/dbraw/zinc/02/41/88/342024188.db2.gz	RBLKKLHZIBIXSO-GHMZBOCLSA-N	1	0	260.378	1.914	50	0		CDAARO
COCC1(CNC(=O)[C@H]2CC23CC[NH2+]CC3)CCC1	ZINC000382010433	342090040	/nfs/dbraw/zinc/09/00/40/342090040.db2.gz	MZHFWVQUZFSBBX-GFCCVEGCSA-N	1	0	266.385	1.309	50	0		CDAARO
COc1cccc(N2CCN(C3CC[NH+](C)CC3)CC2)c1	ZINC000023279975	342088852	/nfs/dbraw/zinc/08/88/52/342088852.db2.gz	CWEGPAJENJZUGJ-UHFFFAOYSA-N	1	0	289.423	1.911	50	0		CDAARO
CCc1cc(C(=O)N[C@H]2C[NH2+]C[C@@H]2OC)oc1CC	ZINC000195554100	342625818	/nfs/dbraw/zinc/62/58/18/342625818.db2.gz	WJBZIYRSMSHIAB-GWCFXTLKSA-N	1	0	266.341	1.121	50	0		CDAARO
[NH3+][C@H](C(=O)N1CCOC2(CCOCC2)C1)c1ccccc1	ZINC000195554445	342625898	/nfs/dbraw/zinc/62/58/98/342625898.db2.gz	HJENACZVSIBLBQ-AWEZNQCLSA-N	1	0	290.363	1.094	50	0		CDAARO
Cc1cnc(CNc2cc([C@H]3C[C@H]([NH3+])C3)nc(C)n2)cn1	ZINC000244564076	361853880	/nfs/dbraw/zinc/85/38/80/361853880.db2.gz	CMCRWCWZIXXAOF-HAQNSBGRSA-N	1	0	284.367	1.700	50	0		CDAARO
Cc1ncc(C(=O)N2CC([N@H+]3CCCC[C@@H]3C)C2)c(C)n1	ZINC000097522296	282141645	/nfs/dbraw/zinc/14/16/45/282141645.db2.gz	LGCBIBIEXXNXRR-NSHDSACASA-N	1	0	288.395	1.792	50	0		CDAARO
Cc1nc(CC[N@@H+](C)C[C@@H]2COCCO2)cs1	ZINC000244882576	361867585	/nfs/dbraw/zinc/86/75/85/361867585.db2.gz	XUKRSXCHMCAMBK-GFCCVEGCSA-N	1	0	256.371	1.341	50	0		CDAARO
Cc1cnc(C)c(N2CC[NH+](C[C@@H]3CCCOC3)CC2)n1	ZINC000244708117	361858524	/nfs/dbraw/zinc/85/85/24/361858524.db2.gz	KNRKYNSRMIAORB-HNNXBMFYSA-N	1	0	290.411	1.642	50	0		CDAARO
CN(CCC[NH+]1CCCCC1)[C@@H]1CCCCNC1=O	ZINC000097103377	342192075	/nfs/dbraw/zinc/19/20/75/342192075.db2.gz	ZEDXYCYHRUDHMV-CQSZACIVSA-N	1	0	267.417	1.463	50	0		CDAARO
CN(C)C(=O)[C@@H]1CC[C@H](C[NH2+]C2Cc3ccccc3C2)O1	ZINC000097033464	185155589	/nfs/dbraw/zinc/15/55/89/185155589.db2.gz	UMSTUHBHFYQIIF-CVEARBPZSA-N	1	0	288.391	1.379	50	0		CDAARO
CON1CCC(CC(=O)N[C@@H]2[C@H](C)CC[NH2+][C@@H]2C)CC1	ZINC000585136380	342216069	/nfs/dbraw/zinc/21/60/69/342216069.db2.gz	CXXPKADGVQXVNS-LALPHHSUSA-N	1	0	283.416	1.153	50	0		CDAARO
CC(C)(C)OC(=O)[C@@H]1CCCC[N@@H+]1C[C@@H]1CNC(=O)C1	ZINC000585094292	362021280	/nfs/dbraw/zinc/02/12/80/362021280.db2.gz	DPERJHVZHOMMST-RYUDHWBXSA-N	1	0	282.384	1.319	50	0		CDAARO
C[C@H]([NH2+][C@@H]1CCCNC(=O)C1)[C@@H](c1ccccc1)N(C)C	ZINC000585116905	362044856	/nfs/dbraw/zinc/04/48/56/362044856.db2.gz	MCGGYGOXRBGGHZ-LXZKKBNFSA-N	1	0	289.423	1.936	50	0		CDAARO
Cn1cc(CCC[NH2+]Cc2nncn2-c2ccccc2)cn1	ZINC000585116553	362045249	/nfs/dbraw/zinc/04/52/49/362045249.db2.gz	ANPRWWISEWISOF-UHFFFAOYSA-N	1	0	296.378	1.723	50	0		CDAARO
COc1cccc([C@H](C)[NH2+][C@H](C)C(=O)N[C@H]2CCOC2)c1	ZINC000252585608	342385882	/nfs/dbraw/zinc/38/58/82/342385882.db2.gz	JUKDHODNBFBQFD-SCRDCRAPSA-N	1	0	292.379	1.639	50	0		CDAARO
C[NH2+]C[C@H]1CCN(C(=O)COc2cccc(C)c2)C1	ZINC000179003264	362251181	/nfs/dbraw/zinc/25/11/81/362251181.db2.gz	GIHDTOBKYNFEGT-CYBMUJFWSA-N	1	0	262.353	1.442	50	0		CDAARO
C[C@@H]1CN(C(=O)CCc2nc3ccccc3[nH]2)C[C@H](C)[NH2+]1	ZINC000179160960	362253430	/nfs/dbraw/zinc/25/34/30/362253430.db2.gz	JESMJWNZGNQNBC-TXEJJXNPSA-N	1	0	286.379	1.704	50	0		CDAARO
C[NH+]1CCC(CCC(=O)N[C@@H]2CCc3c[nH]nc3C2)CC1	ZINC000426606699	530048780	/nfs/dbraw/zinc/04/87/80/530048780.db2.gz	FMJDZCZCRHRZAA-CQSZACIVSA-N	1	0	290.411	1.505	50	0		CDAARO
Fc1ccc(F)c(N2CC[NH+](CCC3OCCO3)CC2)c1	ZINC000097161658	136522027	/nfs/dbraw/zinc/52/20/27/136522027.db2.gz	FKMNSRLDEQCLPR-UHFFFAOYSA-N	1	0	298.333	1.850	50	0		CDAARO
Cc1cccc(OCCN(C)C(=O)[C@H]2CCC[C@@H]2[NH3+])c1	ZINC000085368783	179038613	/nfs/dbraw/zinc/03/86/13/179038613.db2.gz	CWFWINFXTVDBBD-GJZGRUSLSA-N	1	0	276.380	1.960	50	0		CDAARO
C[NH+](C)C[C@@H]1COCCN1C(=O)c1cccc(Cl)c1	ZINC000085469875	179075711	/nfs/dbraw/zinc/07/57/11/179075711.db2.gz	ILILBYMKUHCPOA-CYBMUJFWSA-N	1	0	282.771	1.743	50	0		CDAARO
CSCC(=O)N1CCN(c2cc[nH+]c(C)c2)CC1	ZINC000222251232	136583743	/nfs/dbraw/zinc/58/37/43/136583743.db2.gz	URDDWOYZQULFFR-UHFFFAOYSA-N	1	0	265.382	1.402	50	0		CDAARO
C[C@H]([NH3+])C1CCN(C(=O)c2cccc(NC(N)=O)c2)CC1	ZINC000262501608	362827072	/nfs/dbraw/zinc/82/70/72/362827072.db2.gz	HGVGOULMKUESNM-JTQLQIEISA-N	1	0	290.367	1.377	50	0		CDAARO
CSC[C@H](C)CNC(=O)N(C)[C@H]1CC[N@H+](C)C[C@@H]1C	ZINC000085404572	482581373	/nfs/dbraw/zinc/58/13/73/482581373.db2.gz	KHKSNNYKWADIFF-AGIUHOORSA-N	1	0	287.473	1.967	50	0		CDAARO
Cc1ncccc1C(=O)N1CC[C@@H](C[NH+]2CCCC2)C1	ZINC000089540532	179814802	/nfs/dbraw/zinc/81/48/02/179814802.db2.gz	KHCDYPAEIMYETG-AWEZNQCLSA-N	1	0	273.380	1.948	50	0		CDAARO
CO[C@@H](C)C(=O)N1CCC([NH+]2CCCCCC2)CC1	ZINC000584896061	349357364	/nfs/dbraw/zinc/35/73/64/349357364.db2.gz	SPCIYEPMEATWIR-ZDUSSCGKSA-N	1	0	268.401	1.888	50	0		CDAARO
CC(C)[NH+]1CCC(CNC(=O)C[C@H]2CCOC2)CC1	ZINC000584890219	349349423	/nfs/dbraw/zinc/34/94/23/349349423.db2.gz	OYASTOAQHHUPCA-CQSZACIVSA-N	1	0	268.401	1.650	50	0		CDAARO
OCCC1([NH2+]Cc2ccc(F)cc2)CCOCC1	ZINC000089787895	179866241	/nfs/dbraw/zinc/86/62/41/179866241.db2.gz	CFEVJQLSVZFXCW-UHFFFAOYSA-N	1	0	253.317	1.847	50	0		CDAARO
CC(C)(CNC(=O)CCc1cn[nH]c1)[NH+]1CCCC1	ZINC000584897992	349359828	/nfs/dbraw/zinc/35/98/28/349359828.db2.gz	CXNUJMZKLGTERQ-UHFFFAOYSA-N	1	0	264.373	1.333	50	0		CDAARO
CCOc1ccccc1C(=O)N[C@H]1CCC[NH2+][C@H]1C	ZINC000091496539	180171975	/nfs/dbraw/zinc/17/19/75/180171975.db2.gz	BTLWXOCQCOWUON-AAEUAGOBSA-N	1	0	262.353	1.956	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)COc2ccccc2Cl)C[C@@H]1C1CC1	ZINC000091505240	180176324	/nfs/dbraw/zinc/17/63/24/180176324.db2.gz	MPZWXYBSUITLTD-YPMHNXCESA-N	1	0	294.782	1.915	50	0		CDAARO
CCS(=O)(=O)CCN(C)[C@H]1CCC[C@H]1SC	ZINC000110642450	350228080	/nfs/dbraw/zinc/22/80/80/350228080.db2.gz	DOMVATSAPRWGRJ-WDEREUQCSA-N	1	0	265.444	1.637	50	0		CDAARO
CCC[C@H]1CN(C(=O)CCn2c(C)cccc2=O)C[C@@H]1[NH3+]	ZINC000091678345	180224984	/nfs/dbraw/zinc/22/49/84/180224984.db2.gz	JJNHFQYNTONMQC-KBPBESRZSA-N	1	0	291.395	1.133	50	0		CDAARO
Cc1nn(C)c(C)c1C[NH2+]CCC1CC[NH+](C)CC1	ZINC000105454604	186057966	/nfs/dbraw/zinc/05/79/66/186057966.db2.gz	UTVFPUQXUOVHFV-UHFFFAOYSA-N	1	0	264.417	1.858	50	0		CDAARO
COCC[C@@]1(CO)CCC[N@@H+](C2CCOCC2)C1	ZINC000091951390	180291728	/nfs/dbraw/zinc/29/17/28/180291728.db2.gz	XOPCFGIXBQZHSM-AWEZNQCLSA-N	1	0	257.374	1.276	50	0		CDAARO
COCC[N@H+](C)C[C@@H]1CCCN1C(=O)c1csnc1C	ZINC000097237477	351605648	/nfs/dbraw/zinc/60/56/48/351605648.db2.gz	VNFYGGCQUNQGKK-LBPRGKRZSA-N	1	0	297.424	1.634	50	0		CDAARO
CCC1(C(=O)N2CCN([C@H]3CC[NH2+]C3)CC2)CCCC1	ZINC000261740932	535232635	/nfs/dbraw/zinc/23/26/35/535232635.db2.gz	MAFTXVVPHVOUAK-AWEZNQCLSA-N	1	0	279.428	1.463	50	0		CDAARO
CCNc1nc(NCCNC(=O)CC)cc(C)[nH+]1	ZINC000067603367	355893685	/nfs/dbraw/zinc/89/36/85/355893685.db2.gz	UIKAUEFQXACHFJ-UHFFFAOYSA-N	1	0	251.334	1.155	50	0		CDAARO
COc1ccc(OCC(=O)O[C@H]2CCC[N@H+](C)C2)cc1	ZINC000000249816	355899017	/nfs/dbraw/zinc/89/90/17/355899017.db2.gz	IWRWQKKLZUWGCN-AWEZNQCLSA-N	1	0	279.336	1.711	50	0		CDAARO
O=c1c2nccnc2ncn1C[C@H]1CC[N@@H+](C2CCCC2)C1	ZINC000584901791	355956669	/nfs/dbraw/zinc/95/66/69/355956669.db2.gz	YCTMMVACWVOHHO-LBPRGKRZSA-N	1	0	299.378	1.451	50	0		CDAARO
C[NH2+]Cc1ccccc1Oc1ccc(S(N)(=O)=O)cc1	ZINC000012359908	356294984	/nfs/dbraw/zinc/29/49/84/356294984.db2.gz	AFXXBAMJRRMZDG-UHFFFAOYSA-N	1	0	292.360	1.846	50	0		CDAARO
COC(=O)c1ccc(NC(=O)CC[NH+]2CCCC2)cc1	ZINC000012417830	356299446	/nfs/dbraw/zinc/29/94/46/356299446.db2.gz	PDFFGRCNRNJNKY-UHFFFAOYSA-N	1	0	276.336	1.898	50	0		CDAARO
Cc1c(C)n(CC[NH+](C)C)c2ncn3ncnc3c12	ZINC000013624255	356350928	/nfs/dbraw/zinc/35/09/28/356350928.db2.gz	SXVUYNRHSWUUKQ-UHFFFAOYSA-N	1	0	258.329	1.257	50	0		CDAARO
COCC[NH2+]CC[C@@H]1CCC(=O)N1CCc1ccccc1	ZINC000014999150	356403481	/nfs/dbraw/zinc/40/34/81/356403481.db2.gz	LFNJXNCQRGZCKB-INIZCTEOSA-N	1	0	290.407	1.846	50	0		CDAARO
CC(C)[NH2+][C@H]1CC(=O)N(Cc2cccc(F)c2)C1	ZINC000015074770	356405475	/nfs/dbraw/zinc/40/54/75/356405475.db2.gz	WFWCOQGIRJBFBR-ZDUSSCGKSA-N	1	0	250.317	1.925	50	0		CDAARO
C[NH+]1CCC(NC(=O)Cc2ccc(F)cc2)CC1	ZINC000016580090	356442085	/nfs/dbraw/zinc/44/20/85/356442085.db2.gz	QWGSBCIJSPVREW-UHFFFAOYSA-N	1	0	250.317	1.579	50	0		CDAARO
Cc1ccc(C(=O)O[C@@H](C)CN2CC[NH+](C)CC2)cc1	ZINC000019359362	356482358	/nfs/dbraw/zinc/48/23/58/356482358.db2.gz	BQUNOPATNHQYBA-AWEZNQCLSA-N	1	0	276.380	1.788	50	0		CDAARO
O=C(CN1CC[NH2+]CC1)Nc1ccc(Cl)cc1	ZINC000019390164	356483722	/nfs/dbraw/zinc/48/37/22/356483722.db2.gz	CGCCARCEEBACDW-UHFFFAOYSA-N	1	0	253.733	1.184	50	0		CDAARO
Cc1ccc2oc(=O)cc(CN3CC[NH+](C)CC3)c2c1	ZINC000019371628	356483802	/nfs/dbraw/zinc/48/38/02/356483802.db2.gz	MDSLGVAEIWLHRS-UHFFFAOYSA-N	1	0	272.348	1.849	50	0		CDAARO
Cc1ccc(O[C@@H](C)C(=O)N2CC[NH2+]CC2)c(C)c1	ZINC000019519280	356489728	/nfs/dbraw/zinc/48/97/28/356489728.db2.gz	GBHANYNRBPPGSI-ZDUSSCGKSA-N	1	0	262.353	1.503	50	0		CDAARO
CC[NH+]1CCN(Cc2ccc(OC)cc2OC)CC1	ZINC000019536863	356491012	/nfs/dbraw/zinc/49/10/12/356491012.db2.gz	GELRKJLGIUHMLO-UHFFFAOYSA-N	1	0	264.369	1.841	50	0		CDAARO
COc1cc(CN2CC[NH+](C)CC2)cc(OC)c1	ZINC000019606932	356493543	/nfs/dbraw/zinc/49/35/43/356493543.db2.gz	LUUQSXVZEMAWME-UHFFFAOYSA-N	1	0	250.342	1.451	50	0		CDAARO
Cc1ccc(OCCNCC[NH3+])c(Br)c1	ZINC000020117871	356525690	/nfs/dbraw/zinc/52/56/90/356525690.db2.gz	CWDIVTPUATZCHC-UHFFFAOYSA-N	1	0	273.174	1.685	50	0		CDAARO
CC(C)CC(=O)N1CCC([NH+]2CCOCC2)CC1	ZINC000019888801	356514750	/nfs/dbraw/zinc/51/47/50/356514750.db2.gz	UXVAGNTVHAOFQP-UHFFFAOYSA-N	1	0	254.374	1.356	50	0		CDAARO
CCCCNC(=O)NCC1([NH3+])CCC(F)(F)CC1	ZINC000725254991	538451377	/nfs/dbraw/zinc/45/13/77/538451377.db2.gz	MSAVRBNTQKAWQJ-UHFFFAOYSA-N	1	0	263.332	1.993	50	0		CDAARO
C[NH+](C)CCn1cc(-c2cncc(Br)c2)nn1	ZINC000725270371	538461080	/nfs/dbraw/zinc/46/10/80/538461080.db2.gz	JESCVCPGERUXCR-UHFFFAOYSA-N	1	0	296.172	1.664	50	0		CDAARO
[NH3+]CC(=O)N1CCC([C@H](O)c2ccc(Cl)cc2)CC1	ZINC000269044633	356780604	/nfs/dbraw/zinc/78/06/04/356780604.db2.gz	CLIXJEYDGZJHJF-CQSZACIVSA-N	1	0	282.771	1.571	50	0		CDAARO
CC(C)=CCC[C@H](C)[NH2+]C[C@H]1CCN(S(C)(=O)=O)C1	ZINC000090797113	356831499	/nfs/dbraw/zinc/83/14/99/356831499.db2.gz	WFOCDXJNMLLWDI-UONOGXRCSA-N	1	0	288.457	1.992	50	0		CDAARO
CNC(=O)[C@H]1C[N@H+](CCCCc2ccccc2)CCO1	ZINC000187468106	356967262	/nfs/dbraw/zinc/96/72/62/356967262.db2.gz	UBIDDPVBQMEOAG-OAHLLOKOSA-N	1	0	276.380	1.456	50	0		CDAARO
C[C@H](C(=O)NCCc1nccn1C)[NH+]1CCCCCC1	ZINC000095404151	357197807	/nfs/dbraw/zinc/19/78/07/357197807.db2.gz	SLBCHUXDQHZGBN-CYBMUJFWSA-N	1	0	278.400	1.343	50	0		CDAARO
[NH3+][C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000054918281	357325917	/nfs/dbraw/zinc/32/59/17/357325917.db2.gz	JGZOEQPCTDHQRN-OAHLLOKOSA-N	1	0	254.333	1.873	50	0		CDAARO
COCCC(=O)N(CC[NH+](C)C)Cc1ccccc1C	ZINC000055052625	357327646	/nfs/dbraw/zinc/32/76/46/357327646.db2.gz	YSTNEZOZYNEOEW-UHFFFAOYSA-N	1	0	278.396	1.922	50	0		CDAARO
CN1CC[NH+](C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000059722320	357433892	/nfs/dbraw/zinc/43/38/92/357433892.db2.gz	PUGUVPMTGGMMAB-UHFFFAOYSA-N	1	0	283.416	1.633	50	0		CDAARO
C[C@H](CO)[NH+]1CCN(c2ccnc(C(C)(C)C)n2)CC1	ZINC000096453665	357476847	/nfs/dbraw/zinc/47/68/47/357476847.db2.gz	GDELIBPRKMNYQJ-GFCCVEGCSA-N	1	0	278.400	1.277	50	0		CDAARO
C[C@@H](COc1ccccc1)[NH2+]CCc1nnc(N)s1	ZINC000065382310	357534520	/nfs/dbraw/zinc/53/45/20/357534520.db2.gz	CLTZDKYXJAVXTN-JTQLQIEISA-N	1	0	278.381	1.720	50	0		CDAARO
Cc1cc(N2CCO[C@H](C[NH3+])C2)nc(-c2ccccc2)n1	ZINC000065460483	357543594	/nfs/dbraw/zinc/54/35/94/357543594.db2.gz	GPXWEWGKQVMWII-CQSZACIVSA-N	1	0	284.363	1.616	50	0		CDAARO
Cc1nnsc1C(=O)NC[C@H]1CCC[N@@H+](CC(C)C)C1	ZINC000067772157	357625881	/nfs/dbraw/zinc/62/58/81/357625881.db2.gz	LHUHUMUCCUWVEO-GFCCVEGCSA-N	1	0	296.440	1.944	50	0		CDAARO
CC[C@@H]1CN(C(=O)c2ccc3c(c2)OCO3)CC[NH2+]1	ZINC000067513753	357612005	/nfs/dbraw/zinc/61/20/05/357612005.db2.gz	RGMMHPBBTCHREQ-LLVKDONJSA-N	1	0	262.309	1.239	50	0		CDAARO
CCNc1cc(N2CCN(C(=O)CC)CC2)nc(C)[nH+]1	ZINC000067602210	357613947	/nfs/dbraw/zinc/61/39/47/357613947.db2.gz	GCJSYAADYPLGAU-UHFFFAOYSA-N	1	0	277.372	1.275	50	0		CDAARO
CCC[N@@H+]1CCN(C)C2(CCN(C(=O)CCOC)CC2)C1	ZINC000067642806	357616615	/nfs/dbraw/zinc/61/66/15/357616615.db2.gz	IBSBMRVVHXMIMW-UHFFFAOYSA-N	1	0	297.443	1.042	50	0		CDAARO
O=C(C[NH2+]CCc1c[nH]c2ccccc12)Nc1cnccn1	ZINC000067849984	357632199	/nfs/dbraw/zinc/63/21/99/357632199.db2.gz	BKXQZCMCLACMSC-UHFFFAOYSA-N	1	0	295.346	1.729	50	0		CDAARO
Cc1cc(=O)c(C(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)c[nH]1	ZINC000067946495	357638390	/nfs/dbraw/zinc/63/83/90/357638390.db2.gz	OXAOYBMWCRGANB-CYBMUJFWSA-N	1	0	291.395	1.391	50	0		CDAARO
CNC(=O)C(C)(C)[N@H+](C)C[C@H]1CCOC(C)(C)C1	ZINC000065490928	283281975	/nfs/dbraw/zinc/28/19/75/283281975.db2.gz	HKCQMBNVNZNBIP-NSHDSACASA-N	1	0	256.390	1.648	50	0		CDAARO
CCN(C(=O)C[NH+]1CCC(c2cn[nH]c2)CC1)C1CC1	ZINC000097203455	358033595	/nfs/dbraw/zinc/03/35/95/358033595.db2.gz	AXJBAEVSRSNQAZ-UHFFFAOYSA-N	1	0	276.384	1.600	50	0		CDAARO
Cc1cccc(S(=O)(=O)N[C@H]2CCC[NH2+]C2)c1Cl	ZINC000097234911	358050459	/nfs/dbraw/zinc/05/04/59/358050459.db2.gz	GMJWEADLBPXGEN-JTQLQIEISA-N	1	0	288.800	1.679	50	0		CDAARO
CC[C@H]1CN(C(=O)Cc2cccnc2)CC[N@@H+]1C(C)C	ZINC000082120934	358147730	/nfs/dbraw/zinc/14/77/30/358147730.db2.gz	VIOKTBQYOHKPPW-HNNXBMFYSA-N	1	0	275.396	1.955	50	0		CDAARO
CC(C)c1cc(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)[nH]n1	ZINC000192485330	358208296	/nfs/dbraw/zinc/20/82/96/358208296.db2.gz	MVNHRBKRNIYJGF-PHIMTYICSA-N	1	0	262.357	1.167	50	0		CDAARO
CC[C@H](C)[C@H]([NH3+])C(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1	ZINC000195554596	358557813	/nfs/dbraw/zinc/55/78/13/358557813.db2.gz	UUIVQKHBAVRWQA-UGQVUOCMSA-N	1	0	293.455	1.835	50	0		CDAARO
C[C@]1(O)CC[N@H+](CCc2c[nH]c3ccccc23)C[C@@H]1O	ZINC000096164601	358711890	/nfs/dbraw/zinc/71/18/90/358711890.db2.gz	YOIQVSBCKFRVHZ-HOTGVXAUSA-N	1	0	274.364	1.528	50	0		CDAARO
Nc1ccnc(N2CCC[C@H](C[NH+]3CCCCC3)C2)n1	ZINC000096163592	358712352	/nfs/dbraw/zinc/71/23/52/358712352.db2.gz	FWSQLYGTTBMKCU-CYBMUJFWSA-N	1	0	275.400	1.761	50	0		CDAARO
COc1ccc2ccccc2c1CNCC[NH2+]C[C@H](C)O	ZINC000096318715	358732736	/nfs/dbraw/zinc/73/27/36/358732736.db2.gz	FIYUUQWXOFFGNT-ZDUSSCGKSA-N	1	0	288.391	1.908	50	0		CDAARO
Cc1nccn1CC1CC[NH+](C[C@H]2CCOC2)CC1	ZINC000097468355	358778834	/nfs/dbraw/zinc/77/88/34/358778834.db2.gz	ZSGRDYPZXCTIGR-OAHLLOKOSA-N	1	0	263.385	1.940	50	0		CDAARO
Cc1nccn1CC1CC[NH+](C[C@@H]2CCOC2)CC1	ZINC000097468353	358779211	/nfs/dbraw/zinc/77/92/11/358779211.db2.gz	ZSGRDYPZXCTIGR-HNNXBMFYSA-N	1	0	263.385	1.940	50	0		CDAARO
Cc1nc(C(=O)N2[C@@H]3CC[C@H]2C[NH2+]CC3)c(C)s1	ZINC000097515046	358781369	/nfs/dbraw/zinc/78/13/69/358781369.db2.gz	YCLLQVHBOZYTRF-MNOVXSKESA-N	1	0	265.382	1.726	50	0		CDAARO
CC[N@H+](C/C=C/c1ccc(F)cc1)[C@H]1COC[C@@H]1O	ZINC000097572319	358786083	/nfs/dbraw/zinc/78/60/83/358786083.db2.gz	FMVOHJKCTGJNAF-WCYDHSITSA-N	1	0	265.328	1.921	50	0		CDAARO
Cc1c[nH]c(CN2CCC([NH+]3CCC(O)CC3)CC2)n1	ZINC000097619653	358788673	/nfs/dbraw/zinc/78/86/73/358788673.db2.gz	PIVNRQKGFUDVCK-UHFFFAOYSA-N	1	0	278.400	1.139	50	0		CDAARO
CC(C)c1ncc(CN2CCN([C@@H]3CC[NH2+]C3)CC2)cn1	ZINC000097618861	358788692	/nfs/dbraw/zinc/78/86/92/358788692.db2.gz	KVWALNMOGSHDEY-OAHLLOKOSA-N	1	0	289.427	1.080	50	0		CDAARO
C[NH+](C)[C@@H]1C[C@@H](CO)N(Cc2ccc(Cl)o2)C1	ZINC000215943005	358911344	/nfs/dbraw/zinc/91/13/44/358911344.db2.gz	VISYORDGDCCVTQ-ZJUUUORDSA-N	1	0	258.749	1.430	50	0		CDAARO
Cc1n[nH]c(C)c1CCC[N@@H+](C)C[C@@H]1CCOC1	ZINC000215808771	358904829	/nfs/dbraw/zinc/90/48/29/358904829.db2.gz	RSVACLBWTVYYHZ-ZDUSSCGKSA-N	1	0	251.374	1.927	50	0		CDAARO
C[N@@H+]1CCN(Cc2ccc(F)c(Cl)c2)C[C@@H]1CO	ZINC000216466548	358946635	/nfs/dbraw/zinc/94/66/35/358946635.db2.gz	IZSSHQHTOUHKLC-LLVKDONJSA-N	1	0	272.751	1.587	50	0		CDAARO
C[C@@H](C(=O)NC1CCCCC1)[NH+]1CCC2(CC1)OCCO2	ZINC000028077649	359523415	/nfs/dbraw/zinc/52/34/15/359523415.db2.gz	OUDUPRDSECRDNY-ZDUSSCGKSA-N	1	0	296.411	1.663	50	0		CDAARO
O=C(N1CCc2ccccc21)C1(n2cccn2)CC[NH2+]CC1	ZINC000262029138	359603307	/nfs/dbraw/zinc/60/33/07/359603307.db2.gz	XJOKGOAPTIZLRC-UHFFFAOYSA-N	1	0	296.374	1.551	50	0		CDAARO
Cc1ccc(SCC[NH+]2CCN(CCO)CC2)cc1	ZINC000033359706	359708202	/nfs/dbraw/zinc/70/82/02/359708202.db2.gz	DXKDXFXZQPCQCD-UHFFFAOYSA-N	1	0	280.437	1.697	50	0		CDAARO
COc1cccc(C(=O)NC[C@@H]2CC[C@H](C)[N@@H+]2C)c1	ZINC000521394089	359966527	/nfs/dbraw/zinc/96/65/27/359966527.db2.gz	YWFRCGNCFAVTKS-AAEUAGOBSA-N	1	0	262.353	1.908	50	0		CDAARO
CC(C)C(=O)N1CCC2(C[N@@H+](C3CCC3)C[C@H]2CO)CC1	ZINC000409419604	360226767	/nfs/dbraw/zinc/22/67/67/360226767.db2.gz	ATOWWMAYAXDDKU-AWEZNQCLSA-N	1	0	294.439	1.728	50	0		CDAARO
Cc1cccn2c(CN3CCC[C@H]3C(=O)NC3CC3)cnc12	ZINC000121485021	360242462	/nfs/dbraw/zinc/24/24/62/360242462.db2.gz	BKNVDWUTCKSPMJ-HNNXBMFYSA-N	1	0	298.390	1.886	50	0		CDAARO
O=C1C[C@@H]([NH2+]C2CCOCC2)CN1CCc1ccccc1	ZINC000011874570	360381614	/nfs/dbraw/zinc/38/16/14/360381614.db2.gz	IRCFSYWKZQXVFT-MRXNPFEDSA-N	1	0	288.391	1.599	50	0		CDAARO
C[C@H](C(=O)N1CCC[C@H]1[C@H]1CCC[N@@H+]1C)n1cccn1	ZINC000248158299	360417735	/nfs/dbraw/zinc/41/77/35/360417735.db2.gz	WNXWDXZFXJULEB-MCIONIFRSA-N	1	0	276.384	1.529	50	0		CDAARO
CO[C@@H]1CC[C@@]2(OC)CC[N@H+](Cc3nc(C)c[nH]3)[C@H]2C1	ZINC000426433592	360527866	/nfs/dbraw/zinc/52/78/66/360527866.db2.gz	HMODSTGSNCKISX-VNHYZAJKSA-N	1	0	279.384	1.877	50	0		CDAARO
Cc1cc(C)cc(CNC(=O)NC[C@]2(O)CCC[NH2+]C2)c1	ZINC000426435015	360530916	/nfs/dbraw/zinc/53/09/16/360530916.db2.gz	URFVNJSVGXUCPW-INIZCTEOSA-N	1	0	291.395	1.217	50	0		CDAARO
Cc1nnc(CNC(=O)C[C@H]2CCCC[N@H+]2C)s1	ZINC000426593547	360686643	/nfs/dbraw/zinc/68/66/43/360686643.db2.gz	CPFTUQWHFKPAOS-SNVBAGLBSA-N	1	0	268.386	1.337	50	0		CDAARO
[NH3+]C[C@H]1CCN(C(=O)c2ccccc2OCC2CC2)C1	ZINC000178560530	189126980	/nfs/dbraw/zinc/12/69/80/189126980.db2.gz	SDRDLXQGCRECQY-CYBMUJFWSA-N	1	0	274.364	1.896	50	0		CDAARO
[NH3+]CCOc1ccc(CC(=O)N2CCC(F)(F)CC2)cc1	ZINC000426722428	360698747	/nfs/dbraw/zinc/69/87/47/360698747.db2.gz	LIVGZBAVHLWEGN-UHFFFAOYSA-N	1	0	298.333	1.824	50	0		CDAARO
Cc1cccc(S(=O)(=O)NC[C@H]([NH3+])c2ccccc2)c1	ZINC000036297555	361462370	/nfs/dbraw/zinc/46/23/70/361462370.db2.gz	NIBUSPRFIPBQKU-HNNXBMFYSA-N	1	0	290.388	1.973	50	0		CDAARO
C[C@@H]([NH2+][C@@H]1C=C[C@H](CO)C1)c1ccc(-n2cncn2)cc1	ZINC000183570804	189362652	/nfs/dbraw/zinc/36/26/52/189362652.db2.gz	VZNBBQNTYQYUMH-VNHYZAJKSA-N	1	0	284.363	1.855	50	0		CDAARO
O[C@H](Cn1ccc2ccccc21)CN1CCOCC1	ZINC000020060365	361582611	/nfs/dbraw/zinc/58/26/11/361582611.db2.gz	PFCCRVSTTSDWEQ-AWEZNQCLSA-N	1	0	260.337	1.334	50	0		CDAARO
CCNC(=O)NC(=O)C[NH2+][C@@H](C)c1cc(C)ccc1C	ZINC000012886341	364142647	/nfs/dbraw/zinc/14/26/47/364142647.db2.gz	YFVCZFCAYSKDTI-LBPRGKRZSA-N	1	0	277.368	1.800	50	0		CDAARO
c1c[nH]c(CNCC2([NH+]3CCCCC3)CCOCC2)n1	ZINC000111403618	364956469	/nfs/dbraw/zinc/95/64/69/364956469.db2.gz	YFHYJZRFUYFBNM-UHFFFAOYSA-N	1	0	278.400	1.534	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)C1CCOCC1	ZINC000249690193	365163115	/nfs/dbraw/zinc/16/31/15/365163115.db2.gz	KCCBYIGWKMWLEL-HUUCEWRRSA-N	1	0	280.412	1.888	50	0		CDAARO
Cc1csc(S(=O)(=O)N[C@@H]2CCC[C@H]2[NH+](C)C)c1	ZINC000641440106	365437397	/nfs/dbraw/zinc/43/73/97/365437397.db2.gz	DRMANIFLRRYZJO-GHMZBOCLSA-N	1	0	288.438	1.818	50	0		CDAARO
CC(C)[N@H+](C)CC(=O)N[C@@H](C)[C@H](O)c1cccc(F)c1	ZINC000089869444	366952033	/nfs/dbraw/zinc/95/20/33/366952033.db2.gz	MGNVQGPLAYMVJM-NHYWBVRUSA-N	1	0	282.359	1.704	50	0		CDAARO
C[C@@H]1C[N@H+](C)CCN1CCCn1c2ccccc2oc1=O	ZINC000089939232	366974520	/nfs/dbraw/zinc/97/45/20/366974520.db2.gz	VIRBMMLGZHWUME-CYBMUJFWSA-N	1	0	289.379	1.621	50	0		CDAARO
CCCc1noc([C@H](C)[NH2+][C@@H]2CCN(C(C)=O)C[C@@H]2C)n1	ZINC000089960488	366984457	/nfs/dbraw/zinc/98/44/57/366984457.db2.gz	UXDFIYUWEUWTPH-GMXVVIOVSA-N	1	0	294.399	1.930	50	0		CDAARO
CC(C)COCC[NH2+]C1(CO)Cc2ccccc2C1	ZINC000252508367	367655635	/nfs/dbraw/zinc/65/56/35/367655635.db2.gz	XLQFJBPCUROLPT-UHFFFAOYSA-N	1	0	263.381	1.779	50	0		CDAARO
CC[C@@H]1C[N@@H+]([C@@H]2C[C@@H](C)O[C@@H](C)C2)CCN1C[C@H](C)O	ZINC000252517744	367741576	/nfs/dbraw/zinc/74/15/76/367741576.db2.gz	QGMZKBYZLRBSRP-RBZJEDDUSA-N	1	0	284.444	1.719	50	0		CDAARO
C[C@H](OCc1ccccc1)[C@@H]([NH3+])C(=O)Nc1cccnc1	ZINC000638048234	367798179	/nfs/dbraw/zinc/79/81/79/367798179.db2.gz	PHGLEQHWKPHBKO-SWLSCSKDSA-N	1	0	285.347	1.953	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+]1C[C@H]1CCc2ccccc2C1	ZINC000252584729	368161388	/nfs/dbraw/zinc/16/13/88/368161388.db2.gz	CJYXIPGPCYXWNO-RCBQFDQVSA-N	1	0	289.375	1.400	50	0		CDAARO
COc1ccccc1S(=O)(=O)N[C@@H]1CCC[C@H]1C[NH3+]	ZINC000089091801	368832711	/nfs/dbraw/zinc/83/27/11/368832711.db2.gz	LGWWXCIFHKYCNG-WDEREUQCSA-N	1	0	284.381	1.101	50	0		CDAARO
O=C1NCCCC[C@H]1[N@@H+]1CCC[C@@H](OCC2CC2)C1	ZINC000375321349	376204036	/nfs/dbraw/zinc/20/40/36/376204036.db2.gz	VCQHIASGRBGOKQ-ZIAGYGMSSA-N	1	0	266.385	1.546	50	0		CDAARO
CC(C)C[C@@H]([NH3+])C(=O)NCc1nncn1C1CCCCC1	ZINC000071774524	541870725	/nfs/dbraw/zinc/87/07/25/541870725.db2.gz	QLVIEKGFTUJUFR-CYBMUJFWSA-N	1	0	293.415	1.773	50	0		CDAARO
CC(C)(C)OC(=O)N[C@@H]1CC[N@@H+](C2CCOCC2)C1	ZINC000067800939	372358640	/nfs/dbraw/zinc/35/86/40/372358640.db2.gz	ZCXDCILJOPQCNH-LLVKDONJSA-N	1	0	270.373	1.764	50	0		CDAARO
O=C(Cc1cccs1)N1CC[C@@H]2[NH2+]CCC[C@@H]2C1	ZINC000299758880	372746935	/nfs/dbraw/zinc/74/69/35/372746935.db2.gz	DYQKXSFZQFVSLD-YPMHNXCESA-N	1	0	264.394	1.891	50	0		CDAARO
CO[C@@H]1CC[C@@]2(OC)CC[N@H+](Cc3nc(C)no3)[C@H]2C1	ZINC000299773404	372752604	/nfs/dbraw/zinc/75/26/04/372752604.db2.gz	AHBMZENRDJPNFZ-MBNYWOFBSA-N	1	0	281.356	1.536	50	0		CDAARO
CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000037800012	373339852	/nfs/dbraw/zinc/33/98/52/373339852.db2.gz	FDYUEXSHPWNZFT-WPRPVWTQSA-N	1	0	288.800	1.473	50	0		CDAARO
Cc1noc([C@@H]2C[N@H+](Cc3ccoc3)C[C@H]2CO)n1	ZINC000253404270	373692126	/nfs/dbraw/zinc/69/21/26/373692126.db2.gz	HTAICXVSTXVCJS-NWDGAFQWSA-N	1	0	263.297	1.179	50	0		CDAARO
C[C@@H]1[NH2+]CCC[C@@H]1NC(=O)Cc1ccc(F)cc1F	ZINC000095066534	373706556	/nfs/dbraw/zinc/70/65/56/373706556.db2.gz	FNGZTJNRLRFTOO-ZANVPECISA-N	1	0	268.307	1.764	50	0		CDAARO
Cn1nccc1C[NH2+]C[C@@H]1Cc2ccccc2N(C)C1	ZINC000253433376	373748807	/nfs/dbraw/zinc/74/88/07/373748807.db2.gz	WFDOBDMUFSUYRW-ZDUSSCGKSA-N	1	0	270.380	1.818	50	0		CDAARO
COc1ncccc1C(=O)N1CC[C@H](Oc2ccncc2)C1	ZINC000120930849	374167093	/nfs/dbraw/zinc/16/70/93/374167093.db2.gz	OKQKGKKLNHTQAW-ZDUSSCGKSA-N	1	0	299.330	1.779	50	0		CDAARO
Cc1ccc(NC(=O)NCC[NH+]2CCC(O)CC2)cc1C	ZINC000206610092	374179701	/nfs/dbraw/zinc/17/97/01/374179701.db2.gz	YPXFRIQAXWTUPM-UHFFFAOYSA-N	1	0	291.395	1.882	50	0		CDAARO
Cc1cccc(S(=O)(=O)N2CCC[C@H]([C@@H](C)[NH3+])C2)c1	ZINC000111713081	374201532	/nfs/dbraw/zinc/20/15/32/374201532.db2.gz	NUQJHVBUEBXYOM-OLZOCXBDSA-N	1	0	282.409	1.743	50	0		CDAARO
OC1(C[NH2+]Cc2ccc(-n3cccn3)cc2)CCOCC1	ZINC000112717267	374227661	/nfs/dbraw/zinc/22/76/61/374227661.db2.gz	RRSVARGRLZMNNQ-UHFFFAOYSA-N	1	0	287.363	1.503	50	0		CDAARO
