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-])CCc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)Cc2ccccc2-3)cc1	ZINC000013079002	818201830	/nfs/dbraw/zinc/20/18/30/818201830.db2.gz	VJLCSAJZXBKIAI-UHFFFAOYSA-N	-2	1	393.464	4.076	20	0		GIADML
O=C([O-])c1cccc(Cl)c1[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000013269559	818208291	/nfs/dbraw/zinc/20/82/91/818208291.db2.gz	GLIPXOGDTNCJKK-UHFFFAOYSA-N	-2	1	380.636	4.146	20	0		GIADML
Cc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000014097299	818222339	/nfs/dbraw/zinc/22/23/39/818222339.db2.gz	DMRXBLKRXWTSGZ-UHFFFAOYSA-N	-2	1	393.770	4.166	20	0		GIADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3cnc(C4CC4)o3)cc2)cc1C(=O)[O-]	ZINC000026548311	820112426	/nfs/dbraw/zinc/11/24/26/820112426.db2.gz	HARPHCPTOOXKKS-UHFFFAOYSA-N	-2	1	398.440	4.026	20	0		GIADML
O=C([O-])CCc1ccc(S(=O)(=O)[N-]c2cccc(Oc3ccccc3)c2)cc1	ZINC000057584287	823312083	/nfs/dbraw/zinc/31/20/83/823312083.db2.gz	HORZKWWAJKFZIO-UHFFFAOYSA-N	-2	1	397.452	4.297	20	0		GIADML
Cc1nc(-c2ccc(S(=O)(=O)[N-]c3ccc([O-])c(Cl)c3)s2)cs1	ZINC000182491018	822264517	/nfs/dbraw/zinc/26/45/17/822264517.db2.gz	WQMIWHHYJJZNTP-UHFFFAOYSA-N	-2	1	386.907	4.340	20	0		GIADML
O=C([O-])c1ccc(F)c([N-]S(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)c1	ZINC000047318002	822564738	/nfs/dbraw/zinc/56/47/38/822564738.db2.gz	UHGFIKPYRBZXRP-UHFFFAOYSA-N	-2	1	398.626	4.285	20	0		GIADML
Cc1ccc(S(=O)(=O)[N-]c2ccccc2NC(C)(C)C)c(C)c1C(=O)[O-]	ZINC000410400910	823487203	/nfs/dbraw/zinc/48/72/03/823487203.db2.gz	KHSSAEOFQAPLIJ-UHFFFAOYSA-N	-2	1	376.478	4.013	20	0		GIADML
Cc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(SC(F)(F)F)cc1	ZINC000064937770	823915396	/nfs/dbraw/zinc/91/53/96/823915396.db2.gz	OWCHRKDSRBKDQE-UHFFFAOYSA-N	-2	1	391.392	4.106	20	0		GIADML
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(SC(F)F)cc1	ZINC000060706657	823553571	/nfs/dbraw/zinc/55/35/71/823553571.db2.gz	ITQQLLAQGXCPBX-UHFFFAOYSA-N	-2	1	387.429	4.063	20	0		GIADML
Cc1ccc(S(=O)(=O)[N-]c2ccc3c(ccn3CC(C)C)c2)cc1C(=O)[O-]	ZINC000063476034	823674961	/nfs/dbraw/zinc/67/49/61/823674961.db2.gz	HDURSQXEGXNYCH-UHFFFAOYSA-N	-2	1	386.473	4.105	20	0		GIADML
Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c(SCCC(=O)[O-])c1	ZINC000460451011	823393492	/nfs/dbraw/zinc/39/34/92/823393492.db2.gz	PGCCIEYNBJDFSP-UHFFFAOYSA-N	-2	1	385.894	4.016	20	0		GIADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(F)c(Cl)c2)cc(Cl)c1Cl	ZINC000058488403	823398753	/nfs/dbraw/zinc/39/87/53/823398753.db2.gz	MLMBETVSYZZEHB-UHFFFAOYSA-N	-2	1	398.626	4.285	20	0		GIADML
