smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])CCCc1ccc(NS(=O)(=O)c2cccc3nsnc32)cc1	ZINC000534686689	564994226	/nfs/dbraw/zinc/99/42/26/564994226.db2.gz	BAKHPEGYRJKXJN-UHFFFAOYSA-N	-1	2	377.447	2.899	20	10		GFCDLM
O=C([O-])N1CCc2cc(NS(=O)(=O)c3cccc4nsnc43)ccc21	ZINC000740529173	602246639	/nfs/dbraw/zinc/24/66/39/602246639.db2.gz	JNDOZLDBXQCYPH-UHFFFAOYSA-N	-1	2	376.419	2.533	20	10		GFCDLM
Cc1oc(C)c(S(=O)(=O)Nc2nc(-c3ccccn3)cs2)c1C(=O)[O-]	ZINC000738969728	600052047	/nfs/dbraw/zinc/05/20/47/600052047.db2.gz	PUHLZTCFPWUOBZ-UHFFFAOYSA-N	-1	2	379.419	2.914	20	10		GFCDLM
C[N@H+](Cc1cccc(Br)c1O)[C@H]1CCCC[C@H]1S(C)(=O)=O	ZINC000245760024	655428579	/nfs/dbraw/zinc/42/85/79/655428579.db2.gz	PNVDNEZOXGOKCO-UONOGXRCSA-N	-1	2	376.316	2.942	20	10		GFCDLM
O=C([O-])c1cc(S(=O)(=O)Nc2nc(-c3cccnc3)cs2)c(F)cc1F	ZINC000740090113	600423521	/nfs/dbraw/zinc/42/35/21/600423521.db2.gz	SGSXWFRXHKWHEB-UHFFFAOYSA-N	-1	2	397.384	2.982	20	10		GFCDLM
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)Nc1cc(Cl)c(O)cc1F	ZINC000808115912	659878255	/nfs/dbraw/zinc/87/82/55/659878255.db2.gz	YRACVAWJEWVAJO-UHFFFAOYSA-N	-1	2	389.788	2.621	20	10		GFCDLM
O=C([O-])c1cc(NS(=O)(=O)c2ccc(Br)s2)ccc1O	ZINC000037373673	654614638	/nfs/dbraw/zinc/61/46/38/654614638.db2.gz	SRJCZPYCHNCDSD-UHFFFAOYSA-N	-1	2	378.225	2.715	20	10		GFCDLM
C[C@@H](Sc1ccc(NS(=O)(=O)c2cccc3nonc32)cc1)C(=O)[O-]	ZINC000794766276	658610536	/nfs/dbraw/zinc/61/05/36/658610536.db2.gz	DNMKUVUNAMFNNP-SECBINFHSA-N	-1	2	379.419	2.589	20	10		GFCDLM
COc1cc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)c(Cl)c2F)ccc1O	ZINC000797820000	659054626	/nfs/dbraw/zinc/05/46/26/659054626.db2.gz	AQSZYHULGPIXPY-UHFFFAOYSA-N	-1	2	393.751	2.831	20	10		GFCDLM
Cc1sc(NS(=O)(=O)c2cnn(CC(=O)[O-])c2)nc1-c1ccc(C)cc1	ZINC000832907913	600976959	/nfs/dbraw/zinc/97/69/59/600976959.db2.gz	BOGPFZWOQAUIEM-UHFFFAOYSA-N	-1	2	392.462	2.509	20	10		GFCDLM
COC(=O)c1cncc(S(=O)(=O)Nc2cc(Cl)c([O-])c(Cl)c2)c1	ZINC000788492874	657730333	/nfs/dbraw/zinc/73/03/33/657730333.db2.gz	MCMIHXUBDYFFSS-UHFFFAOYSA-N	-1	2	377.205	2.681	20	10		GFCDLM
O=C([O-])N1CCCc2cc(NS(=O)(=O)c3cccc4nsnc43)ccc21	ZINC000740524157	602647031	/nfs/dbraw/zinc/64/70/31/602647031.db2.gz	PHSAMPSPTZNCLX-UHFFFAOYSA-N	-1	2	390.446	2.923	20	10		GFCDLM
COC(=O)c1cc(S(=O)(=O)Nc2cc(Cl)c([O-])c(Cl)c2)cnc1C	ZINC000793416090	658394535	/nfs/dbraw/zinc/39/45/35/658394535.db2.gz	PQBPOWVKRIUSBL-UHFFFAOYSA-N	-1	2	391.232	2.990	20	10		GFCDLM
COc1cc(Br)cc(C[N@H+]2CCOC[C@H]2[C@H]2CCCC2=O)c1O	ZINC000365152089	563775509	/nfs/dbraw/zinc/77/55/09/563775509.db2.gz	NPQNXLOHJIXGJD-KGLIPLIRSA-N	-1	2	384.270	2.733	20	10		GFCDLM
CN(Cc1ccc(NS(=O)(=O)c2cccc3nsnc32)cc1)C(=O)[O-]	ZINC000737485923	600299882	/nfs/dbraw/zinc/29/98/82/600299882.db2.gz	LQYSPXUXMYBVKT-UHFFFAOYSA-N	-1	2	378.435	2.602	20	10		GFCDLM
O=C([O-])Cn1cc(S(=O)(=O)Nc2nc(-c3ccccc3Cl)cs2)cn1	ZINC000833273636	600975291	/nfs/dbraw/zinc/97/52/91/600975291.db2.gz	ABMNHIYIGBKSNH-UHFFFAOYSA-N	-1	2	398.853	2.545	20	10		GFCDLM
Cc1cc(C(=O)[O-])c(O)c(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)c1	ZINC000808114282	659877646	/nfs/dbraw/zinc/87/76/46/659877646.db2.gz	VGMCMYKWKMIUDI-UHFFFAOYSA-N	-1	2	375.761	2.698	20	10		GFCDLM
COc1ccccc1S(=O)(=O)Nc1nc(-c2c[nH]c(C(=O)[O-])c2)cs1	ZINC000738142808	600055000	/nfs/dbraw/zinc/05/50/00/600055000.db2.gz	JZWPCWWTWZVSJB-UHFFFAOYSA-N	-1	2	379.419	2.646	20	10		GFCDLM
C[C@H](Sc1ccc(NS(=O)(=O)c2cccc3nonc32)cc1)C(=O)[O-]	ZINC000794766277	658610265	/nfs/dbraw/zinc/61/02/65/658610265.db2.gz	DNMKUVUNAMFNNP-VIFPVBQESA-N	-1	2	379.419	2.589	20	10		GFCDLM
