smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(C(=O)Nc2ccc(C(=O)[O-])c(Cl)c2)[n-]c2nc(=O)[nH]c(=O)c1-2	ZINC000832865109	600959757	/nfs/dbraw/zinc/95/97/57/600959757.db2.gz	MRWWCZSHOXYLKX-UHFFFAOYSA-N	-2	2	374.740	2.348	20	0		FEADLL
O=C([O-])c1ccc(F)c(S(=O)(=O)Nc2ccc(C(=O)[O-])c(F)c2)c1	ZINC000754758883	602323065	/nfs/dbraw/zinc/32/30/65/602323065.db2.gz	JFZDZQSWPJYFOC-UHFFFAOYSA-N	-2	2	357.290	2.162	20	0		FEADLL
Cc1cc(C)c(C(=O)[O-])c(NS(=O)(=O)c2cc(C(=O)[O-])ccc2O)c1	ZINC000433511553	559883224	/nfs/dbraw/zinc/88/32/24/559883224.db2.gz	SWBBYTUVUCLTRU-UHFFFAOYSA-N	-2	2	365.363	2.206	20	0		FEADLL
O=C([O-])Cc1ccccc1NS(=O)(=O)c1cc(C(=O)[O-])cc(F)c1F	ZINC000821539456	597411027	/nfs/dbraw/zinc/41/10/27/597411027.db2.gz	XHKWTQZOHATQMK-UHFFFAOYSA-N	-2	2	371.317	2.091	20	0		FEADLL
O=C([O-])c1csc(NS(=O)(=O)c2cc(C(=O)[O-])cc3c2CCC3)c1	ZINC000833343687	602116276	/nfs/dbraw/zinc/11/62/76/602116276.db2.gz	MGBZFMAREHGXPJ-UHFFFAOYSA-N	-2	2	367.404	2.434	20	0		FEADLL
Cc1cc(C(=O)[O-])ccc1NS(=O)(=O)c1cc(C(=O)[O-])cc(F)c1F	ZINC000328159206	673062802	/nfs/dbraw/zinc/06/28/02/673062802.db2.gz	HMMDYGGSXFGMCC-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
Cc1cc(S(=O)(=O)Nc2ccc(F)cc2C(=O)[O-])sc1C(=O)[O-]	ZINC000055587044	540661517	/nfs/dbraw/zinc/66/15/17/540661517.db2.gz	MEQAAJSHQXLVDC-UHFFFAOYSA-N	-2	2	359.356	2.393	20	0		FEADLL
O=C([O-])Nc1cccc(NS(=O)(=O)c2ccc(C(=O)[O-])cc2F)c1	ZINC000833290744	600677140	/nfs/dbraw/zinc/67/71/40/600677140.db2.gz	ZVBMHCRIZAEHGO-UHFFFAOYSA-N	-2	2	354.315	2.415	20	0		FEADLL
O=C([O-])c1ccc(O)c(S(=O)(=O)Nc2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000436994936	559958999	/nfs/dbraw/zinc/95/89/99/559958999.db2.gz	PEMZLNNTEKUUNK-UHFFFAOYSA-N	-2	2	371.754	2.243	20	0		FEADLL
Cc1cc(S(=O)(=O)Nc2ccccc2CC(=O)[O-])sc1C(=O)[O-]	ZINC000818853107	597315173	/nfs/dbraw/zinc/31/51/73/597315173.db2.gz	FXMJEGHJRZJIFO-UHFFFAOYSA-N	-2	2	355.393	2.183	20	0		FEADLL
COc1cc(NS(=O)(=O)c2cc(C)c(C(=O)[O-])s2)ccc1C(=O)[O-]	ZINC000432778649	559864553	/nfs/dbraw/zinc/86/45/53/559864553.db2.gz	ZKMOQRFDSCOSKF-UHFFFAOYSA-N	-2	2	371.392	2.262	20	0		FEADLL
Cc1c(NS(=O)(=O)c2cc(C(=O)[O-])ccc2F)cccc1C(=O)[O-]	ZINC000392091324	599868151	/nfs/dbraw/zinc/86/81/51/599868151.db2.gz	FTAHGNGFIWPCBX-UHFFFAOYSA-N	-2	2	353.327	2.331	20	0		FEADLL
CC(C)(C(=O)[O-])c1ccc(NS(=O)(=O)c2csnc2C(=O)[O-])cc1	ZINC000826126812	601484735	/nfs/dbraw/zinc/48/47/35/601484735.db2.gz	KULHDNOQSUKOSP-UHFFFAOYSA-N	-2	2	370.408	2.004	20	0		FEADLL
Cc1cc(C(=O)Nc2ccc(NC(=O)[O-])cc2)[n-]c2nc(=O)[nH]c(=O)c1-2	ZINC000738206948	603752946	/nfs/dbraw/zinc/75/29/46/603752946.db2.gz	LABLIGWCNMGSCO-UHFFFAOYSA-N	-2	2	355.310	2.087	20	0		FEADLL
Cc1ccc(N2CCOCC2)cc1NS(=O)(=O)c1cc(O)cc(F)c1	ZINC000872369072	684941269	/nfs/dbraw/zinc/94/12/69/684941269.db2.gz	ADYWDOPFFSSEFZ-UHFFFAOYSA-N	-2	2	366.414	2.477	20	0		FEADLL
CCc1cc2c(C[N@H+]3CCC[C@@H](c4n[nH]c(=O)o4)C3)cc(=O)oc2cc1O	ZINC000295130794	552961832	/nfs/dbraw/zinc/96/18/32/552961832.db2.gz	CIIPXIFZLBVVMY-GFCCVEGCSA-N	-2	2	371.393	2.117	20	0		FEADLL
Cc1cc(C(=O)Nc2ccc(CCC(=O)[O-])cc2)[n-]c2nc(=O)[nH]c(=O)c1-2	ZINC000832865114	600933548	/nfs/dbraw/zinc/93/35/48/600933548.db2.gz	NHKPDUKMVXNIRW-UHFFFAOYSA-N	-2	2	368.349	2.014	20	0		FEADLL
Cc1cc(C)c(NS(=O)(=O)c2ccc(CC(=O)[O-])s2)c(C(=O)[O-])c1	ZINC000832875104	601329474	/nfs/dbraw/zinc/32/94/74/601329474.db2.gz	ULFJOZRGKPDJOD-UHFFFAOYSA-N	-2	2	369.420	2.491	20	0		FEADLL
O=C([O-])c1csc(S(=O)(=O)Nc2ccc3c(c2)CCN3C(=O)[O-])c1	ZINC000740717791	602246674	/nfs/dbraw/zinc/24/66/74/602246674.db2.gz	ZGIKEUQZUPGXGX-UHFFFAOYSA-N	-2	2	368.392	2.288	20	0		FEADLL
Cc1cc(C)c(NS(=O)(=O)c2cc(C(=O)[O-])ccc2O)c(C(=O)[O-])c1	ZINC000481485114	561233773	/nfs/dbraw/zinc/23/37/73/561233773.db2.gz	VLBPGWFBHVGKFU-UHFFFAOYSA-N	-2	2	365.363	2.206	20	0		FEADLL