Cc1cccc(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc(SC(F)(F)F)cc1	ZINC000064937874	823915269	/nfs/dbraw/zinc/91/52/69/823915269.db2.gz	MSAMOYAMLQUHQA-UHFFFAOYSA-N	-2	1	391.392	4.106	20	0		GIADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccccc2SCc2ccccc2)cc1	ZINC000007709864	817899570	/nfs/dbraw/zinc/89/95/70/817899570.db2.gz	WAQOSLDVRXCSTM-UHFFFAOYSA-N	-2	1	399.493	4.478	20	0		GIADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1Cc1ccccc1	ZINC000013027999	818201280	/nfs/dbraw/zinc/20/12/80/818201280.db2.gz	OPISSZMZOCIIFU-UHFFFAOYSA-N	-2	1	381.453	4.085	20	0		GIADML
O=C([O-])CCc1ccc(S(=O)(=O)[N-]c2ccccc2-c2cccs2)cc1	ZINC000010512341	204335804	/nfs/dbraw/zinc/33/58/04/204335804.db2.gz	SYXCYCWAMHRCHC-UHFFFAOYSA-N	-2	1	387.482	4.233	20	0		GIADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccccc2NC2CCCCC2)ccc1F	ZINC000013247614	818207301	/nfs/dbraw/zinc/20/73/01/818207301.db2.gz	BSPBXOMKSDJTJY-UHFFFAOYSA-N	-2	1	392.452	4.069	20	0		GIADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(C(F)(F)F)c2)cc1C(=O)[O-]	ZINC000013349098	818210271	/nfs/dbraw/zinc/21/02/71/818210271.db2.gz	YNZPBIPIGCYTGW-UHFFFAOYSA-N	-2	1	393.770	4.166	20	0		GIADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(Cl)c(F)c2)cc(Cl)c1Cl	ZINC000058494122	823399759	/nfs/dbraw/zinc/39/97/59/823399759.db2.gz	BMAMFLSOGMZCAA-UHFFFAOYSA-N	-2	1	398.626	4.285	20	0		GIADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(Oc3ccccc3)c2)ccc1F	ZINC000058707739	823436347	/nfs/dbraw/zinc/43/63/47/823436347.db2.gz	UQCLFDJWNPPGLN-UHFFFAOYSA-N	-2	1	387.388	4.117	20	0		GIADML
Cc1cccc(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000013464568	818212955	/nfs/dbraw/zinc/21/29/55/818212955.db2.gz	SBVBPKMWPSGLPB-UHFFFAOYSA-N	-2	1	393.770	4.166	20	0		GIADML
CC(C)Oc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2)c2ccccc12	ZINC000032585687	820972155	/nfs/dbraw/zinc/97/21/55/820972155.db2.gz	ACCAFPFWQKZADW-UHFFFAOYSA-N	-2	1	385.441	4.126	20	0		GIADML
Cc1ccc(Nc2ccccc2[N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000174992676	822864878	/nfs/dbraw/zinc/86/48/78/822864878.db2.gz	OIBARJRTVGRHAH-UHFFFAOYSA-N	-2	1	396.468	4.167	20	0		GIADML
Cc1cc(-c2ccccc2)ccc1[N-]S(=O)(=O)c1cccc(CC(=O)[O-])c1	ZINC000571458684	823185887	/nfs/dbraw/zinc/18/58/87/823185887.db2.gz	AAHWIYWQJAKEHL-UHFFFAOYSA-N	-2	1	381.453	4.090	20	0		GIADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(CSC(C)C)c1C	ZINC000460822043	823522263	/nfs/dbraw/zinc/52/22/63/823522263.db2.gz	CRAMVFCDYZYRQU-UHFFFAOYSA-N	-2	1	393.530	4.444	20	0		GIADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000013278865	818208376	/nfs/dbraw/zinc/20/83/76/818208376.db2.gz	QTWUBKQQKFABQE-UHFFFAOYSA-N	-2	1	392.285	4.214	20	0		GIADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc(Cl)c1Cl	ZINC000058488294	823398723	/nfs/dbraw/zinc/39/87/23/823398723.db2.gz	YZCFTXCXMHKBPD-UHFFFAOYSA-N	-2	1	380.636	4.146	20	0		GIADML