CCn1cc(S(=O)(=O)Nc2nc(-c3ccc(C(=O)[O-])cc3)cs2)cn1	ZINC000737302353	600051349	/nfs/dbraw/zinc/05/13/49/600051349.db2.gz	DWQBXYPZHHJAIN-UHFFFAOYSA-N	-1	2	378.435	2.526	20	10		GFCDLM
O=C([O-])c1cc(-c2csc(NS(=O)(=O)c3cc(F)ccc3F)n2)c[nH]1	ZINC000740068503	600055138	/nfs/dbraw/zinc/05/51/38/600055138.db2.gz	ITSSCGQYCJWFFO-UHFFFAOYSA-N	-1	2	385.373	2.915	20	10		GFCDLM
Cc1ccccc1-c1csc(NS(=O)(=O)c2cc(C(=O)[O-])n(C)c2)n1	ZINC000832973769	600828160	/nfs/dbraw/zinc/82/81/60/600828160.db2.gz	CKZBSKGQYUYNAU-UHFFFAOYSA-N	-1	2	377.447	2.956	20	10		GFCDLM
O=C([O-])c1cc(S(=O)(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c[nH]1	ZINC000833306157	600975341	/nfs/dbraw/zinc/97/53/41/600975341.db2.gz	HZMVTFVZPXVUMO-UHFFFAOYSA-N	-1	2	394.390	2.545	20	10		GFCDLM
O=C([O-])c1cc(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)ccc1[N+](=O)[O-]	ZINC000808115043	659878061	/nfs/dbraw/zinc/87/80/61/659878061.db2.gz	MIQHDUMXJHNVSW-UHFFFAOYSA-N	-1	2	390.732	2.592	20	10		GFCDLM
O=C([O-])c1nscc1S(=O)(=O)Nc1nc2c(s1)COc1ccccc1-2	ZINC000833346300	601767737	/nfs/dbraw/zinc/76/77/37/601767737.db2.gz	NAVXIBZZJLKEJG-UHFFFAOYSA-N	-1	2	395.443	2.658	20	10		GFCDLM
CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](c1c[nH+]cn1C)N(C)C	ZINC000281118612	563367142	/nfs/dbraw/zinc/36/71/42/563367142.db2.gz	XJQPPKXBTDOLQW-INIZCTEOSA-N	-1	2	395.301	2.540	20	10		GFCDLM
CC(=O)c1cccc(S(=O)(=O)Nc2nc(-c3c[nH]c(C(=O)[O-])c3)cs2)c1	ZINC000736197343	600054840	/nfs/dbraw/zinc/05/48/40/600054840.db2.gz	XJVSNDMCWDVXJB-UHFFFAOYSA-N	-1	2	391.430	2.840	20	10		GFCDLM
CC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3c[nH]c(C(=O)[O-])c3)cs2)cc1	ZINC000736195836	600054894	/nfs/dbraw/zinc/05/48/94/600054894.db2.gz	IPICBMPZFSPZAO-UHFFFAOYSA-N	-1	2	391.430	2.840	20	10		GFCDLM
Cn1cc(-c2csc(NS(=O)(=O)c3cc(Cl)cc(C(=O)[O-])c3)n2)cn1	ZINC000833041398	600984775	/nfs/dbraw/zinc/98/47/75/600984775.db2.gz	SDHTXJUWDKQSCY-UHFFFAOYSA-N	-1	2	398.853	2.696	20	10		GFCDLM
O=C([O-])c1nscc1S(=O)(=O)Nc1nc2c(s1)CCc1ccccc1-2	ZINC000833346268	601767730	/nfs/dbraw/zinc/76/77/30/601767730.db2.gz	MTNGMJUWDFIELK-UHFFFAOYSA-N	-1	2	393.471	2.864	20	10		GFCDLM
CC[N@H+](Cc1cc(Br)ccc1O)Cc1nc2c(cnn2C)c(=O)[nH]1	ZINC000744427151	655740072	/nfs/dbraw/zinc/74/00/72/655740072.db2.gz	ZZGKYRMMIBTAEU-UHFFFAOYSA-N	-1	2	392.257	2.559	20	10		GFCDLM
O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cc(Cl)c([O-])cc2F)c([N+](=O)[O-])c1	ZINC000808115500	659878096	/nfs/dbraw/zinc/87/80/96/659878096.db2.gz	GXWHVBQEGOFDKV-UHFFFAOYSA-N	-1	2	391.720	2.802	20	10		GFCDLM
CS(=O)(=O)CC[C@H]1CCCC[N@@H+]1Cc1c(O)cccc1Br	ZINC000862374395	662283748	/nfs/dbraw/zinc/28/37/48/662283748.db2.gz	LGMQVMUOCBRODB-GFCCVEGCSA-N	-1	2	376.316	2.944	20	10		GFCDLM
C[C@H](Cc1ccc(NS(=O)(=O)c2cccc3nsnc32)cc1)C(=O)[O-]	ZINC000544645654	564391413	/nfs/dbraw/zinc/39/14/13/564391413.db2.gz	SHKWREQFRNWBBW-SNVBAGLBSA-N	-1	2	377.447	2.755	20	10		GFCDLM
O=C([O-])c1cc(-c2csc(NS(=O)(=O)c3cccnc3Cl)n2)c[nH]1	ZINC000740068875	600513470	/nfs/dbraw/zinc/51/34/70/600513470.db2.gz	ODOWENFAGZIGSF-UHFFFAOYSA-N	-1	2	384.826	2.686	20	10		GFCDLM
C[C@@H](NC(=O)[O-])c1ccc(NS(=O)(=O)c2cccc3nsnc32)cc1	ZINC000825448924	660428107	/nfs/dbraw/zinc/42/81/07/660428107.db2.gz	HYHBISUNYVLOEF-SECBINFHSA-N	-1	2	378.435	2.821	20	10		GFCDLM
O=C([O-])Cc1sc(NS(=O)(=O)c2cncc(F)c2)nc1-c1ccccc1	ZINC000739899303	600056079	/nfs/dbraw/zinc/05/60/79/600056079.db2.gz	JLQOGUKVKDNGQS-UHFFFAOYSA-N	-1	2	393.421	2.772	20	10		GFCDLM