O=C([O-])c1ccc(F)c(S(=O)(=O)Nc2cccc(F)c2C(=O)[O-])c1	ZINC000745978553	600814895	/nfs/dbraw/zinc/81/48/95/600814895.db2.gz	XJBAHPLUTBLDLA-UHFFFAOYSA-N	-2	2	357.290	2.162	20	0		FEADLL
O=C([O-])c1ccc(O)c(S(=O)(=O)Nc2cccc(Cl)c2C(=O)[O-])c1	ZINC000436994937	559958989	/nfs/dbraw/zinc/95/89/89/559958989.db2.gz	PESRLXNQPAYEBP-UHFFFAOYSA-N	-2	2	371.754	2.243	20	0		FEADLL
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)Nc2ccc(C(=O)[O-])c(F)c2)c1	ZINC000532851247	562490491	/nfs/dbraw/zinc/49/04/91/562490491.db2.gz	QFQYESUVNSQQNZ-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)[O-])c(F)c2)sc1C(=O)[O-]	ZINC000533624838	562514606	/nfs/dbraw/zinc/51/46/06/562514606.db2.gz	NMZFLHCNYKVYGN-UHFFFAOYSA-N	-2	2	359.356	2.393	20	0		FEADLL
CC(C)c1cccc(C(=O)[O-])c1NS(=O)(=O)c1csnc1C(=O)[O-]	ZINC000827134193	601837459	/nfs/dbraw/zinc/83/74/59/601837459.db2.gz	JIGFEIPTOFLVFB-UHFFFAOYSA-N	-2	2	370.408	2.464	20	0		FEADLL
CCOc1ccc(S(=O)(=O)Nc2cc(C(=O)[O-])cs2)cc1C(=O)[O-]	ZINC000830094710	602117343	/nfs/dbraw/zinc/11/73/43/602117343.db2.gz	YRMKELNKDLMILQ-UHFFFAOYSA-N	-2	2	371.392	2.344	20	0		FEADLL
Cc1cc(F)c(S(=O)(=O)Nc2ccsc2C(=O)[O-])cc1C(=O)[O-]	ZINC000833744402	605168231	/nfs/dbraw/zinc/16/82/31/605168231.db2.gz	FOFSQMJDEBILJJ-UHFFFAOYSA-N	-2	2	359.356	2.393	20	0		FEADLL
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccc(C(=O)[O-])c(O)c2)c1F	ZINC000749865980	680082271	/nfs/dbraw/zinc/08/22/71/680082271.db2.gz	AGPZGHBSMCSABF-UHFFFAOYSA-N	-2	2	369.326	2.037	20	0		FEADLL
Cc1cc(S(=O)(=O)NNc2c(F)c(F)nc(F)c2F)ccc1F	ZINC000105589699	670803831	/nfs/dbraw/zinc/80/38/31/670803831.db2.gz	HCOWKUYGTSWNFK-UHFFFAOYSA-N	-2	2	353.272	2.391	20	0		FEADLL
Cc1noc(C2CC2)c1NS(=O)(=O)c1cc(C(=O)[O-])cc(C(=O)[O-])c1	ZINC000463782629	560824141	/nfs/dbraw/zinc/82/41/41/560824141.db2.gz	NGIAYWLHZPKQFV-UHFFFAOYSA-N	-2	2	366.351	2.058	20	0		FEADLL
COc1ccc(Cl)c(S(=O)(=O)Nc2ccc(-c3nn[nH]n3)cc2)c1	ZINC000112266543	543437003	/nfs/dbraw/zinc/43/70/03/543437003.db2.gz	ANWCSTQFYXTUFK-UHFFFAOYSA-N	-2	2	365.802	2.330	20	0		FEADLL
Cc1cc(S(=O)(=O)Nc2ccc(F)c(C(=O)[O-])c2)sc1C(=O)[O-]	ZINC000319969185	553764478	/nfs/dbraw/zinc/76/44/78/553764478.db2.gz	WIEXJSJGMCXVPP-UHFFFAOYSA-N	-2	2	359.356	2.393	20	0		FEADLL
O=S(=O)(Nc1ccc(-c2nn[nH]n2)cc1)c1ccc(Cl)nc1Cl	ZINC000362957301	555002716	/nfs/dbraw/zinc/00/27/16/555002716.db2.gz	DXRDCDCPMOZQAD-UHFFFAOYSA-N	-2	2	371.209	2.369	20	0		FEADLL
Cc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)cc1C(=O)[O-]	ZINC000756935692	680505798	/nfs/dbraw/zinc/50/57/98/680505798.db2.gz	HSEOLPJRYCGDBE-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
CCc1cc2c(C[N@H+]3CCC[C@H](c4n[nH]c(=O)o4)C3)cc(=O)oc2cc1O	ZINC000295130798	552961810	/nfs/dbraw/zinc/96/18/10/552961810.db2.gz	CIIPXIFZLBVVMY-LBPRGKRZSA-N	-2	2	371.393	2.117	20	0		FEADLL
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2)c1F	ZINC000749141339	601224048	/nfs/dbraw/zinc/22/40/48/601224048.db2.gz	HXIHYWGGXKVACU-UHFFFAOYSA-N	-2	2	353.327	2.331	20	0		FEADLL
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)Nc2ccc(CC(=O)[O-])cc2)c1	ZINC000547246602	673837660	/nfs/dbraw/zinc/83/76/60/673837660.db2.gz	ZNGDFEANVCWSCV-UHFFFAOYSA-N	-2	2	367.354	2.260	20	0		FEADLL
Cc1cc(S(=O)(=O)Nc2cccc(CC(=O)[O-])c2)sc1C(=O)[O-]	ZINC000462104871	560797464	/nfs/dbraw/zinc/79/74/64/560797464.db2.gz	RRUJPDOFRHHHMF-UHFFFAOYSA-N	-2	2	355.393	2.183	20	0		FEADLL
Cc1c(C(=O)[O-])csc1NS(=O)(=O)c1ccc(C(=O)[O-])cc1F	ZINC000833741540	605127443	/nfs/dbraw/zinc/12/74/43/605127443.db2.gz	RDASHRZFQDWCQR-UHFFFAOYSA-N	-2	2	359.356	2.393	20	0		FEADLL
O=C([O-])c1ccc(F)c(S(=O)(=O)Nc2ccc(F)cc2C(=O)[O-])c1	ZINC000833318894	600812242	/nfs/dbraw/zinc/81/22/42/600812242.db2.gz	XGCZMRRDJCUBHW-UHFFFAOYSA-N	-2	2	357.290	2.162	20	0		FEADLL
O=C([O-])c1ccc(NS(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)cc1	ZINC000756928648	680505494	/nfs/dbraw/zinc/50/54/94/680505494.db2.gz	SGJBNSRJNRACQL-UHFFFAOYSA-N	-2	2	357.290	2.162	20	0		FEADLL
