smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(S(=O)(=O)N[C@H](CCSC)C(=O)[O-])cc1C(=O)[O-]	ZINC000085344800	205167624	/nfs/dbraw/zinc/16/76/24/205167624.db2.gz	BBXVFOIOIFPCBO-SNVBAGLBSA-N	-2	0	363.413	0.878	40	0		FCABRL
Cc1ncc(COP(=O)([O-])[O-])c([C@H]2N[C@H](C(=O)[O-])CS2)c1O	ZINC000013213453	487561522	/nfs/dbraw/zinc/56/15/22/487561522.db2.gz	CXFXHBNEDOKOBZ-XVKPBYJWSA-N	-3	0	350.289	0.493	40	0		FCABRL
COc1cc([N-]S(=O)(=O)c2cc(CC(=O)[O-])ccc2OC)nn1C	ZINC000547822107	490363503	/nfs/dbraw/zinc/36/35/03/490363503.db2.gz	UKTASAKCTUKXEZ-UHFFFAOYSA-N	-2	0	355.372	0.865	40	0		FCABRL
CN(C)c1cccc(S(=O)(=O)N2CC[C@H](C(=O)[O-])[C@H](C(=O)[O-])C2)c1	ZINC000559136447	491455476	/nfs/dbraw/zinc/45/54/76/491455476.db2.gz	QWHVWYCYGSGEFY-QWHCGFSZSA-N	-2	0	356.400	0.549	40	0		FCABRL
Nc1cc(S(=O)(=O)[O-])ccc1-n1n2c3ccc(S(=O)(=O)[O-])cc3n21	ZINC000004235310	204128725	/nfs/dbraw/zinc/12/87/25/204128725.db2.gz	VIXHUCRZLPJRLE-UHFFFAOYSA-N	-2	0	370.368	0.496	40	0		FCABRL
Nc1cc(S(=O)(=O)[O-])ccc1NNc1ccc(S(=O)(=O)[O-])cc1N	ZINC000004235308	204128799	/nfs/dbraw/zinc/12/87/99/204128799.db2.gz	RUYFAOCCPNIMPZ-UHFFFAOYSA-N	-2	0	374.400	0.783	40	0		FCABRL
Nc1cccc(S(=O)(=O)Nc2c(N)nc(SCC(=O)[O-])[n-]c2=O)c1	ZINC000008651775	204337391	/nfs/dbraw/zinc/33/73/91/204337391.db2.gz	ALCOJKJIXBNNQY-UHFFFAOYSA-N	-2	0	371.400	0.324	40	0		FCABRL
CN(C)c1cccc(S(=O)(=O)N2CC[C@@H](C(=O)[O-])[C@H](C(=O)[O-])C2)c1	ZINC000559136445	491455575	/nfs/dbraw/zinc/45/55/75/491455575.db2.gz	QWHVWYCYGSGEFY-CHWSQXEVSA-N	-2	0	356.400	0.549	40	0		FCABRL
Cc1cc(=O)oc2cc(OS(=O)(=O)[O-])c(OS(=O)(=O)[O-])cc12	ZINC000001846413	204020623	/nfs/dbraw/zinc/02/06/23/204020623.db2.gz	SZNQDPUZKFSCNG-UHFFFAOYSA-N	-2	0	352.298	0.465	40	0	in-man	FCABRL
COc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)[O-])cc1C(=O)[O-]	ZINC000085344798	205167075	/nfs/dbraw/zinc/16/70/75/205167075.db2.gz	BBXVFOIOIFPCBO-JTQLQIEISA-N	-2	0	363.413	0.878	40	0		FCABRL
CN(C)c1cccc(S(=O)(=O)N2CC[C@@H](C(=O)[O-])[C@@H](C(=O)[O-])C2)c1	ZINC000559136446	491455406	/nfs/dbraw/zinc/45/54/06/491455406.db2.gz	QWHVWYCYGSGEFY-OLZOCXBDSA-N	-2	0	356.400	0.549	40	0		FCABRL
O=C([O-])CSc1nc(SCC(=O)[O-])nc(SCC(=O)[O-])n1	ZINC000004896006	204173774	/nfs/dbraw/zinc/17/37/74/204173774.db2.gz	VXNGOCHAONEDDA-UHFFFAOYSA-N	-3	0	351.387	0.402	40	0		FCABRL