CS(=O)(=O)[C@@H]1CCCC[C@@H]1[NH2+]Cc1cccnc1	ZINC000095427022	374927466	/nfs/dbraw/zinc/92/74/66/374927466.db2.gz	LNJMPFOYXYKXKJ-QWHCGFSZSA-N	1	0	268.382	1.527	50	0		CDAARO
C[C@H](C(=O)NCC(F)(F)F)[N@H+](C)C[C@@H]1CCCCO1	ZINC000095430179	374932435	/nfs/dbraw/zinc/93/24/35/374932435.db2.gz	UMGFQTBMGKDCLS-ZJUUUORDSA-N	1	0	282.306	1.554	50	0		CDAARO
CSc1ccc(NC[C@@H]2C[N@H+](CC(C)C)CCO2)nn1	ZINC000095407714	374911365	/nfs/dbraw/zinc/91/13/65/374911365.db2.gz	POKDPNIIVFAWOY-GFCCVEGCSA-N	1	0	296.440	1.967	50	0		CDAARO
CC(C)(C)OCCC[N@@H+]1CC[C@@H](CN2CCOCC2)C1	ZINC000095410509	374912780	/nfs/dbraw/zinc/91/27/80/374912780.db2.gz	BYOHIKKESOOZNK-OAHLLOKOSA-N	1	0	284.444	1.846	50	0		CDAARO
CC(C)([NH3+])C(=O)N1CCC([C@H](O)c2ccc(F)cc2)CC1	ZINC000299747476	375206883	/nfs/dbraw/zinc/20/68/83/375206883.db2.gz	DDDXEHCWNCVGFB-CQSZACIVSA-N	1	0	294.370	1.835	50	0		CDAARO
CCCn1ccc(C(=O)N2CC[N@@H+]3CCC[C@H]3C2)n1	ZINC000028244555	375219802	/nfs/dbraw/zinc/21/98/02/375219802.db2.gz	KKQJKLNNYYAAGC-LBPRGKRZSA-N	1	0	262.357	1.213	50	0		CDAARO
COc1ccc(OCC[NH2+]C[C@H]2CCCO2)cc1	ZINC000003247031	375601932	/nfs/dbraw/zinc/60/19/32/375601932.db2.gz	WWNHKUSYSXLHAB-CQSZACIVSA-N	1	0	251.326	1.843	50	0		CDAARO
OC[C@H]([NH2+][C@@H]1Cc2ccccc2[C@H]1O)c1ccccc1	ZINC000241371401	376018988	/nfs/dbraw/zinc/01/89/88/376018988.db2.gz	MNGSIXOJRACXGG-IXDOHACOSA-N	1	0	269.344	1.968	50	0		CDAARO
CCOCCN1CC[N@H+](C[C@@H](O)c2ccccc2)C[C@H]1C	ZINC000242389443	376020735	/nfs/dbraw/zinc/02/07/35/376020735.db2.gz	ZXGPTXPFXNQJJI-NVXWUHKLSA-N	1	0	292.423	1.763	50	0		CDAARO
Cc1nc(CC[NH3+])cc(NCc2cn3c(n2)SCC3)n1	ZINC000067433044	377073591	/nfs/dbraw/zinc/07/35/91/377073591.db2.gz	ALUCMQZPECEVSM-UHFFFAOYSA-N	1	0	290.396	1.201	50	0		CDAARO
COc1ncc(C[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)cn1	ZINC000067786110	377238749	/nfs/dbraw/zinc/23/87/49/377238749.db2.gz	LQQOPQPSZVNYFG-LBPRGKRZSA-N	1	0	273.340	1.588	50	0		CDAARO
Cc1nc2c(c(NCC3(Cn4cccn4)CC3)n1)CC[NH2+]C2	ZINC000067675778	377201622	/nfs/dbraw/zinc/20/16/22/377201622.db2.gz	DGAUJWCYNLRRHQ-UHFFFAOYSA-N	1	0	298.394	1.520	50	0		CDAARO
COC1CCC(C(=O)NC[C@@H]2CCC[N@H+](C)C2)CC1	ZINC000067967979	377336699	/nfs/dbraw/zinc/33/66/99/377336699.db2.gz	VMNSOKWZKRWGCD-HSBZDZAISA-N	1	0	268.401	1.650	50	0		CDAARO
COCCC1(CNC(=O)N[C@H]2CCC[N@H+](C)C2)CC1	ZINC000089375311	377848221	/nfs/dbraw/zinc/84/82/21/377848221.db2.gz	JBRHFEQRHWWSBW-LBPRGKRZSA-N	1	0	269.389	1.197	50	0		CDAARO
CN1CC[N@H+](C)C[C@H]1CNC(=O)N1CCCC(C)(C)CC1	ZINC000078952907	377905885	/nfs/dbraw/zinc/90/58/85/377905885.db2.gz	BNHLHRFRJRZKMB-CQSZACIVSA-N	1	0	296.459	1.454	50	0		CDAARO
CCC(C)(C)NC(=O)C[NH+]1CCC(C(=O)N(C)C)CC1	ZINC000012743485	377980320	/nfs/dbraw/zinc/98/03/20/377980320.db2.gz	MUOWKHCDHZMJJR-UHFFFAOYSA-N	1	0	283.416	1.091	50	0		CDAARO
CCNC(=O)N[C@H]1CC[N@H+](Cc2cnc(C)s2)C[C@H]1C	ZINC000245316873	378069557	/nfs/dbraw/zinc/06/95/57/378069557.db2.gz	LACLLWAMJGFKJS-MFKMUULPSA-N	1	0	296.440	1.981	50	0		CDAARO
COC(=O)[C@H]1CC(=O)N(OCCC(C)C)C12CC[NH2+]CC2	ZINC000299802752	291809557	/nfs/dbraw/zinc/80/95/57/291809557.db2.gz	OQMWUQKKJOVCOR-GFCCVEGCSA-N	1	0	298.383	1.108	50	0		CDAARO
COCCN1CCC[C@H]1C[NH2+]C1Cc2ccccc2C1	ZINC000096477034	285037615	/nfs/dbraw/zinc/03/76/15/285037615.db2.gz	PIIXXKWEZBQVFH-KRWDZBQOSA-N	1	0	274.408	1.854	50	0		CDAARO
OC1(C[NH2+]Cc2ccccc2Cl)CCOCC1	ZINC000112716995	285239165	/nfs/dbraw/zinc/23/91/65/285239165.db2.gz	FOEOBBZKBKTPLE-UHFFFAOYSA-N	1	0	255.745	1.971	50	0		CDAARO
COc1cccc(C[NH2+][C@@H]2CC(=O)N(C)C2)c1OC	ZINC000096403300	256791385	/nfs/dbraw/zinc/79/13/85/256791385.db2.gz	FHOBXFYYABXFHL-LLVKDONJSA-N	1	0	264.325	1.024	50	0		CDAARO
O=C(NCc1ccncn1)c1cccc([C@H]2CCC[NH2+]C2)c1	ZINC000095362760	184952869	/nfs/dbraw/zinc/95/28/69/184952869.db2.gz	SDPGBIOUPYXGBB-HNNXBMFYSA-N	1	0	296.374	1.874	50	0		CDAARO
O=C1NC(=O)[C@@]2(CCC[N@H+](Cc3ccccc3)C2)N1	ZINC000037325819	390413898	/nfs/dbraw/zinc/41/38/98/390413898.db2.gz	CRGSUMHEXUMJFZ-AWEZNQCLSA-N	1	0	259.309	1.701	50	0		CDAARO
Cc1cc(N)nc(N2CC[NH+](Cc3ccccc3)CC2)n1	ZINC000074934107	390662342	/nfs/dbraw/zinc/66/23/42/390662342.db2.gz	VLJFESVWIBKZDL-UHFFFAOYSA-N	1	0	283.379	1.689	50	0		CDAARO
O[C@H]1COCC[N@H+](CCCCOc2ccccc2)C1	ZINC000077438508	390810293	/nfs/dbraw/zinc/81/02/93/390810293.db2.gz	MSOBCGVOANDRFJ-CQSZACIVSA-N	1	0	265.353	1.539	50	0		CDAARO
CC(C)c1nn(C)c(Cl)c1C(=O)N(C)[C@@H]1CC[NH2+]C1	ZINC000179104707	390942540	/nfs/dbraw/zinc/94/25/40/390942540.db2.gz	ULMDCYKODSXBOJ-SECBINFHSA-N	1	0	284.791	1.631	50	0		CDAARO
Cc1cccc(-n2nc([C@H]3CCOC3)nc2C[NH2+]C2CC2)n1	ZINC000097604291	390917717	/nfs/dbraw/zinc/91/77/17/390917717.db2.gz	AFBSXVDLDOWGAC-LBPRGKRZSA-N	1	0	299.378	1.727	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)COCc2ccccc2Cl)C1	ZINC000178965712	390926227	/nfs/dbraw/zinc/92/62/27/390926227.db2.gz	ZGOAISHBFYATOP-LBPRGKRZSA-N	1	0	296.798	1.925	50	0		CDAARO
Cc1noc(C)c1[C@H](C)C(=O)N1CC[NH2+][C@H](C)C1	ZINC000188370929	390957433	/nfs/dbraw/zinc/95/74/33/390957433.db2.gz	QKBAAJJKLMWHHC-BDAKNGLRSA-N	1	0	251.330	1.215	50	0		CDAARO
CCOC(=O)[C@H](C)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1	ZINC000246822354	392019681	/nfs/dbraw/zinc/01/96/81/392019681.db2.gz	NUAGYNOMYKZNEN-YDHLFZDLSA-N	1	0	280.412	1.887	50	0		CDAARO
CN(C(=O)C1(c2ccccc2F)CC1)[C@@H]1CC[NH2+]C1	ZINC000269149338	132121655	/nfs/dbraw/zinc/12/16/55/132121655.db2.gz	MJDRWKFIDVBSAY-LLVKDONJSA-N	1	0	262.328	1.678	50	0		CDAARO
C[NH+](C)CCCNC(=O)[C@@]1(C)CC(c2ccccc2)=NO1	ZINC000096192707	393168242	/nfs/dbraw/zinc/16/82/42/393168242.db2.gz	UXVIEGQMOZJQRN-MRXNPFEDSA-N	1	0	289.379	1.638	50	0		CDAARO
C[C@H]1C[C@H](C)C[NH+](CC(=O)NC(=O)NCc2ccco2)C1	ZINC000007788242	393179934	/nfs/dbraw/zinc/17/99/34/393179934.db2.gz	ZWSQIZUDLPKUPB-RYUDHWBXSA-N	1	0	293.367	1.583	50	0		CDAARO
CC1(C)[C@H]([NH2+]C[C@H](O)Cn2ccnn2)[C@@H]2CCC[C@@H]21	ZINC000658035949	413145772	/nfs/dbraw/zinc/14/57/72/413145772.db2.gz	SOZVOPLAWFBJEP-QNWHQSFQSA-N	1	0	264.373	1.053	50	0		CDAARO
O=C(C1Cc2ccccc2C1)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000426439055	397708537	/nfs/dbraw/zinc/70/85/37/397708537.db2.gz	UXIZAGBEFFDVAB-CVEARBPZSA-N	1	0	270.376	1.754	50	0		CDAARO
CSCC[C@@H](C)NC(=O)N1CC[C@H]([NH+]2CC=CC2)C1	ZINC000101388693	397792117	/nfs/dbraw/zinc/79/21/17/397792117.db2.gz	MKBPMRSHANKTJG-OLZOCXBDSA-N	1	0	283.441	1.784	50	0		CDAARO
C[C@H](C(=O)Nc1sccc1C(N)=O)N1CCC[C@H](C)C1	ZINC000104714224	397949955	/nfs/dbraw/zinc/94/99/55/397949955.db2.gz	PAJZXEZUOOIMMH-VHSXEESVSA-N	1	0	295.408	1.906	50	0		CDAARO
C[C@@H]1C[C@H](C[NH3+])CN1C(=O)c1cccc2cn[nH]c21	ZINC000262070634	149008673	/nfs/dbraw/zinc/00/86/73/149008673.db2.gz	WUXBFPXEJRFMIB-NXEZZACHSA-N	1	0	258.325	1.372	50	0		CDAARO
COc1ccc(C[NH2+][C@@H]2CCCCNC2=O)cc1F	ZINC000037502277	286312026	/nfs/dbraw/zinc/31/20/26/286312026.db2.gz	GDGQKQWISBBZTP-GFCCVEGCSA-N	1	0	266.316	1.593	50	0		CDAARO
C[NH+](C)Cc1ccc(C(=O)N[C@H]2CCc3c[nH]nc3C2)cc1	ZINC000371956776	160064987	/nfs/dbraw/zinc/06/49/87/160064987.db2.gz	JSWHKOLMHAMDTO-HNNXBMFYSA-N	1	0	298.390	1.759	50	0		CDAARO
C[C@@H]1C[C@H]1N1C[C@H](Nc2ncnc(N)c2Cl)CC1=O	ZINC000372967594	160161586	/nfs/dbraw/zinc/16/15/86/160161586.db2.gz	OASGNRZBMIGLEO-BWZBUEFSSA-N	1	0	281.747	1.133	50	0		CDAARO
Cc1ccc(OC[C@H](O)C[NH2+]C(C)(C)CO)c(C)c1	ZINC000002476185	169793906	/nfs/dbraw/zinc/79/39/06/169793906.db2.gz	RLQYFLNOYKHAPH-CYBMUJFWSA-N	1	0	267.369	1.404	50	0		CDAARO
CC(=O)c1cc(N)ccc1OC[C@H](O)C[NH2+]C(C)C	ZINC000005138354	170069981	/nfs/dbraw/zinc/06/99/81/170069981.db2.gz	DBUJVRULIBQHKT-GFCCVEGCSA-N	1	0	266.341	1.209	50	0	in-vitro	CDAARO
Cc1noc(C)c1CSc1nc(N)cc(N)[nH+]1	ZINC000005229222	170077923	/nfs/dbraw/zinc/07/79/23/170077923.db2.gz	PIKVFWNVLSKDON-UHFFFAOYSA-N	1	0	251.315	1.538	50	0		CDAARO
C[N@H+](Cc1ccc2c(c1)OCCO2)[C@@H]1CCCCNC1=O	ZINC000009962076	170392504	/nfs/dbraw/zinc/39/25/04/170392504.db2.gz	QYVDSIJKSPOHER-CYBMUJFWSA-N	1	0	290.363	1.558	50	0		CDAARO
C[N@H+](CC(=O)Nc1ccc(C(N)=O)cc1)C1CCCCC1	ZINC000010023457	170395774	/nfs/dbraw/zinc/39/57/74/170395774.db2.gz	DENVQLXZRPMBOJ-UHFFFAOYSA-N	1	0	289.379	1.989	50	0		CDAARO
CN1CCC([N@@H+]2CCC[C@@H](NC(=O)C3CCCC3)C2)CC1	ZINC000020201141	171065545	/nfs/dbraw/zinc/06/55/45/171065545.db2.gz	FZZYTNFZHFRZGR-OAHLLOKOSA-N	1	0	293.455	1.851	50	0		CDAARO
C[C@@H](Oc1ccc(F)cc1)C(=O)N1CCC[N@H+](C)CC1	ZINC000020498946	171227394	/nfs/dbraw/zinc/22/73/94/171227394.db2.gz	RMFOXZVWMYXZIY-GFCCVEGCSA-N	1	0	280.343	1.757	50	0		CDAARO
CN(Cc1ccsc1)C[C@@H]1C[N@H+](C)CC[C@H]1O	ZINC000020540145	171241562	/nfs/dbraw/zinc/24/15/62/171241562.db2.gz	POQYGPCOMYOBTA-QWHCGFSZSA-N	1	0	254.399	1.493	50	0		CDAARO
CC(C)(C)NS(=O)(=O)Cc1ccc(C[NH3+])cc1	ZINC000020567163	171255201	/nfs/dbraw/zinc/25/52/01/171255201.db2.gz	HTMFFZFHEDTURN-UHFFFAOYSA-N	1	0	256.371	1.363	50	0		CDAARO
CCCc1cn(CC2CC[NH+](C[C@H]3CCOC3)CC2)nn1	ZINC000020598712	171266247	/nfs/dbraw/zinc/26/62/47/171266247.db2.gz	PEMRHHBLFURUPX-OAHLLOKOSA-N	1	0	292.427	1.979	50	0		CDAARO
CN1CC[N@H+](CCCC2CCCC2)C[C@@H]1CCO	ZINC000020783348	171272864	/nfs/dbraw/zinc/27/28/64/171272864.db2.gz	IEAVKJMXPCCZFU-HNNXBMFYSA-N	1	0	254.418	1.955	50	0		CDAARO
O=C(C[N@@H+]1CCC[C@H]1c1ccccc1)N1CCNC1=O	ZINC000021417037	171303639	/nfs/dbraw/zinc/30/36/39/171303639.db2.gz	JBWDUFVSPOTILO-ZDUSSCGKSA-N	1	0	273.336	1.375	50	0		CDAARO
C[C@@H](Cc1ccccc1F)[NH2+]CCN1CCOCC1	ZINC000022455363	171388406	/nfs/dbraw/zinc/38/84/06/171388406.db2.gz	QXIIGXDXESRKKG-ZDUSSCGKSA-N	1	0	266.360	1.679	50	0		CDAARO
CNC(=O)C1CC[NH+](Cc2cnn(-c3ccccc3)c2)CC1	ZINC000024838370	171442130	/nfs/dbraw/zinc/44/21/30/171442130.db2.gz	UVXYDNGQQBQXMO-UHFFFAOYSA-N	1	0	298.390	1.830	50	0		CDAARO
O=C(NC[C@@H]1CCC[NH2+]C1)Nc1cccc(F)c1	ZINC000038076421	174086864	/nfs/dbraw/zinc/08/68/64/174086864.db2.gz	NRJBUWGDABYNSR-SNVBAGLBSA-N	1	0	251.305	1.947	50	0		CDAARO
CC(C)Oc1ccc([C@@H](O)CN2CC[NH+](C)CC2)cc1	ZINC000044116657	175141765	/nfs/dbraw/zinc/14/17/65/175141765.db2.gz	JJRCHJVVHPEAKH-INIZCTEOSA-N	1	0	278.396	1.755	50	0		CDAARO
[NH3+][C@@H](CO)Cc1ccc(I)cc1	ZINC000044466883	175177675	/nfs/dbraw/zinc/17/76/75/175177675.db2.gz	MPCOBLKNQSOAGC-SECBINFHSA-N	1	0	277.105	1.153	50	0		CDAARO
COCc1c(C)onc1C(=O)N1CCC[C@]2(CC[NH2+]C2)C1	ZINC000067821685	175795557	/nfs/dbraw/zinc/79/55/57/175795557.db2.gz	UPLMOGKWULHUOL-OAHLLOKOSA-N	1	0	293.367	1.345	50	0		CDAARO
COc1ccccc1CCC(=O)N1CC[C@@H]([NH3+])[C@@H](OC)C1	ZINC000071415784	176160523	/nfs/dbraw/zinc/16/05/23/176160523.db2.gz	QBGDGURHIIISQA-HIFRSBDPSA-N	1	0	292.379	1.202	50	0		CDAARO
C[NH2+]CC(=O)N1CCC[C@@H]1c1nc2c(cccc2C)[nH]1	ZINC000071639469	176238591	/nfs/dbraw/zinc/23/85/91/176238591.db2.gz	BHINWJAEAOYNMD-GFCCVEGCSA-N	1	0	272.352	1.754	50	0		CDAARO
Cc1ccsc1CN(C(=O)[C@H]1C[NH2+]CCO1)C1CC1	ZINC000071662241	176242554	/nfs/dbraw/zinc/24/25/54/176242554.db2.gz	JGZFNZKGBOYLFU-GFCCVEGCSA-N	1	0	280.393	1.536	50	0		CDAARO
Cc1ccc(O[C@@H](C)C(=O)NCC[NH+](C)C)cc1C	ZINC000072119140	176319543	/nfs/dbraw/zinc/31/95/43/176319543.db2.gz	ABLWASRRLXJTAN-ZDUSSCGKSA-N	1	0	264.369	1.749	50	0		CDAARO
CC1(C)Cc2cccc(C[N@@H+]3CCC[C@@](O)(CO)C3)c2O1	ZINC000072153482	176328226	/nfs/dbraw/zinc/32/82/26/176328226.db2.gz	NOHVGJDNQJWVQT-KRWDZBQOSA-N	1	0	291.391	1.719	50	0		CDAARO
Cc1cc(C)cc(C(=O)NC[C@]2(O)CCC[NH2+]CC2)c1	ZINC000072158978	176329527	/nfs/dbraw/zinc/32/95/27/176329527.db2.gz	DVUPPLXEPNZEDA-INIZCTEOSA-N	1	0	276.380	1.538	50	0		CDAARO
Cc1cncc(C(=O)N2CCC[C@](O)(C[NH+](C)C)CC2)c1	ZINC000072166783	176331793	/nfs/dbraw/zinc/33/17/93/176331793.db2.gz	ZCASXLGGUQCBKX-MRXNPFEDSA-N	1	0	291.395	1.309	50	0		CDAARO
CC(C)c1ncc(S(C)(=O)=O)c([C@H]2CCC[NH2+]C2)n1	ZINC000077425234	177265721	/nfs/dbraw/zinc/26/57/21/177265721.db2.gz	RMZOYUHWXQRAKJ-JTQLQIEISA-N	1	0	283.397	1.471	50	0		CDAARO
COc1nccnc1-c1cc(C)cc2c1O[C@@H](C[NH3+])C2	ZINC000067851092	274170914	/nfs/dbraw/zinc/17/09/14/274170914.db2.gz	NNZPKEKWQDEFOJ-LLVKDONJSA-N	1	0	271.320	1.723	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]1)N1CCc2c(cnn2-c2ccccc2)C1	ZINC000261611026	275004105	/nfs/dbraw/zinc/00/41/05/275004105.db2.gz	CAEFMPRWDYDQJU-HNNXBMFYSA-N	1	0	296.374	1.509	50	0		CDAARO
CC1=C[C@H](C)[C@H]2C(=O)N(Cc3ccc[n+](C)c3)C(=O)[C@H]2C1	ZINC000004124578	275925161	/nfs/dbraw/zinc/92/51/61/275925161.db2.gz	PYBDZRRKYOKDCJ-AEGPPILISA-N	1	0	285.367	1.598	50	0		CDAARO
COCCN1CC[N@H+](C[C@H]2CCCCO2)C[C@H]1C	ZINC000247101655	277225254	/nfs/dbraw/zinc/22/52/54/277225254.db2.gz	IFPSMSFNHFHRTL-ZIAGYGMSSA-N	1	0	256.390	1.208	50	0		CDAARO
CC(C)[C@@H](CO)[NH2+]CC(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C	ZINC000097082211	277747243	/nfs/dbraw/zinc/74/72/43/277747243.db2.gz	NVUJHFTZFMPWQP-AAVRWANBSA-N	1	0	270.417	1.534	50	0		CDAARO
C[C@@H]1C[C@H](C)CN(C(=O)C2([NH3+])Cc3ccccc3C2)C1	ZINC000299739820	278000898	/nfs/dbraw/zinc/00/08/98/278000898.db2.gz	RPBAFNCNHKYSSK-BETUJISGSA-N	1	0	272.392	1.987	50	0		CDAARO
CC(C)c1cncnc1N1C[C@H](CO)[C@H](C[NH+](C)C)C1	ZINC000091706599	278066859	/nfs/dbraw/zinc/06/68/59/278066859.db2.gz	GCQMNKJDWUSBPI-CHWSQXEVSA-N	1	0	278.400	1.206	50	0		CDAARO
C[C@@H]1CN(C(=O)C[C@@H]([NH3+])c2ccccc2)C[C@@H](C)O1	ZINC000019426034	278646213	/nfs/dbraw/zinc/64/62/13/278646213.db2.gz	CMVFCAPGNXSBNG-YRGRVCCFSA-N	1	0	262.353	1.712	50	0		CDAARO
C[C@@H]1CN(CC[N@@H+]2CCCC[C@@H]2c2ccnn2C)CCO1	ZINC000253398424	288169617	/nfs/dbraw/zinc/16/96/17/288169617.db2.gz	POSADKDFIMECRH-GDBMZVCRSA-N	1	0	292.427	1.668	50	0		CDAARO
C[C@@H]1COC[C@H](C)N1C(=O)c1ccc2c(c1)CC[NH2+]CC2	ZINC000276719674	288377935	/nfs/dbraw/zinc/37/79/35/288377935.db2.gz	PRINLSXHUWTNAV-BETUJISGSA-N	1	0	288.391	1.624	50	0		CDAARO
C[C@H](c1cccnc1)N1CC[N@@H+](C[C@H](C)O)[C@@H](C)C1	ZINC000106840971	290271224	/nfs/dbraw/zinc/27/12/24/290271224.db2.gz	SRZSJHATCWPYQU-MELADBBJSA-N	1	0	263.385	1.530	50	0		CDAARO
Cc1cnc(C)c(NC[C@@H](O)C[NH+]2CCC(C)CC2)n1	ZINC000195563812	292888787	/nfs/dbraw/zinc/88/87/87/292888787.db2.gz	KSLINOKYXAMUAW-CQSZACIVSA-N	1	0	278.400	1.598	50	0		CDAARO
Cc1c(C(=O)N(CC[NH+](C)C)C[C@@H]2CCCO2)ccn1C	ZINC000195245074	300914711	/nfs/dbraw/zinc/91/47/11/300914711.db2.gz	YZFZVPSAHGYCQH-AWEZNQCLSA-N	1	0	293.411	1.516	50	0		CDAARO
O=C(COc1ccc(F)cc1)N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000534581964	328312342	/nfs/dbraw/zinc/31/23/42/328312342.db2.gz	KYMIIFPVWYAFKW-NMWPEEMBSA-N	1	0	290.338	1.413	50	0		CDAARO
O=C([C@@H]1C=CC[NH2+]1)N1Cc2cnc(-c3ccccc3)nc2C1	ZINC000534590161	328317840	/nfs/dbraw/zinc/31/78/40/328317840.db2.gz	AJYHKFRCVNANKD-AWEZNQCLSA-N	1	0	292.342	1.514	50	0		CDAARO
O=S(=O)(c1cccc(F)c1)N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000534629978	328328622	/nfs/dbraw/zinc/32/86/22/328328622.db2.gz	JFPRSAMCWKZUFJ-KPWCQOOUSA-N	1	0	296.367	1.197	50	0		CDAARO
Cc1ccccc1[C@@H](CNC(=O)c1cn[nH]n1)[NH+](C)C	ZINC000534644184	328330087	/nfs/dbraw/zinc/33/00/87/328330087.db2.gz	ZSWAUNCQPKLAMW-CYBMUJFWSA-N	1	0	273.340	1.146	50	0		CDAARO
CCOc1ccc(C(=O)NC[C@@H](C(C)C)[NH+](C)C)o1	ZINC000534635520	328333431	/nfs/dbraw/zinc/33/34/31/328333431.db2.gz	WELGOTYMWBRPOT-NSHDSACASA-N	1	0	268.357	1.994	50	0		CDAARO
CCCOC[C@@H]1CCN(C(=O)C2CC[NH2+]CC2)C1	ZINC000534659686	328342411	/nfs/dbraw/zinc/34/24/11/328342411.db2.gz	QBEHDZDUHKWKPC-GFCCVEGCSA-N	1	0	254.374	1.261	50	0		CDAARO
Cc1ccccc1N1CCC([NH2+][C@H]2CCNC2=O)CC1	ZINC000534654319	328338832	/nfs/dbraw/zinc/33/88/32/328338832.db2.gz	QOCKLYNEPRTNBT-AWEZNQCLSA-N	1	0	273.380	1.442	50	0		CDAARO
Cc1cc(C)nc(CNC(=O)c2ccc(C[NH3+])cc2)n1	ZINC000534655143	328339340	/nfs/dbraw/zinc/33/93/40/328339340.db2.gz	NHOYAOSTEAGEEJ-UHFFFAOYSA-N	1	0	270.336	1.482	50	0		CDAARO
Clc1cnc(N[C@H]2COC[C@@H]2[NH+]2CCCC2)nc1	ZINC000534655283	328339585	/nfs/dbraw/zinc/33/95/85/328339585.db2.gz	YUVUDGUTTXKNLB-QWRGUYRKSA-N	1	0	268.748	1.405	50	0		CDAARO
[NH3+]CC[C@@H]1CN(Cc2ccc3cc[nH]c3n2)CCO1	ZINC000534665548	328345175	/nfs/dbraw/zinc/34/51/75/328345175.db2.gz	HDSZFWLIGMJQTQ-CYBMUJFWSA-N	1	0	260.341	1.113	50	0		CDAARO
CCc1nccn1CCCNC(=O)[C@H]1CCC[NH2+]CC1	ZINC000534670112	328347065	/nfs/dbraw/zinc/34/70/65/328347065.db2.gz	ARJKCDNTKKUXRM-ZDUSSCGKSA-N	1	0	278.400	1.342	50	0		CDAARO
Cc1ccc(CNC(=O)N2C[C@H]3CC[C@@H](C2)[C@H]3[NH3+])cc1	ZINC000534676115	328356248	/nfs/dbraw/zinc/35/62/48/328356248.db2.gz	UKUHASCDHSDMTJ-FICVDOATSA-N	1	0	273.380	1.874	50	0		CDAARO
[NH3+][C@@H](C(=O)N1CCC(Cn2ccnn2)CC1)c1ccccc1	ZINC000097234153	323207536	/nfs/dbraw/zinc/20/75/36/323207536.db2.gz	OZUAYZIOIQZSQU-OAHLLOKOSA-N	1	0	299.378	1.217	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCO[C@H](c2ccc(F)c(C)c2)C1	ZINC000097234117	323207730	/nfs/dbraw/zinc/20/77/30/323207730.db2.gz	IWAIFQVRZCAJFF-KGLIPLIRSA-N	1	0	280.343	1.771	50	0		CDAARO
C[C@H](NC(=O)N1CC[C@H](C[NH+](C)C)C1)[C@@H]1CCOC1	ZINC000130148596	323210556	/nfs/dbraw/zinc/21/05/56/323210556.db2.gz	NUNLYNCOPGGQOX-YNEHKIRRSA-N	1	0	269.389	1.005	50	0		CDAARO
C[C@@H]1OCC[C@H]1[NH2+][C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000090919031	482519215	/nfs/dbraw/zinc/51/92/15/482519215.db2.gz	ZPCLXIWDZKCOCF-NUEKZKHPSA-N	1	0	288.391	1.945	50	0		CDAARO
COc1coc(CN(C)CCn2nc(C)cc2C)cc1=O	ZINC000670448034	483005590	/nfs/dbraw/zinc/00/55/90/483005590.db2.gz	OLHCRZKYHUUDJQ-UHFFFAOYSA-N	1	0	291.351	1.594	50	0		CDAARO
O=C(CCC(F)(F)F)NCCC[N@H+]1CCCC[C@H]1CO	ZINC000670456222	483036057	/nfs/dbraw/zinc/03/60/57/483036057.db2.gz	ZRWVZHZYDIXTJG-NSHDSACASA-N	1	0	296.333	1.682	50	0		CDAARO
COc1ccccc1-n1cc(CNC(=O)[C@@H]2C=CC[NH2+]2)cn1	ZINC000670463849	483054538	/nfs/dbraw/zinc/05/45/38/483054538.db2.gz	DWQKLTHPVFZVDD-ZDUSSCGKSA-N	1	0	298.346	1.025	50	0		CDAARO
CN1C(=O)[C@H]2C[N@H+](CC3=CC[C@H]4C[C@@H]3C4(C)C)C[C@H]2C1=O	ZINC000670470434	483070577	/nfs/dbraw/zinc/07/05/77/483070577.db2.gz	USOWXOYMSDBDBQ-FQUUOJAGSA-N	1	0	288.391	1.525	50	0		CDAARO
Cn1cc([C@H]2OCC[C@H]2C[NH2+]Cc2ccc(CO)o2)cn1	ZINC000084317499	483272083	/nfs/dbraw/zinc/27/20/83/483272083.db2.gz	DWIFMEYFSMBMHX-NHYWBVRUSA-N	1	0	291.351	1.373	50	0		CDAARO
C[C@H](CO)NC(=O)NC[C@@H](c1ccc(Cl)cc1)[NH+](C)C	ZINC000084640289	483304552	/nfs/dbraw/zinc/30/45/52/483304552.db2.gz	ODAPDMHQAFDRFU-MFKMUULPSA-N	1	0	299.802	1.623	50	0		CDAARO
CC[C@H](O)[C@@H]1CCCC[N@@H+]1CCS(=O)(=O)C(C)C	ZINC000084727058	483318737	/nfs/dbraw/zinc/31/87/37/483318737.db2.gz	OUPGIODOULTFSY-STQMWFEESA-N	1	0	277.430	1.435	50	0		CDAARO
Cc1noc(CN2CC[NH+](C[C@@H]3CC=CCC3)CC2)n1	ZINC000096489594	534408423	/nfs/dbraw/zinc/40/84/23/534408423.db2.gz	ZMYUAGLBHMFJNI-CQSZACIVSA-N	1	0	276.384	1.852	50	0		CDAARO
O=C(NCc1cc2cc(F)ccc2s1)[C@H]1C[C@H](O)C[NH2+]1	ZINC000299749644	526642944	/nfs/dbraw/zinc/64/29/44/526642944.db2.gz	LDGGVKKZUDIVNB-CMPLNLGQSA-N	1	0	294.351	1.379	50	0		CDAARO
CC(C)C[N@@H+]1CCO[C@@H](CNc2cncc(Cl)n2)C1	ZINC000096453233	528013905	/nfs/dbraw/zinc/01/39/05/528013905.db2.gz	BYDNEKJVMINAHK-NSHDSACASA-N	1	0	284.791	1.899	50	0		CDAARO
CCS(=O)(=O)Nc1ccc([C@H](C)N2CCOCC2)cc1	ZINC000097098456	567904029	/nfs/dbraw/zinc/90/40/29/567904029.db2.gz	WZEQAEIMCXQTCP-LBPRGKRZSA-N	1	0	298.408	1.841	50	0		CDAARO
CC(C)([NH3+])c1nc(-c2ccc(Cl)cc2)nn1CCO	ZINC000952977122	614163123	/nfs/dbraw/zinc/16/31/23/614163123.db2.gz	ZWVLDDCHQLXCAX-UHFFFAOYSA-N	1	0	280.759	1.785	50	0		CDAARO
C[NH2+][C@H](CC(C)(C)C)C(=O)NC1(c2nc[nH]n2)CCC1	ZINC000888096467	617758606	/nfs/dbraw/zinc/75/86/06/617758606.db2.gz	WFLXBGJNLGXYET-SNVBAGLBSA-N	1	0	279.388	1.324	50	0		CDAARO
C[NH+]1CCC(CNC(=O)/C=C/c2cc(CO)cs2)CC1	ZINC000952976356	616169890	/nfs/dbraw/zinc/16/98/90/616169890.db2.gz	MFDOLZLVSZXLQZ-NSCUHMNNSA-N	1	0	294.420	1.712	50	0		CDAARO
CCc1[nH+]c(N)nc(N[C@@H](C)c2ncnn2C)c1C	ZINC001772708346	1159442578	/nfs/dbraw/zinc/44/25/78/1159442578.db2.gz	GAUVOKUZZKCRBY-QMMMGPOBSA-N	1	0	261.333	1.231	50	0		CDAARO
Cc1ccc(O)cc1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@H]1C	ZINC000585135289	1164216811	/nfs/dbraw/zinc/21/68/11/1164216811.db2.gz	AGBYZSGOMGHARG-VXGBXAGGSA-N	1	0	262.353	1.865	50	0		CDAARO
Cn1ccnc1[C@@H](O)C1CC[NH+](CCc2cn[nH]c2)CC1	ZINC000244774034	705377346	/nfs/dbraw/zinc/37/73/46/705377346.db2.gz	PMWKUIFSUMLLIX-AWEZNQCLSA-N	1	0	289.383	1.131	50	0		CDAARO
O=C(NCC[N@H+]1CCC[C@H](CO)C1)NCC1CCCCC1	ZINC000952971891	705649463	/nfs/dbraw/zinc/64/94/63/705649463.db2.gz	YLGQQISYRFFXSJ-HNNXBMFYSA-N	1	0	297.443	1.570	50	0		CDAARO
CC[NH+](CC)CCNc1cc([C@@H]2CCOC2)ncn1	ZINC000426523752	705937751	/nfs/dbraw/zinc/93/77/51/705937751.db2.gz	XOXHEWISTOWSLK-GFCCVEGCSA-N	1	0	264.373	1.156	50	0		CDAARO
CC(C)(C)C[N@@H+]1CCN(C2CCOCC2)C[C@@H]1CCO	ZINC000019227351	710217901	/nfs/dbraw/zinc/21/79/01/710217901.db2.gz	IAOFDBSFDXJGHE-HNNXBMFYSA-N	1	0	284.444	1.580	50	0		CDAARO
COC(C)(C)C[NH2+]C[C@](C)(O)C(=O)OC(C)(C)C	ZINC000952995736	711691191	/nfs/dbraw/zinc/69/11/91/711691191.db2.gz	XGIYNPGJSVGZCQ-ZDUSSCGKSA-N	1	0	261.362	1.094	50	0		CDAARO
COC1(OC)CC[C@H]1[NH2+][C@H]1CCN(c2ncccc2F)C1	ZINC000864097257	711785410	/nfs/dbraw/zinc/78/54/10/711785410.db2.gz	RAMMOLPSMPDHBX-WCQYABFASA-N	1	0	295.358	1.541	50	0		CDAARO
[NH3+]CCN(C(=O)NCc1ccccc1)C1CCOCC1	ZINC000675019936	899875379	/nfs/dbraw/zinc/87/53/79/899875379.db2.gz	SAPOURZGSWXALN-UHFFFAOYSA-N	1	0	277.368	1.336	50	0		CDAARO
CCC1(CC)C[N@H+](CCn2cnnc2C)CCO1	ZINC000822679077	925645475	/nfs/dbraw/zinc/64/54/75/925645475.db2.gz	XEBARDYGTDKCRH-UHFFFAOYSA-N	1	0	252.362	1.478	50	0		CDAARO
CCCc1nc(N2CCC([N@H+](C)CCN(C)C)CC2)no1	ZINC000823023305	925667521	/nfs/dbraw/zinc/66/75/21/925667521.db2.gz	AZVHYUPVUMFANJ-UHFFFAOYSA-N	1	0	295.431	1.484	50	0		CDAARO
C[N@H+](Cc1cc(-c2ccccn2)no1)[C@H]1CCOC1	ZINC000823671483	925719089	/nfs/dbraw/zinc/71/90/89/925719089.db2.gz	YWKRWXKLQVWECP-NSHDSACASA-N	1	0	259.309	1.957	50	0		CDAARO
Cc1n[nH]c(C)c1CC(=O)NC[C@@]1(C)CC[N@@H+](C)C1	ZINC000823754965	925724141	/nfs/dbraw/zinc/72/41/41/925724141.db2.gz	LMYCYYHYEPJNFO-CQSZACIVSA-N	1	0	264.373	1.027	50	0		CDAARO
CN(C[C@H]1CCCC[N@@H+]1C)c1ccc(C(N)=O)cn1	ZINC000823777541	925728559	/nfs/dbraw/zinc/72/85/59/925728559.db2.gz	GIOWZZMMZSXQCC-GFCCVEGCSA-N	1	0	262.357	1.101	50	0		CDAARO
COCCCC1CC[NH+](C[C@H]2COCCO2)CC1	ZINC000824385252	925818819	/nfs/dbraw/zinc/81/88/19/925818819.db2.gz	XBOAFEXIWXGZPC-AWEZNQCLSA-N	1	0	257.374	1.540	50	0		CDAARO
Cc1nn(C)cc1-c1ccnc(N2CC[N@H+](C)[C@H](C)C2)n1	ZINC000048194420	937314815	/nfs/dbraw/zinc/31/48/15/937314815.db2.gz	VJOFGMBWCZPBCK-LLVKDONJSA-N	1	0	286.383	1.326	50	0		CDAARO
C[C@H](CNC(=O)Nc1ccc(F)cn1)C[NH+](C)C	ZINC000585086509	930889043	/nfs/dbraw/zinc/88/90/43/930889043.db2.gz	VZUBXPLHJHBHSY-SECBINFHSA-N	1	0	254.309	1.540	50	0		CDAARO
Cc1cc(CN2C[C@H](O)[C@@H]([NH+](C)C)C2)ccc1F	ZINC000585085457	930890921	/nfs/dbraw/zinc/89/09/21/930890921.db2.gz	RJHXCUIVFWLJPI-KBPBESRZSA-N	1	0	252.333	1.241	50	0		CDAARO
O=C(NCCc1ccccn1)[C@@H]1CC[C@H]2CCCC[N@@H+]21	ZINC000585122384	930988917	/nfs/dbraw/zinc/98/89/17/930988917.db2.gz	ZCCFDUNEFGKILK-CABCVRRESA-N	1	0	273.380	1.757	50	0		CDAARO
CCc1c(C)nn(C)c1NC(=O)[C@H]([NH3+])Cc1ccccc1	ZINC001529127002	968988031	/nfs/dbraw/zinc/98/80/31/968988031.db2.gz	WOJGLPXFKLKWSM-CQSZACIVSA-N	1	0	286.379	1.799	50	0		CDAARO
Cn1nccc1C[NH+]1CCC(CCN2CCCC2=O)CC1	ZINC001506404012	975150456	/nfs/dbraw/zinc/15/04/56/975150456.db2.gz	DUTQJUHXDRWDEC-UHFFFAOYSA-N	1	0	290.411	1.645	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]C2(C(N)=O)CCCC2)n1	ZINC001506402063	975150500	/nfs/dbraw/zinc/15/05/00/975150500.db2.gz	HVWIHTVTRGVURD-NSHDSACASA-N	1	0	264.373	1.276	50	0		CDAARO