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2nc(-c3cnn(C)c3)cs2)c1C	ZINC000832866661	601361472	/nfs/dbraw/zinc/36/14/72/601361472.db2.gz	QFFXBVFGILWMJL-UHFFFAOYSA-N	-1	2	392.462	2.659	20	10		GFCDLM
O=C([O-])COc1ccc(NS(=O)(=O)c2cccc3nonc32)c2ccccc12	ZINC000833259432	602201833	/nfs/dbraw/zinc/20/18/33/602201833.db2.gz	OKFXLRLZSKRTSX-UHFFFAOYSA-N	-1	2	399.384	2.640	20	10		GFCDLM
COCc1cccc(S(=O)(=O)Nc2nc(-c3c[nH]c(C(=O)[O-])c3)cs2)c1	ZINC000737835092	600055024	/nfs/dbraw/zinc/05/50/24/600055024.db2.gz	QBBYADJGANQEKF-UHFFFAOYSA-N	-1	2	393.446	2.784	20	10		GFCDLM
Cc1ccc(-c2csc(NS(=O)(=O)c3cnn(CC(=O)[O-])c3)n2)c(C)c1	ZINC000832907094	600976743	/nfs/dbraw/zinc/97/67/43/600976743.db2.gz	MNKJKRBXYNMHHL-UHFFFAOYSA-N	-1	2	392.462	2.509	20	10		GFCDLM
Cc1nc(C)c(-c2csc(NS(=O)(=O)c3c[nH]c(C(=O)[O-])c3)n2)s1	ZINC000832995009	600976976	/nfs/dbraw/zinc/97/69/76/600976976.db2.gz	XMBHZOMUARTCGJ-UHFFFAOYSA-N	-1	2	384.464	2.711	20	10		GFCDLM
COc1ccc(S(=O)(=O)Nc2nc(-c3c[nH]c(C(=O)[O-])c3)cs2)cc1F	ZINC000738069988	600055043	/nfs/dbraw/zinc/05/50/43/600055043.db2.gz	VCWAVPANRXYYSG-UHFFFAOYSA-N	-1	2	397.409	2.785	20	10		GFCDLM
Cn1cc(S(=O)(=O)Nc2nc(-c3cccc(F)c3)cs2)cc1C(=O)[O-]	ZINC000833056195	600828529	/nfs/dbraw/zinc/82/85/29/600828529.db2.gz	YKUAHVBJWYVLHW-UHFFFAOYSA-N	-1	2	381.410	2.787	20	10		GFCDLM
COc1cc(Br)cc(C[N@H+]2CCOC[C@@H]2[C@@H]2CCCC2=O)c1O	ZINC000365152091	563775437	/nfs/dbraw/zinc/77/54/37/563775437.db2.gz	NPQNXLOHJIXGJD-UONOGXRCSA-N	-1	2	384.270	2.733	20	10		GFCDLM
O=C([O-])CN(Cc1nc(=O)c2sccc2[nH]1)Cc1cc(Cl)ccc1O	ZINC000739799574	600145614	/nfs/dbraw/zinc/14/56/14/600145614.db2.gz	WNXRILHVUFSSTJ-UHFFFAOYSA-N	-1	2	379.825	2.843	20	10		GFCDLM
Cn1cc(S(=O)(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)cc1C(=O)[O-]	ZINC000833055584	600828375	/nfs/dbraw/zinc/82/83/75/600828375.db2.gz	JBEYXQMLGSUTNO-UHFFFAOYSA-N	-1	2	399.400	2.926	20	10		GFCDLM
O=C([O-])CSCc1cccc(NS(=O)(=O)c2cccc3nsnc32)c1	ZINC000739873471	599926982	/nfs/dbraw/zinc/92/69/82/599926982.db2.gz	ATILMEDBCDVZIL-UHFFFAOYSA-N	-1	2	395.487	2.810	20	10		GFCDLM
O=C([O-])c1cc(S(=O)(=O)Nc2nc3c(s2)COc2ccccc2-3)c[nH]1	ZINC000833306137	600975401	/nfs/dbraw/zinc/97/54/01/600975401.db2.gz	GLTJMRYWMWMALQ-UHFFFAOYSA-N	-1	2	377.403	2.530	20	10		GFCDLM
COc1ccc(-c2nc(NS(=O)(=O)c3c[nH]c(C(=O)[O-])c3)sc2C)cc1	ZINC000832129872	600974632	/nfs/dbraw/zinc/97/46/32/600974632.db2.gz	PBSIPGGATCJTRG-UHFFFAOYSA-N	-1	2	393.446	2.954	20	10		GFCDLM
COC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc([O-])c([N+](=O)[O-])c2)c1	ZINC000775287999	656621998	/nfs/dbraw/zinc/62/19/98/656621998.db2.gz	HHJMMWDCWVHJGR-UHFFFAOYSA-N	-1	2	386.769	2.541	20	10		GFCDLM
Cc1cc(S(=O)(=O)Nc2nc(-c3c[nH]c(C(=O)[O-])c3)cs2)cnc1Cl	ZINC000738478397	600377474	/nfs/dbraw/zinc/37/74/74/600377474.db2.gz	NHSJELVDYOLQAP-UHFFFAOYSA-N	-1	2	398.853	2.994	20	10		GFCDLM
Cc1ccc(-c2csc(NS(=O)(=O)c3cnn(CC(=O)[O-])c3)n2)cc1C	ZINC000832907343	600975364	/nfs/dbraw/zinc/97/53/64/600975364.db2.gz	SFHJWPIVSGBVJO-UHFFFAOYSA-N	-1	2	392.462	2.509	20	10		GFCDLM
Cc1c(Cl)cc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cc1C(=O)[O-]	ZINC000794871383	658629624	/nfs/dbraw/zinc/62/96/24/658629624.db2.gz	AJDLXMXKUQYBKH-UHFFFAOYSA-N	-1	2	386.769	2.761	20	10		GFCDLM
O=C([O-])c1cc(F)c(F)c(S(=O)(=O)Nc2cc(Cl)c(O)cc2F)c1	ZINC000808113728	659877661	/nfs/dbraw/zinc/87/76/61/659877661.db2.gz	HSNVSZAEXPEIRG-UHFFFAOYSA-N	-1	2	381.715	2.962	20	10		GFCDLM
COc1ccc(Cl)c(C(=O)[O-])c1NS(=O)(=O)c1cccc2nsnc21	ZINC000522215497	564646900	/nfs/dbraw/zinc/64/69/00/564646900.db2.gz	RAVKUJIMDNAWBF-UHFFFAOYSA-N	-1	2	399.837	2.852	20	10		GFCDLM