COc1ccc(C(=O)[O-])c(NS(=O)(=O)c2cc(C)c(C(=O)[O-])s2)c1	ZINC000511688839	561878225	/nfs/dbraw/zinc/87/82/25/561878225.db2.gz	SXEIXHCJLABYGY-UHFFFAOYSA-N	-2	2	371.392	2.262	20	0		FEADLL
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)Nc2cccc(CC(=O)[O-])c2)c1	ZINC000512746536	561913957	/nfs/dbraw/zinc/91/39/57/561913957.db2.gz	JNYGFOICAFXXGR-UHFFFAOYSA-N	-2	2	367.354	2.260	20	0		FEADLL
COc1ccc(NS(=O)(=O)c2cc(C)c(C(=O)[O-])s2)c(C(=O)[O-])c1	ZINC000536393896	562574667	/nfs/dbraw/zinc/57/46/67/562574667.db2.gz	DWZKLACSXWORBZ-UHFFFAOYSA-N	-2	2	371.392	2.262	20	0		FEADLL
O=C([O-])Nc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2F)cc1	ZINC000833289807	600811970	/nfs/dbraw/zinc/81/19/70/600811970.db2.gz	LYTFBTFGSLNMSH-UHFFFAOYSA-N	-2	2	354.315	2.415	20	0		FEADLL
O=C([O-])c1ccc(NS(=O)(=O)c2cccc(F)c2F)cc1C(=O)[O-]	ZINC000548524623	673965513	/nfs/dbraw/zinc/96/55/13/673965513.db2.gz	VSCPRCJHAHZDGU-UHFFFAOYSA-N	-2	2	357.290	2.162	20	0		FEADLL
Cc1cc(NS(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)ccc1C(=O)[O-]	ZINC000756938401	680505940	/nfs/dbraw/zinc/50/59/40/680505940.db2.gz	KDMFDIDHHNATNL-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
CCc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1cc(C(=O)[O-])ccc1O	ZINC000530957518	562429996	/nfs/dbraw/zinc/42/99/96/562429996.db2.gz	LVFYYTZQUJKKJC-UHFFFAOYSA-N	-2	2	365.363	2.152	20	0		FEADLL
Cc1ccc(NC(=O)c2cc(C)c3c(=O)[nH]c(=O)nc-3[n-]2)cc1C(=O)[O-]	ZINC000832948086	601066910	/nfs/dbraw/zinc/06/69/10/601066910.db2.gz	REOSOQXBUNIYMX-UHFFFAOYSA-N	-2	2	354.322	2.003	20	0		FEADLL
CC[C@@H](CNC(=O)c1c(O)cccc1F)NC(=O)c1c(O)cccc1F	ZINC000185202755	547950587	/nfs/dbraw/zinc/95/05/87/547950587.db2.gz	RCUUUCUNMDJERG-JTQLQIEISA-N	-2	2	364.348	2.314	20	0		FEADLL
O=S(=O)(Nc1ccc(-c2nn[nH]n2)cc1)c1c(F)cc(F)cc1F	ZINC000362959006	555003058	/nfs/dbraw/zinc/00/30/58/555003058.db2.gz	WYUDSUMHOONVND-UHFFFAOYSA-N	-2	2	355.301	2.085	20	0		FEADLL
O=C([O-])c1ccc(O)c(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)[O-])c1	ZINC000436889626	559955604	/nfs/dbraw/zinc/95/56/04/559955604.db2.gz	WOXAAUFGJDAQNR-UHFFFAOYSA-N	-2	2	371.754	2.243	20	0		FEADLL
Cc1cc(S(=O)(=O)Nc2cccc(F)c2C(=O)[O-])sc1C(=O)[O-]	ZINC000067660027	541497133	/nfs/dbraw/zinc/49/71/33/541497133.db2.gz	LEZJBWYPSGPVKK-UHFFFAOYSA-N	-2	2	359.356	2.393	20	0		FEADLL
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2O)c1	ZINC000512776574	561914876	/nfs/dbraw/zinc/91/48/76/561914876.db2.gz	PZANBDTXVJZWIJ-UHFFFAOYSA-N	-2	2	369.326	2.037	20	0		FEADLL
O=C([O-])c1ccc(S(=O)(=O)Nc2cccc(F)c2C(=O)[O-])c(F)c1	ZINC000438787372	559983700	/nfs/dbraw/zinc/98/37/00/559983700.db2.gz	RVWYZAGOBOQEDP-UHFFFAOYSA-N	-2	2	357.290	2.162	20	0		FEADLL
Cc1cc(C(=O)Nc2cc(Cl)cc(C(=O)[O-])c2)[n-]c2nc(=O)[nH]c(=O)c1-2	ZINC000832865139	600962770	/nfs/dbraw/zinc/96/27/70/600962770.db2.gz	PDBRWVANHWAJCB-UHFFFAOYSA-N	-2	2	374.740	2.348	20	0		FEADLL
O=C([O-])Nc1cc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2O)ccc1F	ZINC000833282772	601250274	/nfs/dbraw/zinc/25/02/74/601250274.db2.gz	JPLKZYBVVMVDTI-UHFFFAOYSA-N	-2	2	370.314	2.120	20	0		FEADLL
CC(C)c1scnc1NS(=O)(=O)c1cc(C(=O)[O-])cc(C(=O)[O-])c1	ZINC000579156204	671716037	/nfs/dbraw/zinc/71/60/37/671716037.db2.gz	ZYMHQTKPFVCZEJ-UHFFFAOYSA-N	-2	2	370.408	2.464	20	0		FEADLL
Cc1cccc(C(=O)[O-])c1NS(=O)(=O)c1cc(C(=O)[O-])cc(F)c1F	ZINC000756930830	680505457	/nfs/dbraw/zinc/50/54/57/680505457.db2.gz	HEQXNOOGSXACEW-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
O=c1[nH]nc(C2CC[NH+](Cc3nc4c5ccccc5oc4c(=O)[nH]3)CC2)[nH]1	ZINC000329679577	553987391	/nfs/dbraw/zinc/98/73/91/553987391.db2.gz	XKWQGMPXURVRSO-UHFFFAOYSA-N	-2	2	366.381	2.285	20	0		FEADLL
Cc1ccc(-c2n[nH]c(=O)[nH]2)cc1NS(=O)(=O)c1ccc(N(C)C)cc1	ZINC000375612858	558057101	/nfs/dbraw/zinc/05/71/01/558057101.db2.gz	OVUBZTDPBYWKRC-UHFFFAOYSA-N	-2	2	373.438	2.353	20	0		FEADLL