CC12C=C(Cl)C(Cl)([C@H](C(=O)[O-])[C@H]1C(=O)[O-])[C@H](C(=O)[O-])[C@@H]2C(=O)[O-]	ZINC000004611551	206179844	/nfs/dbraw/zinc/17/98/44/206179844.db2.gz	GAUWFYWDNGIVSY-SJCWSRECSA-N	-4	0	367.137	0.923	40	0		FCABRL
COC(=O)[C@H]1CS[C@@H](c2c(COP(=O)([O-])[O-])cnc(C)c2O)N1	ZINC000001608321	204014083	/nfs/dbraw/zinc/01/40/83/204014083.db2.gz	OTJUDGXSYPMNAZ-KCJUWKMLSA-N	-2	0	364.316	0.582	40	0		FCABRL
CC1(C)S[C@@H]([C@H](NC(=O)Cc2ccccc2)C(=O)[O-])N[C@H]1C(=O)[O-]	ZINC000004576926	204148693	/nfs/dbraw/zinc/14/86/93/204148693.db2.gz	HCYWNSXLUZRKJX-AVGNSLFASA-N	-2	0	352.412	0.693	40	0	in-man	FCABRL
Nc1ccccc1S(=O)(=O)Nc1c(N)nc(SCC(=O)[O-])[n-]c1=O	ZINC000008651779	204337539	/nfs/dbraw/zinc/33/75/39/204337539.db2.gz	AJJBCHXNAORZDI-UHFFFAOYSA-N	-2	0	371.400	0.324	40	0		FCABRL
Cc1ccc2nc(NC(=O)C(=O)c3c([O-])[nH]c(=S)[nH]c3=O)sc2c1	ZINC000102936785	222314981	/nfs/dbraw/zinc/31/49/81/222314981.db2.gz	IFYDAMWOEKJLSE-UHFFFAOYSA-N	-2	0	362.392	0.259	40	0		FCABRL
NS(=O)(=O)c1ccccc1[N-]S(=O)(=O)c1ccccc1C(=O)[O-]	ZINC000019418227	487604636	/nfs/dbraw/zinc/60/46/36/487604636.db2.gz	JUXRPKFXRPQGLP-UHFFFAOYSA-N	-2	0	356.381	0.833	40	0		FCABRL
C[C@]12C=C(Cl)[C@](Cl)([C@@H](C(=O)[O-])[C@@H]1C(=O)[O-])[C@H](C(=O)[O-])[C@@H]2C(=O)[O-]	ZINC000253476385	206584887	/nfs/dbraw/zinc/58/48/87/206584887.db2.gz	GAUWFYWDNGIVSY-BDTHUAPASA-N	-4	0	367.137	0.923	40	0		FCABRL
COc1nn(C)cc1[N-]S(=O)(=O)c1cc(CC(=O)[O-])ccc1OC	ZINC000473483177	250232354	/nfs/dbraw/zinc/23/23/54/250232354.db2.gz	STGOVVYVDGOWPX-UHFFFAOYSA-N	-2	0	355.372	0.865	40	0		FCABRL
Nc1nc(SCC(=O)[O-])[n-]c(=O)c1NS(=O)(=O)c1ccccc1	ZINC000008651773	207240378	/nfs/dbraw/zinc/24/03/78/207240378.db2.gz	DUQPYKCQCXTGJC-UHFFFAOYSA-N	-2	0	356.385	0.742	40	0		FCABRL
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-]	ZINC000001579830	487470142	/nfs/dbraw/zinc/47/01/42/487470142.db2.gz	JMDKBDALNFZTOV-PWSUYJOCSA-N	-2	0	352.343	0.736	40	0		FCABRL
CP(=O)([O-])N(CCN(P(C)(=O)[O-])[P@](C)(=O)[O-])P(C)(=O)[O-]	ZINC000005360303	487487764	/nfs/dbraw/zinc/48/77/64/487487764.db2.gz	GYGFHOKBIHKDDB-UHFFFAOYSA-N	-4	0	372.128	0.851	40	0		FCABRL
C[C@]12C=C(Cl)[C@](Cl)([C@H](C(=O)[O-])[C@H]1C(=O)[O-])[C@H](C(=O)[O-])[C@@H]2C(=O)[O-]	ZINC000253476386	488520554	/nfs/dbraw/zinc/52/05/54/488520554.db2.gz	GAUWFYWDNGIVSY-HLTNJDAKSA-N	-4	0	367.137	0.923	40	0		FCABRL