O=C([O-])c1cc(-c2csc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3)n2)c[nH]1	ZINC000740069366	600055271	/nfs/dbraw/zinc/05/52/71/600055271.db2.gz	WHLQJQNGUOLRAX-UHFFFAOYSA-N	-1	2	394.390	2.545	20	10		GFCDLM
O=C([O-])c1cc(-c2csc(NS(=O)(=O)c3ccc(Cl)nc3)n2)c[nH]1	ZINC000740069292	600055333	/nfs/dbraw/zinc/05/53/33/600055333.db2.gz	TXYYSPGBIMTBGR-UHFFFAOYSA-N	-1	2	384.826	2.686	20	10		GFCDLM
COc1cc(C(=O)[O-])sc1S(=O)(=O)Nc1nc(-c2cccnc2)cs1	ZINC000831949764	601200906	/nfs/dbraw/zinc/20/09/06/601200906.db2.gz	DWASPJFUDPBZDE-UHFFFAOYSA-N	-1	2	397.459	2.774	20	10		GFCDLM
CSc1cc(O)ccc1NS(=O)(=O)c1cc(C(=O)[O-])cc(F)c1F	ZINC000792703293	658313294	/nfs/dbraw/zinc/31/32/94/658313294.db2.gz	STUFGBJHFFHVAS-UHFFFAOYSA-N	-1	2	375.374	2.891	20	10		GFCDLM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccco2)cs1	ZINC000832208594	601359032	/nfs/dbraw/zinc/35/90/32/601359032.db2.gz	HIBJBBNOOOINFU-UHFFFAOYSA-N	-1	2	380.403	2.911	20	10		GFCDLM
COc1ccc(-c2csc(NS(=O)(=O)c3csnc3C(=O)[O-])n2)cc1	ZINC000832124267	601767387	/nfs/dbraw/zinc/76/73/87/601767387.db2.gz	MPCBAAOGBLFJHE-UHFFFAOYSA-N	-1	2	397.459	2.774	20	10		GFCDLM
COc1ccccc1-c1csc(NS(=O)(=O)c2csnc2C(=O)[O-])n1	ZINC000832582802	601767425	/nfs/dbraw/zinc/76/74/25/601767425.db2.gz	JHXTWESQCHSZQP-UHFFFAOYSA-N	-1	2	397.459	2.774	20	10		GFCDLM
O=[N+]([O-])c1cc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)ccc1[O-]	ZINC000775285953	656621156	/nfs/dbraw/zinc/62/11/56/656621156.db2.gz	GEKHISKGEBCLGT-UHFFFAOYSA-N	-1	2	386.769	2.526	20	10		GFCDLM
Cc1ccc(-c2csc(NS(=O)(=O)c3cc(C(=O)[O-])n(C)c3)n2)cc1	ZINC000832906879	600827771	/nfs/dbraw/zinc/82/77/71/600827771.db2.gz	CWLUJBPDDNIPMG-UHFFFAOYSA-N	-1	2	377.447	2.956	20	10		GFCDLM
Cc1noc(C)c1S(=O)(=O)Nc1nc(-c2ccccc2)c(CC(=O)[O-])s1	ZINC000738948198	600056151	/nfs/dbraw/zinc/05/61/51/600056151.db2.gz	PVWFCOIHBWBUEI-UHFFFAOYSA-N	-1	2	393.446	2.843	20	10		GFCDLM
COc1ccccc1-c1csc(NS(=O)(=O)c2c[nH]c(C(=O)[O-])c2)n1	ZINC000832583100	600976831	/nfs/dbraw/zinc/97/68/31/600976831.db2.gz	NUTOVXQQOMWDFE-UHFFFAOYSA-N	-1	2	379.419	2.646	20	10		GFCDLM
O=C([O-])c1cc(-c2csc(NS(=O)(=O)c3ccccc3[N+](=O)[O-])n2)c[nH]1	ZINC000740069349	600055154	/nfs/dbraw/zinc/05/51/54/600055154.db2.gz	VSMHVXNDQZHMLJ-UHFFFAOYSA-N	-1	2	394.390	2.545	20	10		GFCDLM
O=C([O-])c1cc(S(=O)(=O)Nc2nc(-c3cccnc3)cs2)ccc1F	ZINC000833306122	601359358	/nfs/dbraw/zinc/35/93/58/601359358.db2.gz	FKZTXMQUPXKORK-UHFFFAOYSA-N	-1	2	379.394	2.843	20	10		GFCDLM
CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](c1c[nH+]cn1C)N(C)C	ZINC000281118619	563366907	/nfs/dbraw/zinc/36/69/07/563366907.db2.gz	XJQPPKXBTDOLQW-MRXNPFEDSA-N	-1	2	395.301	2.540	20	10		GFCDLM
COc1cc(Br)cc(C[N@H+]2CCOC[C@@H]2[C@H]2CCCC2=O)c1O	ZINC000365152093	563775501	/nfs/dbraw/zinc/77/55/01/563775501.db2.gz	NPQNXLOHJIXGJD-ZIAGYGMSSA-N	-1	2	384.270	2.733	20	10		GFCDLM
COC(=O)c1ccc(S(=O)(=O)Nc2cc(Cl)c([O-])c(Cl)c2)cn1	ZINC000758163949	655924787	/nfs/dbraw/zinc/92/47/87/655924787.db2.gz	OLRZFSKKPKCPRR-UHFFFAOYSA-N	-1	2	377.205	2.681	20	10		GFCDLM
O=C([O-])c1cc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c(F)c(Cl)c1F	ZINC000779824989	656945941	/nfs/dbraw/zinc/94/59/41/656945941.db2.gz	LSEKCAOCISZSDP-UHFFFAOYSA-N	-1	2	391.735	2.846	20	10		GFCDLM
Cn1cc(S(=O)(=O)Nc2nc(-c3ccccc3F)cs2)cc1C(=O)[O-]	ZINC000833056085	600828570	/nfs/dbraw/zinc/82/85/70/600828570.db2.gz	WWAGZKJRHSDZLE-UHFFFAOYSA-N	-1	2	381.410	2.787	20	10		GFCDLM
O=C([O-])c1ccc(C(F)(F)F)cc1NS(=O)(=O)c1cccc2nonc21	ZINC000833312219	602197826	/nfs/dbraw/zinc/19/78/26/602197826.db2.gz	MLBSHBNNBLMHCV-UHFFFAOYSA-N	-1	2	387.295	2.741	20	10		GFCDLM