Cc1cc(S(=O)(=O)[N-]c2ccccc2NC(C)(C)C)cc(C(=O)[O-])c1C	ZINC000410402157	823487789	/nfs/dbraw/zinc/48/77/89/823487789.db2.gz	PBRVBKFYXHIUBZ-UHFFFAOYSA-N	-2	1	376.478	4.013	20	0		GIADML
Cc1cc(C)c(S(=O)(=O)[N-]c2ccccc2NC(C)(C)C)cc1C(=O)[O-]	ZINC000410402931	823488086	/nfs/dbraw/zinc/48/80/86/823488086.db2.gz	QQMGUZXIBIINPY-UHFFFAOYSA-N	-2	1	376.478	4.013	20	0		GIADML
Cc1cc(S(=O)(=O)[N-]c2cc(Cl)c(Cl)cc2F)sc1C(=O)[O-]	ZINC000410424343	823493553	/nfs/dbraw/zinc/49/35/53/823493553.db2.gz	RPRSTZKNGJFWBJ-UHFFFAOYSA-N	-2	1	384.237	4.001	20	0		GIADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cccc(Oc3ccccc3)c2)cc1F	ZINC000462061604	823816853	/nfs/dbraw/zinc/81/68/53/823816853.db2.gz	VOZKFWUJOPZQLE-UHFFFAOYSA-N	-2	1	387.388	4.117	20	0		GIADML
Cc1c(Cl)cccc1[N-]S(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)[O-])c1	ZINC000058488322	823398654	/nfs/dbraw/zinc/39/86/54/823398654.db2.gz	VTPUJMKGQNNGKK-UHFFFAOYSA-N	-2	1	394.663	4.454	20	0		GIADML
CC(C)c1ccc([N-]S(=O)(=O)c2ccc(Br)c(C(=O)[O-])c2)cc1	ZINC000013345653	818210308	/nfs/dbraw/zinc/21/03/08/818210308.db2.gz	QZYMNMHXHMXPKT-UHFFFAOYSA-N	-2	1	398.278	4.072	20	0		GIADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3oc4ccccc4c3c2)ccc1F	ZINC000013362385	818210664	/nfs/dbraw/zinc/21/06/64/818210664.db2.gz	JHZMERTYXIBUOX-UHFFFAOYSA-N	-2	1	385.372	4.224	20	0		GIADML
Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1cc(C(=O)[O-])cc(C(F)(F)F)c1	ZINC000062640783	823642952	/nfs/dbraw/zinc/64/29/52/823642952.db2.gz	GDRCQQFTGYZGHY-UHFFFAOYSA-N	-2	1	393.770	4.166	20	0		GIADML
Cc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000007057349	817749472	/nfs/dbraw/zinc/74/94/72/817749472.db2.gz	PVQBAHBKPFHFTG-UHFFFAOYSA-N	-2	1	393.770	4.166	20	0		GIADML
CC(C)OCc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C(C)C)c1	ZINC000063849222	823701817	/nfs/dbraw/zinc/70/18/17/823701817.db2.gz	PLOZMCGJCGTWDI-UHFFFAOYSA-N	-2	1	391.489	4.234	20	0		GIADML
O=C([O-])CCc1ccc(S(=O)(=O)[N-]c2ccc3oc4ccccc4c3c2)cc1	ZINC000008105423	818000907	/nfs/dbraw/zinc/00/09/07/818000907.db2.gz	UATLBZZYQUFUBQ-UHFFFAOYSA-N	-2	1	395.436	4.404	20	0		GIADML
Cc1ccc(S(=O)(=O)[N-]c2ccccc2Cc2ccccc2)cc1C(=O)[O-]	ZINC000013349115	818209904	/nfs/dbraw/zinc/20/99/04/818209904.db2.gz	AWWMFZDPRAAYKD-UHFFFAOYSA-N	-2	1	381.453	4.085	20	0		GIADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(Cl)c2F)c(Cl)cc1Cl	ZINC000013265502	818208259	/nfs/dbraw/zinc/20/82/59/818208259.db2.gz	LPPPDWCXHWHUPZ-UHFFFAOYSA-N	-2	1	398.626	4.285	20	0		GIADML