CC(=O)Nc1ccc(N)c2cc(S(=O)(=O)[O-])c(S(=O)(=O)[O-])cc12	ZINC000001683646	487470153	/nfs/dbraw/zinc/47/01/53/487470153.db2.gz	PVMWPQFIVZFAQA-UHFFFAOYSA-N	-2	0	360.369	0.874	40	0		FCABRL
CCOC(=O)C1=C(N)Oc2[n-]c([O-])nc(=O)c2[C@@H]1c1cccc(Cl)c1	ZINC000003073399	487470481	/nfs/dbraw/zinc/47/04/81/487470481.db2.gz	GXYTZAJHKXHSSX-SECBINFHSA-N	-2	0	363.757	0.974	40	0		FCABRL
CCOc1cc(/C=C2/NC(=O)N(CC(=O)[O-])C2=O)ccc1OCC(=O)[O-]	ZINC000408589697	528194290	/nfs/dbraw/zinc/19/42/90/528194290.db2.gz	FOPIBFMZBQTBMA-BJMVGYQFSA-N	-2	0	364.310	0.526	40	0		FCABRL
CC12C=C(Cl)C(Cl)([C@@H](C(=O)[O-])[C@H]1C(=O)[O-])[C@H](C(=O)[O-])[C@@H]2C(=O)[O-]	ZINC000004611552	487480840	/nfs/dbraw/zinc/48/08/40/487480840.db2.gz	GAUWFYWDNGIVSY-AZLILRRJSA-N	-4	0	367.137	0.923	40	0		FCABRL
Cc1ncc(COP(=O)([O-])[O-])c([C@H]2N[C@@H](C(=O)[O-])CS2)c1O	ZINC000013213457	487561650	/nfs/dbraw/zinc/56/16/50/487561650.db2.gz	CXFXHBNEDOKOBZ-XCBNKYQSSA-N	-3	0	350.289	0.493	40	0		FCABRL
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CCC(=O)[O-])C(=O)[O-]	ZINC000001579831	209489395	/nfs/dbraw/zinc/48/93/95/209489395.db2.gz	JMDKBDALNFZTOV-CMPLNLGQSA-N	-2	0	352.343	0.736	40	0		FCABRL
O=C([O-])c1nc2cn1/C=C\C=N/CC1=CN3C=CC=N[C@]3(C(=O)[O-])N1C2	ZINC000104202782	209259407	/nfs/dbraw/zinc/25/94/07/209259407.db2.gz	FNQNTCHQOZUQHN-IDLBFEJNSA-N	-2	0	354.326	0.432	40	0		FCABRL
CC12C=C(Cl)C(Cl)([C@@H](C(=O)[O-])[C@@H]1C(=O)[O-])[C@H](C(=O)[O-])[C@@H]2C(=O)[O-]	ZINC000004611550	487480301	/nfs/dbraw/zinc/48/03/01/487480301.db2.gz	GAUWFYWDNGIVSY-KXYWAAIRSA-N	-4	0	367.137	0.923	40	0		FCABRL
CC12C=C(Cl)C(Cl)([C@H](C(=O)[O-])[C@@H]1C(=O)[O-])[C@H](C(=O)[O-])[C@@H]2C(=O)[O-]	ZINC000004611549	207032886	/nfs/dbraw/zinc/03/28/86/207032886.db2.gz	GAUWFYWDNGIVSY-AHJUADSSSA-N	-4	0	367.137	0.923	40	0		FCABRL
O=S(=O)([O-])c1ccc2cc(S(=O)(=O)[O-])c(S(=O)(=O)[O-])cc2c1	ZINC000033359462	208088532	/nfs/dbraw/zinc/08/85/32/208088532.db2.gz	FAMAGPXMXMUBMH-UHFFFAOYSA-N	-3	0	368.366	0.580	40	0		FCABRL
Cn1ncc([N-]S(=O)(=O)c2cc(C(F)(F)F)nn2C)c1C(=O)[O-]	ZINC000530136859	490890347	/nfs/dbraw/zinc/89/03/47/490890347.db2.gz	IVIFEZIKXQRELQ-UHFFFAOYSA-N	-2	0	353.282	0.671	40	0		FCABRL