CC(C)c1ccc(NC2CC[NH+](CCO)CC2)nn1	ZINC001506406366	975151659	/nfs/dbraw/zinc/15/16/59/975151659.db2.gz	ZXUYRORWZKCXBY-UHFFFAOYSA-N	1	0	264.373	1.469	50	0		CDAARO
O[C@H]1CN(c2ccc(Cl)cn2)C[C@@H]1[NH+]1CCCCC1	ZINC001506407182	975151799	/nfs/dbraw/zinc/15/17/99/975151799.db2.gz	PEBAGHJCCUCRIB-STQMWFEESA-N	1	0	281.787	1.770	50	0		CDAARO
Cc1nn(C)c(C)c1C[N@H+](CCn1cnnc1C)C1CC1	ZINC001506414132	975154366	/nfs/dbraw/zinc/15/43/66/975154366.db2.gz	WBNBKDRXQCASBA-UHFFFAOYSA-N	1	0	288.399	1.601	50	0		CDAARO
C[C@@H](CN(C)CCO)[NH2+]CCn1ccc2ccccc21	ZINC001506412295	975154584	/nfs/dbraw/zinc/15/45/84/975154584.db2.gz	BACUWQAYXAUVOD-AWEZNQCLSA-N	1	0	275.396	1.544	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1C1CN(CCN2CCCC2=O)C1	ZINC001506412740	975154706	/nfs/dbraw/zinc/15/47/06/975154706.db2.gz	NQBARRHITUPSCH-CYBMUJFWSA-N	1	0	265.401	1.167	50	0		CDAARO
CO[C@@H]1CCCC[C@H]1NC(=O)N[C@@H]1CC[N@H+](CC2CC2)C1	ZINC000096440560	230372648	/nfs/dbraw/zinc/37/26/48/230372648.db2.gz	DPRHZPSESSLVPU-RBSFLKMASA-N	1	0	295.427	1.728	50	0		CDAARO
CC(C)(C)C(=O)N1C[C@H](O)[C@@H]([NH+]2CCCCC2)C1	ZINC000584902144	341986832	/nfs/dbraw/zinc/98/68/32/341986832.db2.gz	YHNYEIUIHJPRQW-RYUDHWBXSA-N	1	0	254.374	1.090	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)Nc1cccc2c[nH]nc21	ZINC000095516323	185001420	/nfs/dbraw/zinc/00/14/20/185001420.db2.gz	QDWGXRVPJKNOBB-UHFFFAOYSA-N	1	0	273.340	1.780	50	0		CDAARO
CC(=O)OC[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1O	ZINC000095626796	185016183	/nfs/dbraw/zinc/01/61/83/185016183.db2.gz	VSGFDXSAMDSNKW-GJZGRUSLSA-N	1	0	263.337	1.433	50	0		CDAARO
CS(=O)(=O)N[C@@H]1CCC[C@H]1C[NH2+][C@@H]1CCCSC1	ZINC000097371013	342002138	/nfs/dbraw/zinc/00/21/38/342002138.db2.gz	XZJVYNWJQAHZSH-QJPTWQEYSA-N	1	0	292.470	1.190	50	0		CDAARO
C[C@@H]1COCC[C@@H]1CNC(=O)NC[C@@H]1CCCC[N@H+](C)C1	ZINC000624048510	342003463	/nfs/dbraw/zinc/00/34/63/342003463.db2.gz	NMKPLCHOVHEICF-QLFBSQMISA-N	1	0	297.443	1.690	50	0		CDAARO
C[NH+](C)CCc1ccccc1C(=O)NCCn1cccn1	ZINC000095940214	185036370	/nfs/dbraw/zinc/03/63/70/185036370.db2.gz	YXZGMUFWHHWDBK-UHFFFAOYSA-N	1	0	286.379	1.417	50	0		CDAARO
NC(=O)COc1ccc(CC[NH2+][C@@H]2CCSC2)cc1	ZINC000095967316	185046527	/nfs/dbraw/zinc/04/65/27/185046527.db2.gz	CESXIJPVEABHIF-GFCCVEGCSA-N	1	0	280.393	1.188	50	0		CDAARO
C[C@@H](C[N@@H+]1CCC[C@H](C)C1)NS(=O)(=O)c1cccnc1	ZINC000249263737	361778098	/nfs/dbraw/zinc/77/80/98/361778098.db2.gz	ZHHNCXTZCOTKBL-STQMWFEESA-N	1	0	297.424	1.480	50	0		CDAARO
Cc1cccc2[nH]c(CCC(=O)N3CC[NH2+]C[C@H]3C)nc21	ZINC000124848374	187157823	/nfs/dbraw/zinc/15/78/23/187157823.db2.gz	ZVMFIVJDXKGNLM-GFCCVEGCSA-N	1	0	286.379	1.624	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CNC(=O)c1cc(-c2cccnc2)n[nH]1	ZINC000096118152	185102127	/nfs/dbraw/zinc/10/21/27/185102127.db2.gz	HTHXHFFUEJQITL-ZDUSSCGKSA-N	1	0	299.378	1.686	50	0		CDAARO
Cc1nc(C(=O)N2C[C@H]3CC[C@@H]2C[N@H+](C)C3)cs1	ZINC000096131401	185103915	/nfs/dbraw/zinc/10/39/15/185103915.db2.gz	PIGCATFPTLRXKL-WDEREUQCSA-N	1	0	265.382	1.618	50	0		CDAARO
CO[C@H]1C[NH2+]C[C@@H]1NC(=O)c1ccc(F)c(SC)c1	ZINC000195554009	342625754	/nfs/dbraw/zinc/62/57/54/342625754.db2.gz	RVWNWKQMOXIGDM-QWRGUYRKSA-N	1	0	284.356	1.264	50	0		CDAARO
CNC(=O)c1ccc(C[N@H+](C)[C@H](C)Cc2cnccn2)o1	ZINC000244874411	361868018	/nfs/dbraw/zinc/86/80/18/361868018.db2.gz	XAXDHDNZDJCDNV-LLVKDONJSA-N	1	0	288.351	1.492	50	0		CDAARO
CC(C)OC[C@H](O)C[N@H+](C)CCOc1ccccc1F	ZINC000096967984	185143428	/nfs/dbraw/zinc/14/34/28/185143428.db2.gz	XMAFXQNYCVOKHY-CYBMUJFWSA-N	1	0	285.359	1.922	50	0		CDAARO
C/C=C/C[C@H](CO)[NH2+]C1CCN(c2nnc(C)s2)CC1	ZINC000253430502	361941769	/nfs/dbraw/zinc/94/17/69/361941769.db2.gz	ZYJNVOXOUARWRI-ITDFMYJTSA-N	1	0	296.440	1.732	50	0		CDAARO
Cn1cnc(-c2ccc(C[NH+](C)C)c(F)c2)c1CO	ZINC000685943401	539046055	/nfs/dbraw/zinc/04/60/55/539046055.db2.gz	MFFCUSZCAIZMFE-UHFFFAOYSA-N	1	0	263.316	1.780	50	0		CDAARO
C[NH+](C)C[C@@H]1CCCC2=C1NC1(CCCCC1)NC2=O	ZINC000585152454	342226351	/nfs/dbraw/zinc/22/63/51/342226351.db2.gz	HPJBWWVPVBNVEV-LBPRGKRZSA-N	1	0	277.412	1.982	50	0		CDAARO
NC(=O)[C@H]1C[N@@H+]([C@H]2CCCCc3ccccc32)CCO1	ZINC000257365171	539096203	/nfs/dbraw/zinc/09/62/03/539096203.db2.gz	WTVCQOLEZGUJIU-LSDHHAIUSA-N	1	0	274.364	1.640	50	0		CDAARO
Cc1ccc(CN2C[C@H](C)[NH2+]C[C@H]2CCO)cc1F	ZINC000072233544	342273304	/nfs/dbraw/zinc/27/33/04/342273304.db2.gz	JMHXBOVTVXXFPW-GXTWGEPZSA-N	1	0	266.360	1.679	50	0		CDAARO
COc1ccccc1OC[C@@H](O)CN1CCC[N@H+](C)CC1	ZINC000061721513	362095090	/nfs/dbraw/zinc/09/50/90/362095090.db2.gz	VALINRZNAGOHRX-AWEZNQCLSA-N	1	0	294.395	1.072	50	0		CDAARO
CN(C(=O)Cc1ccccc1Br)[C@@H]1CC[NH2+]C1	ZINC000084719071	362270304	/nfs/dbraw/zinc/27/03/04/362270304.db2.gz	KKBUMLHJYVKKOF-LLVKDONJSA-N	1	0	297.196	1.812	50	0		CDAARO
Cc1nnc(CN(C)CC[N@H+]2CCCC[C@H]2C)o1	ZINC000252483256	362385685	/nfs/dbraw/zinc/38/56/85/362385685.db2.gz	DYBHNXWERIOSOX-LLVKDONJSA-N	1	0	252.362	1.684	50	0		CDAARO
[NH3+][C@H]1C[C@H](c2nnc(Cn3cc4c(n3)CCC4)n2C2CC2)C1	ZINC000252527721	362392369	/nfs/dbraw/zinc/39/23/69/362392369.db2.gz	DEWRRFJDZYHRPO-HAQNSBGRSA-N	1	0	298.394	1.551	50	0		CDAARO
C[NH+]1CCC(CCNc2cc([C@H]3CCOC3)ncn2)CC1	ZINC000426471577	530048811	/nfs/dbraw/zinc/04/88/11/530048811.db2.gz	NYIOEWVXDWFOGL-AWEZNQCLSA-N	1	0	290.411	1.546	50	0		CDAARO
C[C@@H]([NH2+]CC(=O)NCc1cccs1)[C@@H]1CCCO1	ZINC000097111721	185537306	/nfs/dbraw/zinc/53/73/06/185537306.db2.gz	JQKZQHSNNKZJIV-PWSUYJOCSA-N	1	0	268.382	1.521	50	0		CDAARO
CC(C)[C@@H](C[NH2+][C@@H]1CCOC1)ONC(=O)OC(C)(C)C	ZINC000398827652	345586908	/nfs/dbraw/zinc/58/69/08/345586908.db2.gz	CNJHTUQJDFQOBX-VXGBXAGGSA-N	1	0	288.388	1.846	50	0		CDAARO
Cc1nscc1C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000192487768	362615933	/nfs/dbraw/zinc/61/59/33/362615933.db2.gz	KKCCDKQEHHMYRW-AOOOYVTPSA-N	1	0	251.355	1.085	50	0		CDAARO
COc1ccc(N2C[C@@H](C[NH3+])OC2=O)cc1Cl	ZINC000019669113	362628471	/nfs/dbraw/zinc/62/84/71/362628471.db2.gz	MEGBCHTUNNTZTF-MRVPVSSYSA-N	1	0	256.689	1.633	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@@H]1CCC[C@@H]1[NH3+]	ZINC000085375772	179044185	/nfs/dbraw/zinc/04/41/85/179044185.db2.gz	CNHBDSSILIVBOA-ZJUUUORDSA-N	1	0	253.371	1.537	50	0		CDAARO
CC[C@@H]1COCCN1C(=O)N[C@@H](C)C(C)(C)C[NH+](C)C	ZINC000085425483	179059677	/nfs/dbraw/zinc/05/96/77/179059677.db2.gz	CUXBSKDVLHMOAG-QWHCGFSZSA-N	1	0	285.432	1.783	50	0		CDAARO
CC[C@@H]1CN(C(=O)c2csc(COC)n2)C[C@@H]1[NH+](C)C	ZINC000089948581	347628045	/nfs/dbraw/zinc/62/80/45/347628045.db2.gz	WSNWDXHCKACLLQ-PWSUYJOCSA-N	1	0	297.424	1.702	50	0		CDAARO
O=C(NCC[N@H+]1CCC[C@@H](CO)C1)C1CCCCCC1	ZINC000584889070	349347975	/nfs/dbraw/zinc/34/79/75/349347975.db2.gz	NSDLNGDJEIZCMA-CQSZACIVSA-N	1	0	282.428	1.777	50	0		CDAARO
O=C(Cc1cccs1)N1C[C@H](O)[C@@H]([NH+]2CCCCC2)C1	ZINC000584891123	349350313	/nfs/dbraw/zinc/35/03/13/349350313.db2.gz	QTSBCOISEKHNKI-KBPBESRZSA-N	1	0	294.420	1.348	50	0		CDAARO
CC(C)C[N@@H+]1CC[C@H](CN(C)C(=O)C2(C)COC2)C1	ZINC000584895110	349355034	/nfs/dbraw/zinc/35/50/34/349355034.db2.gz	BSPBSXFROBJBSA-CYBMUJFWSA-N	1	0	268.401	1.459	50	0		CDAARO
C[C@@H](C[NH2+][C@@H](C)c1ccc2c(c1)OCO2)[S@](C)=O	ZINC000090843418	180044286	/nfs/dbraw/zinc/04/42/86/180044286.db2.gz	XHZGZIYQENGZDY-LXIMFEHMSA-N	1	0	269.366	1.833	50	0		CDAARO
Cc1ncsc1CCN(C)c1cc(C)[nH+]c(N)n1	ZINC000091254569	180114738	/nfs/dbraw/zinc/11/47/38/180114738.db2.gz	YXNRDXHESUMLPH-UHFFFAOYSA-N	1	0	263.370	1.811	50	0		CDAARO
CCNc1ncc(CN2C[C@H]([NH3+])[C@@H](C3CC3)C2)cn1	ZINC000091452363	180159818	/nfs/dbraw/zinc/15/98/18/180159818.db2.gz	NLKBDBMVSXVDCA-OLZOCXBDSA-N	1	0	261.373	1.078	50	0		CDAARO
COc1cccc(CCC(=O)N2C[C@H]([NH3+])[C@@H](C3CC3)C2)c1	ZINC000091460913	180161699	/nfs/dbraw/zinc/16/16/99/180161699.db2.gz	FTFSGLKDYCJUBR-CVEARBPZSA-N	1	0	288.391	1.824	50	0		CDAARO
C[C@@H]1C[N@H+](Cc2cnn(C)c2C2CC2)CC[C@]1(C)O	ZINC000091792987	180257598	/nfs/dbraw/zinc/25/75/98/180257598.db2.gz	AFJYGDQBJKEAOI-ABAIWWIYSA-N	1	0	263.385	1.890	50	0		CDAARO
OC[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1CN1CCOCC1	ZINC000091736482	180242919	/nfs/dbraw/zinc/24/29/19/180242919.db2.gz	DFKGXOQOYHYSDM-IAGOWNOFSA-N	1	0	290.407	1.059	50	0		CDAARO
Cn1cc(CC[N@@H+]2CC[C@](C)(O)C(C)(C)C2)cn1	ZINC000091876979	180278899	/nfs/dbraw/zinc/27/88/99/180278899.db2.gz	DESHOKGLAIDROR-AWEZNQCLSA-N	1	0	251.374	1.446	50	0		CDAARO
CCCn1ncc(CN2C[C@H](CO)[C@H](C[NH+](C)C)C2)c1C	ZINC000092080955	180319654	/nfs/dbraw/zinc/31/96/54/180319654.db2.gz	NFEHTBSMNLWHGQ-HZPDHXFCSA-N	1	0	294.443	1.203	50	0		CDAARO
C[C@H](OC[C@@H]1CCCCO1)C(=O)N1C[C@H]([NH+](C)C)[C@@H](C)C1	ZINC000107057368	186157624	/nfs/dbraw/zinc/15/76/24/186157624.db2.gz	VENIEMXADHKUCK-AJNGGQMLSA-N	1	0	298.427	1.369	50	0		CDAARO
[NH3+]Cc1ccnc(OC2CCC3(CC2)OCCO3)c1	ZINC000390825897	351372594	/nfs/dbraw/zinc/37/25/94/351372594.db2.gz	NZNPZVWULPIIJY-UHFFFAOYSA-N	1	0	264.325	1.605	50	0		CDAARO
CCCC[NH+]1CCN([C@H]2CCCN(C(C)C)C2=O)CC1	ZINC000095999472	351468306	/nfs/dbraw/zinc/46/83/06/351468306.db2.gz	UEYJJOZMGIIWIN-HNNXBMFYSA-N	1	0	281.444	1.804	50	0		CDAARO
CC[NH2+]Cc1cc(OC)c(OC)cc1NC(C)=O	ZINC000096027772	351475138	/nfs/dbraw/zinc/47/51/38/351475138.db2.gz	ZWJCATZBSUVMOP-UHFFFAOYSA-N	1	0	252.314	1.772	50	0		CDAARO
[NH3+][C@@H]1CCN(S(=O)(=O)Cc2ccccc2Cl)C1	ZINC000122719884	187047879	/nfs/dbraw/zinc/04/78/79/187047879.db2.gz	QSAHRIMFWDBNSE-SNVBAGLBSA-N	1	0	274.773	1.203	50	0		CDAARO
COc1cccc(SCC(=O)N2CCC[C@H]([NH3+])C2)c1	ZINC000158444892	188376025	/nfs/dbraw/zinc/37/60/25/188376025.db2.gz	CLTVCCJWSJTIBN-NSHDSACASA-N	1	0	280.393	1.737	50	0		CDAARO
[NH3+]C1(CO)CCN(C(=O)OCc2ccccc2)CC1	ZINC000169804475	188665675	/nfs/dbraw/zinc/66/56/75/188665675.db2.gz	GRNDNKZYKHELLX-UHFFFAOYSA-N	1	0	264.325	1.109	50	0		CDAARO
O=C(NC[C@H]1OCCc2sccc21)[C@H]1CCC[NH2+]1	ZINC000072501377	538343026	/nfs/dbraw/zinc/34/30/26/538343026.db2.gz	JDLWHCNSYXUGPE-GHMZBOCLSA-N	1	0	266.366	1.230	50	0		CDAARO
O=C1OCCN1CCC[NH2+]Cc1cc(F)cc(F)c1	ZINC000195546032	363453472	/nfs/dbraw/zinc/45/34/72/363453472.db2.gz	VYNMCQIEUHIULM-UHFFFAOYSA-N	1	0	270.279	1.897	50	0		CDAARO
C[C@@H](Oc1ccccc1)C(=O)NC[C@H](C)C[NH+](C)C	ZINC000002881514	355986354	/nfs/dbraw/zinc/98/63/54/355986354.db2.gz	POVREMZLKFLXJK-QWHCGFSZSA-N	1	0	264.369	1.768	50	0		CDAARO
COC(=O)[C@@H](CC(C)C)NC(=O)[C@H]([NH3+])CC(C)C	ZINC000004556762	356036195	/nfs/dbraw/zinc/03/61/95/356036195.db2.gz	AJMOLNFDYWTVQW-GHMZBOCLSA-N	1	0	258.362	1.064	50	0		CDAARO
Cc1c(C)n(C[C@H](O)C[NH2+]CCCO)c2ccccc12	ZINC000003904538	356013191	/nfs/dbraw/zinc/01/31/91/356013191.db2.gz	GDVLDDOMEVYIQI-CQSZACIVSA-N	1	0	276.380	1.591	50	0		CDAARO
C[C@@H]1[C@@H](c2ccccc2)[N@H+](C)CC[C@]12NC(=O)NC2=O	ZINC000004011778	356014570	/nfs/dbraw/zinc/01/45/70/356014570.db2.gz	FQTIIVLASVNVSP-GMXABZIVSA-N	1	0	273.336	1.278	50	0		CDAARO
CC[NH+]1CCC(NC(=O)c2ccc(OC)cc2)CC1	ZINC000016580644	356442026	/nfs/dbraw/zinc/44/20/26/356442026.db2.gz	ANZSTPCORAYIMS-UHFFFAOYSA-N	1	0	262.353	1.909	50	0		CDAARO
CC[NH+]1CCC(NC(=O)Cc2ccc(F)cc2)CC1	ZINC000016603665	356442999	/nfs/dbraw/zinc/44/29/99/356442999.db2.gz	MMTSPXOYJCIVNB-UHFFFAOYSA-N	1	0	264.344	1.969	50	0		CDAARO
C[N@@H+]1CCCN(Cc2nc(-c3ccsc3)no2)CC1	ZINC000022944094	356448221	/nfs/dbraw/zinc/44/82/21/356448221.db2.gz	JIOKPFNPKXLJQT-UHFFFAOYSA-N	1	0	278.381	1.936	50	0		CDAARO
CCOc1ccc(Cl)cc1CNCC[NH2+]C[C@@H](C)O	ZINC000019370691	356482966	/nfs/dbraw/zinc/48/29/66/356482966.db2.gz	KLNGOBWTMLNDJK-LLVKDONJSA-N	1	0	286.803	1.799	50	0		CDAARO
CC(C)c1ccc(N2C(=O)C[C@H]([NH2+]CCO)C2=O)cc1	ZINC000018155243	356468513	/nfs/dbraw/zinc/46/85/13/356468513.db2.gz	SDZASXWKAGEFCR-ZDUSSCGKSA-N	1	0	276.336	1.024	50	0		CDAARO
C[NH+]1CCN(CCC(=O)Nc2cccc(F)c2)CC1	ZINC000019590027	356493264	/nfs/dbraw/zinc/49/32/64/356493264.db2.gz	UDNRTWAJEUUWNA-UHFFFAOYSA-N	1	0	265.332	1.402	50	0		CDAARO
Cc1ccc(Cl)c(OCCN2CC[NH2+]CC2)c1	ZINC000019728634	356498012	/nfs/dbraw/zinc/49/80/12/356498012.db2.gz	FUUGZHROTCNZLM-UHFFFAOYSA-N	1	0	254.761	1.932	50	0		CDAARO
Cc1ccn2cc(C(=O)NCC[NH+]3CCCC3)nc2c1	ZINC000023171013	356631282	/nfs/dbraw/zinc/63/12/82/356631282.db2.gz	FIEMQHWBKLYAFD-UHFFFAOYSA-N	1	0	272.352	1.468	50	0		CDAARO
Cc1nn(C(C)C)c(C)c1CN1CC[N@H+](C)[C@@H](CCO)C1	ZINC000023145511	356629807	/nfs/dbraw/zinc/62/98/07/356629807.db2.gz	XVDZAAABUNDARZ-HNNXBMFYSA-N	1	0	294.443	1.579	50	0		CDAARO
NC(=[NH2+])SCCOC(=O)NCc1ccccc1	ZINC000023549854	356645505	/nfs/dbraw/zinc/64/55/05/356645505.db2.gz	NELQYEMEUVDCJF-UHFFFAOYSA-N	1	0	253.327	1.539	50	0		CDAARO
CNC(=O)[C@H]1CCCCN1Cc1nc(C)cs1	ZINC000176348584	366320971	/nfs/dbraw/zinc/32/09/71/366320971.db2.gz	FPAIGYZKNYYARZ-SNVBAGLBSA-N	1	0	253.371	1.552	50	0		CDAARO
Cn1cc(C[NH2+]CCCN2CCOCC2)c2ccccc21	ZINC000025180734	356668740	/nfs/dbraw/zinc/66/87/40/356668740.db2.gz	CDNIADXLCKZXSS-UHFFFAOYSA-N	1	0	287.407	1.990	50	0		CDAARO
C[C@H]1Oc2ccc(C(=O)C3CC[NH2+]CC3)cc2NC1=O	ZINC000036244098	356867241	/nfs/dbraw/zinc/86/72/41/356867241.db2.gz	JIPZQLXFNYZWRY-SECBINFHSA-N	1	0	274.320	1.588	50	0		CDAARO
[NH3+][C@@H]1CCC2(C[C@@H]1OCc1ccccc1)OCCO2	ZINC000037981086	356949416	/nfs/dbraw/zinc/94/94/16/356949416.db2.gz	BJBTZUJRKVTZDI-KGLIPLIRSA-N	1	0	263.337	1.826	50	0		CDAARO
COc1ccc(OC2C[NH2+]C2)c(Br)c1	ZINC000042769527	357079129	/nfs/dbraw/zinc/07/91/29/357079129.db2.gz	HLWKYOXBHUQIAN-UHFFFAOYSA-N	1	0	258.115	1.808	50	0		CDAARO
COC(=O)c1ccccc1NC(=O)[C@@H]1CCCC[NH2+]1	ZINC000036135395	357349288	/nfs/dbraw/zinc/34/92/88/357349288.db2.gz	ZQROKTOCCZZEEX-LBPRGKRZSA-N	1	0	262.309	1.554	50	0		CDAARO
CC(C)([NH3+])CNS(=O)(=O)c1cc(F)ccc1Cl	ZINC000095432138	357516290	/nfs/dbraw/zinc/51/62/90/357516290.db2.gz	FXAOTJQEVNCEFF-UHFFFAOYSA-N	1	0	280.752	1.495	50	0		CDAARO
Cc1cc(C[C@H](C)[NH2+]CCC(=O)Nc2cccnc2)[nH]n1	ZINC000065424495	357540058	/nfs/dbraw/zinc/54/00/58/357540058.db2.gz	JKRSYVQNPPZJTF-NSHDSACASA-N	1	0	287.367	1.663	50	0		CDAARO
COC(=O)[C@@H]1C[C@H](NC(=O)OCC(C)(C)C)CN1C	ZINC000065457219	357542493	/nfs/dbraw/zinc/54/24/93/357542493.db2.gz	NIIHLDLTPOOXSC-UWVGGRQHSA-N	1	0	272.345	1.004	50	0		CDAARO
Cc1cc(-n2nc(C3CC3)nc2[C@@H]2COCCO2)cc[nH+]1	ZINC000065508192	357546908	/nfs/dbraw/zinc/54/69/08/357546908.db2.gz	IOJXZQPLINVYLC-ZDUSSCGKSA-N	1	0	286.335	1.936	50	0		CDAARO
CC[N@@H+](Cc1c(CO)cnc(C)c1O)C[C@@H]1CCCO1	ZINC000067673683	357618237	/nfs/dbraw/zinc/61/82/37/357618237.db2.gz	IUHILNMXOOHCEY-ZDUSSCGKSA-N	1	0	280.368	1.589	50	0		CDAARO
COC(=O)c1ccc(C[NH2+][C@@H]2CCCC[C@@H]2O)s1	ZINC000097102607	357972076	/nfs/dbraw/zinc/97/20/76/357972076.db2.gz	QWRCKNHABXQISK-MNOVXSKESA-N	1	0	269.366	1.928	50	0		CDAARO
COC[C@H]([NH2+]CC(=O)N1C[C@H](C)C[C@H](C)C1)C1CC1	ZINC000097049016	358115829	/nfs/dbraw/zinc/11/58/29/358115829.db2.gz	RCSPZVRGNMXCIU-SCRDCRAPSA-N	1	0	268.401	1.506	50	0		CDAARO
[NH3+]C[C@H](NS(=O)(=O)CCCF)C1CCCCC1	ZINC000195544537	358559800	/nfs/dbraw/zinc/55/98/00/358559800.db2.gz	XIYLYUSFXRLTHX-NSHDSACASA-N	1	0	266.382	1.173	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)CCc3cccs3)C[C@@H]12	ZINC000195562260	358565409	/nfs/dbraw/zinc/56/54/09/358565409.db2.gz	ZIGZRERIIHCQSD-RAIGVLPGSA-N	1	0	264.394	1.876	50	0		CDAARO
Cc1n[nH]c(C)c1CCCNC(=O)[C@H]1CCCCC[N@H+]1C	ZINC000095367313	358686479	/nfs/dbraw/zinc/68/64/79/358686479.db2.gz	NSLSKJXAUMJYRC-OAHLLOKOSA-N	1	0	292.427	1.950	50	0		CDAARO
CN1CC[C@]2(CN(Cc3ccoc3)CC[N@@H+]2C)CCC1=O	ZINC000095382704	358690445	/nfs/dbraw/zinc/69/04/45/358690445.db2.gz	YTDJSUSPBDHEQN-INIZCTEOSA-N	1	0	291.395	1.408	50	0		CDAARO
Cc1nc([C@@H]2C[C@@H](O)C[NH2+]2)n(C2CCCCC2)n1	ZINC000096151716	358709142	/nfs/dbraw/zinc/70/91/42/358709142.db2.gz	WGZSTMJGJIRWMM-NEPJUHHUSA-N	1	0	250.346	1.487	50	0		CDAARO
CC(C)[N@@H+]1CCO[C@H](CC(=O)NCc2ccccn2)C1	ZINC000097572368	358786044	/nfs/dbraw/zinc/78/60/44/358786044.db2.gz	ZXCQNQZPNZRMBH-CQSZACIVSA-N	1	0	277.368	1.197	50	0		CDAARO
O=C(NCC[NH+]1CCCC1)c1ccccc1-c1ncc[nH]1	ZINC000097600927	358786483	/nfs/dbraw/zinc/78/64/83/358786483.db2.gz	PXHYEJJDQHCKBC-UHFFFAOYSA-N	1	0	284.363	1.902	50	0		CDAARO
O=C(C[C@H]1CCc2ccccc21)N1C[C@H]2C[NH2+]C[C@H]2C1	ZINC000097823495	358800880	/nfs/dbraw/zinc/80/08/80/358800880.db2.gz	SHDZTQIOVWDXAU-KFWWJZLASA-N	1	0	270.376	1.784	50	0		CDAARO
Nc1ncccc1C[NH+]1CCC(Cn2cccn2)CC1	ZINC000216008612	358917244	/nfs/dbraw/zinc/91/72/44/358917244.db2.gz	DLZSXNOJXXDPAW-UHFFFAOYSA-N	1	0	271.368	1.773	50	0		CDAARO
COc1cc2c(cc1C[N@H+]1CCC(=O)N(C)CC1)CCC2	ZINC000215227183	358879669	/nfs/dbraw/zinc/87/96/69/358879669.db2.gz	JIJMITMOPIWGKR-UHFFFAOYSA-N	1	0	288.391	1.848	50	0		CDAARO
[NH3+]C[C@@H](c1cccnc1)N1CCN(c2ccccc2)CC1	ZINC000019271932	358895207	/nfs/dbraw/zinc/89/52/07/358895207.db2.gz	XCMWUJNMFJHDAC-KRWDZBQOSA-N	1	0	282.391	1.904	50	0		CDAARO
CCCC1(CO)CC[NH+](Cc2cnc(N(C)C)nc2)CC1	ZINC000215669536	358898551	/nfs/dbraw/zinc/89/85/51/358898551.db2.gz	TYGSSYHXKYKWER-UHFFFAOYSA-N	1	0	292.427	1.917	50	0		CDAARO
CCc1nc(CN(C)C(=O)CC[N@@H+]2C[C@@H]3CC[C@H]2C3)no1	ZINC000219040077	359076473	/nfs/dbraw/zinc/07/64/73/359076473.db2.gz	FAJDRQMJJSLPEE-NEPJUHHUSA-N	1	0	292.383	1.465	50	0		CDAARO
COCc1nc(NC[C@@H]2CCCO2)cc(C2CC([NH3+])C2)n1	ZINC000219248473	359083748	/nfs/dbraw/zinc/08/37/48/359083748.db2.gz	WXDBXZLSDHYTLV-MCIGGMRASA-N	1	0	292.383	1.419	50	0		CDAARO
CN1Cc2cccn2C[C@@H]1CNC(=O)NC1CCCC1	ZINC000257177795	359135255	/nfs/dbraw/zinc/13/52/55/359135255.db2.gz	FHMQPZJITPWYSV-AWEZNQCLSA-N	1	0	276.384	1.544	50	0		CDAARO
C[C@@]1(CO)CCC[N@H+](C[C@H](O)c2ccccc2F)C1	ZINC000095973215	359153863	/nfs/dbraw/zinc/15/38/63/359153863.db2.gz	FVZGOQRBGOLCDC-LSDHHAIUSA-N	1	0	267.344	1.954	50	0		CDAARO
CNC(=O)[C@@H]1C[N@H+](Cc2cccc(Cl)c2)C[C@H]1COC	ZINC000257180298	359213855	/nfs/dbraw/zinc/21/38/55/359213855.db2.gz	DKYSXTJFWHNZFW-GXTWGEPZSA-N	1	0	296.798	1.780	50	0		CDAARO
CN(CC[N@H+](C)C1CC1)C(=O)c1cccc2oc(=O)[nH]c21	ZINC000408517149	359900250	/nfs/dbraw/zinc/90/02/50/359900250.db2.gz	AGBOGJCPQVKBAZ-UHFFFAOYSA-N	1	0	289.335	1.700	50	0		CDAARO
CN(CC[N@H+](C)C1CC1)C(=O)C1(Br)CC1	ZINC000408522183	359921066	/nfs/dbraw/zinc/92/10/66/359921066.db2.gz	FEPSVBKPKXBLSU-UHFFFAOYSA-N	1	0	275.190	1.467	50	0		CDAARO
C[NH+](C)CCc1ccc(C(=O)NC[C@H]2CCCOC2)cc1	ZINC000408524311	359933413	/nfs/dbraw/zinc/93/34/13/359933413.db2.gz	ZJOHBVXMJPFFAS-OAHLLOKOSA-N	1	0	290.407	1.947	50	0		CDAARO
Cc1nnc([C@@H](C)N2CCC[C@H]2Cn2cccn2)o1	ZINC000257365777	359946278	/nfs/dbraw/zinc/94/62/78/359946278.db2.gz	MCSQZTOYIQRHOU-PWSUYJOCSA-N	1	0	261.329	1.800	50	0		CDAARO
Cc1ccccc1[C@@H](C)[NH2+]C[C@H](O)CN1CCCC1=O	ZINC000089515072	360095155	/nfs/dbraw/zinc/09/51/55/360095155.db2.gz	NVHDEYIQPJKXHY-KGLIPLIRSA-N	1	0	276.380	1.629	50	0		CDAARO
Cc1ccc(CNC(=O)NC2CC[NH+](C)CC2)cc1	ZINC000035855974	360121314	/nfs/dbraw/zinc/12/13/14/360121314.db2.gz	CKVYCFABLLZHNR-UHFFFAOYSA-N	1	0	261.369	1.888	50	0		CDAARO
Cn1nccc1C(=O)N1CCC(CC2CC2)([NH+](C)C)CC1	ZINC000409421210	360230245	/nfs/dbraw/zinc/23/02/45/360230245.db2.gz	VCFRPTIXHFSMLY-UHFFFAOYSA-N	1	0	290.411	1.757	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1[C@H]1CCCN1C(=O)c1ccnc(C)n1	ZINC000247983386	360290823	/nfs/dbraw/zinc/29/08/23/360290823.db2.gz	YESNXVJKPXCWRR-HUUCEWRRSA-N	1	0	288.395	1.874	50	0		CDAARO
C[N@@H+]1CCC[C@H]1C(=O)N1CCN([C@@H]2C=CCCC2)CC1	ZINC000248159824	360417439	/nfs/dbraw/zinc/41/74/39/360417439.db2.gz	RXWJXZNFHZUSMX-CABCVRRESA-N	1	0	277.412	1.334	50	0		CDAARO
CC(C)c1nccc(C(=O)NCCC[NH+]2CCCC2)n1	ZINC000426487345	360573289	/nfs/dbraw/zinc/57/32/89/360573289.db2.gz	KUZLXJWUCBJKCB-UHFFFAOYSA-N	1	0	276.384	1.816	50	0		CDAARO
C[NH2+]CCCNC(=O)c1cccn1Cc1cccs1	ZINC000178417215	189114992	/nfs/dbraw/zinc/11/49/92/189114992.db2.gz	HHWNOYUBBRPMIE-UHFFFAOYSA-N	1	0	277.393	1.937	50	0		CDAARO
Cc1[nH]nc(C(=O)N2CCC[C@H]([NH+](C)C)CC2)c1Cl	ZINC000426517784	360678538	/nfs/dbraw/zinc/67/85/38/360678538.db2.gz	FRPWHBKECNABMN-JTQLQIEISA-N	1	0	284.791	1.928	50	0		CDAARO
C[NH+](C)CCNC(=O)N1CCOc2ccc(Cl)cc2C1	ZINC000426387855	360662901	/nfs/dbraw/zinc/66/29/01/360662901.db2.gz	LEMNRVISKJNMLR-UHFFFAOYSA-N	1	0	297.786	1.806	50	0		CDAARO
CN(C)[C@H](C(=O)N1CC[C@H](C[NH3+])C1)c1ccccc1	ZINC000178551718	189126329	/nfs/dbraw/zinc/12/63/29/189126329.db2.gz	LDNNGYPSMAVLIK-OCCSQVGLSA-N	1	0	261.369	1.097	50	0		CDAARO
C[C@@H](Cc1ccccc1F)C(=O)N1CC[C@@H](C[NH3+])C1	ZINC000178582136	189128732	/nfs/dbraw/zinc/12/87/32/189128732.db2.gz	DTCIBEQBEKYTLQ-RYUDHWBXSA-N	1	0	264.344	1.812	50	0		CDAARO
COc1ccc(CC(=O)N(C)[C@@H]2CC[NH2+]C2)cc1F	ZINC000179047242	189164780	/nfs/dbraw/zinc/16/47/80/189164780.db2.gz	YJUFZMFCIGIOCC-LLVKDONJSA-N	1	0	266.316	1.197	50	0		CDAARO
COCCC[N@@H+](Cc1cccn1C)C[C@H](O)COC(C)C	ZINC000036098182	360910188	/nfs/dbraw/zinc/91/01/88/360910188.db2.gz	LNTDZPJXXDDNDI-INIZCTEOSA-N	1	0	298.427	1.650	50	0		CDAARO
CC(C)[C@H](Oc1ccc(F)cc1F)C(=O)N1CC[C@@H]([NH3+])C1	ZINC000299738956	200850593	/nfs/dbraw/zinc/85/05/93/200850593.db2.gz	ITXMYRGMCPTXMT-RISCZKNCSA-N	1	0	298.333	1.928	50	0		CDAARO
CCO[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCC[C@H]2[NH3+])C1(C)C	ZINC000299738576	200850707	/nfs/dbraw/zinc/85/07/07/200850707.db2.gz	CIIPPJDFQMVVIA-QNWHQSFQSA-N	1	0	268.401	1.776	50	0		CDAARO
CN1CCN(CCC(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000036182259	361205612	/nfs/dbraw/zinc/20/56/12/361205612.db2.gz	CWGHEPDCXGFXQA-UHFFFAOYSA-N	1	0	290.363	1.278	50	0		CDAARO
COc1ccc(OC)c(COC[C@H](O)C[NH2+]C(C)C)c1	ZINC000012382634	361226415	/nfs/dbraw/zinc/22/64/15/361226415.db2.gz	HIABGQVTNPYOQX-CYBMUJFWSA-N	1	0	283.368	1.579	50	0		CDAARO
CC(C)(C)C[C@H](O)C[NH2+][C@@H]1CCC[C@@H]1S(C)(=O)=O	ZINC000182987912	189341707	/nfs/dbraw/zinc/34/17/07/189341707.db2.gz	UCCVEVHHQNXZPN-TUAOUCFPSA-N	1	0	277.430	1.339	50	0		CDAARO
COC(=O)[C@H](N[C@@H]1CCc2ccccc2C1)[C@H](C)O	ZINC000191962511	361589962	/nfs/dbraw/zinc/58/99/62/361589962.db2.gz	ZIPAEWXPHPZZNY-ZLKJLUDKSA-N	1	0	263.337	1.056	50	0		CDAARO
C[NH+](C)CCN(Cc1ccco1)C(=O)C1=CCCCO1	ZINC000088348592	364775970	/nfs/dbraw/zinc/77/59/70/364775970.db2.gz	TVKCUWZKSPABII-UHFFFAOYSA-N	1	0	278.352	1.864	50	0		CDAARO
O=C(C[C@H]1COCC[NH2+]1)N1CCC[C@H]1c1ccccc1	ZINC000097815494	283872551	/nfs/dbraw/zinc/87/25/51/283872551.db2.gz	QJBVKOUKYUFYLF-GJZGRUSLSA-N	1	0	274.364	1.729	50	0		CDAARO
O=C1C[C@@H]([NH2+]C[C@@H](c2ccco2)N2CCCC2)CCCN1	ZINC000630060067	366974654	/nfs/dbraw/zinc/97/46/54/366974654.db2.gz	GZHQSVKNUQZXHR-KBPBESRZSA-N	1	0	291.395	1.675	50	0		CDAARO
CCOCC[N@@H+]1CCN(C[C@H](O)c2ccccc2)[C@@H](C)C1	ZINC000252474775	367536055	/nfs/dbraw/zinc/53/60/55/367536055.db2.gz	MACWBFHZFSCYFM-RDJZCZTQSA-N	1	0	292.423	1.763	50	0		CDAARO
CCO[C@@H]1C[C@H]([NH2+][C@@H](C)[C@H]2CN(C)CCO2)C1(C)C	ZINC000252486925	367576557	/nfs/dbraw/zinc/57/65/57/367576557.db2.gz	OMBYQXWKUWRLHY-RFQIPJPRSA-N	1	0	270.417	1.499	50	0		CDAARO
Cc1nccc(NCC[N@@H+]2CCc3ccccc3C2)n1	ZINC000361160379	368670315	/nfs/dbraw/zinc/67/03/15/368670315.db2.gz	XIBKTGPMJVIKSS-UHFFFAOYSA-N	1	0	268.364	1.677	50	0		CDAARO
COc1cccc(C[C@H]([NH3+])C(=O)Nc2ccc(C)nc2)c1	ZINC000638275029	369061749	/nfs/dbraw/zinc/06/17/49/369061749.db2.gz	UVZCNHGXIFVSIW-HNNXBMFYSA-N	1	0	285.347	1.907	50	0		CDAARO