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)Nc2ccc(C(=O)[O-])c(O)c2)c1	ZINC000436635186	559947280	/nfs/dbraw/zinc/94/72/80/559947280.db2.gz	MWEBLRITCGARHV-UHFFFAOYSA-N	-2	2	369.326	2.037	20	0		FEADLL
O=C([O-])c1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)c(O)c1	ZINC000738685276	599826756	/nfs/dbraw/zinc/82/67/56/599826756.db2.gz	WMAVDISOJIMBOC-UHFFFAOYSA-N	-2	2	371.754	2.243	20	0		FEADLL
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)Nc2ccccc2C(=O)[O-])c1	ZINC000544645066	673722646	/nfs/dbraw/zinc/72/26/46/673722646.db2.gz	JCNNHIRNFPFWRT-UHFFFAOYSA-N	-2	2	353.327	2.331	20	0		FEADLL
Cc1c(C(=O)[O-])csc1NS(=O)(=O)c1ccc(C(=O)[O-])c(F)c1	ZINC000833741267	605124778	/nfs/dbraw/zinc/12/47/78/605124778.db2.gz	FCOBOAVGJGPTRI-UHFFFAOYSA-N	-2	2	359.356	2.393	20	0		FEADLL
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccccc2CC(=O)[O-])c1F	ZINC000818801445	597493747	/nfs/dbraw/zinc/49/37/47/597493747.db2.gz	WUNZVPYLHVFTJS-UHFFFAOYSA-N	-2	2	367.354	2.260	20	0		FEADLL
Cc1cc(C(=O)Nc2ccc(F)c(NC(=O)[O-])c2)[n-]c2nc(=O)[nH]c(=O)c1-2	ZINC000738335644	600682804	/nfs/dbraw/zinc/68/28/04/600682804.db2.gz	NSHVSXJFXGRMAN-UHFFFAOYSA-N	-2	2	373.300	2.226	20	0		FEADLL
Cc1c(C(=O)[O-])csc1NS(=O)(=O)c1ccc(F)c(C(=O)[O-])c1	ZINC000833741479	605127388	/nfs/dbraw/zinc/12/73/88/605127388.db2.gz	OPYWFQNQDQDEAX-UHFFFAOYSA-N	-2	2	359.356	2.393	20	0		FEADLL
Cc1cc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2O)c(C(=O)[O-])cc1C	ZINC000478673665	561172515	/nfs/dbraw/zinc/17/25/15/561172515.db2.gz	JLVBKFSBPSPPHS-UHFFFAOYSA-N	-2	2	365.363	2.206	20	0		FEADLL
Cc1cc(F)c(S(=O)(=O)Nc2ccccc2CC(=O)[O-])cc1C(=O)[O-]	ZINC000820980080	597386095	/nfs/dbraw/zinc/38/60/95/597386095.db2.gz	JHUVIFLQCKZYMQ-UHFFFAOYSA-N	-2	2	367.354	2.260	20	0		FEADLL
Cc1ccc(NC(=O)c2cc(C)c3c(=O)[nH]c(=O)nc-3[n-]2)c(C(=O)[O-])c1	ZINC000738627095	600669351	/nfs/dbraw/zinc/66/93/51/600669351.db2.gz	JFRQANKZPBEXCH-UHFFFAOYSA-N	-2	2	354.322	2.003	20	0		FEADLL
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2cccc(F)c2C(=O)[O-])c1F	ZINC000749144376	601224072	/nfs/dbraw/zinc/22/40/72/601224072.db2.gz	XLRJPSUIOYGLTH-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
O=C([O-])Cc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)cc1	ZINC000762445327	604632832	/nfs/dbraw/zinc/63/28/32/604632832.db2.gz	UEDDYTZDMAHFTF-UHFFFAOYSA-N	-2	2	371.317	2.091	20	0		FEADLL
O=S(=O)(CCOCC1CC1)Nc1cc(Br)ccc1O	ZINC000574511293	671248554	/nfs/dbraw/zinc/24/85/54/671248554.db2.gz	GIYWJKXHMOOIRR-UHFFFAOYSA-N	-2	2	350.234	2.323	20	0		FEADLL
O=C([O-])c1ccc(NS(=O)(=O)c2cc(F)ccc2F)cc1C(=O)[O-]	ZINC000547870643	673894971	/nfs/dbraw/zinc/89/49/71/673894971.db2.gz	HDBGUEHXKOYJCL-UHFFFAOYSA-N	-2	2	357.290	2.162	20	0		FEADLL
Cc1ccc(F)c(-c2cc(=NC(=O)c3cnc4c(cnn4C)c3O)[nH][nH]2)c1	ZINC000444810309	560121558	/nfs/dbraw/zinc/12/15/58/560121558.db2.gz	CFSDQKAUTHEQHG-UHFFFAOYSA-N	-2	2	366.356	2.764	20	0		FEADLL
Cc1ccc(NS(=O)(=O)c2ccc(CC(=O)[O-])s2)cc1C(=O)[O-]	ZINC000832950128	601334146	/nfs/dbraw/zinc/33/41/46/601334146.db2.gz	CDDCMTOTJMMARE-UHFFFAOYSA-N	-2	2	355.393	2.183	20	0		FEADLL
Cc1c(C(=O)[O-])csc1NS(=O)(=O)c1ccc(OCC(=O)[O-])cc1	ZINC000833741825	605127351	/nfs/dbraw/zinc/12/73/51/605127351.db2.gz	XEFUQPPYOJWDBD-UHFFFAOYSA-N	-2	2	371.392	2.019	20	0		FEADLL
Cc1c(C(=O)[O-])csc1NS(=O)(=O)c1cc(C(=O)[O-])c(O)cc1C	ZINC000833746867	605128297	/nfs/dbraw/zinc/12/82/97/605128297.db2.gz	KOZGATVXVWHHFI-UHFFFAOYSA-N	-2	2	371.392	2.268	20	0		FEADLL
O=S(=O)(Nc1ccc(-c2nn[nH]n2)cc1)c1cc(F)ccc1Cl	ZINC000103059352	543089671	/nfs/dbraw/zinc/08/96/71/543089671.db2.gz	LVYWUOGEHMWRQM-UHFFFAOYSA-N	-2	2	353.766	2.460	20	0		FEADLL
CC[C@H](CNC(=O)c1c(O)cccc1F)NC(=O)c1c(O)cccc1F	ZINC000185202772	547951194	/nfs/dbraw/zinc/95/11/94/547951194.db2.gz	RCUUUCUNMDJERG-SNVBAGLBSA-N	-2	2	364.348	2.314	20	0		FEADLL