CN(CC(=O)[O-])C(=O)NC[C@@H]1CCC[C@@H](CNC(=O)N(C)CC(=O)[O-])C1	ZINC000005525236	207103422	/nfs/dbraw/zinc/10/34/22/207103422.db2.gz	QTGHXCHFZAVOEG-VXGBXAGGSA-N	-2	0	372.422	0.245	40	0		FCABRL
O=C([O-])[C@H]1[C@H](c2ccco2)N[C@@H](c2ccco2)[C@@H](C(=O)[O-])S1(=O)=O	ZINC000575410714	491553127	/nfs/dbraw/zinc/55/31/27/491553127.db2.gz	CGTSLBOEZHNBPN-FIQHERPVSA-N	-2	0	355.324	0.579	40	0		FCABRL
CC(=O)c1cc(C)c(O)c(C[C@@](C)(NC(=O)C=CC(=O)[O-])C(=O)[O-])c1O	ZINC001772591619	1178872557	/nfs/dbraw/zinc/87/25/57/1178872557.db2.gz	IMVQDBHLAYMWLK-LAQIPUCWSA-N	-2	0	365.338	0.752	40	0		FCABRL
CC1(C)S[C@@H]([C@H](NC(=O)COc2ccccc2)C(=O)[O-])N[C@H]1C(=O)[O-]	ZINC000065748377	221236014	/nfs/dbraw/zinc/23/60/14/221236014.db2.gz	FJTUHYOOCYRLJI-AVGNSLFASA-N	-2	0	368.411	0.529	40	0	in-vitro	FCABRL
O=C([O-])CSC(=S)N1CCN(C(=S)SCC(=O)[O-])CC1	ZINC000001686711	210365111	/nfs/dbraw/zinc/36/51/11/210365111.db2.gz	DWMIVTUQXUDODL-UHFFFAOYSA-N	-2	0	354.500	0.809	40	0	in-vivo	FCABRL
C[C@]12C=C(Cl)[C@](Cl)([C@@H](C(=O)[O-])[C@H]1C(=O)[O-])[C@H](C(=O)[O-])[C@@H]2C(=O)[O-]	ZINC000253476387	488520536	/nfs/dbraw/zinc/52/05/36/488520536.db2.gz	GAUWFYWDNGIVSY-UTNUPKOHSA-N	-4	0	367.137	0.923	40	0		FCABRL
Cc1ncc(COP(=O)([O-])[O-])c([C@@H]2N[C@@H](C(=O)[O-])CS2)c1O	ZINC000013213455	211028962	/nfs/dbraw/zinc/02/89/62/211028962.db2.gz	CXFXHBNEDOKOBZ-GMSGAONNSA-N	-3	0	350.289	0.493	40	0		FCABRL
O=C([N-]c1[nH][n-]c(=S)[nH+]1)C(=O)C1=S([O-])c2ccccc2NC1=O	ZINC000017214754	211182786	/nfs/dbraw/zinc/18/27/86/211182786.db2.gz	HKGYJZNTRDWZLP-JRSYYBBYSA-N	-2	0	351.369	0.103	40	0		FCABRL
NS(=O)(=O)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2F)cc1	ZINC000223369232	488448562	/nfs/dbraw/zinc/44/85/62/488448562.db2.gz	NKMBNRKUBPFLNA-UHFFFAOYSA-N	-2	0	374.371	0.972	40	0		FCABRL
O=C([O-])[C@@H]1[C@@H](c2ccco2)N[C@@H](c2ccco2)[C@@H](C(=O)[O-])S1(=O)=O	ZINC000575410715	491553017	/nfs/dbraw/zinc/55/30/17/491553017.db2.gz	CGTSLBOEZHNBPN-USZNOCQGSA-N	-2	0	355.324	0.579	40	0		FCABRL
CC1(C)S[C@@H]([C@H](NC(=O)COc2ccccc2)C(=O)[O-])N[C@@H]1C(=O)[O-]	ZINC000065748378	221236256	/nfs/dbraw/zinc/23/62/56/221236256.db2.gz	FJTUHYOOCYRLJI-XQQFMLRXSA-N	-2	0	368.411	0.529	40	0	in-vitro	FCABRL
O=C([N-]c1[nH][n-]c(=S)[nH+]1)C(=O)C1=S([O-])c2ccccc2NC1=O	ZINC000017214760	211183597	/nfs/dbraw/zinc/18/35/97/211183597.db2.gz	HKGYJZNTRDWZLP-OTHYDSGKSA-N	-2	0	351.369	0.103	40	0		FCABRL