Cc1cc(C)n(C[C@H](C)[NH2+]C2CCS(=O)(=O)CC2)n1	ZINC000670442275	482989675	/nfs/dbraw/zinc/98/96/75/482989675.db2.gz	KSQKLKWYUNXHCG-NSHDSACASA-N	1	0	285.413	1.055	50	0		CDAARO
NC(=O)c1cncc(-c2ccc(F)c3c2O[C@@H](C[NH3+])C3)c1	ZINC000299779375	372757242	/nfs/dbraw/zinc/75/72/42/372757242.db2.gz	TZFJDROARQCDLQ-SNVBAGLBSA-N	1	0	287.294	1.249	50	0		CDAARO
Cc1ccc(C(=O)N2CC[N@@H+]3CCCC[C@H]3C2)cc1N	ZINC000037812718	373414544	/nfs/dbraw/zinc/41/45/44/373414544.db2.gz	BLKRNFMMTKWURM-AWEZNQCLSA-N	1	0	273.380	1.888	50	0		CDAARO
CC[N@@H+]1CC[C@H]2[C@@H](C1)OCCN2C(=O)c1cccnc1	ZINC000253416337	373725913	/nfs/dbraw/zinc/72/59/13/373725913.db2.gz	CZBUNVDHKQZPBT-UONOGXRCSA-N	1	0	275.352	1.017	50	0		CDAARO
O=C(CCC1CC[NH2+]CC1)NCCOC1CCCC1	ZINC000111640574	374174319	/nfs/dbraw/zinc/17/43/19/374174319.db2.gz	IYHLKKVLNPFPFC-UHFFFAOYSA-N	1	0	268.401	1.842	50	0		CDAARO
Cc1ccnc(Nc2ccc(N3CC[NH2+]CC3)nn2)c1	ZINC000206578789	374178051	/nfs/dbraw/zinc/17/80/51/374178051.db2.gz	PQARIKUGFHWGTD-UHFFFAOYSA-N	1	0	270.340	1.333	50	0		CDAARO
C[C@@H]1CCC[C@@H](C)[NH+]1CCCNC(=O)CN1CCCC1=O	ZINC000027748934	374280479	/nfs/dbraw/zinc/28/04/79/374280479.db2.gz	SKQJXFIFVWTIIF-ZIAGYGMSSA-N	1	0	295.427	1.378	50	0		CDAARO
Cc1cc2c(ncnc2N2CC[NH+](CCO)CC2)s1	ZINC000020320009	374875744	/nfs/dbraw/zinc/87/57/44/374875744.db2.gz	PHILBNKDHGGIOI-UHFFFAOYSA-N	1	0	278.381	1.114	50	0		CDAARO
CCCCC[N@H+](CC(N)=O)Cc1ccc2c(c1)OCCO2	ZINC000095357304	374890259	/nfs/dbraw/zinc/89/02/59/374890259.db2.gz	CZPWCFVUJCGTBB-UHFFFAOYSA-N	1	0	292.379	1.935	50	0		CDAARO
Cc1ncc2c(c1-c1noc(-c3cn[nH]c3)n1)CC[NH2+]C2	ZINC000020119536	374846206	/nfs/dbraw/zinc/84/62/06/374846206.db2.gz	UOCOIILOSMJDSB-UHFFFAOYSA-N	1	0	282.307	1.476	50	0		CDAARO
CCc1ccc(C[NH2+][C@@H]2CCCN(S(C)(=O)=O)C2)o1	ZINC000095415427	374918003	/nfs/dbraw/zinc/91/80/03/374918003.db2.gz	BUWCYDWXRBOYAF-LLVKDONJSA-N	1	0	286.397	1.356	50	0		CDAARO
Cc1ccc(C[NH2+][C@@H](C)CCN2CCOCC2)nc1	ZINC000095416685	374918634	/nfs/dbraw/zinc/91/86/34/374918634.db2.gz	CHYXMWMPJPPXPG-AWEZNQCLSA-N	1	0	263.385	1.590	50	0		CDAARO
Cc1ccc([C@@H](C)[NH2+]CCCNS(C)(=O)=O)c(C)c1	ZINC000095419597	374922162	/nfs/dbraw/zinc/92/21/62/374922162.db2.gz	LTAVQMJUIMGPMF-CYBMUJFWSA-N	1	0	284.425	1.893	50	0		CDAARO
C[C@H](Sc1nnnn1CC[NH+](C)C)C(F)(F)F	ZINC000095427373	374926785	/nfs/dbraw/zinc/92/67/85/374926785.db2.gz	CQMGERSJAHVUBI-LURJTMIESA-N	1	0	269.296	1.278	50	0		CDAARO
Cn1cc(N2CCC[C@H]([NH2+]C3CCSCC3)C2)cn1	ZINC000095403001	374907703	/nfs/dbraw/zinc/90/77/03/374907703.db2.gz	WOAIJKBSXWJICE-ZDUSSCGKSA-N	1	0	280.441	1.874	50	0		CDAARO
C[C@H]([NH2+]CCSCC(C)(C)O)C1CCOCC1	ZINC000096477825	375105547	/nfs/dbraw/zinc/10/55/47/375105547.db2.gz	XKONSQQHVDAPHT-NSHDSACASA-N	1	0	261.431	1.895	50	0		CDAARO
CC(C)c1ccc([C@H]([NH3+])CNS(C)(=O)=O)cc1	ZINC000095972609	375044414	/nfs/dbraw/zinc/04/44/14/375044414.db2.gz	MTPVEGLFMUSMEF-GFCCVEGCSA-N	1	0	256.371	1.359	50	0		CDAARO
Cc1nnc(CN(C)C(=O)[C@@H]2C[C@H]3CCCC[C@H]3[NH2+]2)n1C	ZINC000299740173	375202137	/nfs/dbraw/zinc/20/21/37/375202137.db2.gz	WPIWLVYMQBTBNG-UPJWGTAASA-N	1	0	291.399	1.003	50	0		CDAARO
CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1CC(=O)N(CC)CC	ZINC000239761683	376017242	/nfs/dbraw/zinc/01/72/42/376017242.db2.gz	CKENJVGWRLIJJW-KGLIPLIRSA-N	1	0	267.417	1.413	50	0		CDAARO
CCOCC[N@@H+]1CCN(Cc2cnc(C)cn2)C[C@H]1C	ZINC000241124222	376017480	/nfs/dbraw/zinc/01/74/80/376017480.db2.gz	JGMBTDCJVVTECV-CQSZACIVSA-N	1	0	278.400	1.328	50	0		CDAARO
Cc1ccc(F)c(NC(=O)NC[C@@H]2C[N@@H+](C)CCN2C)c1	ZINC000264639227	190124723	/nfs/dbraw/zinc/12/47/23/190124723.db2.gz	MJIGDLCBEVWCLY-GFCCVEGCSA-N	1	0	294.374	1.501	50	0		CDAARO
Nc1cnc(-c2cc3c(c(F)c2)O[C@@H](C[NH3+])C3)cn1	ZINC000067642321	377194621	/nfs/dbraw/zinc/19/46/21/377194621.db2.gz	LIYKSTFSXXYGOZ-SECBINFHSA-N	1	0	260.272	1.127	50	0		CDAARO
Cc1cc(C)n(CCCC(=O)N[C@@H]2CC[C@@H]([NH3+])C2)n1	ZINC000067740025	377236127	/nfs/dbraw/zinc/23/61/27/377236127.db2.gz	WNZBGHNVARXZKX-CHWSQXEVSA-N	1	0	264.373	1.276	50	0		CDAARO
c1ccc2c(c1)OC[C@H](C[NH+]1CCSCC1)O2	ZINC000067947618	377322631	/nfs/dbraw/zinc/32/26/31/377322631.db2.gz	RHUGFZMYUZITCI-NSHDSACASA-N	1	0	251.351	1.875	50	0		CDAARO
O=C(c1ccc(F)cc1Cl)N1CCC[NH2+]CC1	ZINC000021967084	284659967	/nfs/dbraw/zinc/65/99/67/284659967.db2.gz	PPTNTNRXZIWFAL-UHFFFAOYSA-N	1	0	256.708	1.915	50	0		CDAARO
O=C(CSC1=[NH+]CCN1)c1cc2ccccc2oc1=O	ZINC000032219951	378113084	/nfs/dbraw/zinc/11/30/84/378113084.db2.gz	YGJIJLCBGYRINC-UHFFFAOYSA-N	1	0	288.328	1.668	50	0		CDAARO
[NH3+][C@@H]1CC[C@@H](NC(=O)c2ccccc2-n2cccn2)C1	ZINC000071764149	379632928	/nfs/dbraw/zinc/63/29/28/379632928.db2.gz	VRBBFZJQJZBJDL-VXGBXAGGSA-N	1	0	270.336	1.482	50	0		CDAARO
COCC(=O)Nc1ccc(OCC[N@@H+]2CC[C@H](C)C2)cc1	ZINC000096443932	533067561	/nfs/dbraw/zinc/06/75/61/533067561.db2.gz	DANBRGWHTNETSP-ZDUSSCGKSA-N	1	0	292.379	1.992	50	0		CDAARO
CC[NH+]1CCC2(CC1)C[C@@H]1C[C@H]3C=C[C@]1(CN2C(C)=O)O3	ZINC000000444298	285192249	/nfs/dbraw/zinc/19/22/49/285192249.db2.gz	ILVPOFGJZSFGPB-ZMSDIMECSA-N	1	0	290.407	1.807	50	0	biogenic	CDAARO
OC1(C[NH2+][C@@H]2CCN(CC(F)(F)F)C2)CCSCC1	ZINC000088727480	285239646	/nfs/dbraw/zinc/23/96/46/285239646.db2.gz	ZXFVEUWJLHGXHW-SNVBAGLBSA-N	1	0	298.374	1.471	50	0		CDAARO
C[C@@H]1CN(C(=O)C[C@@H]2OCCc3ccccc32)C[C@H](C)[NH2+]1	ZINC000246890990	390180774	/nfs/dbraw/zinc/18/07/74/390180774.db2.gz	IYWQTAPYDNFYJV-ZENOOKHLSA-N	1	0	288.391	1.899	50	0		CDAARO
CCc1c(C)[nH+]c(N)nc1NCc1noc(COC)n1	ZINC000095392193	184963666	/nfs/dbraw/zinc/96/36/66/184963666.db2.gz	MNQPRWLWWINCOY-UHFFFAOYSA-N	1	0	278.316	1.071	50	0		CDAARO
CC[C@@](CO)([NH2+]CC(=O)N1CCCC1)c1ccccc1	ZINC000096410573	390510218	/nfs/dbraw/zinc/51/02/18/390510218.db2.gz	SCPLKHLSYKRTJN-INIZCTEOSA-N	1	0	276.380	1.496	50	0		CDAARO
CCOC(=O)CCCC[NH+]1CCC(N2CCCC2=O)CC1	ZINC000096417421	390512038	/nfs/dbraw/zinc/51/20/38/390512038.db2.gz	VAJMDRIZLHMZGH-UHFFFAOYSA-N	1	0	296.411	1.807	50	0		CDAARO
Cc1csc(NC(=O)NCC2(O)CC[NH+](C)CC2)n1	ZINC000096418359	390512133	/nfs/dbraw/zinc/51/21/33/390512133.db2.gz	SILQUIBPZNOZNB-UHFFFAOYSA-N	1	0	284.385	1.030	50	0		CDAARO
COCCCN1c2ccccc2NC2(CC[NH2+]CC2)C1=O	ZINC000082125327	390837960	/nfs/dbraw/zinc/83/79/60/390837960.db2.gz	CBLNDWPCJRCOFH-UHFFFAOYSA-N	1	0	289.379	1.604	50	0		CDAARO
COC(=O)N1C[C@H]2CC[C@@H]1C[N@H+](Cc1ccccn1)C2	ZINC000091644461	390891386	/nfs/dbraw/zinc/89/13/86/390891386.db2.gz	MOKYQUQTVZWGNI-GXTWGEPZSA-N	1	0	275.352	1.744	50	0		CDAARO
C[C@H](C[N@@H+]1C[C@@H](O)C[C@H]1CO)c1cccc(Cl)c1	ZINC000188568891	390967800	/nfs/dbraw/zinc/96/78/00/390967800.db2.gz	FVIJBWIQYISCDT-SWHYSGLUSA-N	1	0	269.772	1.871	50	0		CDAARO
O=C(Nc1nccs1)[C@]12C[NH2+]C[C@@H]1CCCC2	ZINC000375983724	391209043	/nfs/dbraw/zinc/20/90/43/391209043.db2.gz	BJGGCRVBAAQFNF-JOYOIKCWSA-N	1	0	251.355	1.861	50	0		CDAARO
COc1cc(C[NH+]2[C@H](C)CC(O)C[C@H]2C)sn1	ZINC000521396515	391668212	/nfs/dbraw/zinc/66/82/12/391668212.db2.gz	ODRAUKOXYGCVIC-RKDXNWHRSA-N	1	0	256.371	1.885	50	0		CDAARO
CN1CC[C@H]([N@@H+]2CCC[C@H]2C[C@H](O)c2ccccc2)C1=O	ZINC000245338627	131084838	/nfs/dbraw/zinc/08/48/38/131084838.db2.gz	NISBGRIODMBHNH-JYJNAYRXSA-N	1	0	288.391	1.805	50	0		CDAARO
[NH3+][C@@H]1CCC[C@@H](C(=O)NC[C@H](O)c2ccccc2F)C1	ZINC000269230768	132137521	/nfs/dbraw/zinc/13/75/21/132137521.db2.gz	OWIWTLNLZMMZLD-GYSYKLTISA-N	1	0	280.343	1.493	50	0		CDAARO
Cc1cc(C(=O)NC2CC[NH+](C[C@H]3CCOC3)CC2)no1	ZINC000195183529	393107648	/nfs/dbraw/zinc/10/76/48/393107648.db2.gz	WAWLPPJORHWRRS-GFCCVEGCSA-N	1	0	293.367	1.214	50	0		CDAARO
C[C@@H]1CN(C(=O)C[NH2+][C@H]2CCCC2(C)C)C[C@@H](C)O1	ZINC000195577942	393306068	/nfs/dbraw/zinc/30/60/68/393306068.db2.gz	GOZRDELVDNYOGS-UPJWGTAASA-N	1	0	268.401	1.791	50	0		CDAARO
Cc1nn(C)c(Cl)c1/C=C\C(=O)N1CCC([NH3+])CC1	ZINC000493812176	393441947	/nfs/dbraw/zinc/44/19/47/393441947.db2.gz	BNWGWDKXMKCELF-ARJAWSKDSA-N	1	0	282.775	1.345	50	0		CDAARO
COC(C)(C)C[C@H](C)[NH2+]CCn1c(C)cc(C)nc1=O	ZINC000065380999	292075867	/nfs/dbraw/zinc/07/58/67/292075867.db2.gz	VTZNBEWOXYNAGR-LBPRGKRZSA-N	1	0	281.400	1.653	50	0		CDAARO
C[C@H]1CN(C)CC[N@@H+]1CC1CCN(C(=O)C2CC2)CC1	ZINC000085468050	397611089	/nfs/dbraw/zinc/61/10/89/397611089.db2.gz	VUJKFPMRXMESHV-ZDUSSCGKSA-N	1	0	279.428	1.271	50	0		CDAARO
CCCC[NH2+]Cc1cc(=O)n2nc(-c3ccccc3)nc2[nH]1	ZINC000101747124	397817831	/nfs/dbraw/zinc/81/78/31/397817831.db2.gz	RBOKKZQMPVLDKZ-UHFFFAOYSA-N	1	0	297.362	1.974	50	0		CDAARO
C[NH+](C)CCSCC1(CS(C)(=O)=O)CC1	ZINC000089314371	289175521	/nfs/dbraw/zinc/17/55/21/289175521.db2.gz	UXDXETAVHPBJAI-UHFFFAOYSA-N	1	0	251.417	1.106	50	0		CDAARO
C[C@@H](CC(=O)OC(C)(C)C)[NH2+]Cc1nnc2ccccn21	ZINC000183818745	148317596	/nfs/dbraw/zinc/31/75/96/148317596.db2.gz	LFGPSGZKCKSDKX-NSHDSACASA-N	1	0	290.367	1.939	50	0		CDAARO
CS(=O)(=O)N1CCCSC[C@H]1C[NH+]1CCCCC1	ZINC000085473287	286607652	/nfs/dbraw/zinc/60/76/52/286607652.db2.gz	RFACFQAVLAOCTE-GFCCVEGCSA-N	1	0	292.470	1.239	50	0		CDAARO
CO[C@H](C[NH2+][C@@H]1CCC(=O)NC1(C)C)C1CCCC1	ZINC000658317406	413367777	/nfs/dbraw/zinc/36/77/77/413367777.db2.gz	VSZIMXMVLJCXAK-CHWSQXEVSA-N	1	0	268.401	1.838	50	0		CDAARO
CC[C@H](CO)[NH2+]C[C@@H](O)COCc1ccc(Cl)cc1	ZINC000003893465	169921108	/nfs/dbraw/zinc/92/11/08/169921108.db2.gz	RKQDUSVCVGWAKJ-ZIAGYGMSSA-N	1	0	287.787	1.578	50	0		CDAARO
CC(C)C[NH+]1CCC(C(=O)N2CCOCC2)CC1	ZINC000004725508	170006635	/nfs/dbraw/zinc/00/66/35/170006635.db2.gz	UDWQNNCETPRZJT-UHFFFAOYSA-N	1	0	254.374	1.213	50	0		CDAARO
CCOC(=O)C[C@@]1(C)OC[C@@H](C[NH+]2CCCCC2)O1	ZINC000004811444	170021024	/nfs/dbraw/zinc/02/10/24/170021024.db2.gz	UZULUDFGYFDQFW-OCCSQVGLSA-N	1	0	271.357	1.557	50	0		CDAARO
Cc1cccc(O[C@H](C)C(=O)NCC[NH+](C)C)c1	ZINC000004832731	170025922	/nfs/dbraw/zinc/02/59/22/170025922.db2.gz	PSDSWADHTOYFLP-GFCCVEGCSA-N	1	0	250.342	1.440	50	0		CDAARO
CC(C)[NH2+]C[C@@H](O)COc1cc(=O)oc2ccccc12	ZINC000005284727	170082825	/nfs/dbraw/zinc/08/28/25/170082825.db2.gz	MQSKIFZJQYDFJI-LLVKDONJSA-N	1	0	277.320	1.531	50	0		CDAARO
Cc1ccc(CN2C(=[NH2+])S[C@H]3CS(=O)(=O)C[C@H]32)cc1	ZINC000005443345	170099950	/nfs/dbraw/zinc/09/99/50/170099950.db2.gz	JYVNZVYQTGDGNP-NEPJUHHUSA-N	1	0	296.417	1.644	50	0		CDAARO
CCC[NH2+]CC(=O)NCc1ccc(OC)c(OC)c1	ZINC000007780863	170302221	/nfs/dbraw/zinc/30/22/21/170302221.db2.gz	CEQQUHFOKIGKMP-UHFFFAOYSA-N	1	0	266.341	1.320	50	0		CDAARO
O=C1C[C@@H]([NH2+]CC2CC2)CN1Cc1ccc(F)cc1	ZINC000015062786	170655297	/nfs/dbraw/zinc/65/52/97/170655297.db2.gz	OCUINCZMXHGMLC-CQSZACIVSA-N	1	0	262.328	1.926	50	0		CDAARO
C[C@@H]1CCC(=O)N1CC(=O)NCC[N@H+]1[C@H](C)CCC[C@@H]1C	ZINC000040511631	287244639	/nfs/dbraw/zinc/24/46/39/287244639.db2.gz	SRENKLLCHKVTEE-HZSPNIEDSA-N	1	0	295.427	1.376	50	0		CDAARO
C[NH+](C)CCn1c(=O)c2cc(Cl)ccc2[n-]c1=S	ZINC000020645233	171268762	/nfs/dbraw/zinc/26/87/62/171268762.db2.gz	UJVJNRLICRWZPA-UHFFFAOYSA-N	1	0	283.784	1.900	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COc2ccc(C)cc2)CC1	ZINC000020707245	171269832	/nfs/dbraw/zinc/26/98/32/171269832.db2.gz	XESYSLHPNHXOGU-HNNXBMFYSA-N	1	0	278.396	1.372	50	0		CDAARO
CC[NH+]1CCN([C@H](C)C(=O)Nc2ccc(F)cc2)CC1	ZINC000022786870	171399091	/nfs/dbraw/zinc/39/90/91/171399091.db2.gz	VURVBIXCJLHINM-GFCCVEGCSA-N	1	0	279.359	1.790	50	0		CDAARO
CO[C@H]1C[C@@H](CN(C)C(=O)Cc2ccccc2O)[N@H+](C)C1	ZINC000285346874	196256590	/nfs/dbraw/zinc/25/65/90/196256590.db2.gz	WUMAEFKWHNTFQJ-KBPBESRZSA-N	1	0	292.379	1.112	50	0		CDAARO
O=C([C@@H]1CCC[NH2+]1)N1CCC[C@H]1Cc1ccccc1	ZINC000037804090	173743709	/nfs/dbraw/zinc/74/37/09/173743709.db2.gz	XEWUIEICOPIFNT-GJZGRUSLSA-N	1	0	258.365	1.972	50	0		CDAARO
[NH3+][C@@H]1CCCN(Cc2nc(-c3cccs3)no2)C1	ZINC000041029395	174454255	/nfs/dbraw/zinc/45/42/55/174454255.db2.gz	CCDLBNOEVGGRND-SECBINFHSA-N	1	0	264.354	1.721	50	0		CDAARO
O=C([C@@H]1CCCCO1)N1CCC[C@H]1C1CC[NH2+]CC1	ZINC000050960577	175521600	/nfs/dbraw/zinc/52/16/00/175521600.db2.gz	VHSOTTABVGCWHU-KBPBESRZSA-N	1	0	266.385	1.546	50	0		CDAARO
CC(C)C[C@@H]([NH3+])C(=O)N1CCC(CCn2cccn2)CC1	ZINC000071662005	176242497	/nfs/dbraw/zinc/24/24/97/176242497.db2.gz	KJZJJGPASMSXJR-OAHLLOKOSA-N	1	0	292.427	1.885	50	0		CDAARO
CC[C@@H]1C[N@H+](CCO)CCC(=O)N1Cc1ccccc1	ZINC000071752640	176260070	/nfs/dbraw/zinc/26/00/70/176260070.db2.gz	JPQILORLYIZRTE-OAHLLOKOSA-N	1	0	276.380	1.492	50	0		CDAARO
COCC[N@@H+]1C[C@@H]2c3ccc(OC)cc3OC[C@]2(CO)C1	ZINC000095517248	274033382	/nfs/dbraw/zinc/03/33/82/274033382.db2.gz	FIKZYMYPXXAYMF-GDBMZVCRSA-N	1	0	293.363	1.112	50	0		CDAARO
Fc1ccc(O[C@H]2CCOC[C@H]2NC2CC[NH2+]CC2)cc1	ZINC000220401006	274911996	/nfs/dbraw/zinc/91/19/96/274911996.db2.gz	RJHQFWOKFLCOSR-CVEARBPZSA-N	1	0	294.370	1.704	50	0		CDAARO
O=C([C@H]1C[C@@H](O)C[NH2+]1)N1CC2(CCCC2)c2ccccc21	ZINC000252519018	275009580	/nfs/dbraw/zinc/00/95/80/275009580.db2.gz	AQXGWCXECJTIAE-TZMCWYRMSA-N	1	0	286.375	1.568	50	0		CDAARO
CCN(CC)C(=O)[C@H]1CCC[N@@H+](C2CCN(C)CC2)C1	ZINC000003683516	276320277	/nfs/dbraw/zinc/32/02/77/276320277.db2.gz	PPCBIZLRRZTOBD-AWEZNQCLSA-N	1	0	281.444	1.661	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)[C@H]1COc2ccccc21	ZINC000122614172	277277617	/nfs/dbraw/zinc/27/76/17/277277617.db2.gz	VSQNQLAKQUGORK-AAEUAGOBSA-N	1	0	260.337	1.373	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN1C(=O)[C@@H]1COc2ccccc21	ZINC000122613739	277277684	/nfs/dbraw/zinc/27/76/84/277277684.db2.gz	VSQNQLAKQUGORK-WCQYABFASA-N	1	0	260.337	1.373	50	0		CDAARO
COC[C@@H]([NH2+]CC(=O)N1C[C@H](C)C[C@H](C)C1)C1CC1	ZINC000108463745	277568246	/nfs/dbraw/zinc/56/82/46/277568246.db2.gz	RCSPZVRGNMXCIU-MBNYWOFBSA-N	1	0	268.401	1.506	50	0		CDAARO
C[C@@H]1CCCN(C(=O)c2ncncc2Cl)[C@H]1C[NH3+]	ZINC000179222220	278478633	/nfs/dbraw/zinc/47/86/33/278478633.db2.gz	MFVATGFOGLJSML-SCZZXKLOSA-N	1	0	268.748	1.329	50	0		CDAARO
CC[NH+](CC)C[C@H](O)COc1ccc(OC)cc1	ZINC000000189890	279133393	/nfs/dbraw/zinc/13/33/93/279133393.db2.gz	AFHIPGDASBQREJ-LBPRGKRZSA-N	1	0	253.342	1.777	50	0		CDAARO
C[C@H](Oc1cccnc1)C(=O)N1CCC[C@H](C)[C@H]1C[NH3+]	ZINC000247314692	279589939	/nfs/dbraw/zinc/58/99/39/279589939.db2.gz	RPDRENXZEZLVCM-SGMGOOAPSA-N	1	0	277.368	1.435	50	0		CDAARO
Cc1c(Cl)c(C(=O)N2[C@@H]3CC[C@H]2C[NH2+]CC3)nn1C	ZINC000097610027	280229103	/nfs/dbraw/zinc/22/91/03/280229103.db2.gz	MFULVIKOTIOFIV-ZJUUUORDSA-N	1	0	282.775	1.348	50	0		CDAARO
C[C@@H]1COC[C@@H](C)N1C(=O)[C@H]1CC12CC[NH2+]CC2	ZINC000261961852	288373107	/nfs/dbraw/zinc/37/31/07/288373107.db2.gz	RXZJOOPGCXNIQM-IJLUTSLNSA-N	1	0	252.358	1.012	50	0		CDAARO
CCC(=O)N1CC[C@@H]([NH2+][C@H]2CC(C)(C)OC2(C)C)C1	ZINC000095969370	289063516	/nfs/dbraw/zinc/06/35/16/289063516.db2.gz	JYZPMUUASFCKPX-NEPJUHHUSA-N	1	0	268.401	1.933	50	0		CDAARO
CCOc1ccc(/C=C\C(=O)N2CC[C@H]([NH3+])C2)cc1	ZINC000254956170	289346831	/nfs/dbraw/zinc/34/68/31/289346831.db2.gz	LRYGTBYNGZYVGT-UJZCVKTISA-N	1	0	260.337	1.658	50	0		CDAARO
Cc1ccccc1C1(C(=O)N(C)[C@@H]2CC[NH2+]C2)CC1	ZINC000179053696	315967786	/nfs/dbraw/zinc/96/77/86/315967786.db2.gz	RFEAUHBWTFBPIP-CYBMUJFWSA-N	1	0	258.365	1.847	50	0		CDAARO
C[NH+](C)C1(CNC(=O)C[C@H]2CCCOC2)CCCC1	ZINC000534580789	328311597	/nfs/dbraw/zinc/31/15/97/328311597.db2.gz	RIZFKXSZMQSICL-CYBMUJFWSA-N	1	0	268.401	1.794	50	0		CDAARO
Cc1nn(C(C)C)c(C)c1CN(C)C(=O)[C@H]1C=CC[NH2+]1	ZINC000534588251	328316509	/nfs/dbraw/zinc/31/65/09/328316509.db2.gz	AFMMDNSQISDSFF-CQSZACIVSA-N	1	0	276.384	1.567	50	0		CDAARO
CCC[C@H](NC(C)=O)C(=O)NCC1(C[NH+]2CCCC2)CC1	ZINC000534588843	328316758	/nfs/dbraw/zinc/31/67/58/328316758.db2.gz	VBSDHSBJNLARGY-AWEZNQCLSA-N	1	0	295.427	1.283	50	0		CDAARO
CC[N@H+](C)[C@H](C)C(=O)NCc1nn(C)c2ccc(C)cc12	ZINC000534633679	328332768	/nfs/dbraw/zinc/33/27/68/328332768.db2.gz	QXJFVVIGNIAQDT-GFCCVEGCSA-N	1	0	288.395	1.838	50	0		CDAARO
CC(=O)NC(C)(C)C[C@@H](C)[NH2+]Cc1cccc(CO)c1	ZINC000534635475	328333449	/nfs/dbraw/zinc/33/34/49/328333449.db2.gz	CBNRUGABMBXJSS-GFCCVEGCSA-N	1	0	278.396	1.962	50	0		CDAARO
COc1cc(NC[C@H](C(C)C)[NH+](C)C)nc(OC)n1	ZINC000534640042	328335794	/nfs/dbraw/zinc/33/57/94/328335794.db2.gz	DSFJCOJJUKMXIE-SNVBAGLBSA-N	1	0	268.361	1.492	50	0		CDAARO
CCc1ccc2c(c1)C(=O)N(CC[NH+](C)C)CC(=O)N2	ZINC000534659720	328342551	/nfs/dbraw/zinc/34/25/51/328342551.db2.gz	QALCEARUOKJNIP-UHFFFAOYSA-N	1	0	275.352	1.205	50	0		CDAARO
Cc1n[nH]c(C)c1CCNC(=O)[C@@H]1CCC[NH2+]CC1	ZINC000534660295	328342596	/nfs/dbraw/zinc/34/25/96/328342596.db2.gz	ZFNVKZMXDDJDTO-GFCCVEGCSA-N	1	0	264.373	1.075	50	0		CDAARO
O=C1CC[C@@H]([NH2+]CCc2ncc[nH]2)CN1Cc1ccccc1	ZINC000534649325	328343828	/nfs/dbraw/zinc/34/38/28/328343828.db2.gz	JMDVFMVWHLRJLS-OAHLLOKOSA-N	1	0	298.390	1.733	50	0		CDAARO
O=C(c1ccc(Cl)cn1)N1[C@@H]2CC[C@H]1[C@H]1C[NH2+]C[C@H]12	ZINC000534676007	328355972	/nfs/dbraw/zinc/35/59/72/328355972.db2.gz	HNDPATIEAOCLHF-NIFPGPBJSA-N	1	0	277.755	1.557	50	0		CDAARO
[NH3+]CC(=O)N1CCC[C@H](COc2ccc(F)cc2)C1	ZINC000077421163	327132343	/nfs/dbraw/zinc/13/23/43/327132343.db2.gz	VYOYHHSEIPCSEW-NSHDSACASA-N	1	0	266.316	1.402	50	0		CDAARO
CS(=O)(=O)Nc1ccc([C@H]2CCC[NH2+]C2)cc1	ZINC000258618181	1159737184	/nfs/dbraw/zinc/73/71/84/1159737184.db2.gz	LPOWYZXFMZFXKT-NSHDSACASA-N	1	0	254.355	1.525	50	0		CDAARO
CCOC1CC[NH+](CC[C@@H]2CCS(=O)(=O)C2)CC1	ZINC000677678342	482746712	/nfs/dbraw/zinc/74/67/12/482746712.db2.gz	HNNRTOZCDGYZQJ-GFCCVEGCSA-N	1	0	275.414	1.312	50	0		CDAARO
CCN1C[C@@H](C[N@H+](C)C2CSCCSC2)CC1=O	ZINC000670453872	483024030	/nfs/dbraw/zinc/02/40/30/483024030.db2.gz	GETFFFKBSYWUPB-LLVKDONJSA-N	1	0	288.482	1.635	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](CN(C)c2ncc(Cl)cn2)C1	ZINC000670458299	483039591	/nfs/dbraw/zinc/03/95/91/483039591.db2.gz	IEJNRIGMVNRGIH-LBPRGKRZSA-N	1	0	298.818	1.925	50	0		CDAARO
CCCc1nc(N2CC[N@H+](CC)C(C)(C)C2)no1	ZINC000670468154	483059554	/nfs/dbraw/zinc/05/95/54/483059554.db2.gz	QCUVSVDNIIIECK-UHFFFAOYSA-N	1	0	252.362	1.943	50	0		CDAARO
O=C(C[C@@H]1CCOC1)NC1CC[NH+](C2CCOCC2)CC1	ZINC000670472383	483081166	/nfs/dbraw/zinc/08/11/66/483081166.db2.gz	FQBAHXZBEAMUGK-ZDUSSCGKSA-N	1	0	296.411	1.173	50	0		CDAARO
Cc1nnc(CN(C)[C@@H]2CC[N@H+](CC3CCCC3)C2)n1C	ZINC000084291166	483270268	/nfs/dbraw/zinc/27/02/68/483270268.db2.gz	FOOGFBRLFJSKKH-OAHLLOKOSA-N	1	0	291.443	1.820	50	0		CDAARO
CC[C@H](C)c1cc(C(=O)N2CC[C@H](C[NH3+])C2)on1	ZINC000178532392	522024565	/nfs/dbraw/zinc/02/45/65/522024565.db2.gz	GOXNRPXVIBQZBE-VHSXEESVSA-N	1	0	251.330	1.609	50	0		CDAARO
Cc1cc(C[NH+]2CCC(CCC(=O)NC3CC3)CC2)[nH]n1	ZINC000012306004	524673610	/nfs/dbraw/zinc/67/36/10/524673610.db2.gz	GNWIUNASCZAOML-UHFFFAOYSA-N	1	0	290.411	1.989	50	0		CDAARO
CCO[C@H]1C[N@H+](Cc2ccc3[nH]ccc3c2)C[C@@H]1O	ZINC000222749775	528063493	/nfs/dbraw/zinc/06/34/93/528063493.db2.gz	CAIHFQFPXVYZIE-GJZGRUSLSA-N	1	0	260.337	1.750	50	0		CDAARO
CC(C)[N@H+](C)CC(=O)NCCn1c(=S)[nH]nc1C1CC1	ZINC000096437025	528812951	/nfs/dbraw/zinc/81/29/51/528812951.db2.gz	RBIRTSHKNFLFIT-UHFFFAOYSA-N	1	0	297.428	1.274	50	0		CDAARO
COc1ccc(C(=O)O[C@H]2C[NH+]3CCC2CC3)cc1	ZINC000000487775	545531774	/nfs/dbraw/zinc/53/17/74/545531774.db2.gz	RTVDYLNYUUQEKN-AWEZNQCLSA-N	1	0	261.321	1.946	50	0	biogenic	CDAARO
CC(C)C(=O)N1CCC[C@H]([NH2+]Cc2ncc[nH]2)C1	ZINC000952991041	614365762	/nfs/dbraw/zinc/36/57/62/614365762.db2.gz	LDSJRUBOANQOOB-NSHDSACASA-N	1	0	250.346	1.146	50	0		CDAARO
CCC[N@@H+]1CCC[C@H](Nc2nc(OC)cc(OC)n2)C1	ZINC000952977816	614676779	/nfs/dbraw/zinc/67/67/79/614676779.db2.gz	DAMGSMJHRGHRSS-NSHDSACASA-N	1	0	280.372	1.780	50	0		CDAARO
CC[C@H]([NH3+])[C@@]1(O)CCCN(C(=O)OC(C)(C)C)C1	ZINC000958528700	615792303	/nfs/dbraw/zinc/79/23/03/615792303.db2.gz	ZNUGSAZMWZVNIU-GXFFZTMASA-N	1	0	258.362	1.486	50	0		CDAARO
O=C(C[N@H+]1CCC[C@@]2(CCC[C@H]2O)C1)N1CCCC1	ZINC001704341111	1177694875	/nfs/dbraw/zinc/69/48/75/1177694875.db2.gz	PUGHHIJLXIUXAW-HIFRSBDPSA-N	1	0	266.385	1.236	50	0		CDAARO
Cc1c[nH]c(-c2nc(-c3c(C)ncc4c3CC[NH2+]C4)no2)n1	ZINC000019839314	711866923	/nfs/dbraw/zinc/86/69/23/711866923.db2.gz	HKPGQQUEZXLSIE-UHFFFAOYSA-N	1	0	296.334	1.784	50	0		CDAARO
C[C@@H]1CC[NH2+][C@@H](C)[C@H]1NC(=O)Cc1cccc(O)c1	ZINC000387947189	712307436	/nfs/dbraw/zinc/30/74/36/712307436.db2.gz	ALZIEVRDPMWTDR-ZETOZRRWSA-N	1	0	262.353	1.437	50	0		CDAARO
C/C(=C/C(=O)NCCN1CC[NH2+]CC1)c1cccc(F)c1	ZINC000095427867	712674562	/nfs/dbraw/zinc/67/45/62/712674562.db2.gz	YFQVIIOSJLWLKQ-QBFSEMIESA-N	1	0	291.370	1.250	50	0		CDAARO
CCN1CCC[C@H]([N@@H+]2CCC[C@@H](CN3CCCC3=O)C2)C1	ZINC000032541248	912774179	/nfs/dbraw/zinc/77/41/79/912774179.db2.gz	MSEIUFLSRDEAKW-CVEARBPZSA-N	1	0	293.455	1.805	50	0		CDAARO
Cc1ccc(C[N@@H+]2CCCC[C@@H]2CCCO)c(=O)[nH]1	ZINC000020539888	899252437	/nfs/dbraw/zinc/25/24/37/899252437.db2.gz	AZOSMYCGXOLUDB-CQSZACIVSA-N	1	0	264.369	1.810	50	0		CDAARO
C[C@@H]([NH2+]CCN1CCc2ccccc2C1=O)c1ncc[nH]1	ZINC000952845590	910404495	/nfs/dbraw/zinc/40/44/95/910404495.db2.gz	YVSOSSVGZCQVND-GFCCVEGCSA-N	1	0	284.363	1.759	50	0		CDAARO
OC[C@@H]1CCCC[N@@H+]1CCNc1ncnc2[nH]ccc21	ZINC000952963274	910475530	/nfs/dbraw/zinc/47/55/30/910475530.db2.gz	IOKKTOJNFCNRPM-NSHDSACASA-N	1	0	275.356	1.217	50	0		CDAARO
O=C(c1cccnc1)N1CCC([NH2+]CCc2cn[nH]c2)CC1	ZINC000952982742	910545317	/nfs/dbraw/zinc/54/53/17/910545317.db2.gz	YMGRSHYZWQZSDN-UHFFFAOYSA-N	1	0	299.378	1.242	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1CCn1ccc2[nH]c(=O)c(C#N)cc2c1=O	ZINC000067513843	936619173	/nfs/dbraw/zinc/61/91/73/936619173.db2.gz	SHJODVAMZKLDJY-GFCCVEGCSA-N	1	0	298.346	1.046	50	0		CDAARO
COCC[N@@H+]1CC[C@H](CNC(=O)CCC2CCC2)C1	ZINC000824412400	925820263	/nfs/dbraw/zinc/82/02/63/925820263.db2.gz	NMQRRYFIMCQODF-CQSZACIVSA-N	1	0	268.401	1.651	50	0		CDAARO
O[C@H]1CCC[N@H+](CCCNc2nccc3cccnc32)C1	ZINC000828627374	926149757	/nfs/dbraw/zinc/14/97/57/926149757.db2.gz	IVAMXKDZZJXPBM-AWEZNQCLSA-N	1	0	286.379	1.889	50	0		CDAARO
C[N@@H+]1CCCCC[C@H]1C(=O)NC1(CO)CCCC1	ZINC000828686742	926163481	/nfs/dbraw/zinc/16/34/81/926163481.db2.gz	INPUJEVOSZYEGX-LBPRGKRZSA-N	1	0	254.374	1.282	50	0		CDAARO
C[NH+](C)[C@@H]1CN(Cc2ccc(F)cc2F)CC[C@@H]1CO	ZINC000581799345	927199590	/nfs/dbraw/zinc/19/95/90/927199590.db2.gz	RAVMXJOUSJMQQA-IUODEOHRSA-N	1	0	284.350	1.709	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNc1ccn2nccc2n1	ZINC000585079417	930851873	/nfs/dbraw/zinc/85/18/73/930851873.db2.gz	BNBXREXXZVTYET-LBPRGKRZSA-N	1	0	259.357	1.438	50	0		CDAARO
Cc1nncn1CC[N@H+](Cc1cccc(O)c1)C1CC1	ZINC001529113369	968983934	/nfs/dbraw/zinc/98/39/34/968983934.db2.gz	XNPIKFHSRPTAKG-UHFFFAOYSA-N	1	0	272.352	1.957	50	0		CDAARO
CC(C)[N@@H+]1CCCN(c2cccc(C(=O)N(C)C)n2)CC1	ZINC001529159251	968996419	/nfs/dbraw/zinc/99/64/19/968996419.db2.gz	RAMCBYVMDJIYRN-UHFFFAOYSA-N	1	0	290.411	1.704	50	0		CDAARO
CN(C)[C@H]1CCCC[N@H+](CCCn2ccnc2)C1	ZINC001506397924	975147902	/nfs/dbraw/zinc/14/79/02/975147902.db2.gz	ZCIXHXBETBGZMY-AWEZNQCLSA-N	1	0	250.390	1.689	50	0		CDAARO
Cc1nncn1CC[NH+]1CCC(Oc2cccnc2)CC1	ZINC001506409624	975152615	/nfs/dbraw/zinc/15/26/15/975152615.db2.gz	YZNNBIZPVLRQJZ-UHFFFAOYSA-N	1	0	287.367	1.525	50	0		CDAARO
c1[nH]nc2c1C[N@H+](C1CSCCSC1)CC2	ZINC001506413094	975153952	/nfs/dbraw/zinc/15/39/52/975153952.db2.gz	QSJIELCEJQWBSE-UHFFFAOYSA-N	1	0	255.412	1.616	50	0		CDAARO