O=C([O-])c1ccc(O)c(S(=O)(=O)Nc2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000436893661	559955435	/nfs/dbraw/zinc/95/54/35/559955435.db2.gz	OPFNYWQVCXMSIB-UHFFFAOYSA-N	-2	2	371.754	2.243	20	0		FEADLL
COc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1cc(C)c(C(=O)[O-])s1	ZINC000462105095	560797364	/nfs/dbraw/zinc/79/73/64/560797364.db2.gz	SXGIMUJSNBMAJQ-UHFFFAOYSA-N	-2	2	371.392	2.262	20	0		FEADLL
Cc1cc(C(=O)Nc2cccc(C(=O)[O-])c2C)[n-]c2nc(=O)[nH]c(=O)c1-2	ZINC000832855489	600882344	/nfs/dbraw/zinc/88/23/44/600882344.db2.gz	BIFWJZMMQZZHKE-UHFFFAOYSA-N	-2	2	354.322	2.003	20	0		FEADLL
O=C([O-])c1ccc(NS(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)c(O)c1	ZINC000489731538	561417958	/nfs/dbraw/zinc/41/79/58/561417958.db2.gz	BNMPJISGCDEZTC-UHFFFAOYSA-N	-2	2	371.754	2.243	20	0		FEADLL
O=C([O-])Nc1cccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2F)c1	ZINC000833290406	600812428	/nfs/dbraw/zinc/81/24/28/600812428.db2.gz	UHYOMKZZNQWPPD-UHFFFAOYSA-N	-2	2	354.315	2.415	20	0		FEADLL
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccc(C(=O)[O-])c(F)c2)c1F	ZINC000754759330	602322257	/nfs/dbraw/zinc/32/22/57/602322257.db2.gz	LSMFNMOCZPHLFU-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
Cc1cc(F)c(S(=O)(=O)Nc2ccc(C(=O)[O-])c(C(=O)[O-])c2)cc1F	ZINC000548198932	673933019	/nfs/dbraw/zinc/93/30/19/673933019.db2.gz	CPZKQOBJJTUUHM-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
Cc1cc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)c(C(=O)[O-])[nH]1	ZINC000738461512	600255770	/nfs/dbraw/zinc/25/57/70/600255770.db2.gz	GBDSVYBZFXEJAS-UHFFFAOYSA-N	-2	2	358.759	2.174	20	0		FEADLL
CN(C(=O)[O-])c1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2F)cc1	ZINC000830519146	600813979	/nfs/dbraw/zinc/81/39/79/600813979.db2.gz	MQISQASKWYWLDL-UHFFFAOYSA-N	-2	2	368.342	2.439	20	0		FEADLL
Cc1cc(S(=O)(=O)Nc2cc(C(=O)[O-])cs2)cc(C(=O)[O-])c1F	ZINC000832903510	601986078	/nfs/dbraw/zinc/98/60/78/601986078.db2.gz	KWXAVPJDICYJOA-UHFFFAOYSA-N	-2	2	359.356	2.393	20	0		FEADLL
Cc1cc(C(=O)Nc2ccccc2NC(=O)[O-])[n-]c2nc(=O)[nH]c(=O)c1-2	ZINC000829965782	603745518	/nfs/dbraw/zinc/74/55/18/603745518.db2.gz	IVEKKUPKRJFBLB-UHFFFAOYSA-N	-2	2	355.310	2.087	20	0		FEADLL
COc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)[O-])cc1F	ZINC000438762841	559983181	/nfs/dbraw/zinc/98/31/81/559983181.db2.gz	HTODITBGVRKKLP-UHFFFAOYSA-N	-2	2	369.326	2.032	20	0		FEADLL
CC(C)c1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1csnc1C(=O)[O-]	ZINC000827118349	602201055	/nfs/dbraw/zinc/20/10/55/602201055.db2.gz	SGRJEMQJYLYTCL-UHFFFAOYSA-N	-2	2	370.408	2.464	20	0		FEADLL
Cc1sc(NC(=O)c2cc(C)c3c(=O)[nH]c(=O)nc-3[n-]2)c(C(=O)[O-])c1C	ZINC000738399156	600678130	/nfs/dbraw/zinc/67/81/30/600678130.db2.gz	SROKFSHWUXHDET-UHFFFAOYSA-N	-2	2	374.378	2.373	20	0		FEADLL
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccsc2C(=O)[O-])c1F	ZINC000832866129	601224513	/nfs/dbraw/zinc/22/45/13/601224513.db2.gz	DPMKGFWEKJVZBF-UHFFFAOYSA-N	-2	2	359.356	2.393	20	0		FEADLL
O=C([O-])c1ccc(S(=O)(=O)Nc2ccc3c(c2)[nH]cc3C(=O)[O-])s1	ZINC000740187113	600236888	/nfs/dbraw/zinc/23/68/88/600236888.db2.gz	GQXMDQTUBSUJEP-UHFFFAOYSA-N	-2	2	366.376	2.427	20	0		FEADLL
CCCc1ccc(NS(=O)(=O)c2csnc2C(=O)[O-])c(C(=O)[O-])c1	ZINC000829566658	601835930	/nfs/dbraw/zinc/83/59/30/601835930.db2.gz	QFGXGWYVSQGDID-UHFFFAOYSA-N	-2	2	370.408	2.293	20	0		FEADLL
O=S(=O)(Nc1ccc(-c2nn[nH]n2)cc1)c1cccc(Cl)c1F	ZINC000103059425	543089775	/nfs/dbraw/zinc/08/97/75/543089775.db2.gz	VDZBPYNCNMPAIT-UHFFFAOYSA-N	-2	2	353.766	2.460	20	0		FEADLL
O=C([O-])Cc1cccc(NS(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)c1	ZINC000756937041	597410888	/nfs/dbraw/zinc/41/08/88/597410888.db2.gz	VERQNWTVAIRFGQ-UHFFFAOYSA-N	-2	2	371.317	2.091	20	0		FEADLL