COC(=O)c1cc(S(=O)(=O)Nc2cc(Cl)c([O-])c(Cl)c2)cn1C	ZINC000758163389	655924694	/nfs/dbraw/zinc/92/46/94/655924694.db2.gz	RHECEGJDMSINNW-UHFFFAOYSA-N	-1	2	379.221	2.625	20	10		GFCDLM
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000775285829	656621171	/nfs/dbraw/zinc/62/11/71/656621171.db2.gz	DZLZKRRPZPDCBE-UHFFFAOYSA-N	-1	2	386.769	2.761	20	10		GFCDLM
O=C(NCC(F)F)[C@@H]1CCCC[N@H+]1Cc1c(O)cccc1Br	ZINC000862386902	662284164	/nfs/dbraw/zinc/28/41/64/662284164.db2.gz	CUCHBMZQBWOYPJ-LBPRGKRZSA-N	-1	2	377.229	2.891	20	10		GFCDLM
COc1cc(Br)cc(C[N@H+]2CCOC[C@H]2[C@@H]2CCCC2=O)c1O	ZINC000365152086	563775492	/nfs/dbraw/zinc/77/54/92/563775492.db2.gz	NPQNXLOHJIXGJD-KBPBESRZSA-N	-1	2	384.270	2.733	20	10		GFCDLM
Cn1cc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1C(=O)[O-]	ZINC000833055174	600828449	/nfs/dbraw/zinc/82/84/49/600828449.db2.gz	AVFGNRBRTMKPJV-UHFFFAOYSA-N	-1	2	381.410	2.787	20	10		GFCDLM
Cc1sc(NS(=O)(=O)c2cc(C(=O)[O-])n(C)c2)nc1-c1ccccc1	ZINC000833037427	600828523	/nfs/dbraw/zinc/82/85/23/600828523.db2.gz	XMVPPOPCJAFODH-UHFFFAOYSA-N	-1	2	377.447	2.956	20	10		GFCDLM
COc1ccc(C)cc1-c1csc(NS(=O)(=O)c2c[nH]c(C(=O)[O-])c2)n1	ZINC000832252434	600977005	/nfs/dbraw/zinc/97/70/05/600977005.db2.gz	NHDLUFYRNSDPGF-UHFFFAOYSA-N	-1	2	393.446	2.954	20	10		GFCDLM
O=C1CCc2cc(Cl)c(S(=O)(=O)Nc3ccc([O-])c([N+](=O)[O-])c3)cc21	ZINC000800839247	659336132	/nfs/dbraw/zinc/33/61/32/659336132.db2.gz	BBTMVPDIOKCXQJ-UHFFFAOYSA-N	-1	2	382.781	2.884	20	10		GFCDLM
Cn1cc(S(=O)(=O)Nc2nc3c(s2)COc2ccccc2-3)cc1C(=O)[O-]	ZINC000833055744	600828135	/nfs/dbraw/zinc/82/81/35/600828135.db2.gz	NHXLDZGXUJPEEH-UHFFFAOYSA-N	-1	2	391.430	2.540	20	10		GFCDLM
O=C([O-])CCCc1ccccc1NS(=O)(=O)c1cccc2nsnc21	ZINC000541929136	564295701	/nfs/dbraw/zinc/29/57/01/564295701.db2.gz	LGULDDHGLIKJRL-UHFFFAOYSA-N	-1	2	377.447	2.899	20	10		GFCDLM
O=C([O-])c1cc(-c2csc(NS(=O)(=O)c3ccc(F)c(F)c3)n2)c[nH]1	ZINC000740068427	600055347	/nfs/dbraw/zinc/05/53/47/600055347.db2.gz	FYMXRSNIFIWXSW-UHFFFAOYSA-N	-1	2	385.373	2.915	20	10		GFCDLM
O=C([O-])c1cc(NS(=O)(=O)c2cc([N+](=O)[O-])cc(Cl)c2F)ccc1O	ZINC000795335929	658807542	/nfs/dbraw/zinc/80/75/42/658807542.db2.gz	YHNUUILCBKSAFW-UHFFFAOYSA-N	-1	2	390.732	2.592	20	10		GFCDLM
CS(=O)(=O)CC[C@@H]1CCCC[N@@H+]1Cc1c(O)cccc1Br	ZINC000862374396	662283820	/nfs/dbraw/zinc/28/38/20/662283820.db2.gz	LGMQVMUOCBRODB-LBPRGKRZSA-N	-1	2	376.316	2.944	20	10		GFCDLM
COCc1ccc(S(=O)(=O)Nc2nc(-c3c[nH]c(C(=O)[O-])c3)cs2)cc1	ZINC000833725674	605050331	/nfs/dbraw/zinc/05/03/31/605050331.db2.gz	FTFTUCHZAUJICR-UHFFFAOYSA-N	-1	2	393.446	2.784	20	10		GFCDLM
O=C([O-])c1ccc(F)cc1S(=O)(=O)Nc1nc(-c2ccccn2)cs1	ZINC000740143051	600052444	/nfs/dbraw/zinc/05/24/44/600052444.db2.gz	ARSMKKBLAXLICQ-UHFFFAOYSA-N	-1	2	379.394	2.843	20	10		GFCDLM
O=C([O-])c1cc(S(=O)(=O)Nc2nc(-c3cc(F)ccc3F)cs2)c[nH]1	ZINC000833306083	600975428	/nfs/dbraw/zinc/97/54/28/600975428.db2.gz	CBODRVFXAWZISR-UHFFFAOYSA-N	-1	2	385.373	2.915	20	10		GFCDLM
Cn1cc(-c2csc(NS(=O)(=O)c3cc(Cl)ccc3C(=O)[O-])n2)cn1	ZINC000833041679	600984549	/nfs/dbraw/zinc/98/45/49/600984549.db2.gz	TZUFYAOIWUZLMS-UHFFFAOYSA-N	-1	2	398.853	2.696	20	10		GFCDLM
O=C([O-])c1cc(-c2csc(NS(=O)(=O)c3ccc(F)cc3F)n2)c[nH]1	ZINC000740068114	600055314	/nfs/dbraw/zinc/05/53/14/600055314.db2.gz	ACINTKWGAIADKW-UHFFFAOYSA-N	-1	2	385.373	2.915	20	10		GFCDLM
O=C([O-])Cc1ccc(S(=O)(=O)Nc2nc(-c3cccnc3)cs2)cc1	ZINC000739889481	600245023	/nfs/dbraw/zinc/24/50/23/600245023.db2.gz	NHGZPOMPTUSKEP-UHFFFAOYSA-N	-1	2	375.431	2.633	20	10		GFCDLM