Cc1cc(C)n(C[C@@H](C)[N@H+](C)CC2(C)COC2)n1	ZINC001506420528	975158119	/nfs/dbraw/zinc/15/81/19/975158119.db2.gz	HLZQCHSQWJBEAN-CYBMUJFWSA-N	1	0	251.374	1.857	50	0		CDAARO
O=C(Nc1ccc(F)c(Cl)c1)N[C@H]1C[NH2+]CC[C@H]1O	ZINC000426465441	230419212	/nfs/dbraw/zinc/41/92/12/230419212.db2.gz	LAPUCEIWAXPNFJ-WDEREUQCSA-N	1	0	287.722	1.323	50	0		CDAARO
O=C(c1cncnc1)N1CC[NH+](CC2CCC2)CC1	ZINC000584902828	341986980	/nfs/dbraw/zinc/98/69/80/341986980.db2.gz	FDRPQMHOZSUDBT-UHFFFAOYSA-N	1	0	260.341	1.035	50	0		CDAARO
COc1ccc2c(c1)C[C@@H]([NH2+]CCc1ncnn1C)CC2	ZINC000584903488	341987273	/nfs/dbraw/zinc/98/72/73/341987273.db2.gz	GYXCZENSKMAUQM-AWEZNQCLSA-N	1	0	286.379	1.513	50	0		CDAARO
[NH3+]CC[C@@H]1CN(C(=O)Cc2cccc(Cl)c2)CCO1	ZINC000219862709	230396908	/nfs/dbraw/zinc/39/69/08/230396908.db2.gz	VKFXPYAMHMAYGQ-CYBMUJFWSA-N	1	0	282.771	1.459	50	0		CDAARO
C[C@]1(c2ccccc2)CCC[N@H+](Cc2cc(=O)[nH]c(=O)[nH]2)C1	ZINC000095524617	185003580	/nfs/dbraw/zinc/00/35/80/185003580.db2.gz	BLSXBIMRRHZJPI-KRWDZBQOSA-N	1	0	299.374	1.617	50	0		CDAARO
CN(C(=O)Nc1ccc(F)nc1)[C@H]1CC[N@H+](C)C1	ZINC000095527266	185003809	/nfs/dbraw/zinc/00/38/09/185003809.db2.gz	GBRNMCUHLQKLDB-JTQLQIEISA-N	1	0	252.293	1.389	50	0		CDAARO
COCC[N@@H+]1CCCN(C(=O)c2oc(C)nc2C)CC1	ZINC000095962876	185044198	/nfs/dbraw/zinc/04/41/98/185044198.db2.gz	FPOIYESSKMRILI-UHFFFAOYSA-N	1	0	281.356	1.086	50	0		CDAARO
NC(=O)COc1ccc(CC[NH2+][C@H]2CCSC2)cc1	ZINC000095967317	185047089	/nfs/dbraw/zinc/04/70/89/185047089.db2.gz	CESXIJPVEABHIF-LBPRGKRZSA-N	1	0	280.393	1.188	50	0		CDAARO
O=C(CCc1ccc(F)cc1)NC[C@H]1CCC[NH2+]C1	ZINC000095971553	185048334	/nfs/dbraw/zinc/04/83/34/185048334.db2.gz	CWSNHDKEXNDIFI-ZDUSSCGKSA-N	1	0	264.344	1.874	50	0		CDAARO
COCC1(CNC(=O)[C@@H]2CC23CC[NH2+]CC3)CCC1	ZINC000382010438	342089933	/nfs/dbraw/zinc/08/99/33/342089933.db2.gz	MZHFWVQUZFSBBX-LBPRGKRZSA-N	1	0	266.385	1.309	50	0		CDAARO
Cc1cc(C)c(OCCOCCNCC[NH3+])c(C)c1	ZINC000022034191	342088884	/nfs/dbraw/zinc/08/88/84/342088884.db2.gz	NSQBGSSUKOHMIO-UHFFFAOYSA-N	1	0	266.385	1.556	50	0		CDAARO
CC(C)[N@H+](C)CCOC(=O)c1ccc2c(c1)OCCO2	ZINC000005018090	342089112	/nfs/dbraw/zinc/08/91/12/342089112.db2.gz	QXOZRAFANVGMTJ-UHFFFAOYSA-N	1	0	279.336	1.955	50	0		CDAARO
CN(C)c1ccc(CCNC(=O)[C@@H]2CCC[NH2+]C2)cc1	ZINC000096132610	185104610	/nfs/dbraw/zinc/10/46/10/185104610.db2.gz	DDRRPKGJQDVRRR-CQSZACIVSA-N	1	0	275.396	1.411	50	0		CDAARO
Cc1c(NC(=O)N2CC[C@H]([NH+](C)C)C2)cccc1C(N)=O	ZINC000096141686	185106239	/nfs/dbraw/zinc/10/62/39/185106239.db2.gz	YCQPBXFNSFYFSL-NSHDSACASA-N	1	0	290.367	1.262	50	0		CDAARO
Cc1cc(CN(C)c2cc([C@H]3C[C@H]([NH3+])C3)nc(N)n2)no1	ZINC000243932087	361830400	/nfs/dbraw/zinc/83/04/00/361830400.db2.gz	BSLFEKNNPZPFRV-MGCOHNPYSA-N	1	0	288.355	1.196	50	0		CDAARO
CC(C)OCCCNc1cc([C@H]2C[C@@H](O)C2)[nH+]c(N)n1	ZINC000244795186	361864741	/nfs/dbraw/zinc/86/47/41/361864741.db2.gz	RBEMMOXNAMTGMA-PHIMTYICSA-N	1	0	280.372	1.524	50	0		CDAARO
CC(C)Oc1cccc(OCC[N@H+](C)[C@H]2COC[C@@H]2O)c1	ZINC000244795495	361864998	/nfs/dbraw/zinc/86/49/98/361864998.db2.gz	RHJLSZITCMOPLM-HOTGVXAUSA-N	1	0	295.379	1.544	50	0		CDAARO
Cc1cc(CNC(=O)N2CCC[C@]3(CC[NH2+]C3)C2)ccn1	ZINC000333638252	539053506	/nfs/dbraw/zinc/05/35/06/539053506.db2.gz	UDDYHQGCUBQKIM-MRXNPFEDSA-N	1	0	288.395	1.675	50	0		CDAARO
COc1ccc([C@@H]2C[C@H]2C(=O)N2CCN(C)C[C@@H]2C)cc1	ZINC000685939474	539045648	/nfs/dbraw/zinc/04/56/48/539045648.db2.gz	YGIMFILAPVATJM-VBNZEHGJSA-N	1	0	288.391	1.961	50	0		CDAARO
COC(=O)C1=CCC[N@H+](CCC(=O)Nc2ccccc2)C1	ZINC000585140960	342218799	/nfs/dbraw/zinc/21/87/99/342218799.db2.gz	MJFOMBKVWXTURG-UHFFFAOYSA-N	1	0	288.347	1.820	50	0		CDAARO
O=C(NC[C@H]1C[N@@H+]2CCC[C@H]2CO1)c1cc(F)cc(F)c1	ZINC000061650514	539051827	/nfs/dbraw/zinc/05/18/27/539051827.db2.gz	DJGNYVXWWYTLQX-KBPBESRZSA-N	1	0	296.317	1.558	50	0		CDAARO
CC[C@@H](C)[C@H]([NH3+])C(=O)N1CCC(N2CCCCC2=O)CC1	ZINC000096499723	529417082	/nfs/dbraw/zinc/41/70/82/529417082.db2.gz	ZEABLEHPLRBBNZ-DOMZBBRYSA-N	1	0	295.427	1.363	50	0		CDAARO
C[C@H]1CN(C(=O)C2CC2)CC[C@@H]1[NH2+]Cc1ccccn1	ZINC000084714959	342267872	/nfs/dbraw/zinc/26/78/72/342267872.db2.gz	NMODUOCAYMNJCQ-WFASDCNBSA-N	1	0	273.380	1.818	50	0		CDAARO
CC[C@H](C)C[N@H+](C)[C@@H]1CCN(CCC(=O)OC)C1=O	ZINC000585094194	362021220	/nfs/dbraw/zinc/02/12/20/362021220.db2.gz	OEPYSUCRPIPTGG-NWDGAFQWSA-N	1	0	270.373	1.128	50	0		CDAARO
CC[NH+](CC)CC[C@@H](CO)NCc1ccoc1C	ZINC000585118097	362047751	/nfs/dbraw/zinc/04/77/51/362047751.db2.gz	BHGUEYINFMNQOJ-AWEZNQCLSA-N	1	0	254.374	1.770	50	0		CDAARO
CC[C@H](C(N)=O)N1CCN(c2cc[nH+]c3ccccc32)CC1	ZINC000289288900	136399386	/nfs/dbraw/zinc/39/93/86/136399386.db2.gz	GZDGKVLWIOBIPU-OAHLLOKOSA-N	1	0	298.390	1.621	50	0		CDAARO
O=C(N[C@@H]1C[NH2+]C[C@H](F)C1)OCc1ccccc1	ZINC000110915990	343762150	/nfs/dbraw/zinc/76/21/50/343762150.db2.gz	ABEYDAZZAVWOEL-NEPJUHHUSA-N	1	0	252.289	1.613	50	0		CDAARO
CNC(=O)c1nc(-c2cccc([C@H](C)[NH+]3CCCC3)c2)n[nH]1	ZINC000426707473	529954227	/nfs/dbraw/zinc/95/42/27/529954227.db2.gz	SEVCTDKVAPGJPS-NSHDSACASA-N	1	0	299.378	1.988	50	0		CDAARO
Cc1cc2c(cc1C)O[C@@H](C(=O)N[C@@H]1CCCC[C@H]1[NH3+])C2	ZINC000128929222	362347024	/nfs/dbraw/zinc/34/70/24/362347024.db2.gz	VXNZCFAFBPFMCS-IIAWOOMASA-N	1	0	288.391	1.993	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)Cc2ccccc2Br)C1	ZINC000084719063	178920398	/nfs/dbraw/zinc/92/03/98/178920398.db2.gz	LTUDBSUKZGSCDU-NSHDSACASA-N	1	0	297.196	1.941	50	0		CDAARO
C[NH2+]CCCCNC(=O)c1sc(C)cc1OC	ZINC000097776132	185666966	/nfs/dbraw/zinc/66/69/66/185666966.db2.gz	GNSXCSRLOIXXSJ-UHFFFAOYSA-N	1	0	256.371	1.795	50	0		CDAARO
CCCCC[N@@H+]1CC[C@]2(C1)NC(=O)N(C(C)C)C2=O	ZINC000089953436	347629509	/nfs/dbraw/zinc/62/95/09/347629509.db2.gz	MHTBTXXHEQPMJB-CQSZACIVSA-N	1	0	267.373	1.581	50	0		CDAARO
Cc1nonc1CNC(=O)C[NH+]1CCCCCCC1	ZINC000584894201	349353970	/nfs/dbraw/zinc/35/39/70/349353970.db2.gz	IXNWJFFQFGBQEU-UHFFFAOYSA-N	1	0	266.345	1.260	50	0		CDAARO
CS[C@H](C)Cc1cn(CC[NH+]2CCCC2)nn1	ZINC000091256082	180114824	/nfs/dbraw/zinc/11/48/24/180114824.db2.gz	XOSFZUKIEDNQCT-LLVKDONJSA-N	1	0	254.403	1.668	50	0		CDAARO
CCn1nc(C(C)C)cc1C(=O)N1CC[C@H]([NH3+])C1	ZINC000091665563	180221357	/nfs/dbraw/zinc/22/13/57/180221357.db2.gz	QRKSTZRBOUOCOG-JTQLQIEISA-N	1	0	250.346	1.200	50	0		CDAARO
O[C@@H]1C[C@H](O)C12CC[NH+](CCc1ccccc1)CC2	ZINC000091873128	180278104	/nfs/dbraw/zinc/27/81/04/180278104.db2.gz	FIQVKYRFCQBIPI-GASCZTMLSA-N	1	0	261.365	1.437	50	0		CDAARO
COc1ccccc1C(=O)NC[C@H]1C[N@@H+]2CCC[C@H]2CO1	ZINC000106517109	186123339	/nfs/dbraw/zinc/12/33/39/186123339.db2.gz	WJPROPGRDSTLLQ-STQMWFEESA-N	1	0	290.363	1.288	50	0		CDAARO
CC[N@@H+]1C[C@@H](C)[C@@H](NS(=O)(=O)c2ccccc2)C1	ZINC000257366039	350964718	/nfs/dbraw/zinc/96/47/18/350964718.db2.gz	HFWSWMJAPFITPE-YPMHNXCESA-N	1	0	268.382	1.305	50	0		CDAARO
CC[C@H]([NH3+])C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000121583360	186983079	/nfs/dbraw/zinc/98/30/79/186983079.db2.gz	NNPHBEYLGVZKEG-ILXRZTDVSA-N	1	0	276.380	1.838	50	0		CDAARO
CN1CC[C@@H]2CC[N@H+](C[C@H](O)COC(C)(C)C)[C@@H]2C1	ZINC000253417072	283076322	/nfs/dbraw/zinc/07/63/22/283076322.db2.gz	LENXEFFBRGIKCU-HZSPNIEDSA-N	1	0	270.417	1.188	50	0		CDAARO
OCCN1CN=C(SCc2ccccc2)NC1	ZINC000000180372	355894424	/nfs/dbraw/zinc/89/44/24/355894424.db2.gz	CYXBIMKIAYKHPQ-UHFFFAOYSA-N	1	0	251.355	1.088	50	0		CDAARO
COc1cccc(OC)c1OCCC[NH2+]C[C@H](C)O	ZINC000002880969	355986445	/nfs/dbraw/zinc/98/64/45/355986445.db2.gz	KYTHIKNEZDLFAM-NSHDSACASA-N	1	0	269.341	1.443	50	0		CDAARO
COCCC[NH+]1CCN(c2ccccc2OC)CC1	ZINC000001664858	355945000	/nfs/dbraw/zinc/94/50/00/355945000.db2.gz	ITNSQDCAZVVFMS-UHFFFAOYSA-N	1	0	264.369	1.854	50	0	in-man	CDAARO
C[NH+](C)CCN1C(=O)c2cccc3cc(N)cc(c32)C1=O	ZINC000004214836	356021805	/nfs/dbraw/zinc/02/18/05/356021805.db2.gz	UPALIKSFLSVKIS-UHFFFAOYSA-N	1	0	283.331	1.580	50	0	investigational	CDAARO
COc1ccc(S(=O)(=O)C[C@H]2CCC[NH2+]C2)cc1	ZINC000011967561	356285676	/nfs/dbraw/zinc/28/56/76/356285676.db2.gz	OYPCDATUUUWGKD-NSHDSACASA-N	1	0	269.366	1.469	50	0		CDAARO
O=C(c1ccc2c(c1)OCO2)[C@@H]1CCC[N@@H+](CCO)C1	ZINC000012593935	356310561	/nfs/dbraw/zinc/31/05/61/356310561.db2.gz	DISAUHXHWRZCEE-GFCCVEGCSA-N	1	0	277.320	1.302	50	0		CDAARO
CCOc1cccc(C(=O)NC2CC[NH+](C)CC2)c1	ZINC000016606062	356443062	/nfs/dbraw/zinc/44/30/62/356443062.db2.gz	LYVKJNOOEJKELL-UHFFFAOYSA-N	1	0	262.353	1.909	50	0		CDAARO
CCOc1ccc([C@@H](C[NH3+])N2CCOCC2)cc1	ZINC000019201075	356476032	/nfs/dbraw/zinc/47/60/32/356476032.db2.gz	DYMOSECQTNSXEE-CQSZACIVSA-N	1	0	250.342	1.417	50	0		CDAARO
Cc1ncc2c(c1-c1noc([C@H]3CCC(=O)N3)n1)CC[NH2+]C2	ZINC000019739986	356499172	/nfs/dbraw/zinc/49/91/72/356499172.db2.gz	JHEFXEWHVSHCJI-LLVKDONJSA-N	1	0	299.334	1.037	50	0		CDAARO
CCCOc1ccc(C[NH2+][C@@H]2CCS(=O)(=O)C2)cc1	ZINC000019772569	356500718	/nfs/dbraw/zinc/50/07/18/356500718.db2.gz	FUOWWSNDOUDKTE-CYBMUJFWSA-N	1	0	283.393	1.752	50	0		CDAARO
COc1ccc([C@@H](C[NH3+])N2CCOCC2)c(OC)c1	ZINC000019796368	356505674	/nfs/dbraw/zinc/50/56/74/356505674.db2.gz	ZEJBQXZLSYSINH-CYBMUJFWSA-N	1	0	266.341	1.036	50	0		CDAARO
CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000195575877	363476053	/nfs/dbraw/zinc/47/60/53/363476053.db2.gz	LVHKJWZGIVLNCW-BFHYXJOUSA-N	1	0	286.441	1.602	50	0		CDAARO
C[C@@H](C(=O)N1CCCn2cncc2C1)[N@@H+]1CCC[C@@H](C)C1	ZINC000072172990	356639542	/nfs/dbraw/zinc/63/95/42/356639542.db2.gz	WRVXAEMEHRWOKH-KGLIPLIRSA-N	1	0	290.411	1.736	50	0		CDAARO
Cc1ccc(Cl)cc1N1CC[NH+](C[C@H](O)CO)CC1	ZINC000025436913	356675107	/nfs/dbraw/zinc/67/51/07/356675107.db2.gz	GXFBASRMMOWXEG-ZDUSSCGKSA-N	1	0	284.787	1.124	50	0		CDAARO
COc1cc(C[N@@H+]2CCCC[C@H]2CO)cc2c1OCO2	ZINC000000210321	356812670	/nfs/dbraw/zinc/81/26/70/356812670.db2.gz	KLNLDBTTZGZDAU-LBPRGKRZSA-N	1	0	279.336	1.771	50	0		CDAARO
CC[N@@H+]1CC[C@@H](CNC(=O)Nc2ccc(F)cn2)C1	ZINC000360397410	357116192	/nfs/dbraw/zinc/11/61/92/357116192.db2.gz	OLEHEIGXBOLTFY-JTQLQIEISA-N	1	0	266.320	1.684	50	0		CDAARO
CCC[C@@H]([NH3+])CNS(=O)(=O)c1ccc(C)cc1F	ZINC000095432152	357516179	/nfs/dbraw/zinc/51/61/79/357516179.db2.gz	WPXJKKCVXIQDEM-SNVBAGLBSA-N	1	0	274.361	1.540	50	0		CDAARO
O=C(c1cccc2nccnc21)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065386184	357534790	/nfs/dbraw/zinc/53/47/90/357534790.db2.gz	WNUMTIBERSFZHJ-NEPJUHHUSA-N	1	0	282.347	1.596	50	0		CDAARO
CC(=O)N1CCC(N(C)CC(=O)c2ccc(O)cc2)CC1	ZINC000065457004	357542618	/nfs/dbraw/zinc/54/26/18/357542618.db2.gz	GIVHVPMGILJPIS-UHFFFAOYSA-N	1	0	290.363	1.518	50	0		CDAARO
O=C(CC1CCOCC1)N1[C@@H]2CC[C@H]1C[NH2+]CC2	ZINC000065468222	357543627	/nfs/dbraw/zinc/54/36/27/357543627.db2.gz	UXEVRYKPZNCKDB-OLZOCXBDSA-N	1	0	252.358	1.156	50	0		CDAARO
C[N@@H+]1CCC[C@@H](c2n[nH]c(=O)n2C2CCCCC2)C1	ZINC000065470427	357543769	/nfs/dbraw/zinc/54/37/69/357543769.db2.gz	NGOHOUJYXNPKMZ-LLVKDONJSA-N	1	0	264.373	1.886	50	0		CDAARO
CC(C)c1nnsc1CNc1cc(C[NH3+])ncn1	ZINC000067789575	357627266	/nfs/dbraw/zinc/62/72/66/357627266.db2.gz	XQFDVCGNCQSDCH-UHFFFAOYSA-N	1	0	264.358	1.522	50	0		CDAARO
COc1nc(C)c(C(=O)NCC[C@@H]2CCC[N@H+](C)C2)s1	ZINC000067559556	357613230	/nfs/dbraw/zinc/61/32/30/357613230.db2.gz	DTKUEECRBLZUEO-NSHDSACASA-N	1	0	297.424	1.922	50	0		CDAARO
COc1ccc(CCC(=O)N2CC[NH2+][C@H](C)C2)cc1F	ZINC000188418889	357667753	/nfs/dbraw/zinc/66/77/53/357667753.db2.gz	QNUNRFVBQSGMOC-LLVKDONJSA-N	1	0	280.343	1.587	50	0		CDAARO
[NH3+][C@@H]1CCC[C@@H]1C(=O)N1CCC(OC[C@H]2CCCO2)CC1	ZINC000299740393	357700149	/nfs/dbraw/zinc/70/01/49/357700149.db2.gz	ZFYPPXWUOYXYDQ-QLFBSQMISA-N	1	0	296.411	1.300	50	0		CDAARO
Cc1ccc(C)c(N2CCN(C(=O)[C@H]3CCC[NH2+]3)CC2)c1	ZINC000072328588	357829644	/nfs/dbraw/zinc/82/96/44/357829644.db2.gz	ZATJVFGLVJILFW-OAHLLOKOSA-N	1	0	287.407	1.704	50	0		CDAARO
C[NH+](C)[C@@H]1CC[C@@H](NC(=O)N[C@H](CO)c2ccccc2)C1	ZINC000097048342	357927153	/nfs/dbraw/zinc/92/71/53/357927153.db2.gz	WQJPIECQLNSZCE-RBSFLKMASA-N	1	0	291.395	1.502	50	0		CDAARO
Cc1cccc(CNC(=O)C[NH2+][C@@H](C)[C@H]2CCCO2)c1	ZINC000097111609	357986837	/nfs/dbraw/zinc/98/68/37/357986837.db2.gz	KNJMKIZRXGPGRE-DZGCQCFKSA-N	1	0	276.380	1.768	50	0		CDAARO
C[N@@H+](CCc1ccncc1)CCn1c(=O)oc2cccnc21	ZINC000097051075	358131000	/nfs/dbraw/zinc/13/10/00/358131000.db2.gz	LADHFLBZSOXCBV-UHFFFAOYSA-N	1	0	298.346	1.559	50	0		CDAARO
C[C@@H]1CCCC[N@@H+]1C1CN(C(=O)c2ncccc2O)C1	ZINC000095358665	358684167	/nfs/dbraw/zinc/68/41/67/358684167.db2.gz	DHULZWFEBYUOLK-LLVKDONJSA-N	1	0	275.352	1.486	50	0		CDAARO
CC(C)[NH+]1CCC(C(=O)N[C@H](C)c2cnn(C)c2)CC1	ZINC000095361445	358685433	/nfs/dbraw/zinc/68/54/33/358685433.db2.gz	DGCRNYVOHIRNDT-GFCCVEGCSA-N	1	0	278.400	1.718	50	0		CDAARO
CC[NH+]1CCC(CC(=O)NCc2noc(C)n2)CC1	ZINC000095361866	358685474	/nfs/dbraw/zinc/68/54/74/358685474.db2.gz	JPBOPPQIOZLJBF-UHFFFAOYSA-N	1	0	266.345	1.116	50	0		CDAARO
CCCCn1ccnc1[C@H]1CCC[N@H+](CC(=O)N(C)C)C1	ZINC000095367376	358686451	/nfs/dbraw/zinc/68/64/51/358686451.db2.gz	ZDXMBOLFNNDOIQ-AWEZNQCLSA-N	1	0	292.427	1.951	50	0		CDAARO
C[N@@H+]1CCC[C@H](CCC(=O)NCCc2cnccn2)C1	ZINC000095371198	358687737	/nfs/dbraw/zinc/68/77/37/358687737.db2.gz	MWFSXNZWNTUUFR-CYBMUJFWSA-N	1	0	276.384	1.257	50	0		CDAARO
Cc1nc(C)n(CCNC(=O)[C@@H]2CCC[N@@H+](C(C)C)C2)n1	ZINC000095497418	358695133	/nfs/dbraw/zinc/69/51/33/358695133.db2.gz	BRQKOECRQNKGGH-CQSZACIVSA-N	1	0	293.415	1.132	50	0		CDAARO
CSCCC[N@@H+]1CCN(Cc2ccccc2)C[C@H](O)C1	ZINC000095501136	358696507	/nfs/dbraw/zinc/69/65/07/358696507.db2.gz	FMIUBDJFHMPITD-MRXNPFEDSA-N	1	0	294.464	1.918	50	0		CDAARO
c1cc(C[N@@H+]2CCCO[C@@H](CN3CCOCC3)C2)ccn1	ZINC000097179334	358756357	/nfs/dbraw/zinc/75/63/57/358756357.db2.gz	SPHONTKMMHNFTB-INIZCTEOSA-N	1	0	291.395	1.005	50	0		CDAARO
CCc1[nH]nc(C(=O)N2CC[C@H]([NH+](CC)CC)C2)c1C	ZINC000097347042	358768552	/nfs/dbraw/zinc/76/85/52/358768552.db2.gz	TUFBLPDVPFTSHD-LBPRGKRZSA-N	1	0	278.400	1.837	50	0		CDAARO
[NH3+]C[C@H]1CC[C@@H](C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2F)O1	ZINC000261998290	358726793	/nfs/dbraw/zinc/72/67/93/358726793.db2.gz	NGWPQOOVUIEPJD-RQSQLSILSA-N	1	0	296.317	1.443	50	0		CDAARO
C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](OC(=O)[C@@H](CO)c1ccccc1)C2	ZINC000100009278	358817317	/nfs/dbraw/zinc/81/73/17/358817317.db2.gz	RKUNBYITZUJHSG-JJXSEGSLSA-N	1	0	289.375	1.931	50	0	endogenous,fda	CDAARO
c1cc(-c2nn[nH]n2)ccc1CN1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000097578584	358785738	/nfs/dbraw/zinc/78/57/38/358785738.db2.gz	IKRLXZAUYHSFCR-KGLIPLIRSA-N	1	0	284.367	1.193	50	0		CDAARO
Cc1cccc(N2CCN(C(=O)[C@@H](C)OC(C)C)CC2)n1	ZINC000097823620	358801352	/nfs/dbraw/zinc/80/13/52/358801352.db2.gz	DESOBEXYVRBEJM-CQSZACIVSA-N	1	0	291.395	1.852	50	0		CDAARO
NC(=O)C[C@H]([NH2+]Cc1ccccc1)C1CCOCC1	ZINC000095452888	358845921	/nfs/dbraw/zinc/84/59/21/358845921.db2.gz	SIEJVPWPWOOEJE-AWEZNQCLSA-N	1	0	262.353	1.447	50	0		CDAARO
Cc1n[nH]cc1CN(C)Cc1cnc(N(C)C)nc1	ZINC000215460459	358889944	/nfs/dbraw/zinc/88/99/44/358889944.db2.gz	HSTAWUPTNIHDDS-UHFFFAOYSA-N	1	0	260.345	1.206	50	0		CDAARO
Cc1ccc2c(cc(CN3C[C@H](O)[C@@H]([NH+](C)C)C3)n2C)c1	ZINC000215606124	358895312	/nfs/dbraw/zinc/89/53/12/358895312.db2.gz	JFVDVEFISVNSII-IRXDYDNUSA-N	1	0	287.407	1.593	50	0		CDAARO
COc1cccc2ccc(C[N@H+](C)[C@H]3COC[C@@H]3O)nc21	ZINC000216270429	358934604	/nfs/dbraw/zinc/93/46/04/358934604.db2.gz	VCFBDVCEZNBRMX-KBPBESRZSA-N	1	0	288.347	1.435	50	0		CDAARO
OC1(c2scnc2Br)CC[NH2+]CC1	ZINC000216654698	358956137	/nfs/dbraw/zinc/95/61/37/358956137.db2.gz	YCUMLKMCSCHUMU-UHFFFAOYSA-N	1	0	263.160	1.477	50	0		CDAARO
C[C@H](CNC(=O)c1cnn(C)c1)[NH+]1CCCCCC1	ZINC000032344796	358984102	/nfs/dbraw/zinc/98/41/02/358984102.db2.gz	INIYSBPEEDSAMT-GFCCVEGCSA-N	1	0	264.373	1.414	50	0		CDAARO
[NH3+][C@H]1[C@H]2CCO[C@H]2[C@@H]1NC(=O)CCc1ccc(F)c(F)c1	ZINC000223268562	359412566	/nfs/dbraw/zinc/41/25/66/359412566.db2.gz	BZRJZEBJNMETQL-KYQLBWAOSA-N	1	0	296.317	1.128	50	0		CDAARO
O[C@H]1CCOC2(CC[NH+](Cc3ccncc3F)CC2)C1	ZINC000257192126	359591022	/nfs/dbraw/zinc/59/10/22/359591022.db2.gz	SMBWYQZPKUTRNW-ZDUSSCGKSA-N	1	0	280.343	1.727	50	0		CDAARO
CNC(=O)CN1CCC([NH2+]Cc2ccccc2C)CC1	ZINC000030905554	359634277	/nfs/dbraw/zinc/63/42/77/359634277.db2.gz	ZBXKSJUFSACWHI-UHFFFAOYSA-N	1	0	275.396	1.295	50	0		CDAARO
CCOC(=O)c1ccc(C[NH2+][C@@H]2CCO[C@H]2C)o1	ZINC000095988515	359709813	/nfs/dbraw/zinc/70/98/13/359709813.db2.gz	DHIMOWMCXLTHOJ-GXSJLCMTSA-N	1	0	253.298	1.723	50	0		CDAARO
CCOC(=O)C[C@@H]([NH2+]CC(=O)N(C)C)c1ccccc1C	ZINC000408524811	359934670	/nfs/dbraw/zinc/93/46/70/359934670.db2.gz	ZLUQTEVKSGAUMG-CQSZACIVSA-N	1	0	292.379	1.667	50	0		CDAARO
CC(C)C[C@H](C[NH3+])CC(=O)OCCOCC(F)F	ZINC000408525726	359935430	/nfs/dbraw/zinc/93/54/30/359935430.db2.gz	WZLNEDUWLCWSDE-JTQLQIEISA-N	1	0	267.316	1.822	50	0		CDAARO
CCC(=O)N1CCC[C@@H]1[C@@H]1CCCN1[C@H]1C[C@H](C)OC1=O	ZINC000257365296	359943984	/nfs/dbraw/zinc/94/39/84/359943984.db2.gz	FUKDQXQUNIJGPV-FQUUOJAGSA-N	1	0	294.395	1.556	50	0		CDAARO
Cc1c[nH+]c(C)n1[C@H]1CCCN(C(=O)c2cnccn2)C1	ZINC000409421092	360230751	/nfs/dbraw/zinc/23/07/51/360230751.db2.gz	GUPBRWUKUZIAHG-ZDUSSCGKSA-N	1	0	285.351	1.767	50	0		CDAARO
O=S(=O)([C@H]1CC[N@H+](C[C@H]2CC=CCC2)C1)N1CCCC1	ZINC000092044711	360261468	/nfs/dbraw/zinc/26/14/68/360261468.db2.gz	APUHFHMEHYJPQZ-GJZGRUSLSA-N	1	0	298.452	1.843	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1C(=O)NCc1cccnc1-n1ccnc1	ZINC000011819173	360333439	/nfs/dbraw/zinc/33/34/39/360333439.db2.gz	FABUJICTSTXQHT-CQSZACIVSA-N	1	0	299.378	1.368	50	0		CDAARO
C[C@H](C(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1C)n1cccn1	ZINC000248158300	360417023	/nfs/dbraw/zinc/41/70/23/360417023.db2.gz	WNXWDXZFXJULEB-MGPQQGTHSA-N	1	0	276.384	1.529	50	0		CDAARO
CC[C@@H](O)CSc1nnc(C[NH3+])n1-c1ccc(F)cc1	ZINC000426563080	360683923	/nfs/dbraw/zinc/68/39/23/360683923.db2.gz	AZGZXQYPHAMXND-LLVKDONJSA-N	1	0	296.371	1.728	50	0		CDAARO
c1nc(NCCC[NH+]2CCCC2)cc([C@@H]2CCOC2)n1	ZINC000426584095	360686818	/nfs/dbraw/zinc/68/68/18/360686818.db2.gz	SKAHHTWGJRMQOH-CYBMUJFWSA-N	1	0	276.384	1.300	50	0		CDAARO
CCn1cncc1CNC(=O)c1ccc(C[NH+](C)C)cc1	ZINC000426618090	360690274	/nfs/dbraw/zinc/69/02/74/360690274.db2.gz	HPXLIPOBQNTJJT-UHFFFAOYSA-N	1	0	286.379	1.895	50	0		CDAARO
Cc1csc(CSc2nnc(CC[NH3+])n2C)n1	ZINC000426623367	360691379	/nfs/dbraw/zinc/69/13/79/360691379.db2.gz	UVVBENHDWWKYDE-UHFFFAOYSA-N	1	0	269.399	1.374	50	0		CDAARO
COc1ccc(CC(=O)N2CC[C@H](C[NH3+])C2)cc1F	ZINC000178515869	189122784	/nfs/dbraw/zinc/12/27/84/189122784.db2.gz	YJULBNJFBZSNPZ-LLVKDONJSA-N	1	0	266.316	1.184	50	0		CDAARO
Cc1ccccc1-n1c(C[NH3+])nnc1SC[C@@H](C)CO	ZINC000426444682	360671964	/nfs/dbraw/zinc/67/19/64/360671964.db2.gz	SQYHXSBJHKYDDB-JTQLQIEISA-N	1	0	292.408	1.755	50	0		CDAARO
COc1cc(CCC(C)=O)ccc1ON1CC[NH2+]CC1	ZINC000426701474	360697635	/nfs/dbraw/zinc/69/76/35/360697635.db2.gz	SJGMDNZYRLLXGU-UHFFFAOYSA-N	1	0	278.352	1.416	50	0		CDAARO
CC(C)Nc1ncccc1C(=O)N1CC[C@H](C[NH3+])C1	ZINC000178531749	189124487	/nfs/dbraw/zinc/12/44/87/189124487.db2.gz	ANTDQFRNYKKBEN-LLVKDONJSA-N	1	0	262.357	1.323	50	0		CDAARO
C1=CC[C@@H](C[N@H+]2CC[C@@H](CN3CCOCC3)C2)CC1	ZINC000245745820	360748155	/nfs/dbraw/zinc/74/81/55/360748155.db2.gz	MSTSDPOUJXITSU-CVEARBPZSA-N	1	0	264.413	1.997	50	0		CDAARO
C[NH2+]C[C@@H]1CCN(C(=O)c2ccc(F)c(COC)c2)C1	ZINC000299738607	200850189	/nfs/dbraw/zinc/85/01/89/200850189.db2.gz	CTGSLUSGJROPKU-NSHDSACASA-N	1	0	280.343	1.654	50	0		CDAARO
CC(C)[NH+]1CCN(CCCSc2ncnn2C)CC1	ZINC000191570268	361110890	/nfs/dbraw/zinc/11/08/90/361110890.db2.gz	QGZDUXMSGAMNQS-UHFFFAOYSA-N	1	0	283.445	1.323	50	0		CDAARO
C[NH+](C)Cc1ccnc(NC(=O)[C@@H]2CCc3c[nH]nc3C2)c1	ZINC000267306374	363792128	/nfs/dbraw/zinc/79/21/28/363792128.db2.gz	YWASVUNNJXUPRK-GFCCVEGCSA-N	1	0	299.378	1.610	50	0		CDAARO
COc1cccc2c1OCC(C(=O)NCC[NH+](C)C)=C2	ZINC000015786329	361527706	/nfs/dbraw/zinc/52/77/06/361527706.db2.gz	QUZVMNHYPFSBLA-UHFFFAOYSA-N	1	0	276.336	1.149	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CCC[C@@H]([NH3+])C2)cc1F	ZINC000606441592	366874003	/nfs/dbraw/zinc/87/40/03/366874003.db2.gz	ZZJYIOJVRCDEPO-SMYYYNMVSA-N	1	0	278.327	1.797	50	0		CDAARO
C[C@H]([NH3+])[C@H]1CCCCN1C(=O)c1cccc2c1OCO2	ZINC000122111009	366896437	/nfs/dbraw/zinc/89/64/37/366896437.db2.gz	QYJJZFYSRICRRD-CMPLNLGQSA-N	1	0	276.336	1.757	50	0		CDAARO
O=C1CCC(=O)N1CC[N@@H+]1CCC[C@H]1c1ccc[nH]1	ZINC000089767984	366930648	/nfs/dbraw/zinc/93/06/48/366930648.db2.gz	VXFOBQNTORNAFL-LBPRGKRZSA-N	1	0	261.325	1.301	50	0		CDAARO
CNC(=O)c1cccc(NCC[N@@H+]2CCC[C@H](C)C2)n1	ZINC000089929807	366971431	/nfs/dbraw/zinc/97/14/31/366971431.db2.gz	SKFSEARULBTPQT-LBPRGKRZSA-N	1	0	276.384	1.585	50	0		CDAARO
C[N@@H+]1CCC[C@@H]1C(=O)NCCC[C@H]1CCCC[C@@H]1O	ZINC000252515171	367734205	/nfs/dbraw/zinc/73/42/05/367734205.db2.gz	HSRYAQWTUWNIRM-MCIONIFRSA-N	1	0	268.401	1.528	50	0		CDAARO
CC[C@@H]1C[N@@H+](C2C[C@H](C)O[C@@H](C)C2)CCN1C[C@H](C)O	ZINC000252517745	367741876	/nfs/dbraw/zinc/74/18/76/367741876.db2.gz	QGMZKBYZLRBSRP-ZQDZILKHSA-N	1	0	284.444	1.719	50	0		CDAARO
CCOC(=O)CCN(CC(=O)OCC)C(C)(C)C	ZINC000130782743	368913445	/nfs/dbraw/zinc/91/34/45/368913445.db2.gz	PGGQDTKQLOSVKE-UHFFFAOYSA-N	1	0	259.346	1.603	50	0		CDAARO
C[NH+]1C[C@@H]2CN(c3cc(C4CCC4)ncn3)C[C@H]2C1	ZINC000575606472	370616654	/nfs/dbraw/zinc/61/66/54/370616654.db2.gz	HOBUYXUTUBPHDQ-CHWSQXEVSA-N	1	0	258.369	1.742	50	0		CDAARO
CCn1ccnc1CNC(=O)C1(OC)CCCCC1	ZINC000295590261	371357418	/nfs/dbraw/zinc/35/74/18/371357418.db2.gz	HSAJFMLEIRDXRP-UHFFFAOYSA-N	1	0	265.357	1.869	50	0		CDAARO
C[C@@H]1C[C@H](Nc2ccnn2C[C@@H]2CCOC2)C[N@@H+]1C1CC1	ZINC000097045669	541879409	/nfs/dbraw/zinc/87/94/09/541879409.db2.gz	FPLPJJACKCPSGZ-RDBSUJKOSA-N	1	0	290.411	1.957	50	0		CDAARO
Cc1n[nH]nc1C(=O)N(C)C[C@@H]1CC[N@@H+](CC(C)C)C1	ZINC000299761311	372746823	/nfs/dbraw/zinc/74/68/23/372746823.db2.gz	VAGXSTLNXPCASA-LBPRGKRZSA-N	1	0	279.388	1.163	50	0		CDAARO
C[NH+]1CCN([C@@H]2CCN(C(=O)Cc3ccsc3)C2)CC1	ZINC000299759738	372747039	/nfs/dbraw/zinc/74/70/39/372747039.db2.gz	RAECCSKRTOZUBK-CQSZACIVSA-N	1	0	293.436	1.139	50	0		CDAARO
O=C(Nc1cncc(F)c1)N1CC[C@H]2C[NH2+]C[C@H]21	ZINC000299802547	372772373	/nfs/dbraw/zinc/77/23/73/372772373.db2.gz	ZFSNKYKSYNHYKD-GZMMTYOYSA-N	1	0	250.277	1.046	50	0		CDAARO
C[C@@H]1OC(=O)[C@H]2[C@H]1[N@@H+]1CCc3ccccc3[C@H]1C[C@H]2O	ZINC000252694573	373119987	/nfs/dbraw/zinc/11/99/87/373119987.db2.gz	MPEJFJFZVUSBET-BGJHODNPSA-N	1	0	273.332	1.281	50	0	biogenic	CDAARO
CC(C)OC[C@H](O)C[NH+]1CCN(c2ccccc2)CC1	ZINC000020000046	373225743	/nfs/dbraw/zinc/22/57/43/373225743.db2.gz	DMKUAYGWDNCIOT-MRXNPFEDSA-N	1	0	278.396	1.595	50	0		CDAARO
Cc1ccc(S(=O)(=O)N2CC[C@H]([NH3+])C[C@H]2C)c(F)c1	ZINC000405028763	373290705	/nfs/dbraw/zinc/29/07/05/373290705.db2.gz	NJJDNKIRFJZASE-MNOVXSKESA-N	1	0	286.372	1.634	50	0		CDAARO
CC(=O)N[C@@H]1CCCN(C(=O)C[C@@H]([NH3+])c2ccccc2)C1	ZINC000037815246	373414390	/nfs/dbraw/zinc/41/43/90/373414390.db2.gz	HKIZICYTMVPCSN-HUUCEWRRSA-N	1	0	289.379	1.204	50	0		CDAARO
Cc1ccc2cc(C[NH2+]C3(C(N)=O)CC3)ccc2n1	ZINC000191485326	373498145	/nfs/dbraw/zinc/49/81/45/373498145.db2.gz	SMWYGOUGBHJJRZ-UHFFFAOYSA-N	1	0	255.321	1.651	50	0		CDAARO
Cc1noc([C@@H]2C[N@@H+](C3CCCC3)C[C@H]2CO)n1	ZINC000253404252	373692103	/nfs/dbraw/zinc/69/21/03/373692103.db2.gz	HSSIFRSBJMNMLD-CMPLNLGQSA-N	1	0	251.330	1.328	50	0		CDAARO