Cc1cc(Cl)c(C)c(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2F)c1Cl	ZINC000024433258	819056595	/nfs/dbraw/zinc/05/65/95/819056595.db2.gz	QXTHOXFDDHXXCF-UHFFFAOYSA-N	-2	1	392.235	4.248	20	0		GIADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc3oc(C(C)C)nc3c2)c1C	ZINC000032097703	820897463	/nfs/dbraw/zinc/89/74/63/820897463.db2.gz	ONQZYLWPIZWSSO-UHFFFAOYSA-N	-2	1	388.445	4.067	20	0		GIADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2ccccc2SCc2ccccc2)c1	ZINC000013031101	818201079	/nfs/dbraw/zinc/20/10/79/818201079.db2.gz	ITXSRVRNVXQMAV-UHFFFAOYSA-N	-2	1	399.493	4.478	20	0		GIADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(SC(F)F)cc2)ccc1Cl	ZINC000013339963	818209359	/nfs/dbraw/zinc/20/93/59/818209359.db2.gz	COEVTLQQLFQVPH-UHFFFAOYSA-N	-2	1	393.820	4.154	20	0		GIADML
CC(C)(C)Nc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(Cl)c1	ZINC000410400111	823487070	/nfs/dbraw/zinc/48/70/70/823487070.db2.gz	HBDUDXMPBFYPPR-UHFFFAOYSA-N	-2	1	382.869	4.049	20	0		GIADML
CC(C)c1cccc([N-]S(=O)(=O)c2ccc(Br)c(C(=O)[O-])c2)c1	ZINC000013265588	818208396	/nfs/dbraw/zinc/20/83/96/818208396.db2.gz	UVFZRCUPIVKAJK-UHFFFAOYSA-N	-2	1	398.278	4.072	20	0		GIADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccccc1C(C)(C)C	ZINC000460415424	823381599	/nfs/dbraw/zinc/38/15/99/823381599.db2.gz	ZLZXFQZDDNOJJU-UHFFFAOYSA-N	-2	1	379.503	4.205	20	0		GIADML
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)[N-]c2cc(Cl)c(Cl)cc2F)c1	ZINC000410419425	823492004	/nfs/dbraw/zinc/49/20/04/823492004.db2.gz	DBKJPHGZQCGSMC-UHFFFAOYSA-N	-2	1	396.198	4.079	20	0		GIADML
CC(C)Oc1ccc(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2)c2ccccc12	ZINC000032585676	820972425	/nfs/dbraw/zinc/97/24/25/820972425.db2.gz	JLRGCEZANRPHCL-UHFFFAOYSA-N	-2	1	385.441	4.126	20	0		GIADML
CSc1cccc([N-]S(=O)(=O)c2cc(Cl)c(Cl)c(C(=O)[O-])c2)c1	ZINC000058488280	823398712	/nfs/dbraw/zinc/39/87/12/823398712.db2.gz	VQWDZOHYUHADSP-UHFFFAOYSA-N	-2	1	392.285	4.214	20	0		GIADML
Cc1ccc([N-]S(=O)(=O)c2cc(Cl)c(Cl)c(C(=O)[O-])c2)cc1Cl	ZINC000058488283	823398766	/nfs/dbraw/zinc/39/87/66/823398766.db2.gz	IQVFUJRNTHYJIT-UHFFFAOYSA-N	-2	1	394.663	4.454	20	0		GIADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(-c2cnc(C3CC3)o2)cc1	ZINC000026548366	820112703	/nfs/dbraw/zinc/11/27/03/820112703.db2.gz	RSFQYVMWKWREQS-UHFFFAOYSA-N	-2	1	398.440	4.026	20	0		GIADML
Cc1ccc(S(=O)(=O)[N-]c2ccccc2COc2ccccc2)cc1C(=O)[O-]	ZINC000055688094	822999604	/nfs/dbraw/zinc/99/96/04/822999604.db2.gz	KNHIBVULSVGXRD-UHFFFAOYSA-N	-2	1	397.452	4.073	20	0		GIADML