O=C([O-])c1cc(S(=O)(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)c[nH]1	ZINC000833306198	600975935	/nfs/dbraw/zinc/97/59/35/600975935.db2.gz	JWJAQDMFNHGUJD-UHFFFAOYSA-N	-1	2	385.373	2.915	20	10		GFCDLM
Cn1cc(-c2csc(NS(=O)(=O)c3cc(C(=O)[O-])ccc3Cl)n2)cn1	ZINC000833040784	600984658	/nfs/dbraw/zinc/98/46/58/600984658.db2.gz	IOGZIIJPCZYXEY-UHFFFAOYSA-N	-1	2	398.853	2.696	20	10		GFCDLM
C[C@H](NC(=O)[O-])c1ccc(NS(=O)(=O)c2cccc3nsnc32)cc1	ZINC000825448926	660428180	/nfs/dbraw/zinc/42/81/80/660428180.db2.gz	HYHBISUNYVLOEF-VIFPVBQESA-N	-1	2	378.435	2.821	20	10		GFCDLM
O=C([O-])c1cc(O)ccc1NS(=O)(=O)c1ccc(Br)cc1F	ZINC000318628265	655381314	/nfs/dbraw/zinc/38/13/14/655381314.db2.gz	QCKWAZLHPOOHFP-UHFFFAOYSA-N	-1	2	390.186	2.793	20	10		GFCDLM
Cc1cc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cc(C(=O)[O-])c1Cl	ZINC000753521756	655855456	/nfs/dbraw/zinc/85/54/56/655855456.db2.gz	MPIWMFQAAZZLEC-UHFFFAOYSA-N	-1	2	386.769	2.761	20	10		GFCDLM
O=C([O-])Cc1ccc(S(=O)(=O)Nc2nc(-c3ccccn3)cs2)cc1	ZINC000739890207	600244857	/nfs/dbraw/zinc/24/48/57/600244857.db2.gz	VWPYJFOMMLDXPA-UHFFFAOYSA-N	-1	2	375.431	2.633	20	10		GFCDLM
CCc1ccc(-c2csc(NS(=O)(=O)c3cnn(CC(=O)[O-])c3)n2)s1	ZINC000830229550	600976607	/nfs/dbraw/zinc/97/66/07/600976607.db2.gz	XRFMCWAIPDWSMG-UHFFFAOYSA-N	-1	2	398.491	2.516	20	10		GFCDLM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccccn2)cs1	ZINC000832208798	601358936	/nfs/dbraw/zinc/35/89/36/601358936.db2.gz	UHIDSIKLBQBERJ-UHFFFAOYSA-N	-1	2	391.430	2.713	20	10		GFCDLM
O=C([O-])c1c(F)cccc1S(=O)(=O)Nc1nc(-c2ccccn2)cs1	ZINC000833293528	601847667	/nfs/dbraw/zinc/84/76/67/601847667.db2.gz	AVIVOCUXXHKYHU-UHFFFAOYSA-N	-1	2	379.394	2.843	20	10		GFCDLM
O=C([O-])c1cc(O)ccc1NS(=O)(=O)c1cccc(Br)c1F	ZINC000798408126	659100136	/nfs/dbraw/zinc/10/01/36/659100136.db2.gz	LXWNJZHOXMBINM-UHFFFAOYSA-N	-1	2	390.186	2.793	20	10		GFCDLM
O=S(=O)([N-]c1ccn(C2CCSCC2)n1)c1cc(F)cc(F)c1O	ZINC000872382874	662763829	/nfs/dbraw/zinc/76/38/29/662763829.db2.gz	FQZXFLZHYMJWCQ-UHFFFAOYSA-N	-1	2	375.422	2.736	20	10		GFCDLM
O=C([O-])c1cc(NS(=O)(=O)c2cc(Br)ccc2F)ccc1O	ZINC000757657332	655914842	/nfs/dbraw/zinc/91/48/42/655914842.db2.gz	UZFVJSNTEWXVOY-UHFFFAOYSA-N	-1	2	390.186	2.793	20	10		GFCDLM
O=C([O-])Cn1cc(S(=O)(=O)Nc2nc(-c3cccc(Cl)c3)cs2)cn1	ZINC000833274299	600977450	/nfs/dbraw/zinc/97/74/50/600977450.db2.gz	YGJMSXMJSJMLIE-UHFFFAOYSA-N	-1	2	398.853	2.545	20	10		GFCDLM
CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCc2[nH+]c[nH]c2C1	ZINC000366088284	563799069	/nfs/dbraw/zinc/79/90/69/563799069.db2.gz	KXFQKUXCTZEXIY-CYBMUJFWSA-N	-1	2	393.285	2.967	20	10		GFCDLM
CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCc2[nH]c[nH+]c2C1	ZINC000366088284	563799073	/nfs/dbraw/zinc/79/90/73/563799073.db2.gz	KXFQKUXCTZEXIY-CYBMUJFWSA-N	-1	2	393.285	2.967	20	10		GFCDLM
O=C([O-])c1ccc(F)cc1S(=O)(=O)Nc1nc(-c2cccnc2)cs1	ZINC000740144226	600052491	/nfs/dbraw/zinc/05/24/91/600052491.db2.gz	LGLBUXVQFXOZAW-UHFFFAOYSA-N	-1	2	379.394	2.843	20	10		GFCDLM
COc1ccc(F)cc1-c1csc(NS(=O)(=O)c2c[nH]c(C(=O)[O-])c2)n1	ZINC000832378298	600976758	/nfs/dbraw/zinc/97/67/58/600976758.db2.gz	IVQDGVOTPDEBKK-UHFFFAOYSA-N	-1	2	397.409	2.785	20	10		GFCDLM
Cc1nn(C)c(C)c1S(=O)(=O)Nc1nc(-c2ccc(C(=O)[O-])cc2)cs1	ZINC000833013585	601134029	/nfs/dbraw/zinc/13/40/29/601134029.db2.gz	BQQBWLXEHAJKTK-UHFFFAOYSA-N	-1	2	392.462	2.659	20	10		GFCDLM
Cc1nc(C)c(-c2csc(NS(=O)(=O)c3cc(C(=O)[O-])n(C)c3)n2)s1	ZINC000832994393	600828444	/nfs/dbraw/zinc/82/84/44/600828444.db2.gz	HQVSGCKNXVVLOM-UHFFFAOYSA-N	-1	2	398.491	2.721	20	10		GFCDLM