C[C@H](NC(=O)C(C)(C)C)C(=O)N(C)[C@@H]1CC[N@H+](C)C[C@H]1C	ZINC000107053479	373796731	/nfs/dbraw/zinc/79/67/31/373796731.db2.gz	KQWNOZKESDAMFR-FRRDWIJNSA-N	1	0	297.443	1.336	50	0		CDAARO
C[C@H](C(=O)NC(N)=O)[N@H+](C)CC12CC3CC(CC(C3)C1)C2	ZINC000027782547	374327228	/nfs/dbraw/zinc/32/72/28/374327228.db2.gz	HYRKWBSUVRHYAF-GYPVXTSCSA-N	1	0	293.411	1.718	50	0		CDAARO
C[NH2+]C[C@H]1CCCN(C(=O)Cc2cccc(F)c2F)C1	ZINC000094713516	374643919	/nfs/dbraw/zinc/64/39/19/374643919.db2.gz	LJXFIEJDGDSLMI-LLVKDONJSA-N	1	0	282.334	1.965	50	0		CDAARO
Cn1cc(CCC(=O)NCC[NH+](C)C)c2ccccc21	ZINC000079490365	374818123	/nfs/dbraw/zinc/81/81/23/374818123.db2.gz	GRPYGWLLESHRIH-UHFFFAOYSA-N	1	0	273.380	1.789	50	0		CDAARO
CC[N@H+](CCNC(=O)Nc1cnc(C2CC2)nc1)C1CC1	ZINC000095395354	374902498	/nfs/dbraw/zinc/90/24/98/374902498.db2.gz	TZVGKNNHAJAQCL-UHFFFAOYSA-N	1	0	289.383	1.960	50	0		CDAARO
CCC[N@H+](CCN1C(=O)CCC1=O)C[C@H]1CCCCO1	ZINC000095431926	374932979	/nfs/dbraw/zinc/93/29/79/374932979.db2.gz	ZXGSCOQXOHUWHP-CYBMUJFWSA-N	1	0	282.384	1.417	50	0		CDAARO
CC[C@H](NC(=O)NC1CC[NH+](CC)CC1)[C@H]1CCCO1	ZINC000095440302	374943186	/nfs/dbraw/zinc/94/31/86/374943186.db2.gz	WXKPYXGLTFHHGC-UONOGXRCSA-N	1	0	283.416	1.728	50	0		CDAARO
O=C(NCCNc1ccccn1)c1ccn2c[nH+]cc2c1	ZINC000095448965	374947763	/nfs/dbraw/zinc/94/77/63/374947763.db2.gz	VCWIULMNNDLINF-UHFFFAOYSA-N	1	0	281.319	1.571	50	0		CDAARO
CC[C@H](CO)[NH+]1CCN([C@@H]2Cc3ccccc3[C@@H]2O)CC1	ZINC000095451580	374951909	/nfs/dbraw/zinc/95/19/09/374951909.db2.gz	XIIZVMWTCZSXIW-OIISXLGYSA-N	1	0	290.407	1.033	50	0		CDAARO
Cn1cc(N2CCC[C@@H]([NH2+]C3CCOCC3)C2)cn1	ZINC000095403000	374907673	/nfs/dbraw/zinc/90/76/73/374907673.db2.gz	KPZWDABQOGJIQR-CYBMUJFWSA-N	1	0	264.373	1.158	50	0		CDAARO
COc1cc(C)c(C[NH2+][C@H](C(N)=O)C(C)C)cc1OC	ZINC000095409296	374911480	/nfs/dbraw/zinc/91/14/80/374911480.db2.gz	IAWCDCJGAXHNIW-AWEZNQCLSA-N	1	0	280.368	1.612	50	0		CDAARO
O[C@@H](C[NH2+]C1CCOCC1)COc1ccc(F)cc1	ZINC000037893009	374986543	/nfs/dbraw/zinc/98/65/43/374986543.db2.gz	JNUBMWIEFBPAOR-ZDUSSCGKSA-N	1	0	269.316	1.334	50	0		CDAARO
CC(C)C[C@H]([NH3+])C(=O)N1CCC(N2CCCCC2=O)CC1	ZINC000095996209	375049635	/nfs/dbraw/zinc/04/96/35/375049635.db2.gz	KKXVTMOJVCOLJG-AWEZNQCLSA-N	1	0	295.427	1.363	50	0		CDAARO
CC(C)COc1ccccc1CNC(=O)[C@@H]1C[C@H](O)C[NH2+]1	ZINC000299747023	375207650	/nfs/dbraw/zinc/20/76/50/375207650.db2.gz	BWELRUUBCSAIJX-KBPBESRZSA-N	1	0	292.379	1.060	50	0		CDAARO
CN1CCC([N@H+](C)C[C@@H](O)COc2ccccc2)CC1	ZINC000003418308	375688899	/nfs/dbraw/zinc/68/88/99/375688899.db2.gz	LBWUCHVKOIBUER-OAHLLOKOSA-N	1	0	278.396	1.452	50	0		CDAARO
C[NH+](C)C1(CNC(=O)C[C@@H]2CCOC2)CCCC1	ZINC000352161331	375824322	/nfs/dbraw/zinc/82/43/22/375824322.db2.gz	BCDGHTIAPKXAMI-LBPRGKRZSA-N	1	0	254.374	1.404	50	0		CDAARO
CC[N@@H+]1CCCC[C@@H]1CNc1nc(OC)cc(OC)n1	ZINC000574474770	295006343	/nfs/dbraw/zinc/00/63/43/295006343.db2.gz	XWGZYQHEOCQHGA-LLVKDONJSA-N	1	0	280.372	1.202	50	0		CDAARO
CCOc1cc(N2C[C@@H]3CC[N@H+](C)C[C@@H]3C2)ncn1	ZINC000631325565	376103900	/nfs/dbraw/zinc/10/39/00/376103900.db2.gz	FUOIOFQEIDEHDL-NWDGAFQWSA-N	1	0	262.357	1.263	50	0		CDAARO
C[C@H](N1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)C(F)(F)F	ZINC000245595153	376106735	/nfs/dbraw/zinc/10/67/35/376106735.db2.gz	HEFQBLKYQXOKIC-QJPTWQEYSA-N	1	0	280.334	1.858	50	0		CDAARO
CCCc1nc(NCCC[N@@H+]2CCCC[C@@H]2CO)no1	ZINC000670474172	483083411	/nfs/dbraw/zinc/08/34/11/483083411.db2.gz	KSXUMKQJDPXUSQ-GFCCVEGCSA-N	1	0	282.388	1.671	50	0		CDAARO
COCC(=O)NCC1CC[NH+](C2CCSCC2)CC1	ZINC000244986120	377821873	/nfs/dbraw/zinc/82/18/73/377821873.db2.gz	JGYICRAUPSKROS-UHFFFAOYSA-N	1	0	286.441	1.357	50	0		CDAARO
C[C@H](CNS(=O)(=O)CCCF)[N@@H+]1CCCC[C@H]1C	ZINC000245344157	378073336	/nfs/dbraw/zinc/07/33/36/378073336.db2.gz	XWISNMFQUKEOSU-VXGBXAGGSA-N	1	0	280.409	1.528	50	0		CDAARO
COCCN1CC[N@H+](C[C@H]2CC=CCC2)CC1=O	ZINC000096499957	532966744	/nfs/dbraw/zinc/96/67/44/532966744.db2.gz	WMDNHPATLGOVLK-ZDUSSCGKSA-N	1	0	252.358	1.133	50	0		CDAARO
Nc1ccc(N2CC[NH+](CCO)CC2)c(C(F)(F)F)c1	ZINC000037754560	390416326	/nfs/dbraw/zinc/41/63/26/390416326.db2.gz	CKDLKDDIMVHZSX-UHFFFAOYSA-N	1	0	289.301	1.402	50	0		CDAARO
Nc1nc2c(c(N3CC[C@@H]([NH3+])C3)n1)CCCc1ccccc1-2	ZINC000040977166	390424648	/nfs/dbraw/zinc/42/46/48/390424648.db2.gz	SDTRYHWIXVHTLM-GFCCVEGCSA-N	1	0	295.390	1.752	50	0	in-vivo	CDAARO
CCOC(=O)[C@](C)(NC(=O)C[N@H+](C)C(C)C)C(C)C	ZINC000096412768	390510817	/nfs/dbraw/zinc/51/08/17/390510817.db2.gz	SPYFRDVTNDGJDF-CQSZACIVSA-N	1	0	272.389	1.421	50	0		CDAARO
Fc1ccc(-c2cc3c(N4CC[NH2+]CC4)nccn3n2)cc1	ZINC000070458557	390606491	/nfs/dbraw/zinc/60/64/91/390606491.db2.gz	WYJZYBZVFFCGMN-UHFFFAOYSA-N	1	0	297.337	1.945	50	0		CDAARO
C[C@@H](O)c1cn(CC2CC[NH+](Cc3ccco3)CC2)nn1	ZINC000023145207	390825369	/nfs/dbraw/zinc/82/53/69/390825369.db2.gz	PNYZJHAKGSBTFX-GFCCVEGCSA-N	1	0	290.367	1.837	50	0		CDAARO
Cc1c[nH+]ccc1N1CCCN(C(=O)[C@@H]2CCOC2)CC1	ZINC000082107314	390838235	/nfs/dbraw/zinc/83/82/35/390838235.db2.gz	DNXHWEBWEYUAIA-CQSZACIVSA-N	1	0	289.379	1.465	50	0		CDAARO
CC(C)[N@@H+]1CCCC[C@H]1CON=C(N)CN1CCOCC1	ZINC000408525187	390853360	/nfs/dbraw/zinc/85/33/60/390853360.db2.gz	OVZMTXVELRYXCA-AWEZNQCLSA-N	1	0	298.431	1.080	50	0		CDAARO
O=C(Nc1cnn(Cc2ccccn2)c1)[C@H]1CCC[NH2+]C1	ZINC000178750194	390901882	/nfs/dbraw/zinc/90/18/82/390901882.db2.gz	WKCYQUUFGYQDPH-LBPRGKRZSA-N	1	0	285.351	1.265	50	0		CDAARO
CN(C)S(=O)(=O)C[C@H](CCc1ccccc1)[NH+](C)C	ZINC000045069187	391160328	/nfs/dbraw/zinc/16/03/28/391160328.db2.gz	VIBIFBZVAWKQPI-AWEZNQCLSA-N	1	0	284.425	1.441	50	0		CDAARO
OC[C@H]1CC[C@H]([NH2+]C2CCC3(CC2)OCCO3)CC1	ZINC000186249156	391219521	/nfs/dbraw/zinc/21/95/21/391219521.db2.gz	HSPAKMOZPWKZLL-BETUJISGSA-N	1	0	269.385	1.813	50	0		CDAARO
CCC(=O)N1c2ccccc2C[C@H]1C(=O)NCC[NH+](C)C	ZINC000015773505	391656602	/nfs/dbraw/zinc/65/66/02/391656602.db2.gz	JLSTVOCSWHPFLU-AWEZNQCLSA-N	1	0	289.379	1.032	50	0		CDAARO
Cc1cc(C)c2c(n1)oc1c2ncnc1N1CC[NH2+]CC1	ZINC000006759580	392380468	/nfs/dbraw/zinc/38/04/68/392380468.db2.gz	AVEIHFDVCLBUOU-UHFFFAOYSA-N	1	0	283.335	1.797	50	0		CDAARO
CC[C@H]1CN(C(C)=O)CC[C@@H]1[NH2+]Cc1cscn1	ZINC000089949176	392529295	/nfs/dbraw/zinc/52/92/95/392529295.db2.gz	FTKPJGUTMOHVCY-AAEUAGOBSA-N	1	0	267.398	1.880	50	0		CDAARO
CCNc1ncc(C(=O)N[C@H]2CCC[N@H+](CC)C2)s1	ZINC000127222962	392607647	/nfs/dbraw/zinc/60/76/47/392607647.db2.gz	SVNLKUCUKYAFNV-JTQLQIEISA-N	1	0	282.413	1.789	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000107064668	392732661	/nfs/dbraw/zinc/73/26/61/392732661.db2.gz	OZZUYPFAUTVLHI-NVXWUHKLSA-N	1	0	292.423	1.590	50	0		CDAARO
CCn1nccc1CC[N@@H+]1CC[C@H](CN2CCOCC2)C1	ZINC000253420289	392718432	/nfs/dbraw/zinc/71/84/32/392718432.db2.gz	HEEXWLJIQCGHSN-HNNXBMFYSA-N	1	0	292.427	1.100	50	0		CDAARO
O=C(N[C@@H]1CCSc2c(F)cccc21)[C@H]1C[C@H](O)C[NH2+]1	ZINC000277559534	393131070	/nfs/dbraw/zinc/13/10/70/393131070.db2.gz	NECWZFMNDSWACM-XXILOJSOSA-N	1	0	296.367	1.202	50	0		CDAARO
CC(C)N1CC[C@@H](N2CC[NH+]([C@@H]3CCSC3)CC2)C1=O	ZINC000095413185	393147854	/nfs/dbraw/zinc/14/78/54/393147854.db2.gz	UEFYFJSKNHXYFR-ZIAGYGMSSA-N	1	0	297.468	1.119	50	0		CDAARO
OCCC[NH+]1CCN(c2cccc(Br)c2)CC1	ZINC000284777207	393192940	/nfs/dbraw/zinc/19/29/40/393192940.db2.gz	NNWBMVSEXLOERH-UHFFFAOYSA-N	1	0	299.212	1.954	50	0		CDAARO
COC[C@@H](O)C[N@H+](C)[C@@H]1CCCN(c2ccccc2)C1	ZINC000083858970	135031097	/nfs/dbraw/zinc/03/10/97/135031097.db2.gz	KQMMHDJSKBQZED-CVEARBPZSA-N	1	0	278.396	1.595	50	0		CDAARO
Nc1ccc(N2CCC([NH+]3CCOCC3)CC2)c(F)c1	ZINC000086003129	135038819	/nfs/dbraw/zinc/03/88/19/135038819.db2.gz	LMINCAAILXAZSF-UHFFFAOYSA-N	1	0	279.359	1.709	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)N2CCN(c3ccc(O)cc3)CC2)C1	ZINC000091546293	135072285	/nfs/dbraw/zinc/07/22/85/135072285.db2.gz	LOVTUSVNAOKKRV-QWHCGFSZSA-N	1	0	289.379	1.168	50	0		CDAARO
Cn1cc(C(=O)Nc2ccc3c(c2F)CC[NH2+]C3)cn1	ZINC000261702490	140377963	/nfs/dbraw/zinc/37/79/63/140377963.db2.gz	JRPLJOMIHMFXOJ-UHFFFAOYSA-N	1	0	274.299	1.457	50	0		CDAARO
CC(C)(C)n1cc(C(=O)N2CC[C@H]([NH3+])C(C)(C)C2)cn1	ZINC000261965441	140411627	/nfs/dbraw/zinc/41/16/27/140411627.db2.gz	LHOJEPCKBBCRAA-LBPRGKRZSA-N	1	0	278.400	1.838	50	0		CDAARO
C[NH2+]C[C@@H]1CCCN(S(=O)(=O)CC2CCCC2)C1	ZINC000262157266	140420842	/nfs/dbraw/zinc/42/08/42/140420842.db2.gz	ZKRWQOONGMEMGZ-ZDUSSCGKSA-N	1	0	274.430	1.438	50	0		CDAARO
CCOCCC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1	ZINC000089986735	286036615	/nfs/dbraw/zinc/03/66/15/286036615.db2.gz	GECNANNJQUHQDR-QWHCGFSZSA-N	1	0	254.374	1.356	50	0		CDAARO
CCO[C@H](C)C(=O)NC[C@H]1[NH2+]CCc2ccccc21	ZINC000262399651	149058193	/nfs/dbraw/zinc/05/81/93/149058193.db2.gz	PJTPLECVZJOYQS-BXUZGUMPSA-N	1	0	262.353	1.415	50	0		CDAARO
CCCOCC(=O)N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21	ZINC000372340287	160108729	/nfs/dbraw/zinc/10/87/29/160108729.db2.gz	RIJWICBCKQDYPJ-QLPKVWCKSA-N	1	0	288.391	1.660	50	0		CDAARO
CC[NH+](CC)CCNC(=S)NC(=O)c1ccc(F)cc1	ZINC000003203330	169867830	/nfs/dbraw/zinc/86/78/30/169867830.db2.gz	NVMYNATWGABLMU-UHFFFAOYSA-N	1	0	297.399	1.772	50	0		CDAARO
COc1cc(OC)cc(C(=O)NC2CC[NH2+]CC2)c1	ZINC000004910441	170040378	/nfs/dbraw/zinc/04/03/78/170040378.db2.gz	LKFJNCBFODRGGJ-UHFFFAOYSA-N	1	0	264.325	1.186	50	0		CDAARO
C[C@H](c1ccccc1)N1C(=[NH2+])S[C@H]2CS(=O)(=O)C[C@H]21	ZINC000005437187	170099021	/nfs/dbraw/zinc/09/90/21/170099021.db2.gz	VPTURGDGEBLVCX-JLLWLGSASA-N	1	0	296.417	1.897	50	0		CDAARO
C[NH+](C)CCNC(=O)c1cccc(Br)c1	ZINC000005718036	170132789	/nfs/dbraw/zinc/13/27/89/170132789.db2.gz	GWYHEJFSZYVDSU-UHFFFAOYSA-N	1	0	271.158	1.741	50	0		CDAARO
CC[C@H](Oc1ccccc1)C(=O)NCCC[NH+](C)C	ZINC000006048857	170172287	/nfs/dbraw/zinc/17/22/87/170172287.db2.gz	XAESZPQJQCCZQH-AWEZNQCLSA-N	1	0	264.369	1.912	50	0		CDAARO
CC[C@H](C)[NH2+]CC(=O)Nc1sc2c(c1C(N)=O)CCC2	ZINC000006048335	170172370	/nfs/dbraw/zinc/17/23/70/170172370.db2.gz	SIJDIPHWRQHCEW-QMMMGPOBSA-N	1	0	295.408	1.662	50	0		CDAARO
c1cc2c(cc1C[NH2+]CCCN1CCOCC1)OCCO2	ZINC000006746451	170239283	/nfs/dbraw/zinc/23/92/83/170239283.db2.gz	AOOWVNWNSSDGJQ-UHFFFAOYSA-N	1	0	292.379	1.270	50	0		CDAARO
C[C@@H]1CCC[N@H+](CC(=O)NC(=O)NCc2ccccc2)C1	ZINC000008489131	170337629	/nfs/dbraw/zinc/33/76/29/170337629.db2.gz	BRIQLCCRNJMDMP-CYBMUJFWSA-N	1	0	289.379	1.744	50	0		CDAARO
COC(=O)[C@@H]1C[NH2+]C[C@@H]1c1ccc(Br)cc1	ZINC000008699274	170346188	/nfs/dbraw/zinc/34/61/88/170346188.db2.gz	OHYNFAGOLZTLOM-GHMZBOCLSA-N	1	0	284.153	1.925	50	0		CDAARO
Cc1nc2c3c(C)c(C)n(CC[NH+](C)C)c3ncn2n1	ZINC000009340832	170373125	/nfs/dbraw/zinc/37/31/25/170373125.db2.gz	CGOBACZFXKUAEE-UHFFFAOYSA-N	1	0	272.356	1.566	50	0		CDAARO
C[NH+](C)Cc1ccccc1CNC(=O)c1ccc(=O)[nH]c1	ZINC000009917243	170390870	/nfs/dbraw/zinc/39/08/70/170390870.db2.gz	LMZZKCOJSSHJHR-UHFFFAOYSA-N	1	0	285.347	1.779	50	0		CDAARO
COc1cccc(OC[C@@H](O)C[NH2+]Cc2ccco2)c1	ZINC000009970653	170392560	/nfs/dbraw/zinc/39/25/60/170392560.db2.gz	HSNSZZHDLPTKFA-LBPRGKRZSA-N	1	0	277.320	1.818	50	0		CDAARO
CC(C)[NH2+]C[C@@]1(O)CCCN(Cc2ccccc2F)C1=O	ZINC000012716971	170505025	/nfs/dbraw/zinc/50/50/25/170505025.db2.gz	JJJSGDCWIPMPLN-INIZCTEOSA-N	1	0	294.370	1.677	50	0		CDAARO
CCOc1cc2c(cc1C[NH2+]CCCO)O[C@@H](C)C2	ZINC000020187738	171052715	/nfs/dbraw/zinc/05/27/15/171052715.db2.gz	DNGYHOIHJWYJPN-NSHDSACASA-N	1	0	265.353	1.881	50	0		CDAARO
CC[NH+]1CCN(C[C@H](O)COc2ccccc2OC)CC1	ZINC000020819732	171273486	/nfs/dbraw/zinc/27/34/86/171273486.db2.gz	LTVGEDJHAVOKEW-AWEZNQCLSA-N	1	0	294.395	1.072	50	0		CDAARO
O=C(N[C@@H]1CC[NH2+]C1)C1(c2cccc(F)c2)CCOCC1	ZINC000126585564	413711615	/nfs/dbraw/zinc/71/16/15/413711615.db2.gz	LUMSWEDHNZUXRB-CQSZACIVSA-N	1	0	292.354	1.352	50	0		CDAARO
COc1ccc(-c2nnc3ccc(OCC[NH3+])nn32)cc1	ZINC000038478042	174141816	/nfs/dbraw/zinc/14/18/16/174141816.db2.gz	QJHWGOKUBJULBD-UHFFFAOYSA-N	1	0	285.307	1.137	50	0		CDAARO
CC(C)(C)OC(=O)NCC1CN([C@H]2CCC[NH2+]C2)C1	ZINC000039952022	174177355	/nfs/dbraw/zinc/17/73/55/174177355.db2.gz	INADAXASGPTAFL-LBPRGKRZSA-N	1	0	269.389	1.195	50	0		CDAARO
CCc1c(C)sc2c1c(N)nc(=O)n2CCC[NH+](C)C	ZINC000040268152	174218758	/nfs/dbraw/zinc/21/87/58/174218758.db2.gz	HNSSQHDPVREUMO-UHFFFAOYSA-N	1	0	294.424	1.863	50	0		CDAARO
COc1ccc(-c2nnc(CSC(N)=[NH2+])o2)cc1OC	ZINC000055175480	175573164	/nfs/dbraw/zinc/57/31/64/175573164.db2.gz	VVKFHYNGBQMMBR-UHFFFAOYSA-N	1	0	294.336	1.880	50	0		CDAARO
CCCn1nccc1C(=O)N1CCC2(CC[NH2+]CC2)CC1	ZINC000071440029	176170281	/nfs/dbraw/zinc/17/02/81/176170281.db2.gz	LEUCTOUASNMEDF-UHFFFAOYSA-N	1	0	290.411	1.899	50	0		CDAARO
C[N@@H+]1C[C@@H](c2ccc3c(c2)OCO3)[C@@H]2[C@H]1C1CCN2CC1	ZINC000072152374	176327506	/nfs/dbraw/zinc/32/75/06/176327506.db2.gz	UCHZOFZGBCEQMN-IAOVAPTHSA-N	1	0	286.375	1.907	50	0		CDAARO
NC(=O)c1noc(C[N@@H+]2C[C@H]3[C@@H](C2)C2CCC3CC2)n1	ZINC000072167223	176331501	/nfs/dbraw/zinc/33/15/01/176331501.db2.gz	CKWOOSFEPCQRJO-HWACXVBKSA-N	1	0	276.340	1.037	50	0		CDAARO
Cc1ccc2[nH]nc(C(=O)N3CCC[C@H]([NH3+])CC3)c2c1	ZINC000072173994	176333584	/nfs/dbraw/zinc/33/35/84/176333584.db2.gz	QJGWPECDLASXFK-NSHDSACASA-N	1	0	272.352	1.825	50	0		CDAARO
CN(Cc1nc2cc(Cl)ccc2[nH]1)C[C@]1(O)CC[NH2+]C1	ZINC000077358882	177257018	/nfs/dbraw/zinc/25/70/18/177257018.db2.gz	OJADTYXDMIGTIB-AWEZNQCLSA-N	1	0	294.786	1.373	50	0		CDAARO
CC1(C)Cc2cccc(C[N@@H+]3CCOC[C@H](CO)C3)c2O1	ZINC000077555990	177280550	/nfs/dbraw/zinc/28/05/50/177280550.db2.gz	GXYWFZPQIRLKAS-ZDUSSCGKSA-N	1	0	291.391	1.841	50	0		CDAARO
CS(=O)(=O)NC1CC[NH+](C[C@@H]2CC=CCC2)CC1	ZINC000077554474	177280683	/nfs/dbraw/zinc/28/06/83/177280683.db2.gz	HOJRFIATRBGGDR-GFCCVEGCSA-N	1	0	272.414	1.356	50	0		CDAARO
COc1ccc(-c2cccc3c2O[C@@H](C[NH3+])C3)nn1	ZINC000299770044	274103981	/nfs/dbraw/zinc/10/39/81/274103981.db2.gz	YZUABQLCYGXBAW-SNVBAGLBSA-N	1	0	257.293	1.414	50	0		CDAARO
C[C@@H](C(=O)NC(N)=O)[N@H+](C)Cc1ccc2ccccc2c1	ZINC000007500513	274198776	/nfs/dbraw/zinc/19/87/76/274198776.db2.gz	PJCWMVUQCHIXFG-NSHDSACASA-N	1	0	285.347	1.855	50	0		CDAARO
[NH3+][C@H]1CCCN(C(=O)c2cn3cc(Cl)ccc3n2)CC1	ZINC000072144151	274962020	/nfs/dbraw/zinc/96/20/20/274962020.db2.gz	MEWKPAGCPBSYST-NSHDSACASA-N	1	0	292.770	1.941	50	0		CDAARO
O=C(c1ccccc1)N1CCC[N@@H+]([C@H]2CCOC2)CC1	ZINC000335937732	275013857	/nfs/dbraw/zinc/01/38/57/275013857.db2.gz	GTHDFTZSCIJTBK-HNNXBMFYSA-N	1	0	274.364	1.623	50	0		CDAARO
CC[N@H+](CC(=O)NC[C@H]1COC2(CCCCC2)O1)C1CC1	ZINC000096493023	276313738	/nfs/dbraw/zinc/31/37/38/276313738.db2.gz	NFJIKPHSOOUFQX-AWEZNQCLSA-N	1	0	296.411	1.663	50	0		CDAARO
CN(C(=O)[C@@H]1Cc2ccccc2C[NH2+]1)C1CCOCC1	ZINC000036321003	276742665	/nfs/dbraw/zinc/74/26/65/276742665.db2.gz	CFPMOSPBCKACOO-HNNXBMFYSA-N	1	0	274.364	1.338	50	0		CDAARO
C[NH+](C)CC(C)(C)NS(=O)(=O)c1ccccc1	ZINC000005523811	276778907	/nfs/dbraw/zinc/77/89/07/276778907.db2.gz	XZOXXHWNDOVQLM-UHFFFAOYSA-N	1	0	256.371	1.305	50	0		CDAARO
COC(=O)C[N@H+](C1CCOCC1)[C@@H]1C=CCCC1	ZINC000089400888	277059832	/nfs/dbraw/zinc/05/98/32/277059832.db2.gz	HQAYNJOEBKKTNE-GFCCVEGCSA-N	1	0	253.342	1.749	50	0		CDAARO
CC(C)(C)c1ncc2c(n1)CC(C)(C)C[C@H]2NC(=O)C[NH3+]	ZINC000091535465	277276696	/nfs/dbraw/zinc/27/66/96/277276696.db2.gz	FHUQTVLDWYFSHJ-LLVKDONJSA-N	1	0	290.411	1.863	50	0		CDAARO
C[NH2+]C[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	ZINC000122617102	277285193	/nfs/dbraw/zinc/28/51/93/277285193.db2.gz	QSTPJHDAIZMCGQ-LLVKDONJSA-N	1	0	262.309	1.239	50	0		CDAARO
CC(C)C[NH+]1CCC(N[C@H](C)c2nncn2C)CC1	ZINC000067757390	278869907	/nfs/dbraw/zinc/86/99/07/278869907.db2.gz	BAVPTOFGTQLWEJ-GFCCVEGCSA-N	1	0	265.405	1.586	50	0		CDAARO
C[C@H]([NH3+])C(=O)N1[C@H](C)CO[C@H](c2ccccc2)[C@H]1C	ZINC000246467002	279392928	/nfs/dbraw/zinc/39/29/28/279392928.db2.gz	COFJXYQBTCAEFS-CZXHOFHRSA-N	1	0	262.353	1.711	50	0		CDAARO
C[C@H]1Cc2cc(S(=O)(=O)NCC(C)(C)[NH3+])ccc2O1	ZINC000095432137	280023115	/nfs/dbraw/zinc/02/31/15/280023115.db2.gz	FHRLNFWRYFVCNL-VIFPVBQESA-N	1	0	284.381	1.026	50	0		CDAARO
O=C1NC(=O)[C@](CCc2ccccc2)(C2CC[NH2+]CC2)N1	ZINC000067804707	280280378	/nfs/dbraw/zinc/28/03/78/280280378.db2.gz	ZZQQBMLEXRCFJO-INIZCTEOSA-N	1	0	287.363	1.197	50	0		CDAARO
[NH3+][C@@H]1CCC[C@H]1C(=O)N1CCC[C@H](C(F)(F)F)C1	ZINC000085365351	295314154	/nfs/dbraw/zinc/31/41/54/295314154.db2.gz	DJIBCPSWSLSRFY-IVZWLZJFSA-N	1	0	264.291	1.915	50	0		CDAARO
Cc1ccc2c(c1)NC(=O)[C@@H]1C[C@@H]([NH+](C)C)CN1C2=O	ZINC000534632371	328332034	/nfs/dbraw/zinc/33/20/34/328332034.db2.gz	OSHSXEVHQOZGJZ-MFKMUULPSA-N	1	0	273.336	1.092	50	0		CDAARO
CCc1ccccc1OCCN1CC[C@H]2C[NH2+]C[C@H]21	ZINC000534634869	328333195	/nfs/dbraw/zinc/33/31/95/328333195.db2.gz	YQYRTAAJLMSBIX-LSDHHAIUSA-N	1	0	260.381	1.922	50	0		CDAARO
Nc1ncc(C(=O)NCC2CC[NH+](CC3CC3)CC2)s1	ZINC000534653011	328338337	/nfs/dbraw/zinc/33/83/37/328338337.db2.gz	DAYROLKPGAWEOP-UHFFFAOYSA-N	1	0	294.424	1.407	50	0		CDAARO
O=C([C@@H]1C=CC[NH2+]1)N1CC=C(c2ccccc2)CC1	ZINC000534659555	328342290	/nfs/dbraw/zinc/34/22/90/328342290.db2.gz	VYRSVBMOFWNCSE-HNNXBMFYSA-N	1	0	254.333	1.830	50	0		CDAARO
CN(Cc1cc(-c2ccccc2)no1)C(=O)[C@@H]1C=CC[NH2+]1	ZINC000534655256	328339530	/nfs/dbraw/zinc/33/95/30/328339530.db2.gz	JIMKMAKFFUITGH-AWEZNQCLSA-N	1	0	283.331	1.828	50	0		CDAARO
CCn1nc(C(=O)NC)c2c1CC[C@H]([NH2+]CC1CC1)C2	ZINC000019299802	326854768	/nfs/dbraw/zinc/85/47/68/326854768.db2.gz	QRQOKNOUIBULHM-NSHDSACASA-N	1	0	276.384	1.120	50	0		CDAARO
COC(=O)[C@@H](CC[NH2+]Cc1ccc(OC)cc1)[C@H](C)O	ZINC000043214671	328754199	/nfs/dbraw/zinc/75/41/99/328754199.db2.gz	CEENHDWLURPRQT-FZMZJTMJSA-N	1	0	281.352	1.345	50	0		CDAARO
CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1C[C@@H]1CNC(=O)C1	ZINC000585094336	482828879	/nfs/dbraw/zinc/82/88/79/482828879.db2.gz	LAQZRBYQEKJSNF-DTWKUNHWSA-N	1	0	264.291	1.785	50	0		CDAARO
CC(C)[C@H](NC(=O)NCC1CC[NH2+]CC1)c1nccn1C	ZINC000670442971	482989351	/nfs/dbraw/zinc/98/93/51/482989351.db2.gz	HMTDTUAEQWRFQS-ZDUSSCGKSA-N	1	0	293.415	1.416	50	0		CDAARO
CCCc1nc(N2CC[NH+](CC(C)C)CC2)no1	ZINC000670456440	483034648	/nfs/dbraw/zinc/03/46/48/483034648.db2.gz	ZQYHGPCVUHBKHI-UHFFFAOYSA-N	1	0	252.362	1.800	50	0		CDAARO
C[C@H](C(=O)N1CCCC1)N1CC[C@H](C[NH+]2CCCC2)C1	ZINC000083888646	483217857	/nfs/dbraw/zinc/21/78/57/483217857.db2.gz	PVMAIUVXOSIZLQ-HUUCEWRRSA-N	1	0	279.428	1.415	50	0		CDAARO
CC(C)NC(=O)C[NH2+][C@H](C)CC(=O)Nc1ccccc1	ZINC000084620499	483299166	/nfs/dbraw/zinc/29/91/66/483299166.db2.gz	OZKJZYSJWVDITA-GFCCVEGCSA-N	1	0	277.368	1.518	50	0		CDAARO
C[C@]1(C(N)=O)CCCC[N@@H+]1Cc1ccc2c[nH]nc2c1	ZINC000680484037	483633306	/nfs/dbraw/zinc/63/33/06/483633306.db2.gz	GFAVPPLNDDBVRW-OAHLLOKOSA-N	1	0	272.352	1.793	50	0		CDAARO
CC(C)(C)c1cc(Cn2cc([C@H]3CCC[NH2+]C3)nn2)n[nH]1	ZINC000095374110	517391919	/nfs/dbraw/zinc/39/19/19/517391919.db2.gz	FLUGCTBXCCMZCZ-NSHDSACASA-N	1	0	288.399	1.814	50	0		CDAARO
Cc1nc(CSc2nnc(C3CC[NH2+]CC3)n2C)co1	ZINC000426397325	534404572	/nfs/dbraw/zinc/40/45/72/534404572.db2.gz	BNCCOIAFZLHPFP-UHFFFAOYSA-N	1	0	293.396	1.871	50	0		CDAARO
NC(=O)c1ccc(C[NH2+][C@H]2CCCSC2)cc1	ZINC000096452771	534485264	/nfs/dbraw/zinc/48/52/64/534485264.db2.gz	XOYMHKYWVCREQB-LBPRGKRZSA-N	1	0	250.367	1.771	50	0		CDAARO
C[N@H+](C[C@@H](O)Cn1cccn1)[C@H]1CCc2ccccc21	ZINC000248061242	523023766	/nfs/dbraw/zinc/02/37/66/523023766.db2.gz	YYTDSSQQHHKWDB-ZBFHGGJFSA-N	1	0	271.364	1.863	50	0		CDAARO
COc1ccccc1/C=C/C[N@@H+]1CCC[C@H](C(N)=O)C1	ZINC000023281611	524316970	/nfs/dbraw/zinc/31/69/70/524316970.db2.gz	OHVFDYSITWQQEJ-GBXSZLQWSA-N	1	0	274.364	1.906	50	0		CDAARO
[NH3+][C@H]1CCC[C@@H](C(=O)NCCCOC2CCCC2)C1	ZINC000237905563	527402053	/nfs/dbraw/zinc/40/20/53/527402053.db2.gz	VHUIPJJRRPUEKS-OLZOCXBDSA-N	1	0	268.401	1.969	50	0		CDAARO
CC(C)c1ncc(C(=O)N[C@H]2C[NH+]3CCC2CC3)cn1	ZINC000097831112	528344745	/nfs/dbraw/zinc/34/47/45/528344745.db2.gz	ROSBPZMDJUBNHG-ZDUSSCGKSA-N	1	0	274.368	1.424	50	0		CDAARO
CCCc1ncncc1C(=O)NCc1ccc(C[NH3+])cc1	ZINC000097743152	528769127	/nfs/dbraw/zinc/76/91/27/528769127.db2.gz	PZMOQYZLYFKXII-UHFFFAOYSA-N	1	0	284.363	1.818	50	0		CDAARO
CCC[C@@H]([NH3+])C(=O)Nc1c[nH]cc(Br)c1=O	ZINC000423761625	535349127	/nfs/dbraw/zinc/34/91/27/535349127.db2.gz	MIBGHAGXKXDUBQ-SSDOTTSWSA-N	1	0	288.145	1.203	50	0		CDAARO
Cn1cc(C[NH2+]Cc2ccc(-n3ccnc3)nc2)cn1	ZINC000097159089	538438075	/nfs/dbraw/zinc/43/80/75/538438075.db2.gz	UGGLFLBEMRGUAH-UHFFFAOYSA-N	1	0	268.324	1.291	50	0		CDAARO
NC[C@@H]1CC[C@H]([C@H]2CC[C@@H](C(F)(F)F)NC2)C[NH2+]1	ZINC000757211920	574906816	/nfs/dbraw/zinc/90/68/16/574906816.db2.gz	JJIVXKCAOKVNDZ-NAKRPEOUSA-N	1	0	265.323	1.244	50	0		CDAARO
C[C@@H]1C[NH2+]C[C@@H](c2ccc(NS(C)(=O)=O)cc2)C1	ZINC000757214590	574907517	/nfs/dbraw/zinc/90/75/17/574907517.db2.gz	UDJLLEPNTOVNCJ-JQWIXIFHSA-N	1	0	268.382	1.771	50	0		CDAARO
CC(C)=CC[N@@H+]1CCCN(C(=O)C2CCOCC2)CC1	ZINC000980605368	614289980	/nfs/dbraw/zinc/28/99/80/614289980.db2.gz	SSVILNNPYCNBMJ-UHFFFAOYSA-N	1	0	280.412	1.914	50	0		CDAARO
CN(C)[C@H](CNC(=O)C[NH+]1CCCCCC1)c1ccco1	ZINC000952973335	615989848	/nfs/dbraw/zinc/98/98/48/615989848.db2.gz	SCRXHEVLYNQZPG-CQSZACIVSA-N	1	0	293.411	1.875	50	0		CDAARO
COC(=O)[C@@H](C[NH2+][C@H](C)CCn1cccn1)CC1CC1	ZINC000952963285	616966013	/nfs/dbraw/zinc/96/60/13/616966013.db2.gz	FPHRKFDHDZBHKI-TZMCWYRMSA-N	1	0	279.384	1.841	50	0		CDAARO
Cc1ccc2c(N3CCNC(=O)C3)cc[nH+]c2c1C	ZINC001704306598	1177682546	/nfs/dbraw/zinc/68/25/46/1177682546.db2.gz	VMSLUJIZEUBUEZ-UHFFFAOYSA-N	1	0	255.321	1.788	50	0		CDAARO
CCN(C)c1ccnc(N2CCCC[C@H]([NH+](C)C)C2)n1	ZINC001704338622	1177695870	/nfs/dbraw/zinc/69/58/70/1177695870.db2.gz	VWQYQYKDPUYONO-ZDUSSCGKSA-N	1	0	277.416	1.853	50	0		CDAARO
Cc1noc(C)c1CN(C)C(=O)[C@H](C)[NH+]1CCCC1	ZINC001704349998	1177697086	/nfs/dbraw/zinc/69/70/86/1177697086.db2.gz	JMBWDRUKQQHLRU-NSHDSACASA-N	1	0	265.357	1.734	50	0		CDAARO
CCc1cc(NCc2ccncc2)nc(N2CCOCC2)[nH+]1	ZINC000032503297	912691315	/nfs/dbraw/zinc/69/13/15/912691315.db2.gz	PREJZOIJMRPSBB-UHFFFAOYSA-N	1	0	299.378	1.883	50	0		CDAARO
O[C@H]1[C@H](N2CCOCC2)c2ccccc2C12CC[NH2+]CC2	ZINC000023159284	897180664	/nfs/dbraw/zinc/18/06/64/897180664.db2.gz	CXCODTIXIUNWFT-CVEARBPZSA-N	1	0	288.391	1.056	50	0		CDAARO
O=C(CCC1CCCC1)N1C[C@@H](CO)C2(C1)CC[NH2+]CC2	ZINC000581800944	898360207	/nfs/dbraw/zinc/36/02/07/898360207.db2.gz	JQYAHLWPEUDOCA-HNNXBMFYSA-N	1	0	294.439	1.777	50	0		CDAARO
CN(C)C(=O)[C@@H]1CC[N@H+](C[C@@H]2COC3(CCCCC3)O2)C1	ZINC000952883226	910451488	/nfs/dbraw/zinc/45/14/88/910451488.db2.gz	YAGHHSLSIIVZSL-ZIAGYGMSSA-N	1	0	296.411	1.472	50	0		CDAARO
C[C@H](C(=O)N(C)C)[NH+]1CCC(CNC(=O)C2CCC2)CC1	ZINC000952977439	910526397	/nfs/dbraw/zinc/52/63/97/910526397.db2.gz	VPHQRJCDGWJNLD-GFCCVEGCSA-N	1	0	295.427	1.091	50	0		CDAARO
OC[C@@H]1CCC[N@H+](CCNc2ncnc3ccccc32)C1	ZINC000952986001	910554329	/nfs/dbraw/zinc/55/43/29/910554329.db2.gz	VUMXLDWQAVODHT-CYBMUJFWSA-N	1	0	286.379	1.746	50	0		CDAARO
CCC(CC)C[NH+]1CCC(n2cc(CCO)nn2)CC1	ZINC000055327074	911345566	/nfs/dbraw/zinc/34/55/66/911345566.db2.gz	FPWFJUJNXZEPAE-UHFFFAOYSA-N	1	0	280.416	1.886	50	0		CDAARO