O=C([O-])[C@@H]1[C@H](c2ccco2)N[C@@H](c2ccco2)[C@@H](C(=O)[O-])S1(=O)=O	ZINC000575410712	491553096	/nfs/dbraw/zinc/55/30/96/491553096.db2.gz	CGTSLBOEZHNBPN-BJDJZHNGSA-N	-2	0	355.324	0.579	40	0		FCABRL
O=C([N-]c1[nH][n-]c(=S)[nH+]1)C(=O)C1=S([O-])c2ccccc2NC1=O	ZINC000017214757	211182871	/nfs/dbraw/zinc/18/28/71/211182871.db2.gz	HKGYJZNTRDWZLP-FHOATMSYSA-N	-2	0	351.369	0.103	40	0		FCABRL
COC(=O)[C@H]1CS[C@H](c2c(COP(=O)([O-])[O-])cnc(C)c2O)N1	ZINC000001608322	210362035	/nfs/dbraw/zinc/36/20/35/210362035.db2.gz	OTJUDGXSYPMNAZ-LDYMZIIASA-N	-2	0	364.316	0.582	40	0		FCABRL
CC(C)(NC(=O)NCCCCCCNC(=O)NC(C)(C)C(=O)[O-])C(=O)[O-]	ZINC000005379446	487488234	/nfs/dbraw/zinc/48/82/34/487488234.db2.gz	FCFVOOOPORUSLU-UHFFFAOYSA-N	-2	0	374.438	0.872	40	0		FCABRL
CN(CC(=O)[O-])C(=O)NC[C@@H]1CCC[C@H](CNC(=O)N(C)CC(=O)[O-])C1	ZINC000005525233	487489189	/nfs/dbraw/zinc/48/91/89/487489189.db2.gz	QTGHXCHFZAVOEG-TXEJJXNPSA-N	-2	0	372.422	0.245	40	0		FCABRL
O=C([O-])c1sc(C(=O)[O-])c2c1OCCOCCOCCOCCO2	ZINC000196479209	488438372	/nfs/dbraw/zinc/43/83/72/488438372.db2.gz	SOQZVVZPRLATHO-UHFFFAOYSA-N	-2	0	362.356	0.966	40	0		FCABRL
COC(=O)[C@@H]1CS[C@@H](c2c(COP(=O)([O-])[O-])cnc(C)c2O)N1	ZINC000001608323	487470122	/nfs/dbraw/zinc/47/01/22/487470122.db2.gz	OTJUDGXSYPMNAZ-KWQFWETISA-N	-2	0	364.316	0.582	40	0		FCABRL
O=C([O-])c1nc2cn1/C=C\C=N\CC1=CN3C=CC=N[C@]3(C(=O)[O-])N1C2	ZINC000005386084	487488218	/nfs/dbraw/zinc/48/82/18/487488218.db2.gz	FNQNTCHQOZUQHN-CVPPPEJMSA-N	-2	0	354.326	0.432	40	0		FCABRL
CN(CC(=O)[O-])C(=O)NC[C@H]1CCC[C@H](CNC(=O)N(C)CC(=O)[O-])C1	ZINC000005525238	487489748	/nfs/dbraw/zinc/48/97/48/487489748.db2.gz	QTGHXCHFZAVOEG-RYUDHWBXSA-N	-2	0	372.422	0.245	40	0		FCABRL
CC1(C)S[C@@H]([C@H](NC(=O)Cc2ccccc2)C(=O)[O-])N[C@@H]1C(=O)[O-]	ZINC000004576929	219587604	/nfs/dbraw/zinc/58/76/04/219587604.db2.gz	HCYWNSXLUZRKJX-XQQFMLRXSA-N	-2	0	352.412	0.693	40	0	in-man	FCABRL
O=C([O-])c1nc2cn1/C=C\C=N/CC1=CN3C=CC=N[C@]3(C(=O)[O-])N1C2	ZINC000017108621	220205871	/nfs/dbraw/zinc/20/58/71/220205871.db2.gz	FNQNTCHQOZUQHN-AWIJTZISSA-N	-2	0	354.326	0.432	40	0		FCABRL