COc1cc(C(=O)[O-])sc1S(=O)(=O)Nc1nc(-c2ccccn2)cs1	ZINC000831950380	601201122	/nfs/dbraw/zinc/20/11/22/601201122.db2.gz	SBUZSCKBRBIWJC-UHFFFAOYSA-N	-1	2	397.459	2.774	20	10		GFCDLM
O=C([O-])COc1ccc(NS(=O)(=O)c2cccc3nsnc32)cc1Cl	ZINC000833259416	604810710	/nfs/dbraw/zinc/81/07/10/604810710.db2.gz	NQMWZMLOPJADJQ-UHFFFAOYSA-N	-1	2	399.837	2.609	20	10		GFCDLM
COc1cccc(S(=O)(=O)Nc2nc(-c3c[nH]c(C(=O)[O-])c3)cs2)c1	ZINC000738109387	600054989	/nfs/dbraw/zinc/05/49/89/600054989.db2.gz	NIKQKTFCEMZPSW-UHFFFAOYSA-N	-1	2	379.419	2.646	20	10		GFCDLM
O=C([O-])c1nscc1S(=O)(=O)Nc1nc(-c2ccccc2F)cs1	ZINC000833346944	601768539	/nfs/dbraw/zinc/76/85/39/601768539.db2.gz	XNLHXHYPWLDILG-UHFFFAOYSA-N	-1	2	385.423	2.905	20	10		GFCDLM
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000753523247	655855445	/nfs/dbraw/zinc/85/54/45/655855445.db2.gz	WFRIIYSEMYMFEA-UHFFFAOYSA-N	-1	2	386.769	2.761	20	10		GFCDLM
CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCc2[nH+]c[nH]c2C1	ZINC000366088287	563798769	/nfs/dbraw/zinc/79/87/69/563798769.db2.gz	KXFQKUXCTZEXIY-ZDUSSCGKSA-N	-1	2	393.285	2.967	20	10		GFCDLM
CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCc2[nH]c[nH+]c2C1	ZINC000366088287	563798771	/nfs/dbraw/zinc/79/87/71/563798771.db2.gz	KXFQKUXCTZEXIY-ZDUSSCGKSA-N	-1	2	393.285	2.967	20	10		GFCDLM
Cn1cc(S(=O)(=O)Nc2nc(-c3cc(F)ccc3F)cs2)cc1C(=O)[O-]	ZINC000833056089	600828282	/nfs/dbraw/zinc/82/82/82/600828282.db2.gz	XBHMNQMZNBAORN-UHFFFAOYSA-N	-1	2	399.400	2.926	20	10		GFCDLM
COc1ccc(-c2csc(NS(=O)(=O)c3c[nH]c(C(=O)[O-])c3)n2)cc1	ZINC000832124748	600974605	/nfs/dbraw/zinc/97/46/05/600974605.db2.gz	YKAHPOAYIAAAHB-UHFFFAOYSA-N	-1	2	379.419	2.646	20	10		GFCDLM
O=C([O-])Cn1cc(S(=O)(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)cn1	ZINC000833274077	600975488	/nfs/dbraw/zinc/97/54/88/600975488.db2.gz	NWPAORCFZQNCKO-UHFFFAOYSA-N	-1	2	398.853	2.545	20	10		GFCDLM
O=C([O-])c1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCO4)cs2)c[nH]1	ZINC000833306505	600978398	/nfs/dbraw/zinc/97/83/98/600978398.db2.gz	ZDANNAXUAHPLIB-UHFFFAOYSA-N	-1	2	391.430	2.572	20	10		GFCDLM
O=C([O-])c1ccc(-c2csc(NS(=O)(=O)c3cncc(F)c3)n2)cc1	ZINC000740099024	600052376	/nfs/dbraw/zinc/05/23/76/600052376.db2.gz	SBBRVAUTDYETCK-UHFFFAOYSA-N	-1	2	379.394	2.843	20	10		GFCDLM
COc1ccccc1-c1csc(NS(=O)(=O)c2cc(C(=O)[O-])n(C)c2)n1	ZINC000832583101	600827625	/nfs/dbraw/zinc/82/76/25/600827625.db2.gz	NZAQRTPYVGIFPL-UHFFFAOYSA-N	-1	2	393.446	2.656	20	10		GFCDLM
COc1cc(C(=O)[O-])sc1S(=O)(=O)Nc1nc(-c2ccco2)cs1	ZINC000831949635	601200931	/nfs/dbraw/zinc/20/09/31/601200931.db2.gz	DAVWCRHVOPGVOU-UHFFFAOYSA-N	-1	2	386.432	2.972	20	10		GFCDLM
Cn1cc(S(=O)(=O)Nc2nc3c(s2)CCc2ccccc2-3)cc1C(=O)[O-]	ZINC000833055625	600828603	/nfs/dbraw/zinc/82/86/03/600828603.db2.gz	KKTCJDABQCURTO-UHFFFAOYSA-N	-1	2	389.458	2.746	20	10		GFCDLM
O=S(=O)(NC1CC[NH+](Cc2cc(F)cc(F)c2O)CC1)c1cccs1	ZINC000893916517	663431479	/nfs/dbraw/zinc/43/14/79/663431479.db2.gz	JTVZGYIDODEZDX-UHFFFAOYSA-N	-1	2	388.461	2.675	20	10		GFCDLM
O=C([O-])c1cc(S(=O)(=O)Nc2nc3c(s2)CCc2ccccc2-3)c[nH]1	ZINC000833306318	600976162	/nfs/dbraw/zinc/97/61/62/600976162.db2.gz	NRVHOXYTFZUXBE-UHFFFAOYSA-N	-1	2	375.431	2.736	20	10		GFCDLM
O=C([O-])CCSCc1cccc(NS(=O)(=O)c2cccc3nonc32)c1	ZINC000833238883	602200566	/nfs/dbraw/zinc/20/05/66/602200566.db2.gz	ADUZBEXEXCAWGH-UHFFFAOYSA-N	-1	2	393.446	2.732	20	10		GFCDLM
O=C([O-])c1cc(-c2csc(NS(=O)(=O)c3cccc(F)c3F)n2)c[nH]1	ZINC000740069350	600055202	/nfs/dbraw/zinc/05/52/02/600055202.db2.gz	VTJQVCLDNJZDII-UHFFFAOYSA-N	-1	2	385.373	2.915	20	10		GFCDLM