CCC[C@H](C)C[NH+]1CCC(n2cc(CCO)nn2)CC1	ZINC000055370769	936415918	/nfs/dbraw/zinc/41/59/18/936415918.db2.gz	ZQKRCYBJAIWVEL-ZDUSSCGKSA-N	1	0	280.416	1.886	50	0		CDAARO
COc1cc(N2CCN(CCc3cccnc3)CC2)ncn1	ZINC000184069802	917592344	/nfs/dbraw/zinc/59/23/44/917592344.db2.gz	YQPWETSMRRAHGV-UHFFFAOYSA-N	1	0	299.378	1.245	50	0		CDAARO
CC(C)c1cncnc1N1CCOC[C@@H](C[NH+](C)C)C1	ZINC000072127078	936652447	/nfs/dbraw/zinc/65/24/47/936652447.db2.gz	ATCGWIYMUPUXFT-ZDUSSCGKSA-N	1	0	278.400	1.614	50	0		CDAARO
Cc1ccc(CNc2nc(N)nc3c2CC[NH2+]C3)cc1C	ZINC000077378351	936739370	/nfs/dbraw/zinc/73/93/70/936739370.db2.gz	OXMFIMFFJRCZEZ-UHFFFAOYSA-N	1	0	283.379	1.933	50	0		CDAARO
CC[C@@]1(O)CCC[N@H+](Cc2cnc(OC)nc2)C1	ZINC000822691561	925645747	/nfs/dbraw/zinc/64/57/47/925645747.db2.gz	VDHGFZAUKAOYLJ-CYBMUJFWSA-N	1	0	251.330	1.222	50	0		CDAARO
CC[N@@H+]1Cc2ccccc2C[C@@H]1C(=O)N1CC=CC1	ZINC000823118878	925670214	/nfs/dbraw/zinc/67/02/14/925670214.db2.gz	SSYLHKQKPKOYFX-OAHLLOKOSA-N	1	0	256.349	1.832	50	0		CDAARO
CCc1nccn1C[C@H](C)[NH2+]CCc1nc(C)cc(=O)[nH]1	ZINC000823557304	925709763	/nfs/dbraw/zinc/70/97/63/925709763.db2.gz	LMJAHYKBXNGDQU-LBPRGKRZSA-N	1	0	289.383	1.470	50	0		CDAARO
[NH3+]C[C@@H]1CCCCN1C(=O)NCc1ccc(CO)cc1	ZINC000827268000	925937142	/nfs/dbraw/zinc/93/71/42/925937142.db2.gz	LGZSGMLBXSJJDZ-AWEZNQCLSA-N	1	0	277.368	1.202	50	0		CDAARO
C[C@@H]1[C@H](C)NC(=O)[C@H](C)N1CCO[C@@H]1CCCCO1	ZINC000585116151	930966697	/nfs/dbraw/zinc/96/66/97/930966697.db2.gz	JEKDMRYBXRSVPJ-QNWHQSFQSA-N	1	0	270.373	1.127	50	0		CDAARO
CCCO[C@H]1CCC[N@H+](CC(=O)NC2CCOCC2)CC1	ZINC000108397680	931462221	/nfs/dbraw/zinc/46/22/21/931462221.db2.gz	MFHUPCOOSIJGJV-HNNXBMFYSA-N	1	0	298.427	1.563	50	0		CDAARO
Cc1cccc(CN2CCC[C@](O)(C[NH+](C)C)C2=O)c1	ZINC000014981608	935532805	/nfs/dbraw/zinc/53/28/05/935532805.db2.gz	HDLPWILQYZLWQD-INIZCTEOSA-N	1	0	276.380	1.410	50	0		CDAARO
CC(C)(C)[C@H]1CN(C(=O)C[NH3+])C[C@@H](c2ccccc2)O1	ZINC001529089566	968979337	/nfs/dbraw/zinc/97/93/37/968979337.db2.gz	ANRALZMIPQTQSF-UONOGXRCSA-N	1	0	276.380	1.960	50	0		CDAARO
CCCn1nc(C)cc1NC(=O)CCN1CC[NH+](C)CC1	ZINC001529125991	968989489	/nfs/dbraw/zinc/98/94/89/968989489.db2.gz	JHAFGEYQFWTBGQ-UHFFFAOYSA-N	1	0	293.415	1.178	50	0		CDAARO
Cc1nc(CN2CC[N@@H+](CC(C)C)[C@@H](CCO)C2)cs1	ZINC001529146837	968995491	/nfs/dbraw/zinc/99/54/91/968995491.db2.gz	QWCTVUFDRZEVEZ-HNNXBMFYSA-N	1	0	297.468	1.976	50	0		CDAARO
CC[C@@H](CNc1ccnc(C)n1)[NH+]1CCN(C)CC1	ZINC001529172445	969002043	/nfs/dbraw/zinc/00/20/43/969002043.db2.gz	HRSGPOBBYDVXFC-ZDUSSCGKSA-N	1	0	263.389	1.223	50	0		CDAARO
CC[C@@H]1CN(CCn2cnnc2C)CC[N@@H+]1C(C)C	ZINC001506398899	975148225	/nfs/dbraw/zinc/14/82/25/975148225.db2.gz	ZJTXINQWRKRCCW-CQSZACIVSA-N	1	0	265.405	1.391	50	0		CDAARO
COc1cc(N2CC[NH+](CC3CCCC3)CC2)nc(N)n1	ZINC001506400557	975149154	/nfs/dbraw/zinc/14/91/54/975149154.db2.gz	DZPGLWPXXGJGDD-UHFFFAOYSA-N	1	0	291.399	1.380	50	0		CDAARO
Cn1ccnc1CC[NH+]1CCC(Oc2ncccn2)CC1	ZINC001506410371	975153174	/nfs/dbraw/zinc/15/31/74/975153174.db2.gz	SVBGTZIMZPEDEI-UHFFFAOYSA-N	1	0	287.367	1.296	50	0		CDAARO
C[C@H](CN(C)CCO)[NH2+]Cc1cc2cc(F)ccc2[nH]1	ZINC001506413205	975153843	/nfs/dbraw/zinc/15/38/43/975153843.db2.gz	HZOTWHPTFQTVKW-LLVKDONJSA-N	1	0	279.359	1.709	50	0		CDAARO
COCC[N@@H+]1CCC[C@@H](CN(C)Cc2ccnn2C)C1	ZINC001506425412	975159115	/nfs/dbraw/zinc/15/91/15/975159115.db2.gz	OMGKYDODQDTPPR-AWEZNQCLSA-N	1	0	280.416	1.210	50	0		CDAARO
Cn1ccnc1CC[N@H+](C)C[C@@H]1Cc2ccccc2CN1C	ZINC001506429721	975161736	/nfs/dbraw/zinc/16/17/36/975161736.db2.gz	XCKGNASVRXFTMW-KRWDZBQOSA-N	1	0	298.434	1.951	50	0		CDAARO
[NH3+]C1CCN(C(=O)CCc2ccc(F)cc2)CC1	ZINC000096482453	230380681	/nfs/dbraw/zinc/38/06/81/230380681.db2.gz	JGCDMVTUTPCMRR-UHFFFAOYSA-N	1	0	250.317	1.708	50	0		CDAARO
CCN1C[C@H](OC)[C@@H](n2cnc3c(C)csc3c2=O)C1	ZINC000584902460	341986786	/nfs/dbraw/zinc/98/67/86/341986786.db2.gz	VBFNDUHEYDBPLE-QWRGUYRKSA-N	1	0	293.392	1.658	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)c1cccc(Oc2cnccn2)c1	ZINC000124571515	187143877	/nfs/dbraw/zinc/14/38/77/187143877.db2.gz	OOFPOYDZPZHEAA-GFCCVEGCSA-N	1	0	298.346	1.703	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)COc1ccccc1F	ZINC000124567639	187143894	/nfs/dbraw/zinc/14/38/94/187143894.db2.gz	FHBXZYYBDWVEKZ-SNVBAGLBSA-N	1	0	252.289	1.025	50	0		CDAARO
C[C@H](CC(=O)N1CCCCCC1)[NH2+][C@@H]1CCCCNC1=O	ZINC000095967269	185046837	/nfs/dbraw/zinc/04/68/37/185046837.db2.gz	GXAJYDHZPVDVKV-ZIAGYGMSSA-N	1	0	295.427	1.426	50	0		CDAARO
CCC1(CC)[C@H]([NH2+][C@@H]2CCC(=O)N(C)C2)C[C@@H]1OC	ZINC000095987931	185057115	/nfs/dbraw/zinc/05/71/15/185057115.db2.gz	MJPZETJOKATEON-UPJWGTAASA-N	1	0	268.401	1.791	50	0		CDAARO
COc1ccc([C@H](C)[C@@H](C)[NH2+]CC(=O)N(C)C)cc1	ZINC000095992476	185058987	/nfs/dbraw/zinc/05/89/87/185058987.db2.gz	RBAYOGULEQENAE-VXGBXAGGSA-N	1	0	264.369	1.865	50	0		CDAARO
COC(=O)N1CCC([NH2+][C@@H](C)[C@@H]2CCCOC2)CC1	ZINC000096003151	185062074	/nfs/dbraw/zinc/06/20/74/185062074.db2.gz	PKPBMXWLQXWKAL-NWDGAFQWSA-N	1	0	270.373	1.622	50	0		CDAARO
CC(C)(C)C(=O)NCc1ccccc1C[N@@H+]1CC[C@@H](O)C1	ZINC000096006299	185063269	/nfs/dbraw/zinc/06/32/69/185063269.db2.gz	GBPKJYPUDXSDBN-OAHLLOKOSA-N	1	0	290.407	1.916	50	0		CDAARO
CN(C)c1cccc(NC(=O)NC2CC[NH+](C)CC2)n1	ZINC000096013136	185065944	/nfs/dbraw/zinc/06/59/44/185065944.db2.gz	BAURFYUMVSUCSC-UHFFFAOYSA-N	1	0	277.372	1.363	50	0		CDAARO
CCn1ccnc1[C@H]1CCCCN1C(=O)[C@H]1CCOC1	ZINC000239782374	361747030	/nfs/dbraw/zinc/74/70/30/361747030.db2.gz	COBOKRIYANASJX-QWHCGFSZSA-N	1	0	277.368	1.993	50	0		CDAARO
C[C@@H]1CN(CC[N@@H+]2CCC[C@H](OCC3CC3)C2)CCO1	ZINC000241588057	361752651	/nfs/dbraw/zinc/75/26/51/361752651.db2.gz	OZFZLHWJQWUCMG-ZBFHGGJFSA-N	1	0	282.428	1.598	50	0		CDAARO
OCCC[NH2+]C[C@H](O)COc1ccc2ccccc2c1	ZINC000022205785	342088957	/nfs/dbraw/zinc/08/89/57/342088957.db2.gz	PAWPHKBFEKXPLC-HNNXBMFYSA-N	1	0	275.348	1.552	50	0		CDAARO
COc1ccc(C[C@H](C)N2CC[NH+](C)CC2)c(OC)c1	ZINC000023280036	342088958	/nfs/dbraw/zinc/08/89/58/342088958.db2.gz	HGKPHBAXCFGQQU-ZDUSSCGKSA-N	1	0	278.396	1.882	50	0		CDAARO
Cn1ccc([C@H](NC(=O)C[NH2+]C2CC2)C(F)(F)F)c1	ZINC000195554663	342626126	/nfs/dbraw/zinc/62/61/26/342626126.db2.gz	AIZZRNVWIGKSSL-NSHDSACASA-N	1	0	275.274	1.497	50	0		CDAARO
C[C@@H](C[NH3+])N(C)S(=O)(=O)N1CCC(C(C)(C)C)CC1	ZINC000195555248	342626298	/nfs/dbraw/zinc/62/62/98/342626298.db2.gz	AUTJDLLCAARGGM-NSHDSACASA-N	1	0	291.461	1.268	50	0		CDAARO
CC[C@H](COc1ccccc1)NC(=O)C[C@H]1C[NH2+]CCO1	ZINC000195543514	342626716	/nfs/dbraw/zinc/62/67/16/342626716.db2.gz	GQGBOMLGJNVUAQ-HIFRSBDPSA-N	1	0	292.379	1.339	50	0		CDAARO
CS[C@@H]1CC[C@@H](NC(=O)N2CC[C@@H](C[NH+](C)C)C2)C1	ZINC000195570442	342628754	/nfs/dbraw/zinc/62/87/54/342628754.db2.gz	APPWHWAFFFLMAS-YNEHKIRRSA-N	1	0	285.457	1.864	50	0		CDAARO
CCOCCN1CC[N@@H+]([C@H]2CCCOC2)C[C@H]1CC	ZINC000252517689	361849982	/nfs/dbraw/zinc/84/99/82/361849982.db2.gz	OPPOSKYGJCEKHR-CABCVRRESA-N	1	0	270.417	1.598	50	0		CDAARO
COCC[C@H]1CCCC[N@@H+]1CCn1cc[nH]c1=O	ZINC000244602012	361853111	/nfs/dbraw/zinc/85/31/11/361853111.db2.gz	DWBOUSYXIURSMX-GFCCVEGCSA-N	1	0	253.346	1.067	50	0		CDAARO
COc1ccc(CC[N@H+](C)C[C@H]2COCCO2)cc1OC	ZINC000244673659	361855211	/nfs/dbraw/zinc/85/52/11/361855211.db2.gz	HTJJKIVRFGXQIG-AWEZNQCLSA-N	1	0	295.379	1.594	50	0		CDAARO
C[NH2+]CC(=O)N1CC(Oc2cccc(Cl)c2)C1	ZINC000244795112	361863726	/nfs/dbraw/zinc/86/37/26/361863726.db2.gz	QZTKQLXQINYPQL-UHFFFAOYSA-N	1	0	254.717	1.149	50	0		CDAARO
Cc1cc([C@H]2CCCN2CC(=O)Nc2ccn(C)n2)on1	ZINC000244828485	361865365	/nfs/dbraw/zinc/86/53/65/361865365.db2.gz	TWVXYPITAMETOL-LLVKDONJSA-N	1	0	289.339	1.492	50	0		CDAARO
Cc1cc(CNc2cc([C@H]3C[C@@H]([NH3+])C3)nc(N)n2)no1	ZINC000244893104	361869275	/nfs/dbraw/zinc/86/92/75/361869275.db2.gz	YVUKJVWYDYEYCU-DTORHVGOSA-N	1	0	274.328	1.172	50	0		CDAARO
C[C@@H]([NH3+])C(=O)N1CC(Oc2cccc(Cl)c2)C1	ZINC000244708143	361859143	/nfs/dbraw/zinc/85/91/43/361859143.db2.gz	KOKNVPPTKPMAQK-MRVPVSSYSA-N	1	0	254.717	1.277	50	0		CDAARO
CCNC(=O)NC(=O)[C@H](C)[NH+](CC(C)C)CC(C)C	ZINC000096969036	185143314	/nfs/dbraw/zinc/14/33/14/185143314.db2.gz	XOFHDVBCKQDOSJ-LBPRGKRZSA-N	1	0	271.405	1.835	50	0		CDAARO
C[C@@H]1CC[NH2+][C@@H](C)[C@H]1NC(=O)c1cccc(CO)c1	ZINC000585136453	342216088	/nfs/dbraw/zinc/21/60/88/342216088.db2.gz	GZXMHUZKWHCYIN-SUNKGSAMSA-N	1	0	262.353	1.295	50	0		CDAARO
Cc1ccc(Cn2cc(O[C@@H]3COC[C@@H]3[NH3+])cn2)c(C)n1	ZINC000685941793	539045967	/nfs/dbraw/zinc/04/59/67/539045967.db2.gz	BWADYWQGQCXDOP-LSDHHAIUSA-N	1	0	288.351	1.048	50	0		CDAARO
OCCC1([NH2+]Cc2cccc3c2OCO3)CCOCC1	ZINC000584907953	539102381	/nfs/dbraw/zinc/10/23/81/539102381.db2.gz	WYBFFPHZAVHEAH-UHFFFAOYSA-N	1	0	279.336	1.437	50	0		CDAARO
CCn1ncc(CNC2CC[NH+](C(C)(C)C)CC2)n1	ZINC000585087118	539103308	/nfs/dbraw/zinc/10/33/08/539103308.db2.gz	GREIPWOUARBMQM-UHFFFAOYSA-N	1	0	265.405	1.651	50	0		CDAARO
CCc1cc(C(=O)N2CC[NH+](C3CCCC3)CC2)[nH]n1	ZINC000127941679	342291991	/nfs/dbraw/zinc/29/19/91/342291991.db2.gz	GMDYCDSSHXRLGL-UHFFFAOYSA-N	1	0	276.384	1.673	50	0		CDAARO
CC[C@@H]([NH3+])C(=O)N1CCC([C@H](O)c2ccc(F)cc2)CC1	ZINC000129786641	529555752	/nfs/dbraw/zinc/55/57/52/529555752.db2.gz	SMXYQUFXRLNLPV-HUUCEWRRSA-N	1	0	294.370	1.835	50	0		CDAARO
C[C@@H]1CCC[C@H](OCC(=O)N2CC[NH2+]C[C@@H]2C)C1	ZINC000126277907	187230129	/nfs/dbraw/zinc/23/01/29/187230129.db2.gz	KKEMQGNZIQXDSG-AGIUHOORSA-N	1	0	254.374	1.402	50	0		CDAARO
CC[C@H](Cn1c(=O)[nH]c2ccccc2c1=O)[NH+]1CCCC1	ZINC000036395981	362061858	/nfs/dbraw/zinc/06/18/58/362061858.db2.gz	GMUZXUZCSSKOMV-GFCCVEGCSA-N	1	0	287.363	1.564	50	0		CDAARO
CC[N@@H+]1CCCC[C@H]1CNC(=O)N1CCO[C@H](C)C1	ZINC000078926023	362121346	/nfs/dbraw/zinc/12/13/46/362121346.db2.gz	MJCIFVPKLJUACW-OLZOCXBDSA-N	1	0	269.389	1.291	50	0		CDAARO
C[N@H+](C[C@H]1CCCO1)CC(C)(C)CN1CCOCC1	ZINC000200581647	342437915	/nfs/dbraw/zinc/43/79/15/342437915.db2.gz	SBBHGFAITOYOCC-CQSZACIVSA-N	1	0	270.417	1.456	50	0		CDAARO
COC[C@H](O)C[N@@H+]1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000127046428	187278355	/nfs/dbraw/zinc/27/83/55/187278355.db2.gz	LSBLPFMUWMSGAU-NVXWUHKLSA-N	1	0	292.423	1.590	50	0		CDAARO
O=C(NC[C@H]1CCCO1)N1CCN(Cc2ccco2)CC1	ZINC000084432969	362263902	/nfs/dbraw/zinc/26/39/02/362263902.db2.gz	ZLSZROYQHAKQPB-CYBMUJFWSA-N	1	0	293.367	1.286	50	0		CDAARO
C[C@@H]1CN(C(=O)Cc2cccc(Br)c2)CC[NH2+]1	ZINC000084719035	362269079	/nfs/dbraw/zinc/26/90/79/362269079.db2.gz	OIDGDLXZLNMNOY-SNVBAGLBSA-N	1	0	297.196	1.812	50	0		CDAARO
C[NH2+]CCN(C)Cc1cncn1Cc1ccccc1	ZINC000252481590	362385586	/nfs/dbraw/zinc/38/55/86/362385586.db2.gz	COSSQUGZKOEAEZ-UHFFFAOYSA-N	1	0	258.369	1.583	50	0		CDAARO
Cc1nnc(CN2CCC([N@@H+]3CCC[C@H](CO)C3)CC2)o1	ZINC000230589280	345084683	/nfs/dbraw/zinc/08/46/83/345084683.db2.gz	PCSSFLKPMQDZGR-ZDUSSCGKSA-N	1	0	294.399	1.047	50	0		CDAARO
COC(=O)C1(C[NH2+]Cc2ccsc2)CCOCC1	ZINC000097108629	185534547	/nfs/dbraw/zinc/53/45/47/185534547.db2.gz	DVWUJUMNEOMGFB-UHFFFAOYSA-N	1	0	269.366	1.808	50	0		CDAARO
COc1ccc(F)cc1C(=O)N1CCC[C@@H]([NH3+])C1	ZINC000084589941	178901713	/nfs/dbraw/zinc/90/17/13/178901713.db2.gz	OCLHUPSATRGDAD-SNVBAGLBSA-N	1	0	252.289	1.398	50	0		CDAARO
Cc1noc(C)c1[C@H](C)NC(=O)N1CC[C@H](C[NH+](C)C)C1	ZINC000130001167	346179433	/nfs/dbraw/zinc/17/94/33/346179433.db2.gz	IYJCPMQSJPDURL-GXFFZTMASA-N	1	0	294.399	1.946	50	0		CDAARO
CCC[C@H](C)[NH+]1CCN(Cc2nc(COC)no2)CC1	ZINC000192839214	362713603	/nfs/dbraw/zinc/71/36/03/362713603.db2.gz	UNUULERUYANHEA-LBPRGKRZSA-N	1	0	282.388	1.522	50	0		CDAARO
c1cnn([C@H]2CCCC[C@@H]2[NH2+]CC2OCCO2)c1	ZINC000128391506	187367102	/nfs/dbraw/zinc/36/71/02/187367102.db2.gz	JCNUJXUYCKURJX-RYUDHWBXSA-N	1	0	251.330	1.329	50	0		CDAARO
C[NH+](C)C[C@H]1COCCN1C(=O)CCC1CCCC1	ZINC000085469768	179075027	/nfs/dbraw/zinc/07/50/27/179075027.db2.gz	ACRSWSCERFFZJJ-AWEZNQCLSA-N	1	0	268.401	1.746	50	0		CDAARO
CC(C)(C)OC(=O)CSc1nc(N)cc(N)[nH+]1	ZINC000000495555	365810102	/nfs/dbraw/zinc/81/01/02/365810102.db2.gz	RRKDCLNBYIUPKP-UHFFFAOYSA-N	1	0	256.331	1.075	50	0		CDAARO
Cn1cc([C@@H]2OCC[C@@H]2C[NH2+]Cc2ccco2)cn1	ZINC000089755331	347612302	/nfs/dbraw/zinc/61/23/02/347612302.db2.gz	XYQRVOAYRTXDFW-BXUZGUMPSA-N	1	0	261.325	1.881	50	0		CDAARO
Cc1cccc([C@H](C)[NH2+]CCN2CCCS2(=O)=O)c1C	ZINC000089520163	179808880	/nfs/dbraw/zinc/80/88/80/179808880.db2.gz	XXMFWEPLFAVOHN-AWEZNQCLSA-N	1	0	296.436	1.990	50	0		CDAARO
C[C@@H]([NH2+]C1CSCCSC1)c1cnn(C)c1	ZINC000584895119	349355093	/nfs/dbraw/zinc/35/50/93/349355093.db2.gz	QAQYIBCFTWMHDL-SECBINFHSA-N	1	0	257.428	1.919	50	0		CDAARO
COc1ccc2c(c1)C[C@H]([NH2+]C[C@H](C)[S@](C)=O)CC2	ZINC000090843036	180044507	/nfs/dbraw/zinc/04/45/07/180044507.db2.gz	AILYWZGCDXMZSV-GEDNVKPRSA-N	1	0	281.421	1.909	50	0		CDAARO
Cc1cnn(CCN2CC3(CC[NH2+]CC3)CCC2=O)c1	ZINC000091350639	180137829	/nfs/dbraw/zinc/13/78/29/180137829.db2.gz	ZXQTWBZEIRBILX-UHFFFAOYSA-N	1	0	276.384	1.184	50	0		CDAARO
CN1CC[C@]2(CN(Cc3ccco3)CC[N@@H+]2C)CCC1=O	ZINC000091518566	180177657	/nfs/dbraw/zinc/17/76/57/180177657.db2.gz	YSFSYAOLWWIUON-INIZCTEOSA-N	1	0	291.395	1.408	50	0		CDAARO
Cc1ncsc1CN(C)C(=O)[C@@H]1CC[C@H]([NH3+])C1	ZINC000091545648	180186685	/nfs/dbraw/zinc/18/66/85/180186685.db2.gz	CIFTZGGGJYRGNY-ZJUUUORDSA-N	1	0	253.371	1.537	50	0		CDAARO
CCCN1CCC[C@]2(CC[N@H+](Cc3nc(C)no3)C2)C1=O	ZINC000091737357	180244196	/nfs/dbraw/zinc/24/41/96/180244196.db2.gz	URNLFQIRMCMVBF-OAHLLOKOSA-N	1	0	292.383	1.603	50	0		CDAARO
Cc1cccc(CS(=O)(=O)N2C[C@H]([NH3+])[C@@H](C(C)C)C2)c1	ZINC000092022777	180308568	/nfs/dbraw/zinc/30/85/68/180308568.db2.gz	HJOVRJLFFATCCM-CABCVRRESA-N	1	0	296.436	1.740	50	0		CDAARO
CC(C)C[N@@H+]1CCCN(CC(=O)N[C@H](C)C(C)C)CC1	ZINC000106802062	186137225	/nfs/dbraw/zinc/13/72/25/186137225.db2.gz	CMLXLDLTEROGGX-OAHLLOKOSA-N	1	0	283.460	1.811	50	0		CDAARO
C[C@H]1C[C@@H]1c1ccc(C[NH2+]CC2(CO)COC2)o1	ZINC000123031797	187066882	/nfs/dbraw/zinc/06/68/82/187066882.db2.gz	PEIJVGOYSIYVOW-JQWIXIFHSA-N	1	0	251.326	1.502	50	0		CDAARO
C[C@]1(C2CC2)NC(=O)N(c2ccc(C[NH3+])cc2)C1=O	ZINC000148587827	187918067	/nfs/dbraw/zinc/91/80/67/187918067.db2.gz	IUGNOUXIEPLKPC-CQSZACIVSA-N	1	0	259.309	1.370	50	0		CDAARO
Cc1ccc(-c2cc(CC(=O)NCC[NH+](C)C)no2)cc1	ZINC000012862474	363258818	/nfs/dbraw/zinc/25/88/18/363258818.db2.gz	BAOXGBNBWGMYCV-UHFFFAOYSA-N	1	0	287.363	1.870	50	0		CDAARO
Cc1ccc(F)cc1S(=O)(=O)N[C@@H]1C[N@@H+](C)C[C@@H]1C	ZINC000076058273	538377188	/nfs/dbraw/zinc/37/71/88/538377188.db2.gz	HNXHOIFUTIJZKW-CMPLNLGQSA-N	1	0	286.372	1.363	50	0		CDAARO
CC[N@@H+]1CCC[C@H](NC(=O)c2cc(NC)ccc2OC)C1	ZINC000000347687	355906111	/nfs/dbraw/zinc/90/61/11/355906111.db2.gz	XWHNDBGCEUFEKS-ZDUSSCGKSA-N	1	0	291.395	1.951	50	0		CDAARO
O=C(C[C@@H](CO)[NH2+]Cc1ccccc1)NCc1ccccc1	ZINC000000034176	355880292	/nfs/dbraw/zinc/88/02/92/355880292.db2.gz	VXVMQZRTMSIEGT-KRWDZBQOSA-N	1	0	298.386	1.844	50	0		CDAARO
CC[C@H](O)[C@H]1CCCC[N@@H+]1C[C@@H](O)CN1CCC(C)CC1	ZINC000195530869	363456209	/nfs/dbraw/zinc/45/62/09/363456209.db2.gz	VOJUROBBYILNPW-BBWFWOEESA-N	1	0	298.471	1.705	50	0		CDAARO
COc1cc(CN(C)C2CC[NH+](C)CC2)cc2c1OCO2	ZINC000000216558	355897367	/nfs/dbraw/zinc/89/73/67/355897367.db2.gz	XYUUKVRNWVQZFN-UHFFFAOYSA-N	1	0	292.379	1.950	50	0		CDAARO
COc1ccc(OCC(=O)O[C@@H]2CCC[N@H+](C)C2)cc1	ZINC000000249808	355899303	/nfs/dbraw/zinc/89/93/03/355899303.db2.gz	IWRWQKKLZUWGCN-CQSZACIVSA-N	1	0	279.336	1.711	50	0		CDAARO
O=C(NCCC[NH2+]Cc1ccccc1)c1ccccn1	ZINC000002829065	355983411	/nfs/dbraw/zinc/98/34/11/355983411.db2.gz	GGUVPGZAANNKDU-UHFFFAOYSA-N	1	0	269.348	1.991	50	0		CDAARO
CCc1ccc(C[NH2+]CCSc2nnnn2C)cc1	ZINC000002178163	355962193	/nfs/dbraw/zinc/96/21/93/355962193.db2.gz	ZLVVKMFQJUSCRQ-UHFFFAOYSA-N	1	0	277.397	1.654	50	0		CDAARO
CC(C)(C)[NH2+]CC(=O)N1CC(=O)Nc2ccccc21	ZINC000002184245	355963437	/nfs/dbraw/zinc/96/34/37/355963437.db2.gz	ZXZGZNBVCRUJOJ-UHFFFAOYSA-N	1	0	261.325	1.360	50	0		CDAARO
COc1cc(OC)c(OC)cc1C[NH2+]C[C@H]1CCCO1	ZINC000004498045	356032582	/nfs/dbraw/zinc/03/25/82/356032582.db2.gz	OXCKCCGTEIJZMV-GFCCVEGCSA-N	1	0	281.352	1.981	50	0		CDAARO
CC(=O)Nc1ccccc1C(=O)NCCCn1ccnc1	ZINC000010313238	356256004	/nfs/dbraw/zinc/25/60/04/356256004.db2.gz	FUKDPDDQTKSWGN-UHFFFAOYSA-N	1	0	286.335	1.662	50	0		CDAARO
COc1ccccc1N1CCN(C(=O)[C@@H]2CCC[NH2+]2)CC1	ZINC000011754489	356278734	/nfs/dbraw/zinc/27/87/34/356278734.db2.gz	PIXDZRAFDOBLOC-ZDUSSCGKSA-N	1	0	289.379	1.096	50	0		CDAARO
O=S(=O)(Cc1ccccc1)NCCC[NH+]1CCCCC1	ZINC000013669512	356352755	/nfs/dbraw/zinc/35/27/55/356352755.db2.gz	SZDAUMYCNCGWLD-UHFFFAOYSA-N	1	0	296.436	1.982	50	0		CDAARO
O=C1CCCN1CCC[NH2+]Cc1ccc2c(c1)OCCO2	ZINC000013727997	356354532	/nfs/dbraw/zinc/35/45/32/356354532.db2.gz	CEWNFSNNOIVKBA-UHFFFAOYSA-N	1	0	290.363	1.560	50	0		CDAARO
COc1ccccc1OCCSc1nc(N)cc(N)[nH+]1	ZINC000004561841	356413250	/nfs/dbraw/zinc/41/32/50/356413250.db2.gz	RDEOSMVPZGWICD-UHFFFAOYSA-N	1	0	292.364	1.821	50	0		CDAARO
C(c1noc(CN2CC[NH+](CC3CC3)CC2)n1)C1CC1	ZINC000019225817	356477719	/nfs/dbraw/zinc/47/77/19/356477719.db2.gz	JJMGDNVVJGHNLX-UHFFFAOYSA-N	1	0	276.384	1.550	50	0		CDAARO
CCN(CC)CC[NH2+]Cc1ccc2c(c1)OCO2	ZINC000019871946	356512085	/nfs/dbraw/zinc/51/20/85/356512085.db2.gz	IBSXWHCQMSFCCE-UHFFFAOYSA-N	1	0	250.342	1.847	50	0		CDAARO
COc1cc(CN2CC[NH+](C)CC2)cc2c1OCO2	ZINC000019606930	356493568	/nfs/dbraw/zinc/49/35/68/356493568.db2.gz	MGWOEUPQEICENC-UHFFFAOYSA-N	1	0	264.325	1.171	50	0		CDAARO
COc1ccc([C@@H](C[NH3+])N2CCOCC2)cc1OC	ZINC000019795690	356505499	/nfs/dbraw/zinc/50/54/99/356505499.db2.gz	DPDHBGJASQWDBQ-GFCCVEGCSA-N	1	0	266.341	1.036	50	0		CDAARO
CCC[NH2+][C@H]1CC(=O)N(c2ccc(OC)cc2)C1=O	ZINC000020064832	356523765	/nfs/dbraw/zinc/52/37/65/356523765.db2.gz	HSWKDRBRRNLLBM-LBPRGKRZSA-N	1	0	262.309	1.327	50	0		CDAARO
Cc1sc2[nH]c(CN3CC[NH2+]CC3)nc(=O)c2c1C	ZINC000023257231	356637196	/nfs/dbraw/zinc/63/71/96/356637196.db2.gz	RQVNUMAYSOSBHH-UHFFFAOYSA-N	1	0	278.381	1.007	50	0		CDAARO
OC1CC[NH+]([C@@H]2CCN(Cc3ccsc3)C[C@H]2O)CC1	ZINC000023338632	356640824	/nfs/dbraw/zinc/64/08/24/356640824.db2.gz	XYQJPIQAEGZLDF-HUUCEWRRSA-N	1	0	296.436	1.140	50	0		CDAARO
O=C(NC[C@H]1CCC[NH2+]1)c1cc(Cl)c(Cl)[nH]1	ZINC000053253180	356658328	/nfs/dbraw/zinc/65/83/28/356658328.db2.gz	PMWSITGJTCDSPD-ZCFIWIBFSA-N	1	0	262.140	1.803	50	0		CDAARO
[NH3+]C[C@@H]1CCN(C(=O)[C@H]2Cc3cc(Cl)ccc3O2)C1	ZINC000269171704	356817501	/nfs/dbraw/zinc/81/75/01/356817501.db2.gz	VHGFLNGIVDEPJT-TVQRCGJNSA-N	1	0	280.755	1.451	50	0		CDAARO
Brc1cccc(OC[C@@H]2CC[NH2+]C2)n1	ZINC000042774187	357079723	/nfs/dbraw/zinc/07/97/23/357079723.db2.gz	HQFMGGRGXPHAON-MRVPVSSYSA-N	1	0	257.131	1.832	50	0		CDAARO
CO[C@H]1CC=C2CC[N@@H+]3CCC4=C(CC(=O)OC4)[C@]23C1	ZINC000053098482	357283115	/nfs/dbraw/zinc/28/31/15/357283115.db2.gz	ALSKYCOJJPXPFS-BBRMVZONSA-N	1	0	275.348	1.813	50	0	in-vitro	CDAARO
OCCOc1ccccc1[C@H]1NCCc2nc[nH]c21	ZINC000065489360	357544853	/nfs/dbraw/zinc/54/48/53/357544853.db2.gz	UZABPLSKMCGOGZ-CYBMUJFWSA-N	1	0	259.309	1.016	50	0		CDAARO
CCn1c(C)cc(C)c(C(=O)N[C@@H]2CC[C@@H]([NH3+])C2)c1=O	ZINC000067654603	357616398	/nfs/dbraw/zinc/61/63/98/357616398.db2.gz	FTFUNUOLEKECBK-VXGBXAGGSA-N	1	0	277.368	1.095	50	0		CDAARO
O=C(c1cccc2c1OCC2)N1CC[C@]2(C1)CCC[NH2+]C2	ZINC000067713614	357620457	/nfs/dbraw/zinc/62/04/57/357620457.db2.gz	YSBAOMWKRFJGSI-QGZVFWFLSA-N	1	0	286.375	1.837	50	0		CDAARO
CC[C@@H](C[NH2+]C1CSCCSC1)N1CCOCC1	ZINC000067714564	357620487	/nfs/dbraw/zinc/62/04/87/357620487.db2.gz	QNORZEADUMRSLV-ZDUSSCGKSA-N	1	0	290.498	1.535	50	0		CDAARO
CCNC(=O)[C@@H]1C[C@H]([NH3+])CN1Cc1ccc(C)cc1OC	ZINC000067840874	357631423	/nfs/dbraw/zinc/63/14/23/357631423.db2.gz	LSMITLMZMJZYQF-KBPBESRZSA-N	1	0	291.395	1.041	50	0		CDAARO
C[NH+](C)C[C@@]1(O)CCN(c2ccc3ccccc3n2)C1	ZINC000072454467	357837239	/nfs/dbraw/zinc/83/72/39/357837239.db2.gz	MNJINORQAIWVRB-INIZCTEOSA-N	1	0	271.364	1.738	50	0		CDAARO
COc1ccc(SCC[NH2+]C[C@@]2(O)CCC[NH2+]C2)cc1	ZINC000072454650	357837284	/nfs/dbraw/zinc/83/72/84/357837284.db2.gz	RNEDAVXEPHKQQA-OAHLLOKOSA-N	1	0	296.436	1.491	50	0		CDAARO
CO[C@H](C)CC(=O)Nc1ccc2c(c1)N(C)CC[N@@H+](C)C2	ZINC000097046235	357924066	/nfs/dbraw/zinc/92/40/66/357924066.db2.gz	STWNYOIDHBAWAS-GFCCVEGCSA-N	1	0	291.395	1.932	50	0		CDAARO
C[C@H]1[NH2+]CCN(Cc2ccc3c(c2)OCCO3)[C@H]1C	ZINC000097095773	357953592	/nfs/dbraw/zinc/95/35/92/357953592.db2.gz	XTMSOZFCPMPGTE-NEPJUHHUSA-N	1	0	262.353	1.640	50	0		CDAARO
CC[N@@H+]1CCC[C@@H]1CNS(=O)(=O)c1cc(C)oc1C	ZINC000097102326	357972270	/nfs/dbraw/zinc/97/22/70/357972270.db2.gz	BGNXFZDHPXTXSD-GFCCVEGCSA-N	1	0	286.397	1.659	50	0		CDAARO
CC[C@@H]1CN(C(=O)[C@@H]([NH3+])c2ccccc2)C[C@H](C)O1	ZINC000299747989	358025575	/nfs/dbraw/zinc/02/55/75/358025575.db2.gz	FSENOTCKPFGQDB-YUTCNCBUSA-N	1	0	262.353	1.712	50	0		CDAARO
[NH3+][C@H]1CCCCN(C(=O)Cc2ccc3c(c2)OCO3)C1	ZINC000082107644	358147087	/nfs/dbraw/zinc/14/70/87/358147087.db2.gz	GUCCWJQNSRVVIT-LBPRGKRZSA-N	1	0	276.336	1.298	50	0		CDAARO
OCC[N@H+](Cc1ccccc1)Cc1ncccc1O	ZINC000019864887	358190726	/nfs/dbraw/zinc/19/07/26/358190726.db2.gz	AFLXMTXOVRGNMC-UHFFFAOYSA-N	1	0	258.321	1.782	50	0		CDAARO
Cc1nc(N2CCC[N@@H+](C)CC2)cc(C(F)(F)F)n1	ZINC000567073725	358624880	/nfs/dbraw/zinc/62/48/80/358624880.db2.gz	OZKKAGKIBYXXKC-UHFFFAOYSA-N	1	0	274.290	1.946	50	0		CDAARO
CCCc1nnc(N2CCN(c3cc[nH+]cc3)CC2)o1	ZINC000095374088	358688857	/nfs/dbraw/zinc/68/88/57/358688857.db2.gz	VSNSYBDBMNKAQY-UHFFFAOYSA-N	1	0	273.340	1.744	50	0		CDAARO
C[N@@H+]1CCCC[C@@H]1CCC(=O)NCCSc1c[nH]nn1	ZINC000095379679	358689528	/nfs/dbraw/zinc/68/95/28/358689528.db2.gz	IWTXVSIWIQZOSV-LLVKDONJSA-N	1	0	297.428	1.278	50	0		CDAARO
CCO[C@@H](C)CN(C)c1nc(N)[nH+]c(C)c1CC	ZINC000095377098	358689643	/nfs/dbraw/zinc/68/96/43/358689643.db2.gz	TZHKWIMWLWAUBP-VIFPVBQESA-N	1	0	252.362	1.791	50	0		CDAARO
COCCC(=O)NC1CC[NH+](Cc2c(C)noc2C)CC1	ZINC000098211946	358816396	/nfs/dbraw/zinc/81/63/96/358816396.db2.gz	VTAYXYMHWVKWBR-UHFFFAOYSA-N	1	0	295.383	1.409	50	0		CDAARO
C[NH+](C)[C@@H]1CCCN(Cc2cccc(OCCO)c2)CC1	ZINC000097528088	358782358	/nfs/dbraw/zinc/78/23/58/358782358.db2.gz	MGILBBJMGUNBDP-MRXNPFEDSA-N	1	0	292.423	1.974	50	0		CDAARO
CC(C)c1ccc(C(=O)NCC[NH+]2CCCC2)c(=O)n1C	ZINC000215350616	358885433	/nfs/dbraw/zinc/88/54/33/358885433.db2.gz	HRASRBFVYOJGKD-UHFFFAOYSA-N	1	0	291.395	1.334	50	0		CDAARO
Cn1ccnc1[C@@H](O)C1CC[NH+](Cc2ccncc2)CC1	ZINC000215760749	358902066	/nfs/dbraw/zinc/90/20/66/358902066.db2.gz	DWMWTNKMRKVYIN-HNNXBMFYSA-N	1	0	286.379	1.761	50	0		CDAARO
Cc1c(C[NH+]2CCC3(CC2)OCCC[C@@H]3O)cnn1C	ZINC000216432814	358944988	/nfs/dbraw/zinc/94/49/88/358944988.db2.gz	VUEGOUHXRJXKHL-AWEZNQCLSA-N	1	0	279.384	1.234	50	0		CDAARO
CCN(CC(=O)N1CCNC1=O)Cc1cccc(F)c1	ZINC000012776513	359024004	/nfs/dbraw/zinc/02/40/04/359024004.db2.gz	WHCRTVKQDNHDHX-UHFFFAOYSA-N	1	0	279.315	1.199	50	0		CDAARO
CO[C@H]1CCCC[C@@H]1[NH+]1CCN(C(=O)c2ccco2)CC1	ZINC000000759070	359007632	/nfs/dbraw/zinc/00/76/32/359007632.db2.gz	HRVLJQXAERGABT-KBPBESRZSA-N	1	0	292.379	1.995	50	0		CDAARO
CNC(=O)C1CC[NH+](Cc2cccc(OC)c2)CC1	ZINC000012333690	359009693	/nfs/dbraw/zinc/00/96/93/359009693.db2.gz	VCBMMQLSUZFPDW-UHFFFAOYSA-N	1	0	262.353	1.653	50	0		CDAARO
C[C@H](CNC(=O)c1cnc2ccccc2n1)n1ccnc1	ZINC000219522645	359103338	/nfs/dbraw/zinc/10/33/38/359103338.db2.gz	OJMLAPDRORBQBK-LLVKDONJSA-N	1	0	281.319	1.817	50	0		CDAARO