Cc1ncc(COP(=O)([O-])[O-])c([C@@H]2N[C@H](C(=O)[O-])CS2)c1O	ZINC000013213450	220060953	/nfs/dbraw/zinc/06/09/53/220060953.db2.gz	CXFXHBNEDOKOBZ-OIBJUYFYSA-N	-3	0	350.289	0.493	40	0		FCABRL
O=C([O-])[C@](O)(C(=O)c1ccccc1)[C@](O)(C(=O)[O-])C(=O)c1ccccc1	ZINC000021298267	220356709	/nfs/dbraw/zinc/35/67/09/220356709.db2.gz	OCQAXYHNMWVLRH-QZTJIDSGSA-N	-2	0	358.302	0.384	40	0		FCABRL
COc1cc(/C=C2/NC(=O)N(CC(=O)[O-])C2=O)ccc1OCC(=O)[O-]	ZINC000408588579	533471619	/nfs/dbraw/zinc/47/16/19/533471619.db2.gz	BXTWWAQQVLHOSY-RUDMXATFSA-N	-2	0	350.283	0.136	40	0		FCABRL
C[C@@](CC(=O)[O-])(NC(=O)OCC1=c2ccccc2=C2CC=CC=C12)C(=O)[O-]	ZINC000584577615	491708183	/nfs/dbraw/zinc/70/81/83/491708183.db2.gz	SULYETVKCLOQCB-FQEVSTJZSA-N	-2	0	369.373	0.932	40	0		FCABRL
COC(=O)[C@@H]1CS[C@H](c2c(COP(=O)([O-])[O-])cnc(C)c2O)N1	ZINC000001608324	487470093	/nfs/dbraw/zinc/47/00/93/487470093.db2.gz	OTJUDGXSYPMNAZ-GZMMTYOYSA-N	-2	0	364.316	0.582	40	0		FCABRL
O=C([N-]c1[nH][n-]c(=S)[nH+]1)C(=O)C1=S([O-])c2ccccc2NC1=O	ZINC000016958038	220199152	/nfs/dbraw/zinc/19/91/52/220199152.db2.gz	HKGYJZNTRDWZLP-MEFFNOMFSA-N	-2	0	351.369	0.103	40	0		FCABRL
CC(=O)c1cc(C)c(O)c(C[C@](C)(NC(=O)C=CC(=O)[O-])C(=O)[O-])c1O	ZINC001772591618	1178872203	/nfs/dbraw/zinc/87/22/03/1178872203.db2.gz	IMVQDBHLAYMWLK-BDUNBXCCSA-N	-2	0	365.338	0.752	40	0		FCABRL
CC(C)(C)OC(=O)NCCCC[C@@H](C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-]	ZINC000065734872	221236027	/nfs/dbraw/zinc/23/60/27/221236027.db2.gz	KLJVHTFKVKHTIN-JTQLQIEISA-N	-3	0	362.379	0.606	40	0	in-vitro	FCABRL
O=C([O-])[C@H]1[C@@H](c2ccco2)N[C@@H](c2ccco2)[C@@H](C(=O)[O-])S1(=O)=O	ZINC000575410713	491553115	/nfs/dbraw/zinc/55/31/15/491553115.db2.gz	CGTSLBOEZHNBPN-BKUVIOGVSA-N	-2	0	355.324	0.579	40	0		FCABRL
C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](CCC(=O)[O-])C(=O)[O-]	ZINC000001579832	487470036	/nfs/dbraw/zinc/47/00/36/487470036.db2.gz	JMDKBDALNFZTOV-ZYHUDNBSSA-N	-2	0	352.343	0.736	40	0		FCABRL
CCOC(=O)C1=C(N)Oc2[n-]c([O-])nc(=O)c2[C@H]1c1cccc(Cl)c1	ZINC000003073398	487470438	/nfs/dbraw/zinc/47/04/38/487470438.db2.gz	GXYTZAJHKXHSSX-VIFPVBQESA-N	-2	0	363.757	0.974	40	0		FCABRL
CN(C)c1cccc(S(=O)(=O)N2CC[C@H](C(=O)[O-])[C@@H](C(=O)[O-])C2)c1	ZINC000559136448	491455561	/nfs/dbraw/zinc/45/55/61/491455561.db2.gz	QWHVWYCYGSGEFY-STQMWFEESA-N	-2	0	356.400	0.549	40	0		FCABRL