Cc1ccc(C(=O)[O-])cc1NC(=O)c1cc(C)c2c(=O)[nH]c(=O)nc-2[n-]1	ZINC000738535981	601125707	/nfs/dbraw/zinc/12/57/07/601125707.db2.gz	VSVHJZVBIXPFJU-UHFFFAOYSA-N	-2	2	354.322	2.003	20	0		FEADLL
Cc1cccc(C(=O)[O-])c1NS(=O)(=O)c1cc(C(=O)[O-])ccc1F	ZINC000745976041	673859852	/nfs/dbraw/zinc/85/98/52/673859852.db2.gz	BXSJJMPYUPEPQH-UHFFFAOYSA-N	-2	2	353.327	2.331	20	0		FEADLL
Cc1cccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2F)c1C(=O)[O-]	ZINC000738735667	600253795	/nfs/dbraw/zinc/25/37/95/600253795.db2.gz	FISDFAVMKUSDSX-UHFFFAOYSA-N	-2	2	353.327	2.331	20	0		FEADLL
COC(=O)C1(CS(=O)(=O)Nc2cccc(C(C)=O)c2O)CCCC1	ZINC000580074662	671781223	/nfs/dbraw/zinc/78/12/23/671781223.db2.gz	YLAOBNIHWURJQO-UHFFFAOYSA-N	-2	2	355.412	2.070	20	0		FEADLL
Cc1cccc(NS(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)c1C(=O)[O-]	ZINC000756935419	680505732	/nfs/dbraw/zinc/50/57/32/680505732.db2.gz	FQDOJYRKQMBKIM-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
Cc1ccc(-c2n[nH]c(NC(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)n2)o1	ZINC000282672028	551258114	/nfs/dbraw/zinc/25/81/14/551258114.db2.gz	PBVQCKIMGIMFRQ-VIFPVBQESA-N	-2	2	359.308	2.015	20	0		FEADLL
COc1ccc(C(=O)[O-])c(NS(=O)(=O)c2cc(C(=O)[O-])ccc2F)c1	ZINC000745977861	600816372	/nfs/dbraw/zinc/81/63/72/600816372.db2.gz	CSHKWHYEKQTIKU-UHFFFAOYSA-N	-2	2	369.326	2.032	20	0		FEADLL
O=C([O-])c1ccc(F)c(S(=O)(=O)Nc2ccc(F)c(C(=O)[O-])c2)c1	ZINC000324891669	673047905	/nfs/dbraw/zinc/04/79/05/673047905.db2.gz	OCHNMQWJIAJFIC-UHFFFAOYSA-N	-2	2	357.290	2.162	20	0		FEADLL
Cc1cc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2F)cc(C(=O)[O-])c1	ZINC000795365889	683045403	/nfs/dbraw/zinc/04/54/03/683045403.db2.gz	OQXWUKRFXXYPHJ-UHFFFAOYSA-N	-2	2	353.327	2.331	20	0		FEADLL
CCc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2O)c(C(=O)[O-])c1	ZINC000433524616	559883564	/nfs/dbraw/zinc/88/35/64/559883564.db2.gz	KMTTWNKGGQDUPD-UHFFFAOYSA-N	-2	2	365.363	2.152	20	0		FEADLL
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccccc2C(=O)[O-])c1F	ZINC000832866588	601224404	/nfs/dbraw/zinc/22/44/04/601224404.db2.gz	MYFNZURDIMHCAK-UHFFFAOYSA-N	-2	2	353.327	2.331	20	0		FEADLL
CN(C(=O)[O-])c1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2O)cc1	ZINC000830519136	601249757	/nfs/dbraw/zinc/24/97/57/601249757.db2.gz	MJIGJVBQVUQDMP-UHFFFAOYSA-N	-2	2	366.351	2.005	20	0		FEADLL
Cc1cc(F)c(S(=O)(=O)Nc2cc(C(=O)[O-])cs2)cc1C(=O)[O-]	ZINC000833745030	605169259	/nfs/dbraw/zinc/16/92/59/605169259.db2.gz	YKVNCXCPYHGMBC-UHFFFAOYSA-N	-2	2	359.356	2.393	20	0		FEADLL
COc1ccc(C(=O)[O-])c(NS(=O)(=O)c2ccc(C(=O)[O-])cc2F)c1	ZINC000438784704	559983656	/nfs/dbraw/zinc/98/36/56/559983656.db2.gz	JFAIUQCDEHCNLR-UHFFFAOYSA-N	-2	2	369.326	2.032	20	0		FEADLL
CC(=O)Nc1cc(S(=O)(=O)Nc2cc3[nH]ncc3c(C)c2)ccc1O	ZINC000499261293	561547031	/nfs/dbraw/zinc/54/70/31/561547031.db2.gz	CJMYEHQDQFUISK-UHFFFAOYSA-N	-2	2	360.395	2.336	20	0		FEADLL
Cc1ccc(-n2cccn2)cc1NS(=O)(=O)c1cc(C(=O)[O-])ccc1O	ZINC000473434498	561050022	/nfs/dbraw/zinc/05/00/22/561050022.db2.gz	ZVPOTZWLBKEDFW-UHFFFAOYSA-N	-3	2	373.390	2.385	20	0		FEADLL
O=C([O-])c1ccc(O)c(S(=O)(=O)Nc2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000833298205	601251303	/nfs/dbraw/zinc/25/13/03/601251303.db2.gz	VGWHMGAZMCFOJK-UHFFFAOYSA-N	-2	2	371.754	2.243	20	0		FEADLL
Cc1cc(C(=O)N2CCCc3cccc(O)c32)[nH]c2nc(=O)[nH]c(=O)c1-2	ZINC000490874103	561439542	/nfs/dbraw/zinc/43/95/42/561439542.db2.gz	RYRQNKDMOBSQIP-UHFFFAOYSA-N	-3	2	352.350	2.043	20	0		FEADLL
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)Nc2cccc(C(=O)[O-])c2O)c1	ZINC000436994022	559958971	/nfs/dbraw/zinc/95/89/71/559958971.db2.gz	KEGZDGWOUYZJSP-UHFFFAOYSA-N	-2	2	369.326	2.037	20	0		FEADLL
O=C([O-])c1cccc(NS(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)c1	ZINC000756927856	680505343	/nfs/dbraw/zinc/50/53/43/680505343.db2.gz	JYVARRGPSKGSNI-UHFFFAOYSA-N	-2	2	357.290	2.162	20	0		FEADLL