CSc1ncc(C(=O)N2CC[N@@H+]3CCC[C@H]3C2)cn1	ZINC000219632013	359108945	/nfs/dbraw/zinc/10/89/45/359108945.db2.gz	NFYOTUCAWMJVEN-NSHDSACASA-N	1	0	278.381	1.119	50	0		CDAARO
CC(C)CC(=O)N1CC[C@@H]2COCC[N@H+](C)[C@@H]2C1	ZINC000257181499	359395918	/nfs/dbraw/zinc/39/59/18/359395918.db2.gz	NFNMMANMFMGSCE-CHWSQXEVSA-N	1	0	254.374	1.212	50	0		CDAARO
COc1cccc(C[NH+]2CCC3(CC[C@H]3O)CC2)n1	ZINC000257189324	359533572	/nfs/dbraw/zinc/53/35/72/359533572.db2.gz	NQBUXWGPSNLLTM-CYBMUJFWSA-N	1	0	262.353	1.827	50	0		CDAARO
CN(C)C(=O)[C@@H]1C[N@H+](Cc2cc(F)cc(F)c2)C[C@H]1CO	ZINC000257192931	359594975	/nfs/dbraw/zinc/59/49/75/359594975.db2.gz	WJHWZXPZJBELQE-SMDDNHRTSA-N	1	0	298.333	1.093	50	0		CDAARO
CC(C)[N@@H+]1CC[C@H](N(C)C(=O)c2ccc(C(N)=O)cc2)C1	ZINC000408520383	359908033	/nfs/dbraw/zinc/90/80/33/359908033.db2.gz	BMGYMKTYOFYXTB-AWEZNQCLSA-N	1	0	289.379	1.340	50	0		CDAARO
C[C@H]1Cc2ccccc2N1C(=O)C[C@H]1COCC[NH2+]1	ZINC000128829788	360053977	/nfs/dbraw/zinc/05/39/77/360053977.db2.gz	GDVFNIIRGXBQLY-AAEUAGOBSA-N	1	0	260.337	1.343	50	0		CDAARO
CS(=O)(=O)NCCc1ccc(CC2CC[NH2+]CC2)cc1	ZINC000409420565	360224135	/nfs/dbraw/zinc/22/41/35/360224135.db2.gz	OBGVRPYEGSYVET-UHFFFAOYSA-N	1	0	296.436	1.320	50	0		CDAARO
O=C(CC1CC[NH2+]CC1)Nc1ccnn1CC1CC1	ZINC000238147608	360238942	/nfs/dbraw/zinc/23/89/42/360238942.db2.gz	XEGTVUXHZJZYNF-UHFFFAOYSA-N	1	0	262.357	1.621	50	0		CDAARO
O=C(NC1CC[NH+](C2CCCC2)CC1)c1cn[nH]c1	ZINC000177412739	189049380	/nfs/dbraw/zinc/04/93/80/189049380.db2.gz	GPDHWQIGCIVLMF-UHFFFAOYSA-N	1	0	262.357	1.547	50	0		CDAARO
COCCN(CC1CC1)C(=O)[C@H](C)n1ccnc1C	ZINC000426533941	360681455	/nfs/dbraw/zinc/68/14/55/360681455.db2.gz	YGBSNWGJPCTWNB-NSHDSACASA-N	1	0	265.357	1.638	50	0		CDAARO
Cc1nc(CSc2nnc([C@@H]3CCC[NH2+]C3)n2C)no1	ZINC000426362113	360660004	/nfs/dbraw/zinc/66/00/04/360660004.db2.gz	YOWQTDZFEKFEEI-SECBINFHSA-N	1	0	294.384	1.266	50	0		CDAARO
C[C@H](C(=O)NCCc1cccc(=O)[nH]1)[NH+]1CCCCC1	ZINC000426734544	360701247	/nfs/dbraw/zinc/70/12/47/360701247.db2.gz	SUCBCALXZLZFOA-GFCCVEGCSA-N	1	0	277.368	1.320	50	0		CDAARO
Cc1c(C(=O)N2CC[C@H](C[NH3+])C2)cnn1-c1ccccc1C	ZINC000178527807	189124308	/nfs/dbraw/zinc/12/43/08/189124308.db2.gz	QTTFKGLCWMDSIK-CQSZACIVSA-N	1	0	298.390	1.910	50	0		CDAARO
CN(C(=O)CCOc1ccccc1Cl)[C@@H]1CC[NH2+]C1	ZINC000179068442	189166306	/nfs/dbraw/zinc/16/63/06/189166306.db2.gz	FVGIILVHAVUAHY-LLVKDONJSA-N	1	0	282.771	1.929	50	0		CDAARO
Cc1n[nH]c(C)c1S(=O)(=O)NC[C@H]([NH3+])c1ccccc1	ZINC000036297712	361462367	/nfs/dbraw/zinc/46/23/67/361462367.db2.gz	MLGZAODPTFIEBZ-LBPRGKRZSA-N	1	0	294.380	1.005	50	0		CDAARO
C[NH+](C)C1(CNC(=O)c2ccncc2Cl)CCOCC1	ZINC000073094912	361585772	/nfs/dbraw/zinc/58/57/72/361585772.db2.gz	LEERTFDPYDKWSO-UHFFFAOYSA-N	1	0	297.786	1.576	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1CN(C)C(=O)c1cccc(N)n1	ZINC000092674549	361684200	/nfs/dbraw/zinc/68/42/00/361684200.db2.gz	PKUXOGWXPXXKMO-NSHDSACASA-N	1	0	262.357	1.220	50	0		CDAARO
[NH3+]Cc1ccc(C(=O)NCCCc2ccccn2)cc1	ZINC000186472452	189440455	/nfs/dbraw/zinc/44/04/55/189440455.db2.gz	BCIHHUBFIFQMEN-UHFFFAOYSA-N	1	0	269.348	1.903	50	0		CDAARO
COc1cc(N2CC[NH+](CC[C@@H]3CCCO3)CC2)ncn1	ZINC000189977173	363964301	/nfs/dbraw/zinc/96/43/01/363964301.db2.gz	VKWLLDFGHHGQRL-ZDUSSCGKSA-N	1	0	292.383	1.176	50	0		CDAARO
COc1cc(C[N@H+](C)C2CCN(C)CC2)cc(OC)c1O	ZINC000000207008	364093395	/nfs/dbraw/zinc/09/33/95/364093395.db2.gz	BNHCWWOOMVLOPK-UHFFFAOYSA-N	1	0	294.395	1.935	50	0		CDAARO
Cc1cc(NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)n2ncnc2n1	ZINC000088164925	364314491	/nfs/dbraw/zinc/31/44/91/364314491.db2.gz	LMMILGBXVMGJIY-YHWZYXNKSA-N	1	0	286.383	1.860	50	0		CDAARO
CC[N@@H+]1CCC[C@H]1[C@H]1CCCN1C(=O)C1CCOCC1	ZINC000249690196	365163244	/nfs/dbraw/zinc/16/32/44/365163244.db2.gz	KCCBYIGWKMWLEL-LSDHHAIUSA-N	1	0	280.412	1.888	50	0		CDAARO
COC[C@@](C)(CCO)[NH2+]Cc1cccc2c1OCCCO2	ZINC000089895571	366958363	/nfs/dbraw/zinc/95/83/63/366958363.db2.gz	MDFPWRLYGFEJTK-MRXNPFEDSA-N	1	0	295.379	1.725	50	0		CDAARO
Cc1ccc(S(=O)(=O)N(C)C2CC[NH+](C)CC2)cc1	ZINC000003328480	367556342	/nfs/dbraw/zinc/55/63/42/367556342.db2.gz	KTFVJJTZAHUNDI-UHFFFAOYSA-N	1	0	282.409	1.710	50	0		CDAARO
COC(=O)NCC1CC[NH+](C2CCSCC2)CC1	ZINC000252496585	367644765	/nfs/dbraw/zinc/64/47/65/367644765.db2.gz	PMICMDIEIDJUTA-UHFFFAOYSA-N	1	0	272.414	1.950	50	0		CDAARO
CC[N@@H+]1CC[C@@H](NS(=O)(=O)Cc2cccc(C)c2)C1	ZINC000359939270	368035546	/nfs/dbraw/zinc/03/55/46/368035546.db2.gz	NRSHWVZUGFFTKA-CQSZACIVSA-N	1	0	282.409	1.509	50	0		CDAARO
O=C(N[C@@H]1CCC[N@@H+](C2CCCCC2)C1)c1cnc[nH]1	ZINC000299771333	284025390	/nfs/dbraw/zinc/02/53/90/284025390.db2.gz	WKBIWDAQXFJBMD-GFCCVEGCSA-N	1	0	276.384	1.937	50	0		CDAARO
Cc1c[nH+]c(C)n1CCNC(=O)Cc1cccc(F)c1	ZINC000575555540	369132181	/nfs/dbraw/zinc/13/21/81/369132181.db2.gz	OXJIKCOEGDYLSQ-UHFFFAOYSA-N	1	0	275.327	1.998	50	0		CDAARO
CCn1nccc1C(=O)NCCn1c(C)c[nH+]c1C	ZINC000575554843	369133367	/nfs/dbraw/zinc/13/33/67/369133367.db2.gz	GUVAOPYQDYZTDR-UHFFFAOYSA-N	1	0	261.329	1.146	50	0		CDAARO
[NH3+]CCCOc1ccc(C(=O)NC[C@H]2CCOC2)cc1	ZINC000299777565	372755009	/nfs/dbraw/zinc/75/50/09/372755009.db2.gz	LHUSZKNQFGKIFA-GFCCVEGCSA-N	1	0	278.352	1.181	50	0		CDAARO
c1cc(C[N@@H+]2CC[C@@H]3OCc4cnnn4[C@H]3C2)cs1	ZINC000299787618	372762390	/nfs/dbraw/zinc/76/23/90/372762390.db2.gz	PSXROAAPEUOARB-STQMWFEESA-N	1	0	276.365	1.685	50	0		CDAARO
Cc1ccc(C[N@@H+]2C[C@@H](CO)[C@H](c3ccccn3)C2)nc1	ZINC000253413785	373723423	/nfs/dbraw/zinc/72/34/23/373723423.db2.gz	VQROFFIGZXANOZ-GOEBONIOSA-N	1	0	283.375	1.993	50	0		CDAARO
CC(C)C[C@H](C[NH3+])NS(=O)(=O)/C=C/c1ccccc1	ZINC000095394510	374065814	/nfs/dbraw/zinc/06/58/14/374065814.db2.gz	NXXZGOJRSZHELE-MYSGNRETSA-N	1	0	282.409	1.950	50	0		CDAARO
COc1cccc(/C=C2\SC(=O)N(CC[NH3+])C2=O)c1	ZINC000012561818	374539129	/nfs/dbraw/zinc/53/91/29/374539129.db2.gz	FSWHESQQOMFRNE-FLIBITNWSA-N	1	0	278.333	1.690	50	0		CDAARO
O=C(c1ccccc1F)N1CCC[N@@H+]([C@@H]2CCOC2)CC1	ZINC000334286713	374780045	/nfs/dbraw/zinc/78/00/45/374780045.db2.gz	CMBBCIUXMXRIEG-CYBMUJFWSA-N	1	0	292.354	1.763	50	0		CDAARO
Cc1cc(C)c2c(ncnc2NC[C@@H]2C[C@H](F)C[NH2+]2)n1	ZINC000095379482	374895050	/nfs/dbraw/zinc/89/50/50/374895050.db2.gz	HXGXTCLQOSCUBC-QWRGUYRKSA-N	1	0	275.331	1.754	50	0		CDAARO
CC(C)[N@@H+]1CC[C@H](Cn2ncn3cccc3c2=O)C1	ZINC000095385978	374898219	/nfs/dbraw/zinc/89/82/19/374898219.db2.gz	IVOSMTSUDGDJDD-LBPRGKRZSA-N	1	0	260.341	1.226	50	0		CDAARO
CC(C)(C)OC[C@@H](O)C[N@@H+]1CCCN(C2CC2)CC1	ZINC000095392523	374899419	/nfs/dbraw/zinc/89/94/19/374899419.db2.gz	UHEJOSRGHOCFLA-AWEZNQCLSA-N	1	0	270.417	1.333	50	0		CDAARO
C[C@H]1C[C@@H]([NH2+]CCCNC(=O)OC(C)(C)C)CN1C	ZINC000095421835	374923995	/nfs/dbraw/zinc/92/39/95/374923995.db2.gz	XUILBISTRDRGNR-NWDGAFQWSA-N	1	0	271.405	1.583	50	0		CDAARO
CS(=O)(=O)[C@H]1CCCC[C@H]1[NH2+]Cc1cccnc1	ZINC000095427025	374927399	/nfs/dbraw/zinc/92/73/99/374927399.db2.gz	LNJMPFOYXYKXKJ-OLZOCXBDSA-N	1	0	268.382	1.527	50	0		CDAARO
C[NH+](C)CCSc1ccc(C(=O)NC2CCCC2)nn1	ZINC000095428504	374928430	/nfs/dbraw/zinc/92/84/30/374928430.db2.gz	HQPPHVVJMNDSDX-UHFFFAOYSA-N	1	0	294.424	1.803	50	0		CDAARO
Cc1cccc([C@@H](C)[N@@H+]2CCCN(S(N)(=O)=O)CC2)c1	ZINC000095405137	374909149	/nfs/dbraw/zinc/90/91/49/374909149.db2.gz	IIBAFHUYOXWBRU-CYBMUJFWSA-N	1	0	297.424	1.267	50	0		CDAARO
COC[C@H]1CCC[N@H+](CC(=O)NCc2ccc(C)cc2)C1	ZINC000056908365	375385888	/nfs/dbraw/zinc/38/58/88/375385888.db2.gz	BNPJFUXRFMRZDB-INIZCTEOSA-N	1	0	290.407	1.970	50	0		CDAARO
COc1ccc(/C=C\C(=O)N2CC[C@H](C[NH3+])C2)cc1F	ZINC000606442018	375823267	/nfs/dbraw/zinc/82/32/67/375823267.db2.gz	ZWOOPBKGYICNGW-KTLBGCOUSA-N	1	0	278.327	1.655	50	0		CDAARO
O=C(N(c1cccnc1)C1CC[NH2+]CC1)C(F)(F)F	ZINC000390822115	375835110	/nfs/dbraw/zinc/83/51/10/375835110.db2.gz	GCINOJZLZAEQSB-UHFFFAOYSA-N	1	0	273.258	1.729	50	0		CDAARO
CC(C)S(=O)(=O)N1CCCC2(CC[NH2+]CC2)CC1	ZINC000067754690	377234452	/nfs/dbraw/zinc/23/44/52/377234452.db2.gz	SFOMXSSKKRXRRX-UHFFFAOYSA-N	1	0	274.430	1.580	50	0		CDAARO
CCc1nc(C)cc(N2CCOC3(CC[NH+](C)CC3)C2)n1	ZINC000645385602	377241103	/nfs/dbraw/zinc/24/11/03/377241103.db2.gz	LNMLHGIQMSKUHT-UHFFFAOYSA-N	1	0	290.411	1.648	50	0		CDAARO
c1ccc(-n2nnnc2-c2cccc3c2CC[NH2+]C3)cc1	ZINC000071753326	379630523	/nfs/dbraw/zinc/63/05/23/379630523.db2.gz	MVSPHRHTNBPNCQ-UHFFFAOYSA-N	1	0	277.331	1.975	50	0		CDAARO
C[N@H+](Cc1ccccc1)C1CN(C(=O)[C@H]2CCCO2)C1	ZINC000288205066	197026703	/nfs/dbraw/zinc/02/67/03/197026703.db2.gz	CUYQKNAQFSUNCI-OAHLLOKOSA-N	1	0	274.364	1.508	50	0		CDAARO
C[C@@H]1C[NH2+]CC[C@H]1NC(=O)c1cc(F)ccc1F	ZINC000094345385	184785112	/nfs/dbraw/zinc/78/51/12/184785112.db2.gz	TXMKFQLMJRWGAD-PRHODGIISA-N	1	0	254.280	1.693	50	0		CDAARO
CC(C)[NH+](C[C@@H](O)CN1C(=O)NC(C)(C)C1=O)C(C)C	ZINC000001268786	169693374	/nfs/dbraw/zinc/69/33/74/169693374.db2.gz	KPHPLRCZTQMMLW-LLVKDONJSA-N	1	0	285.388	1.001	50	0		CDAARO
CCCCCNC(=O)C[N@@H+]1CC[C@@H](CSC)C1	ZINC000096417919	390513020	/nfs/dbraw/zinc/51/30/20/390513020.db2.gz	OPUNODYEASIYGR-GFCCVEGCSA-N	1	0	258.431	1.978	50	0		CDAARO
Cc1ccc([C@H]([NH2+]C(CO)CO)c2cccnc2)cc1C	ZINC000065530869	390551801	/nfs/dbraw/zinc/55/18/01/390551801.db2.gz	BGOOSOYTBDRCFZ-KRWDZBQOSA-N	1	0	286.375	1.731	50	0		CDAARO
Cc1ccc(S(=O)(=O)N[C@@H]2CCC[NH2+][C@H]2C)c(C)c1	ZINC000091496858	390570840	/nfs/dbraw/zinc/57/08/40/390570840.db2.gz	KYZNYRGCPAPKPY-QWHCGFSZSA-N	1	0	282.409	1.722	50	0		CDAARO
Cc1cnc(N2CCCO[C@@H](C[NH+]3CCCCC3)C2)nc1	ZINC000095356213	390910804	/nfs/dbraw/zinc/91/08/04/390910804.db2.gz	LUGPLDCXJIYLRZ-HNNXBMFYSA-N	1	0	290.411	1.866	50	0		CDAARO
Cc1cc(C[NH2+][C@@H](C2CC2)[C@@]2(CO)CCCO2)ccn1	ZINC000527539131	391035299	/nfs/dbraw/zinc/03/52/99/391035299.db2.gz	JFVBYYMACZUXCD-HOTGVXAUSA-N	1	0	276.380	1.800	50	0		CDAARO
CC1(CNC(=O)CSC(F)(F)F)CC[NH2+]CC1	ZINC000181276989	391043798	/nfs/dbraw/zinc/04/37/98/391043798.db2.gz	GLNKMONREPBAIM-UHFFFAOYSA-N	1	0	270.320	1.745	50	0		CDAARO
CC(C)(C)OC(=O)N1CC[C@H]([N@@H+]2CC[C@@H](CCO)C2)C1	ZINC000259868118	391510840	/nfs/dbraw/zinc/51/08/40/391510840.db2.gz	MYACVXPGFGZZNB-STQMWFEESA-N	1	0	284.400	1.700	50	0		CDAARO
CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)Nc1ccc(F)cn1	ZINC000192683636	391762281	/nfs/dbraw/zinc/76/22/81/391762281.db2.gz	SCYRKBZFJJXNIQ-CQSZACIVSA-N	1	0	295.358	1.952	50	0		CDAARO
CN(C)C(=O)c1ccc(N(C)C[C@H]2CCC[N@@H+]2C)nc1	ZINC000420630107	391755794	/nfs/dbraw/zinc/75/57/94/391755794.db2.gz	DJBVFQCRCAWEGF-CYBMUJFWSA-N	1	0	276.384	1.314	50	0		CDAARO
Cc1ccccc1CCC[NH+]1CCN([C@H](C)C(N)=O)CC1	ZINC000089689326	392459587	/nfs/dbraw/zinc/45/95/87/392459587.db2.gz	TZZYBBSJBAUVLG-OAHLLOKOSA-N	1	0	289.423	1.419	50	0		CDAARO
COc1ccc(CC(=O)O[C@@H]2CCC[N@H+](C)C2)cc1	ZINC000000250411	392726541	/nfs/dbraw/zinc/72/65/41/392726541.db2.gz	LQYCBEYRAHDIRD-CQSZACIVSA-N	1	0	263.337	1.875	50	0	biogenic	CDAARO
Cc1ccccc1-n1cc(C(=O)N(C)[C@@H]2CC[NH2+]C2)cn1	ZINC000269145989	132120896	/nfs/dbraw/zinc/12/08/96/132120896.db2.gz	DGHUNQVWJFLJRW-CQSZACIVSA-N	1	0	284.363	1.615	50	0		CDAARO
CO[C@@H]1CCC[C@H]1[NH2+]Cc1cc(=O)n2c(C)cccc2n1	ZINC000451621946	393366604	/nfs/dbraw/zinc/36/66/04/393366604.db2.gz	BGMQVRXYPNPPOV-ZIAGYGMSSA-N	1	0	287.363	1.660	50	0		CDAARO
CN(C)C(=O)CC[NH2+]Cc1ccccc1N1CCOCC1	ZINC000089311954	135058940	/nfs/dbraw/zinc/05/89/40/135058940.db2.gz	XSKCKDZJZDEKRE-UHFFFAOYSA-N	1	0	291.395	1.091	50	0		CDAARO
c1cc(N2CC[NH+](C3CCSCC3)CC2)ncn1	ZINC000091893691	135074286	/nfs/dbraw/zinc/07/42/86/135074286.db2.gz	XMKXYRVBHOKMAZ-UHFFFAOYSA-N	1	0	264.398	1.494	50	0		CDAARO
CC(C)(C)OC(=O)N1CC(O)(C[NH2+]Cc2ccccc2)C1	ZINC000238854054	397600889	/nfs/dbraw/zinc/60/08/89/397600889.db2.gz	MLSHCMOYPVSCEI-UHFFFAOYSA-N	1	0	292.379	1.758	50	0		CDAARO
Cc1cc(C(=O)N2CCOC[C@@H]2C[NH+](C)C)c(C)o1	ZINC000085470083	397611080	/nfs/dbraw/zinc/61/10/80/397611080.db2.gz	MHGIBKAKGZCRRP-LBPRGKRZSA-N	1	0	266.341	1.299	50	0		CDAARO
CCO[C@@H](C)C(=O)NC[C@@H]1[NH2+]CCc2ccccc21	ZINC000262399654	149058227	/nfs/dbraw/zinc/05/82/27/149058227.db2.gz	PJTPLECVZJOYQS-FZMZJTMJSA-N	1	0	262.353	1.415	50	0		CDAARO
COC[C@@H](C)[NH2+]Cc1ccc(OC)c(OC)c1OC	ZINC000004685555	169998507	/nfs/dbraw/zinc/99/85/07/169998507.db2.gz	CTAIAXZIQQOWFD-SNVBAGLBSA-N	1	0	269.341	1.837	50	0		CDAARO
COC[C@@H](C)[NH2+]Cc1cc(OC)c(OC)c(OC)c1	ZINC000004891749	170036775	/nfs/dbraw/zinc/03/67/75/170036775.db2.gz	CKPZKSIJNFEQTD-SNVBAGLBSA-N	1	0	269.341	1.837	50	0		CDAARO
COc1ccc(C[NH+]2CCC(C(N)=O)CC2)cc1C	ZINC000004988839	170050151	/nfs/dbraw/zinc/05/01/51/170050151.db2.gz	MGZXKOOLTQZGIP-UHFFFAOYSA-N	1	0	262.353	1.701	50	0		CDAARO
Cc1ccc(C(=O)CSc2nc(N)cc(N)[nH+]2)cc1	ZINC000005740293	170135894	/nfs/dbraw/zinc/13/58/94/170135894.db2.gz	BABXXQCWMQTFPJ-UHFFFAOYSA-N	1	0	274.349	1.924	50	0		CDAARO
O=C(C1CC[NH+](Cc2ccccc2)CC1)N1CCOCC1	ZINC000006675363	170225223	/nfs/dbraw/zinc/22/52/23/170225223.db2.gz	RPXBDXBQFCDKEM-UHFFFAOYSA-N	1	0	288.391	1.757	50	0		CDAARO
Cc1ccc(CS(=O)(=O)NCCC[NH+](C)C)cc1	ZINC000010111487	170397710	/nfs/dbraw/zinc/39/77/10/170397710.db2.gz	VPZKYKSVKUPGHB-UHFFFAOYSA-N	1	0	270.398	1.366	50	0		CDAARO
[NH3+]C[C@@H]1CN(C(=O)c2c(F)cccc2Cl)CCO1	ZINC000011887391	170452372	/nfs/dbraw/zinc/45/23/72/170452372.db2.gz	IQAAJVJITLDURQ-MRVPVSSYSA-N	1	0	272.707	1.279	50	0		CDAARO
O=C1N(CC2CCC2)CCC[C@@]1(O)C[NH+]1CCSCC1	ZINC000012300235	170474967	/nfs/dbraw/zinc/47/49/67/170474967.db2.gz	VGDIVAQDUAYNMZ-OAHLLOKOSA-N	1	0	298.452	1.189	50	0		CDAARO
C[C@H](CCc1ccc(O)cc1)[NH2+]CCN1CCOCC1	ZINC000019954551	170941041	/nfs/dbraw/zinc/94/10/41/170941041.db2.gz	AVRVBCOFSZRXIV-CQSZACIVSA-N	1	0	278.396	1.635	50	0		CDAARO
[NH3+]CCCCS(=O)(=O)c1ccc(Br)cc1	ZINC000020223514	171086066	/nfs/dbraw/zinc/08/60/66/171086066.db2.gz	DOYOHEDYQBJLBF-UHFFFAOYSA-N	1	0	292.198	1.962	50	0		CDAARO
COC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCC[NH2+]C1	ZINC000022013901	171349353	/nfs/dbraw/zinc/34/93/53/171349353.db2.gz	HKYHGXQKYQHGFW-UWVGGRQHSA-N	1	0	272.345	1.052	50	0		CDAARO
CCNC(=O)C[C@@H]1CCCC[N@@H+]1Cc1cccnc1	ZINC000284881695	196149526	/nfs/dbraw/zinc/14/95/26/196149526.db2.gz	SYUIJHVAGPJPRS-AWEZNQCLSA-N	1	0	261.369	1.962	50	0		CDAARO
Cc1cc(F)ccc1S(=O)(=O)NC[C@H]1CCC[NH2+]C1	ZINC000037376168	173165078	/nfs/dbraw/zinc/16/50/78/173165078.db2.gz	DBDIETHJCNDRKM-NSHDSACASA-N	1	0	286.372	1.412	50	0		CDAARO
CC[C@@H](CO)[NH2+]Cc1cc(OC)c2c(c1)OCCO2	ZINC000037388189	173171913	/nfs/dbraw/zinc/17/19/13/173171913.db2.gz	WUSXKCDTCYEPTO-NSHDSACASA-N	1	0	267.325	1.327	50	0		CDAARO
Cc1ccc(S(=O)(=O)N(C)[C@@H]2CC[NH2+]C2)cc1C	ZINC000037539421	173259822	/nfs/dbraw/zinc/25/98/22/173259822.db2.gz	ITFFFPWOZGTRDY-GFCCVEGCSA-N	1	0	268.382	1.286	50	0		CDAARO
c1ccc(-n2nnnc2SC[C@@H]2CCC[NH2+]C2)cc1	ZINC000043471664	175053614	/nfs/dbraw/zinc/05/36/14/175053614.db2.gz	CMHKZOHTTUQIAA-LLVKDONJSA-N	1	0	275.381	1.754	50	0		CDAARO
Cn1ncc2c1ncnc2N[C@@H]1CC[N@@H+](C2CC2)C1	ZINC000044411823	175172114	/nfs/dbraw/zinc/17/21/14/175172114.db2.gz	LYESEGDDRUNEAG-SECBINFHSA-N	1	0	258.329	1.012	50	0		CDAARO
CCCC(=O)Nc1cccc(C(=O)NC[C@H]2CCC[NH2+]2)c1	ZINC000055183090	175573157	/nfs/dbraw/zinc/57/31/57/175573157.db2.gz	JRKYIKOQSGTJBD-CQSZACIVSA-N	1	0	289.379	1.907	50	0		CDAARO
C[NH+](C)CCNC(=O)C1(c2ccccc2)CCOCC1	ZINC000071376368	176141305	/nfs/dbraw/zinc/14/13/05/176141305.db2.gz	WHSWQKKSNUOYKG-UHFFFAOYSA-N	1	0	276.380	1.413	50	0		CDAARO
[NH3+][C@@H]1CC[C@H](C(=O)Nc2ccc(-n3ccnc3)cc2)C1	ZINC000072411004	176398433	/nfs/dbraw/zinc/39/84/33/176398433.db2.gz	VHGRYRTYHFKAQF-NWDGAFQWSA-N	1	0	270.336	1.938	50	0		CDAARO
O=C(c1ccccn1)N1CCC[C@@](O)(C[NH+]2CCCC2)C1	ZINC000077406624	177264016	/nfs/dbraw/zinc/26/40/16/177264016.db2.gz	MYFSMYUNGLZNDR-MRXNPFEDSA-N	1	0	289.379	1.145	50	0		CDAARO
C[C@@H]1CN(C(=O)[C@@H]2CSc3ccccc32)CC[NH2+]1	ZINC000092239664	274329040	/nfs/dbraw/zinc/32/90/40/274329040.db2.gz	OWPSIYPOLGRTBT-ZYHUDNBSSA-N	1	0	262.378	1.696	50	0		CDAARO
Ic1ccc(N2CC[NH2+]CC2)nc1	ZINC000002526499	274916179	/nfs/dbraw/zinc/91/61/79/274916179.db2.gz	MKKJIJFTSAYHBW-UHFFFAOYSA-N	1	0	289.120	1.096	50	0		CDAARO
CC(C)C[C@@H]1COCCN1C(=O)[C@H]1CC[C@H]([NH3+])C1	ZINC000299739618	275906457	/nfs/dbraw/zinc/90/64/57/275906457.db2.gz	QPQGNNZSVHXJRS-RWMBFGLXSA-N	1	0	254.374	1.387	50	0		CDAARO
CN1CC[N@H+](C)Cc2ccc(NC(=O)c3cc[nH]n3)cc21	ZINC000096495780	277103189	/nfs/dbraw/zinc/10/31/89/277103189.db2.gz	VKSLNIQBXQGOGC-UHFFFAOYSA-N	1	0	285.351	1.544	50	0		CDAARO
C[NH+]1CCN(CCN2CCn3c4ccccc4nc32)CC1	ZINC000020058025	277105819	/nfs/dbraw/zinc/10/58/19/277105819.db2.gz	LGXKAGKITRVDGE-UHFFFAOYSA-N	1	0	285.395	1.104	50	0		CDAARO
C[C@@H]1C[NH2+]CCN1C(=O)[C@@H]1CCOc2ccccc21	ZINC000111188995	278836965	/nfs/dbraw/zinc/83/69/65/278836965.db2.gz	DGIVSORBBMSFHR-DGCLKSJQSA-N	1	0	260.337	1.373	50	0		CDAARO
CCOc1ncccc1NC(=O)NC[C@H]1CCC[N@H+](C)C1	ZINC000108433492	279306744	/nfs/dbraw/zinc/30/67/44/279306744.db2.gz	KVGGMCBSSJRUCN-GFCCVEGCSA-N	1	0	292.383	1.944	50	0		CDAARO
C[C@@H]1C[C@@H](C)C[NH+]([C@@H](C(=O)NC(N)=O)c2ccccc2)C1	ZINC000015377584	288481178	/nfs/dbraw/zinc/48/11/78/288481178.db2.gz	IKYGGGSLPZBIAC-YRGRVCCFSA-N	1	0	289.379	1.901	50	0		CDAARO
CN(C)C(=O)[C@H]1CC[C@H]([NH3+])[C@H](NC(=O)OC(C)(C)C)C1	ZINC000138693248	289026651	/nfs/dbraw/zinc/02/66/51/289026651.db2.gz	JCHIBKSSZNWERE-GARJFASQSA-N	1	0	285.388	1.095	50	0		CDAARO
CCC[C@@H](CNc1cc(OC)nc(N)n1)[NH+](C)C	ZINC000534587719	328316370	/nfs/dbraw/zinc/31/63/70/328316370.db2.gz	BWIYYCDAQYHGSN-VIFPVBQESA-N	1	0	253.350	1.040	50	0		CDAARO
c1[nH][nH]c2ncnc(=NC[C@@H]3CC[N@@H+](C4CCCC4)C3)c1-2	ZINC000534588918	328317015	/nfs/dbraw/zinc/31/70/15/328317015.db2.gz	LIPSNASLCMCIHO-NSHDSACASA-N	1	0	286.383	1.403	50	0		CDAARO
O=C(NC[C@@H]1CC[N@@H+](C2CCCCC2)C1)C1(CO)CC1	ZINC000534634743	328333138	/nfs/dbraw/zinc/33/31/38/328333138.db2.gz	SKUKEGVSEMPVNP-ZDUSSCGKSA-N	1	0	280.412	1.530	50	0		CDAARO
C[NH+](C)CC(C)(C)NC(=O)COC[C@@H]1CCCCO1	ZINC000534639233	328335133	/nfs/dbraw/zinc/33/51/33/328335133.db2.gz	RCDYUCMLEYDAJN-LBPRGKRZSA-N	1	0	272.389	1.029	50	0		CDAARO
O=C(NCc1ccc2c(c1)CCCO2)[C@H]1C=CC[NH2+]1	ZINC000534653651	328338510	/nfs/dbraw/zinc/33/85/10/328338510.db2.gz	VESRVZWBZKEGKH-CYBMUJFWSA-N	1	0	258.321	1.156	50	0		CDAARO
Cc1ncn(C)c1C(=O)NCC1(C[NH+]2CCCC2)CC1	ZINC000534651107	328337497	/nfs/dbraw/zinc/33/74/97/328337497.db2.gz	WFLISNGNKSSUPG-UHFFFAOYSA-N	1	0	276.384	1.334	50	0		CDAARO
CO[C@H]1C[C@H]2CC[C@@H](C1)N2C(=O)C1CC[NH2+]CC1	ZINC000534647871	328343066	/nfs/dbraw/zinc/34/30/66/328343066.db2.gz	QPLUYOIFOUHZEF-ITGUQSILSA-N	1	0	252.358	1.154	50	0		CDAARO
Cc1nc(CCCNC(=O)[C@H]2C=CC[NH2+]2)sc1C	ZINC000534654288	328338830	/nfs/dbraw/zinc/33/88/30/328338830.db2.gz	DPYLUJMUPKRZRR-LLVKDONJSA-N	1	0	265.382	1.337	50	0		CDAARO
CC(C)[C@@H](CNC(=O)CCc1cn[nH]c1)[NH+](C)C	ZINC000534662749	328350549	/nfs/dbraw/zinc/35/05/49/328350549.db2.gz	ZMSDEPQTEZPDLQ-GFCCVEGCSA-N	1	0	252.362	1.045	50	0		CDAARO
[NH3+][C@@H](C(=O)N1CCC[C@H](Cn2ccnn2)C1)c1ccccc1	ZINC000182696353	323296269	/nfs/dbraw/zinc/29/62/69/323296269.db2.gz	KDGHQCXWMSIECM-DZGCQCFKSA-N	1	0	299.378	1.217	50	0		CDAARO
C[C@H](C[C@H]1CCCO1)NC(=O)N1CC[C@@H](C[NH+](C)C)C1	ZINC000195570399	323572611	/nfs/dbraw/zinc/57/26/11/323572611.db2.gz	MDMCCWVAJOFMJF-HZSPNIEDSA-N	1	0	283.416	1.537	50	0		CDAARO
[NH3+][C@H]1CN(C(=O)COCc2ccccc2)C[C@@H]1C1CC1	ZINC000091435210	482566547	/nfs/dbraw/zinc/56/65/47/482566547.db2.gz	SVWCWICWUCWFRE-CABCVRRESA-N	1	0	274.364	1.399	50	0		CDAARO
CC1(C)C[C@@H](O)CC[N@H+](CCCn2cccn2)C1	ZINC000670438497	482981270	/nfs/dbraw/zinc/98/12/70/482981270.db2.gz	VFUWMVVYGIRQQV-ZDUSSCGKSA-N	1	0	251.374	1.756	50	0		CDAARO
Cc1ncn(C)c1C(=O)N1CCC[C@]2(CC[N@H+](C)C2)C1	ZINC000670441093	482985601	/nfs/dbraw/zinc/98/56/01/482985601.db2.gz	VSJGYUUPKSIBNM-OAHLLOKOSA-N	1	0	276.384	1.286	50	0		CDAARO
Cn1c(CO)nnc1C1CC[NH+](C[C@@H]2CC=CCC2)CC1	ZINC000670444963	482994233	/nfs/dbraw/zinc/99/42/33/482994233.db2.gz	CSEYSHDZJGQUBC-CYBMUJFWSA-N	1	0	290.411	1.843	50	0		CDAARO
CN(C)c1nc(CNC(=O)N(C)[C@H]2CC[N@H+](C)C2)cs1	ZINC000670456078	483032718	/nfs/dbraw/zinc/03/27/18/483032718.db2.gz	BAVIFSRLHHNUJA-NSHDSACASA-N	1	0	297.428	1.055	50	0		CDAARO
Cc1cc(C)n(CCCN(C)Cc2nnc(C)o2)n1	ZINC000670455594	483033603	/nfs/dbraw/zinc/03/36/03/483033603.db2.gz	CTBCKFHAIYYZEQ-UHFFFAOYSA-N	1	0	263.345	1.713	50	0		CDAARO
Cc1nc[nH]c1C(=O)NC[C@@H]1CCC[N@H+]1C(C)C	ZINC000670460466	483043911	/nfs/dbraw/zinc/04/39/11/483043911.db2.gz	XJAZPMGBYKHIBR-NSHDSACASA-N	1	0	250.346	1.321	50	0		CDAARO
COc1ccc(O)cc1C[N@@H+]1CC[C@@H](C(C)(C)O)C1	ZINC000670469484	483064505	/nfs/dbraw/zinc/06/45/05/483064505.db2.gz	AASZCPLCUDSUAK-GFCCVEGCSA-N	1	0	265.353	1.994	50	0		CDAARO
CCn1cncc1C[NH2+][C@@H](CC(C)C)C(=O)NC	ZINC000090172092	483210928	/nfs/dbraw/zinc/21/09/28/483210928.db2.gz	WAOWIJNVEKTASE-LBPRGKRZSA-N	1	0	252.362	1.153	50	0		CDAARO
Cc1cccc(C)c1OC[C@@H](O)C[NH2+]C(C)(C)CO	ZINC000026781264	483227775	/nfs/dbraw/zinc/22/77/75/483227775.db2.gz	FDEURGVXBASNCR-ZDUSSCGKSA-N	1	0	267.369	1.404	50	0		CDAARO
Cc1cc([C@H]2CCCN(C(=O)C[N@@H+](C)C3CC3)C2)[nH]n1	ZINC000084110501	483247380	/nfs/dbraw/zinc/24/73/80/483247380.db2.gz	HVMQOUOSZXBSHV-LBPRGKRZSA-N	1	0	276.384	1.518	50	0		CDAARO
C[NH+](C)[C@@H](CNC(=O)C1CC1)c1ccc2c(c1)OCO2	ZINC000012196015	522009292	/nfs/dbraw/zinc/00/92/92/522009292.db2.gz	LUKIKVXDADEBRE-LBPRGKRZSA-N	1	0	276.336	1.544	50	0		CDAARO
CS(=O)(=O)[C@H]1CCCC[C@H]1[NH2+]Cc1ccoc1	ZINC000182555451	525237055	/nfs/dbraw/zinc/23/70/55/525237055.db2.gz	ZCHVZBWYEMJQRL-NEPJUHHUSA-N	1	0	257.355	1.725	50	0		CDAARO
C[NH2+][C@@H]1CCCN(C(=O)COc2ccc(F)cc2F)C1	ZINC000178597396	536356308	/nfs/dbraw/zinc/35/63/08/536356308.db2.gz	MTOBTABQYXPPGM-LLVKDONJSA-N	1	0	284.306	1.554	50	0		CDAARO
Cc1cc(C(=O)N[C@H]2CC[C@H]2[NH3+])cc2sc(N)nc21	ZINC000072163894	567902389	/nfs/dbraw/zinc/90/23/89/567902389.db2.gz	HGADOLWUBNCELK-BDAKNGLRSA-N	1	0	276.365	1.406	50	0		CDAARO
C[C@@H]1C[C@@H](c2ccc(NS(C)(=O)=O)cc2)CC[NH2+]1	ZINC000757211105	577036397	/nfs/dbraw/zinc/03/63/97/577036397.db2.gz	JFOKFYSYWJAASD-PWSUYJOCSA-N	1	0	268.382	1.914	50	0		CDAARO
CC1([NH3+])CN(C(=O)/C=C\c2c(F)cccc2F)C1	ZINC000888096367	617758280	/nfs/dbraw/zinc/75/82/80/617758280.db2.gz	DGIHDAWTMZJTGM-WAYWQWQTSA-N	1	0	252.264	1.538	50	0		CDAARO
Cc1c[nH+]ccc1N1CCC(C(=O)O[C@@H](C)C(N)=O)CC1	ZINC000888097504	617760077	/nfs/dbraw/zinc/76/00/77/617760077.db2.gz	MCUDQAKOWCIDNZ-NSHDSACASA-N	1	0	291.351	1.023	50	0		CDAARO
Cc1ncc(Cl)c(NCC2(O)CC[NH+](C)CC2)n1	ZINC001772707101	1159441342	/nfs/dbraw/zinc/44/13/42/1159441342.db2.gz	SQCVMDGNXPDUIP-UHFFFAOYSA-N	1	0	270.764	1.307	50	0		CDAARO
N[C@H](Cc1ccccc1)c1nnc(NC2CC[NH2+]CC2)o1	ZINC001772707120	1159441347	/nfs/dbraw/zinc/44/13/47/1159441347.db2.gz	PQCUHJPYSRCKBA-CYBMUJFWSA-N	1	0	287.367	1.476	50	0		CDAARO
O=C(N[C@H]1CCC[N@@H+]2CCC[C@@H]12)c1cc(O)ccc1F	ZINC001772709075	1159443219	/nfs/dbraw/zinc/44/32/19/1159443219.db2.gz	MSGLBHCLQWXWEE-KBPBESRZSA-N	1	0	278.327	1.888	50	0		CDAARO
CO[C@@H]1CCC[C@@]12CCC[N@H+](CC(=O)N1CCOCC1)C2	ZINC001704344563	1177695929	/nfs/dbraw/zinc/69/59/29/1177695929.db2.gz	TWOOBPUQICFRCL-ZBFHGGJFSA-N	1	0	296.411	1.126	50	0		CDAARO
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