CSc1ccc([N-]S(=O)(=O)c2cc(Cl)c(Cl)c(C(=O)[O-])c2)cc1	ZINC000058488640	823399016	/nfs/dbraw/zinc/39/90/16/823399016.db2.gz	PDAVVQLFRXNSOQ-UHFFFAOYSA-N	-2	1	392.285	4.214	20	0		GIADML
Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cc(C(=O)[O-])cc(C(F)(F)F)c1	ZINC000062640784	823643016	/nfs/dbraw/zinc/64/30/16/823643016.db2.gz	ZEEOTJZCGIDEGT-UHFFFAOYSA-N	-2	1	393.770	4.166	20	0		GIADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(Cl)c2)cc(Cl)c1Cl	ZINC000058488273	823398598	/nfs/dbraw/zinc/39/85/98/823398598.db2.gz	KHSABCRVOAREGN-UHFFFAOYSA-N	-2	1	380.636	4.146	20	0		GIADML
Cc1c(CSC(C)C)cccc1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1	ZINC000460821438	823521985	/nfs/dbraw/zinc/52/19/85/823521985.db2.gz	HOKJGXKXZUJXHY-UHFFFAOYSA-N	-2	1	379.503	4.136	20	0		GIADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)c(Cl)cc1Cl	ZINC000013265555	818208385	/nfs/dbraw/zinc/20/83/85/818208385.db2.gz	XRVNEZDSFIIJDP-UHFFFAOYSA-N	-2	1	398.626	4.285	20	0		GIADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2ccc(OC3CCCC3)c(Cl)c2)c1	ZINC000409869667	823331184	/nfs/dbraw/zinc/33/11/84/823331184.db2.gz	JWPGUKOVXMXAHR-UHFFFAOYSA-N	-2	1	395.864	4.160	20	0		GIADML
Cc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(OC(C)C)c2ccccc21	ZINC000032589629	820973669	/nfs/dbraw/zinc/97/36/69/820973669.db2.gz	GECCVNDHBGQLKX-UHFFFAOYSA-N	-2	1	399.468	4.434	20	0		GIADML
CSc1ccc(Cl)cc1[N-]S(=O)(=O)c1cc(C(=O)[O-])c(C)cc1C	ZINC000064374855	823803731	/nfs/dbraw/zinc/80/37/31/823803731.db2.gz	WPGVFNZRJLXKPQ-UHFFFAOYSA-N	-2	1	385.894	4.178	20	0		GIADML
Cc1cc2cc([N-]S(=O)(=O)c3cc(Cl)c(Cl)c(C(=O)[O-])c3)ccc2[nH]1	ZINC000058493871	823399849	/nfs/dbraw/zinc/39/98/49/823399849.db2.gz	IUKKHPYYBQKLCY-UHFFFAOYSA-N	-2	1	399.255	4.282	20	0		GIADML
O=C([O-])Cc1cccc(S(=O)(=O)[N-]c2ccc3oc4ccccc4c3c2)c1	ZINC000574968282	823876068	/nfs/dbraw/zinc/87/60/68/823876068.db2.gz	DSYJPJJMUUKEHU-UHFFFAOYSA-N	-2	1	381.409	4.014	20	0		GIADML
Cc1cc(Cl)c2ccccc2c1[N-]S(=O)(=O)c1ccc(CC(=O)[O-])cc1	ZINC000462356356	823939044	/nfs/dbraw/zinc/93/90/44/823939044.db2.gz	HIDZQEOHXYZESS-UHFFFAOYSA-N	-2	1	389.860	4.230	20	0		GIADML
Cc1ccc(Nc2ccccc2[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)cc1	ZINC000013059956	818201937	/nfs/dbraw/zinc/20/19/37/818201937.db2.gz	LUBAAENDNFURIS-UHFFFAOYSA-N	-2	1	382.441	4.238	20	0		GIADML
Cc1cc(C)c(S(=O)(=O)[N-]c2ccccc2SC(F)F)cc1C(=O)[O-]	ZINC000058518982	823402890	/nfs/dbraw/zinc/40/28/90/823402890.db2.gz	SEXGBWQJFGWBMG-UHFFFAOYSA-N	-2	1	387.429	4.117	20	0		GIADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)Cc2ccccc2-3)ccc1Cl	ZINC000013349865	818210075	/nfs/dbraw/zinc/21/00/75/818210075.db2.gz	HVAAITHISHJJRD-UHFFFAOYSA-N	-2	1	399.855	4.410	20	0		GIADML
Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1cc(C(=O)[O-])cc(C(F)(F)F)c1	ZINC000062640787	823642993	/nfs/dbraw/zinc/64/29/93/823642993.db2.gz	RJZXGPJYSHHBRS-UHFFFAOYSA-N	-2	1	393.770	4.166	20	0		GIADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccccc2SC2CCCC2)cc1	ZINC000058744620	823443162	/nfs/dbraw/zinc/44/31/62/823443162.db2.gz	MHLVXDWEPMDNLT-UHFFFAOYSA-N	-2	1	377.487	4.220	20	0		GIADML
O=C([O-])c1cc([N-]S(=O)(=O)c2ccc3ccccc3c2)cc(C(F)(F)F)c1	ZINC000062640780	823642938	/nfs/dbraw/zinc/64/29/38/823642938.db2.gz	NSXIJCAHCNWKHO-UHFFFAOYSA-N	-2	1	395.358	4.358	20	0		GIADML
COc1cc([N-]S(=O)(=O)c2cccc(Cl)c2[O-])c(C2CC2)cc1Cl	ZINC000655602566	452922112	/nfs/dbraw/zinc/92/21/12/452922112.db2.gz	FBIPCUBMEFYIKS-UHFFFAOYSA-N	-2	1	388.272	4.386	20	0		GIADML
Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)[O-])c1	ZINC000058488313	823398827	/nfs/dbraw/zinc/39/88/27/823398827.db2.gz	MYMCFYMTFPDJNQ-UHFFFAOYSA-N	-2	1	394.663	4.454	20	0		GIADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(SC(F)F)cc2)c1C	ZINC000008104768	818000839	/nfs/dbraw/zinc/00/08/39/818000839.db2.gz	WRYXNKIDFRPMBU-UHFFFAOYSA-N	-2	1	387.429	4.117	20	0		GIADML
CCc1cccc(C)c1[N-]S(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)[O-])c1	ZINC000058488278	823398736	/nfs/dbraw/zinc/39/87/36/823398736.db2.gz	UGQBKNPJRVGXNM-UHFFFAOYSA-N	-2	1	388.272	4.363	20	0		GIADML
COc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)c2ccccc12	ZINC000063180383	823654533	/nfs/dbraw/zinc/65/45/33/823654533.db2.gz	DQUZAMGHHLHTBW-UHFFFAOYSA-N	-2	1	391.832	4.001	20	0		GIADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(Cl)cc2F)c(Cl)cc1Cl	ZINC000013340861	818210155	/nfs/dbraw/zinc/21/01/55/818210155.db2.gz	FWQKHIPTQGDJQU-UHFFFAOYSA-N	-2	1	398.626	4.285	20	0		GIADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cc(Cl)cc(Cl)c2)ccc1Cl	ZINC000013340475	818210220	/nfs/dbraw/zinc/21/02/20/818210220.db2.gz	KVRDYXCNFHATSP-UHFFFAOYSA-N	-2	1	380.636	4.146	20	0		GIADML
Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)[O-])c1	ZINC000058488465	823398637	/nfs/dbraw/zinc/39/86/37/823398637.db2.gz	LEBJXCLJRLGHRW-UHFFFAOYSA-N	-2	1	394.663	4.454	20	0		GIADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2ccccc2SC2CCCC2)c1	ZINC000032094443	820896488	/nfs/dbraw/zinc/89/64/88/820896488.db2.gz	MWPOBGXNEWEWLZ-UHFFFAOYSA-N	-2	1	377.487	4.220	20	0		GIADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(Cl)c(C(F)(F)F)c1	ZINC000007708621	221007469	/nfs/dbraw/zinc/00/74/69/221007469.db2.gz	LPUQTEDUIAAJNS-UHFFFAOYSA-N	-2	1	393.770	4.166	20	0		GIADML