CCCOc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1c[nH]c(C(=O)[O-])c1	ZINC000443361600	560081863	/nfs/dbraw/zinc/08/18/63/560081863.db2.gz	MYZZZKURCQJHOX-UHFFFAOYSA-N	-2	2	368.367	2.001	20	0		FEADLL
O=C([O-])c1ccc(S(=O)(=O)Nc2cc(F)c(F)cc2C(=O)[O-])s1	ZINC000740177665	600069372	/nfs/dbraw/zinc/06/93/72/600069372.db2.gz	QYSMRWAQFCGTKZ-UHFFFAOYSA-N	-2	2	363.319	2.224	20	0		FEADLL
Cc1cc(C(=O)Nc2ccc(N(C)C(=O)[O-])cc2)[n-]c2nc(=O)[nH]c(=O)c1-2	ZINC000738209581	600682666	/nfs/dbraw/zinc/68/26/66/600682666.db2.gz	SJFRNSCTRWRDQP-UHFFFAOYSA-N	-2	2	369.337	2.111	20	0		FEADLL
COc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1cc(C(=O)[O-])sc1C	ZINC000608005215	675881257	/nfs/dbraw/zinc/88/12/57/675881257.db2.gz	OUDPINPHNIJPJP-UHFFFAOYSA-N	-2	2	371.392	2.262	20	0		FEADLL
Cc1cccc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)c1C(=O)[O-]	ZINC000738736677	600254057	/nfs/dbraw/zinc/25/40/57/600254057.db2.gz	QIMLLUDGPXGTEN-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
Cc1oc(C)c(S(=O)(=O)Nc2cccc(C)c2C(=O)[O-])c1C(=O)[O-]	ZINC000738736454	600254086	/nfs/dbraw/zinc/25/40/86/600254086.db2.gz	MTJBNVUSCZBOHK-UHFFFAOYSA-N	-2	2	353.352	2.402	20	0		FEADLL
COC(=O)c1ccc(O)cc1NS(=O)(=O)c1cnc(Cl)c(C)c1	ZINC000765990096	680862595	/nfs/dbraw/zinc/86/25/95/680862595.db2.gz	MVCWLJYICSMIDB-UHFFFAOYSA-N	-2	2	356.787	2.336	20	0		FEADLL
Cc1cc([N+](=O)[O-])c(S(=O)(=O)Nc2ccc(-c3nn[nH]n3)cc2)cc1C	ZINC000103059344	543089482	/nfs/dbraw/zinc/08/94/82/543089482.db2.gz	CCJGYXOPTGFCNH-UHFFFAOYSA-N	-2	2	374.382	2.193	20	0		FEADLL
COC(=O)C(C)(C)CS(=O)(=O)Nc1cc(C(F)(F)F)ccc1O	ZINC000288593076	552181057	/nfs/dbraw/zinc/18/10/57/552181057.db2.gz	SMHHKFGOXLZBHE-UHFFFAOYSA-N	-2	2	355.334	2.352	20	0		FEADLL
O=C([O-])CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)[O-])s2)cc1	ZINC000739738027	600546001	/nfs/dbraw/zinc/54/60/01/600546001.db2.gz	FAMWLYOLEVOVSF-UHFFFAOYSA-N	-2	2	371.392	2.101	20	0		FEADLL
Cc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2F)c(C(=O)[O-])c1	ZINC000745978408	600812307	/nfs/dbraw/zinc/81/23/07/600812307.db2.gz	WQZBUHLSLYVDNC-UHFFFAOYSA-N	-2	2	353.327	2.331	20	0		FEADLL
CCc1nc(C)c(NS(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)[O-])c2)s1	ZINC000489033510	561401857	/nfs/dbraw/zinc/40/18/57/561401857.db2.gz	BRTOFFPNOTTWKV-UHFFFAOYSA-N	-2	2	370.408	2.211	20	0		FEADLL
Cc1cc(NC(=O)c2cc(C)c3c(=O)[nH]c(=O)nc-3[n-]2)sc1C(=O)[O-]	ZINC000738242337	600995339	/nfs/dbraw/zinc/99/53/39/600995339.db2.gz	SXHLDAFDTXSAHO-UHFFFAOYSA-N	-2	2	360.351	2.065	20	0		FEADLL
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccc(F)cc2C(=O)[O-])c1F	ZINC000749144123	601224213	/nfs/dbraw/zinc/22/42/13/601224213.db2.gz	YCUODSORJAKSDO-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
Cc1ccc2c(=O)c(C(=O)N3CCC(CN(C)C(=O)[O-])CC3)c[n-]c2[nH+]1	ZINC000740155687	602407713	/nfs/dbraw/zinc/40/77/13/602407713.db2.gz	UDJMMLQNKOWODA-UHFFFAOYSA-N	-2	2	358.398	2.106	20	0		FEADLL
Cc1cc(F)c(S(=O)(=O)Nc2cccc(F)c2C(=O)[O-])cc1C(=O)[O-]	ZINC000753775587	605166786	/nfs/dbraw/zinc/16/67/86/605166786.db2.gz	XEWCLUZVXVRUBA-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
O=C([O-])CCOc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])cs2)cc1	ZINC000507628410	561735875	/nfs/dbraw/zinc/73/58/75/561735875.db2.gz	FGVKMNOIHVCUFR-UHFFFAOYSA-N	-2	2	371.392	2.101	20	0		FEADLL
Cc1cc(S(=O)(=O)Nc2cc(C(=O)[O-])cs2)ccc1OCC(=O)[O-]	ZINC000832903500	602117853	/nfs/dbraw/zinc/11/78/53/602117853.db2.gz	JUTPOUCOVXWACU-UHFFFAOYSA-N	-2	2	371.392	2.019	20	0		FEADLL
Cc1cc(NS(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)cc(C(=O)[O-])c1	ZINC000795364817	683045343	/nfs/dbraw/zinc/04/53/43/683045343.db2.gz	AJHARAHHDUORMV-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)Nc2ccc(F)cc2C(=O)[O-])c1	ZINC000512753453	561914361	/nfs/dbraw/zinc/91/43/61/561914361.db2.gz	XXMBPNKHDIGYNV-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