O=C([O-])c1cc(-c2csc(NS(=O)(=O)c3cc(F)cc(F)c3)n2)c[nH]1	ZINC000740069367	600055337	/nfs/dbraw/zinc/05/53/37/600055337.db2.gz	WJFCSKAMTVWGEI-UHFFFAOYSA-N	-1	2	385.373	2.915	20	10		GFCDLM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1nc(-c2cccnc2)cs1	ZINC000832208597	601358873	/nfs/dbraw/zinc/35/88/73/601358873.db2.gz	HJSREKSHMDSMNR-UHFFFAOYSA-N	-1	2	391.430	2.713	20	10		GFCDLM
C[N@H+](Cc1cccc(Br)c1O)[C@@H]1CCCC[C@H]1S(C)(=O)=O	ZINC000245760028	655428471	/nfs/dbraw/zinc/42/84/71/655428471.db2.gz	PNVDNEZOXGOKCO-ZIAGYGMSSA-N	-1	2	376.316	2.942	20	10		GFCDLM
O=C([O-])c1cc(S(=O)(=O)Nc2nc(-c3ccccn3)cs2)ccc1F	ZINC000833306277	601359362	/nfs/dbraw/zinc/35/93/62/601359362.db2.gz	MPKKNDBHERHROF-UHFFFAOYSA-N	-1	2	379.394	2.843	20	10		GFCDLM
Cn1cc(-c2csc(NS(=O)(=O)c3ccc(Cl)c(C(=O)[O-])c3)n2)cn1	ZINC000833040695	601843732	/nfs/dbraw/zinc/84/37/32/601843732.db2.gz	GZBZAMUHLZAFHD-UHFFFAOYSA-N	-1	2	398.853	2.696	20	10		GFCDLM
CC[N@H+](Cc1cc(Br)ccc1O)[C@H](C)c1nc(N)nc(N(C)C)n1	ZINC000157083563	655098268	/nfs/dbraw/zinc/09/82/68/655098268.db2.gz	DQLWVGYPXZYOLU-SNVBAGLBSA-N	-1	2	395.305	2.571	20	10		GFCDLM
CC[N@H+](Cc1cc(Br)ccc1O)[C@@H](C)c1nc(N)nc(N(C)C)n1	ZINC000157083389	655098381	/nfs/dbraw/zinc/09/83/81/655098381.db2.gz	DQLWVGYPXZYOLU-JTQLQIEISA-N	-1	2	395.305	2.571	20	10		GFCDLM
O=C([O-])COc1ccc(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)cc1	ZINC000326180108	655384930	/nfs/dbraw/zinc/38/49/30/655384930.db2.gz	LVVLZZHGSIIILY-UHFFFAOYSA-N	-1	2	392.216	2.963	20	10		GFCDLM
O=S(=O)([N-]c1ccc(OCC(F)(F)F)nc1)c1cc(F)cc(F)c1O	ZINC000753016081	655849359	/nfs/dbraw/zinc/84/93/59/655849359.db2.gz	GGMZVTCFHIUHNP-UHFFFAOYSA-N	-1	2	384.282	2.807	20	10		GFCDLM
COc1cc(Cl)c(S(=O)(=O)Nc2ccc([O-])c([N+](=O)[O-])c2)cc1OC	ZINC000790347116	657956261	/nfs/dbraw/zinc/95/62/61/657956261.db2.gz	XVZHJKFJJHGAPQ-UHFFFAOYSA-N	-1	2	388.785	2.772	20	10		GFCDLM
C[C@@H](Cc1ccc(NS(=O)(=O)c2cccc3nsnc32)cc1)C(=O)[O-]	ZINC000544645653	564391695	/nfs/dbraw/zinc/39/16/95/564391695.db2.gz	SHKWREQFRNWBBW-JTQLQIEISA-N	-1	2	377.447	2.755	20	10		GFCDLM
O=C([O-])c1cc(S(=O)(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cc(Cl)c1F	ZINC000775287524	656622018	/nfs/dbraw/zinc/62/20/18/656622018.db2.gz	BQUAMOHERGFNNP-UHFFFAOYSA-N	-1	2	390.732	2.592	20	10		GFCDLM
O=C([O-])c1cc(O)ccc1NS(=O)(=O)c1cc(Br)ccc1F	ZINC000776434948	656740722	/nfs/dbraw/zinc/74/07/22/656740722.db2.gz	SCJFZRAJXCCTKT-UHFFFAOYSA-N	-1	2	390.186	2.793	20	10		GFCDLM
Cc1oc(C)c(S(=O)(=O)Nc2nc(-c3cccnc3)cs2)c1C(=O)[O-]	ZINC000738969239	600052246	/nfs/dbraw/zinc/05/22/46/600052246.db2.gz	KJMMQNHYTZKITN-UHFFFAOYSA-N	-1	2	379.419	2.914	20	10		GFCDLM
O=C([O-])c1nscc1S(=O)(=O)Nc1nc(-c2cccc(F)c2)cs1	ZINC000833345603	601767630	/nfs/dbraw/zinc/76/76/30/601767630.db2.gz	DZNSXSVUPXOPIO-UHFFFAOYSA-N	-1	2	385.423	2.905	20	10		GFCDLM
O=C([O-])c1nscc1S(=O)(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000833346239	601767887	/nfs/dbraw/zinc/76/78/87/601767887.db2.gz	LZAYPWDYNNBFTR-UHFFFAOYSA-N	-1	2	385.423	2.905	20	10		GFCDLM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1cc(Cl)c(O)cc1F	ZINC000808113591	659877367	/nfs/dbraw/zinc/87/73/67/659877367.db2.gz	DSGJTDYUHDXNPB-UHFFFAOYSA-N	-1	2	375.761	2.692	20	10		GFCDLM
Cc1nc(C)c(S(=O)(=O)Nc2nc(-c3c[nH]c(C(=O)[O-])c3)cs2)s1	ZINC000832995992	601847593	/nfs/dbraw/zinc/84/75/93/601847593.db2.gz	ODQHZEZTBIJLIM-UHFFFAOYSA-N	-1	2	384.464	2.711	20	10		GFCDLM
O=C([O-])c1c(F)cccc1S(=O)(=O)Nc1nc(-c2cccnc2)cs1	ZINC000833294625	601847631	/nfs/dbraw/zinc/84/76/31/601847631.db2.gz	RWVJJLTVDUCWLQ-UHFFFAOYSA-N	-1	2	379.394	2.843	20	10		GFCDLM