O=C([O-])NCc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2F)cc1	ZINC000833280745	600816778	/nfs/dbraw/zinc/81/67/78/600816778.db2.gz	PTBXEGMQYKIIPN-UHFFFAOYSA-N	-2	2	368.342	2.092	20	0		FEADLL
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)Nc2cccc(F)c2C(=O)[O-])c1	ZINC000512795548	561915720	/nfs/dbraw/zinc/91/57/20/561915720.db2.gz	VLZYBRJUKDPAJS-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
Cc1cc(C(=O)Nc2ccc(Cl)c(C(=O)[O-])c2)[n-]c2nc(=O)[nH]c(=O)c1-2	ZINC000832865122	600835777	/nfs/dbraw/zinc/83/57/77/600835777.db2.gz	NXBLWFIZJYPBNC-UHFFFAOYSA-N	-2	2	374.740	2.348	20	0		FEADLL
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccc(CC(=O)[O-])cc2)c1F	ZINC000762443598	601224431	/nfs/dbraw/zinc/22/44/31/601224431.db2.gz	JNQPYLICGOWIBK-UHFFFAOYSA-N	-2	2	367.354	2.260	20	0		FEADLL
Cc1c(C(=O)[O-])csc1NS(=O)(=O)c1ccc(CC(=O)[O-])cc1	ZINC000833741331	605126667	/nfs/dbraw/zinc/12/66/67/605126667.db2.gz	IAMULWSZGQWCDQ-UHFFFAOYSA-N	-2	2	355.393	2.183	20	0		FEADLL
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)Nc2ccccc2CC(=O)[O-])c1	ZINC000820963560	597386170	/nfs/dbraw/zinc/38/61/70/597386170.db2.gz	CBFSZBIYVBFKPC-UHFFFAOYSA-N	-2	2	367.354	2.260	20	0		FEADLL
O=C([O-])Cc1ccc(S(=O)(=O)Nc2ccc(F)c(C(=O)[O-])c2)s1	ZINC000390732069	601321430	/nfs/dbraw/zinc/32/14/30/601321430.db2.gz	NYXUAMRJNYFWPS-UHFFFAOYSA-N	-2	2	359.356	2.013	20	0		FEADLL
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2cccc(CC(=O)[O-])c2)c1F	ZINC000749145927	601988353	/nfs/dbraw/zinc/98/83/53/601988353.db2.gz	PHFOPKKYBGWFCP-UHFFFAOYSA-N	-2	2	367.354	2.260	20	0		FEADLL
Cc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)c(C(=O)[O-])c1	ZINC000756935475	680505984	/nfs/dbraw/zinc/50/59/84/680505984.db2.gz	DEUPSNNMSXRDDR-UHFFFAOYSA-N	-2	2	371.317	2.470	20	0		FEADLL
O=C([O-])c1ccc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2O)c(Cl)c1	ZINC000436996665	559958962	/nfs/dbraw/zinc/95/89/62/559958962.db2.gz	URHRYGQKMRXWGQ-UHFFFAOYSA-N	-2	2	371.754	2.243	20	0		FEADLL
Cc1cc(S(=O)(=O)Nc2ccc(CC(=O)[O-])cc2)sc1C(=O)[O-]	ZINC000614743327	676189272	/nfs/dbraw/zinc/18/92/72/676189272.db2.gz	JATHZIDBQBUQQY-UHFFFAOYSA-N	-2	2	355.393	2.183	20	0		FEADLL
Cc1cc(F)c(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2O)cc1C(=O)[O-]	ZINC000753776126	680313973	/nfs/dbraw/zinc/31/39/73/680313973.db2.gz	SCLIEDCRGXKVHP-UHFFFAOYSA-N	-2	2	369.326	2.037	20	0		FEADLL
Cc1cc(NS(=O)(=O)c2ccc(CC(=O)[O-])s2)ccc1C(=O)[O-]	ZINC000832899188	601330345	/nfs/dbraw/zinc/33/03/45/601330345.db2.gz	FPOOXXWFDPWGAN-UHFFFAOYSA-N	-2	2	355.393	2.183	20	0		FEADLL
O=C([O-])c1csc(S(=O)(=O)Nc2cc(F)c(F)cc2C(=O)[O-])c1	ZINC000504986435	561665090	/nfs/dbraw/zinc/66/50/90/561665090.db2.gz	WHTYHZBEQBLTOB-UHFFFAOYSA-N	-2	2	363.319	2.224	20	0		FEADLL
Cc1cc(C(=O)[O-])ccc1NS(=O)(=O)c1ccc(CC(=O)[O-])s1	ZINC000319804876	601320619	/nfs/dbraw/zinc/32/06/19/601320619.db2.gz	JTDVUDMEBCICBC-UHFFFAOYSA-N	-2	2	355.393	2.183	20	0		FEADLL
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)Nc2cccc(C(=O)[O-])c2)c1	ZINC000512742010	561913895	/nfs/dbraw/zinc/91/38/95/561913895.db2.gz	DXTVDYHQFROVIM-UHFFFAOYSA-N	-2	2	353.327	2.331	20	0		FEADLL
Cc1cc(S(=O)(=O)Nc2ccc(CNC(=O)[O-])cc2)sc1C(=O)[O-]	ZINC000738477057	600302749	/nfs/dbraw/zinc/30/27/49/600302749.db2.gz	FFGLNHKEORFLTL-UHFFFAOYSA-N	-2	2	370.408	2.323	20	0		FEADLL
Cc1oc(C(=O)[O-])cc1S(=O)(=O)Nc1cc(F)c(C(=O)[O-])c(F)c1	ZINC000746055239	673862196	/nfs/dbraw/zinc/86/21/96/673862196.db2.gz	ATBHMAXXEJEKIA-UHFFFAOYSA-N	-2	2	361.278	2.063	20	0		FEADLL
COc1cc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2F)ccc1C(=O)[O-]	ZINC000788489670	682533221	/nfs/dbraw/zinc/53/32/21/682533221.db2.gz	MTTZWTHANKABMA-UHFFFAOYSA-N	-2	2	369.326	2.032	20	0		FEADLL